A0A087Y2M0_POEFO Loading...

Parathyroid hormone/parathyroid hormone-related peptide receptor

G-protein-coupled receptor for parathyroid hormone (PTH) and for parathyroid hormone-related peptide (PTHLH). Ligand binding causes a conformation change that triggers signaling via guanine nucleotide-binding proteins (G proteins) and modulates the activity of downstream effectors, such as adenylate cyclase (cAMP). PTH1R is coupled to G(s) G alpha proteins and mediates activation of adenylate cyclase activity. PTHLH dissociates from PTH1R more rapidly than PTH; as consequence, the cAMP response induced by PTHLH decays faster than the response induced by PTH.

AlphaFold DB , UniProt , Accession A0A087Y2M0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 548 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M32.3Very low32Very low251 Ų251137.5 Ų137.5100%1.23688%0.875SS**  0160.50-83.7168.5163.700109
2T34.9Very low32.3Very low128 Ų128132 Ų13279%0.78586%0.864SS**  trans-66.9141.1-175.846.20000114.5
3L31Very low32.5Very low173 Ų173134.7 Ų134.791%0.90686%0.861SS**  -163.6169105.2-121.383.4000109
4G33.1Very low32.6Very low78 Ų78129.1 Ų129.180%0.80484%0.84SS**  trans-133.4170.5-174.900000114.5
5G29.4Very low33.1Very low81 Ų81127.3 Ų127.384%0.83583%0.832SS**  trans-141.7155.8178.600000111.8
6R30.3Very low33.5Very low250 Ų250123.8 Ų123.894%0.94381%0.811SS**  trans-90.8147.3-171-73177.4172.1147.1-3.7113.5
7V34.6Very low33.8Very low148 Ų148123.4 Ų123.490%0.89780%0.8SS**  trans-70.6142.2157.51770000109.3
8A32.2Very low34.3Very low93 Ų93125.3 Ų125.377%0.76980%0.796SS**  trans-130.2148.5176.100000111.7
9S31.2Very low34.9Very low116 Ų116124.1 Ų124.181%0.81178%0.782SS**  trans-66.4153.5-169.2-173.40000115
10G29.8Very low35.6Very low84 Ų84124.6 Ų124.687%0.86677%0.774SS**  trans-157.742.717800000114.3
11S33.3Very low36.2Very low110 Ų110123 Ų12377%0.76976%0.761SS**  trans-132.494.1-177.760.50000112.2
12G36.1Very low36.9Very low72 Ų72116.7 Ų116.774%0.74273%0.731SS**  trans-159.628.4-170.800000117.2
13M34.2Very low37.6Very low167 Ų167114 Ų11482%0.82371%0.712SS**SBendtrans-124.6-6.4-178.8-74.2170.663.900115.3
14G34.5Very low38.6Very low56 Ų56113 Ų11358%0.57770%0.701SS**Hα-helixtrans-78.1-28.6-178.900000115
15S40.3Very low39.4Very low102 Ų102114.3 Ų114.371%0.71369%0.689SS**Hα-helixtrans-79.8-39.3-166.1-49.20000114.3L19S15-L19 PolarHBondContact O-N 3.5Å
16S39.3Very low40.4Very low72 Ų72115.2 Ų115.250%0.50367%0.674SS.*Hα-helixtrans-70.5-36.5178.949.70000112.1Q18 L19 H20S16-Q18 PolarHBondContact O-N 3.06Å; S16-L19 PolarHBondContact O-N 3.49Å; S16-H20 PolarHBondContact O-CD2 3.39Å; S16-H20 PolarHBondContact O-N 3.35Å
17L37.8Very low41.6Very low117 Ų117108 Ų10861%0.61365%0.653SS**Hα-helixtrans-67.3-36.5-178.7-148.378.6000112N21L17-N21 WeakPolarHBondContact O-CB 3.25Å; L17-N21 PolarHBondContact O-N 3.46Å; L17-N21 VanDerWaalsContact O-N 3.17Å; L17-N21 PolarHBondContact O-ND2 2.9Å
18Q43.5Very low42.2Very low157 Ų157104.2 Ų104.273%0.73463%0.633SS**Hα-helixtrans-72.3-35.6174.9-74.5-161.7-27.300113S16 N21 L22S16-Q18 PolarHBondContact O-N 3.06Å; Q18-N21 PolarHBondContact O-N 2.94Å; Q18-L22 WeakPolarHBondContact O-CB 3.24Å; Q18-L22 PolarHBondContact O-N 3.3Å
19L45.6Very low43Very low102 Ų102104.3 Ų104.353%0.53462%0.62SS.*Hα-helixtrans-64.9-50.5176.7-167.567.6000111S15 S16 N21 L22 D23S15-L19 PolarHBondContact O-N 3.5Å; S16-L19 PolarHBondContact O-N 3.49Å; L19-N21 VanDerWaalsContact C-N 3.31Å; L19-N21 PolarHBondContact O-N 3.02Å; L19-L22 PolarHBondContact O-N 3.1Å; L19-D23 PolarHBondContact O-N 3.49Å
20H49.5Very low43.9Very low135 Ų135100.8 Ų100.863%0.62559%0.592SS**Hα-helixtrans-58.9-38.7176.2-88.3-73.3000113.3S16 F24S16-H20 PolarHBondContact O-CD2 3.39Å; S16-H20 PolarHBondContact O-N 3.35Å; H20-F24 VanDerWaalsContact O-CB 3.24Å; H20-F24 WeakPolarHBondContact O-CB 3.47Å; H20-F24 PolarHBondContact O-N 3.22Å
21N46.5Very low44.7Very low91 Ų91100.5 Ų100.549%0.48758%0.577SS.*Hα-helixtrans-69.1-34.1175.8-82.9-72.4000112.4L17 Q18 L19 L25L17-N21 WeakPolarHBondContact O-CB 3.25Å; L17-N21 PolarHBondContact O-N 3.46Å; L17-N21 VanDerWaalsContact O-N 3.17Å; L17-N21 PolarHBondContact O-ND2 2.9Å; Q18-N21 PolarHBondContact O-N 2.94Å; L19-N21 VanDerWaalsContact C-N 3.31Å; L19-N21 PolarHBondContact O-N 3.02Å; N21-L25 WeakPolarHBondContact O-CB 3.44Å; N21-L25 WeakPolarHBondContact O-CD1 3.46Å; N21-L25 PolarHBondContact O-N 3.47Å
22L48.8Very low45.3Very low118 Ų11899.1 Ų99.162%0.61857%0.567SS**Hα-helixtrans-69.3-44.2175.7-171.967.4000111.4Q18 L19 F24 L25 L26Q18-L22 WeakPolarHBondContact O-CB 3.24Å; Q18-L22 PolarHBondContact O-N 3.3Å; L19-L22 PolarHBondContact O-N 3.1Å; L22-F24 VanDerWaalsContact C-N 3.34Å; L22-L25 PolarHBondContact O-N 2.93Å; L22-L26 WeakPolarHBondContact O-CB 3.33Å; L22-L26 PolarHBondContact O-N 2.78Å
23D49.4Very low45.8Very low71 Ų7199.8 Ų99.838%0.3855%0.553SS.*Hα-helixtrans-62.1-42.5174.9-66.3-32.7000111L19 L26 I27L19-D23 PolarHBondContact O-N 3.49Å; D23-L26 PolarHBondContact O-N 3.31Å; D23-I27 WeakPolarHBondContact O-CB 3.46Å; D23-I27 WeakPolarHBondContact O-CD1 3.43Å; D23-I27 VanDerWaalsContact O-CG1 3.24Å; D23-I27 WeakPolarHBondContact O-CG1 3.41Å; D23-I27 PolarHBondContact O-N 3.17Å
24F51.6Low46.3Very low154 Ų15493.7 Ų93.768%0.67553%0.527SS*.Hα-helixtrans-68.6-36.1177.7-156.9-91.9000112.5H20 L22 S28H20-F24 VanDerWaalsContact O-CB 3.24Å; H20-F24 WeakPolarHBondContact O-CB 3.47Å; H20-F24 PolarHBondContact O-N 3.22Å; L22-F24 VanDerWaalsContact C-N 3.34Å; F24-S28 VanDerWaalsContact O-CB 3.23Å; F24-S28 WeakPolarHBondContact O-CB 3.22Å; F24-S28 PolarHBondContact O-N 3.48Å
25L49Very low46.4Very low104 Ų10498.5 Ų98.555%0.54554%0.538SS..Hα-helixtrans-64.9-41.4169.9-107.2115.4000111.7N21 L22 S28 L29N21-L25 WeakPolarHBondContact O-CB 3.44Å; N21-L25 WeakPolarHBondContact O-CD1 3.46Å; N21-L25 PolarHBondContact O-N 3.47Å; L22-L25 PolarHBondContact O-N 2.93Å; L25-S28 PolarHBondContact O-N 2.95Å; L25-L29 HydrophobicContact CD2-CD1 4.23Å; L25-L29 VanDerWaalsContact O-CD1 3.25Å; L25-L29 WeakPolarHBondContact O-CD1 3.45Å; L25-L29 PolarHBondContact O-N 2.97Å
26L51.9Low46.5Very low100 Ų10097.1 Ų97.152%0.52453%0.525SS..Hα-helixtrans-65-44.1178.7-168.970.4000111.1L22 D23 L29 L30L22-L26 WeakPolarHBondContact O-CB 3.33Å; L22-L26 PolarHBondContact O-N 2.78Å; D23-L26 PolarHBondContact O-N 3.31Å; L26-L29 PolarHBondContact O-N 2.91Å; L26-L30 HydrophobicContact CG-CD1 4.28Å; L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 WeakPolarHBondContact O-CD1 3.11Å; L26-L30 VanDerWaalsContact O-CG 3.26Å; L26-L30 WeakPolarHBondContact O-CG 3.42Å; L26-L30 PolarHBondContact O-N 3.06Å
27I55.3Low46.3Very low99 Ų99103.6 Ų103.651%0.50854%0.54SS..Hα-helixtrans-62.2-43.4173.2-68.5163.6000110.5D23 L30 S31D23-I27 WeakPolarHBondContact O-CB 3.46Å; D23-I27 WeakPolarHBondContact O-CD1 3.43Å; D23-I27 VanDerWaalsContact O-CG1 3.24Å; D23-I27 WeakPolarHBondContact O-CG1 3.41Å; D23-I27 PolarHBondContact O-N 3.17Å; I27-L30 WeakPolarHBondContact O-CB 3.43Å; I27-L30 PolarHBondContact O-N 2.99Å; I27-S31 PolarHBondContact O-N 2.99Å; I27-S31 PolarHBondContact O-OG 3.25Å
28S47.1Very low46.2Very low69 Ų6999.9 Ų99.948%0.48353%0.526SS..Hα-helixtrans-64.1-40.1176.9-172.30000112.7F24 L25 S31 S32F24-S28 VanDerWaalsContact O-CB 3.23Å; F24-S28 WeakPolarHBondContact O-CB 3.22Å; F24-S28 PolarHBondContact O-N 3.48Å; L25-S28 PolarHBondContact O-N 2.95Å; S28-S31 PolarHBondContact O-N 3.21Å; S28-S32 WeakPolarHBondContact O-CB 3.19Å; S28-S32 PolarHBondContact O-N 2.87Å; S28-S32 PolarHBondContact O-OG 2.88Å
29L49.2Very low46.1Very low95 Ų9598.1 Ų98.150%0.49752%0.522SS..Hα-helixtrans-65.6-45.1173.6-96.898.1000111.1L25 L26 S31 S32 L33L25-L29 HydrophobicContact CD2-CD1 4.23Å; L25-L29 VanDerWaalsContact O-CD1 3.25Å; L25-L29 WeakPolarHBondContact O-CD1 3.45Å; L25-L29 PolarHBondContact O-N 2.97Å; L26-L29 PolarHBondContact O-N 2.91Å; L29-S31 VanDerWaalsContact C-N 3.34Å; L29-S31 PolarHBondContact O-N 3.41Å; L29-S32 WeakPolarHBondContact CA-OG 3.45Å; L29-S32 PolarHBondContact O-N 3.26Å; L29-S32 VanDerWaalsContact O-N 3.14Å; L29-S32 PolarHBondContact O-OG 2.71Å; L29-L33 WeakPolarHBondContact O-CG 3.4Å; L29-L33 PolarHBondContact O-N 3.32Å
30L49.6Very low46.5Very low42 Ų4299.1 Ų99.122%0.2253%0.528CS..Hα-helixtrans-56.4-46.7174.5-76.8162.7000111.2L26 I27 S32 L33 C34 V328L26-L30 HydrophobicContact CG-CD1 4.28Å; L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 WeakPolarHBondContact O-CD1 3.11Å; L26-L30 VanDerWaalsContact O-CG 3.26Å; L26-L30 WeakPolarHBondContact O-CG 3.42Å; L26-L30 PolarHBondContact O-N 3.06Å; I27-L30 WeakPolarHBondContact O-CB 3.43Å; I27-L30 PolarHBondContact O-N 2.99Å; L30-S32 PolarHBondContact O-N 2.9Å; L30-L33 PolarHBondContact O-N 3.32Å; L30-C34 PolarHBondContact O-N 2.86Å; L30-C34 VanDerWaalsContact O-N 3.12Å; L30-C34 PolarHBondContact O-SG 3.49Å; L30-V328 HydrophobicContact CD2-CB 3.69Å; L30-V328 HydrophobicContact CD2-CG1 3.6Å; L30-V328 HydrophobicContact CD2-CG2 4.43Å
31S46.4Very low47.3Very low78 Ų7898.4 Ų98.455%0.54553%0.533SS..Hα-helixtrans-61.8-40.2174.7-63.90000112.7I27 S28 L29 L33 C34I27-S31 PolarHBondContact O-N 2.99Å; I27-S31 PolarHBondContact O-OG 3.25Å; S28-S31 PolarHBondContact O-N 3.21Å; L29-S31 VanDerWaalsContact C-N 3.34Å; L29-S31 PolarHBondContact O-N 3.41Å; S31-L33 VanDerWaalsContact C-N 3.29Å; S31-L33 PolarHBondContact O-N 3.35Å; S31-C34 PolarHBondContact O-N 2.91Å
32S46.1Very low48.6Very low81 Ų8197.1 Ų97.157%0.56653%0.526SS*.Hα-helixtrans-68-27.1177.372.80000113.7S28 L29 L30S28-S32 WeakPolarHBondContact O-CB 3.19Å; S28-S32 PolarHBondContact O-N 2.87Å; S28-S32 PolarHBondContact O-OG 2.88Å; L29-S32 WeakPolarHBondContact CA-OG 3.45Å; L29-S32 PolarHBondContact O-N 3.26Å; L29-S32 VanDerWaalsContact O-N 3.14Å; L29-S32 PolarHBondContact O-OG 2.71Å; L30-S32 PolarHBondContact O-N 2.9Å
33L47.3Very low49.8Very low85 Ų8593.3 Ų93.345%0.44551%0.507SS..Hα-helixtrans-83.5-15.6175-74.8164000113.3L29 L30 S31 L35 V328L29-L33 WeakPolarHBondContact O-CG 3.4Å; L29-L33 PolarHBondContact O-N 3.32Å; L30-L33 PolarHBondContact O-N 3.32Å; S31-L33 VanDerWaalsContact C-N 3.29Å; S31-L33 PolarHBondContact O-N 3.35Å; L33-L35 PolarHBondContact O-N 3.28Å; L33-V328 HydrophobicContact CD1-CG1 4.08Å; L33-V328 HydrophobicContact CD1-CG2 4.37Å
34C43.6Very low51.1Low40 Ų4096.9 Ų96.927%0.2752%0.519SS..THydrogen-bonded Turntrans-81.718.2177-690000113.8L30 S31 N321L30-C34 PolarHBondContact O-N 2.86Å; L30-C34 VanDerWaalsContact O-N 3.12Å; L30-C34 PolarHBondContact O-SG 3.49Å; S31-C34 PolarHBondContact O-N 2.91Å; C34-N321 PolarHBondContact O-ND2 2.99Å; C34-N321 PolarHBondContact O-OD1 3.3Å
35L36.8Very low52.2Low156 Ų15694 Ų9482%0.81751%0.508SS*.  trans-108.647.8-178.4-130.6166.7000111.4L33L33-L35 PolarHBondContact O-N 3.28Å
36V41.6Very low53.8Low73 Ų7393.7 Ų93.744%0.44250%0.504SS..SBendtrans-96.5157.6168-177.10000108.3N321 W324V36-N321 WeakPolarHBondContact CB-OD1 3.26Å; V36-N321 PolarHBondContact N-OD1 2.95Å; V36-N321 PolarHBondContact O-ND2 2.78Å; V36-N321 PolarHBondContact O-OD1 3.45Å; V36-W324 HydrophobicContact CG2-CZ2 4.29Å
37Y36.2Very low55.4Low209 Ų20990.8 Ų90.882%0.8249%0.488SS*.PPolyproline II helixtrans-68.3155.8177.5-138.2-105.1000111.4
38A36.4Very low56.9Low39 Ų3990 Ų9032%0.32248%0.483SS..PPolyproline II helixtrans-94.4118176.200000110.3D40A38-D40 VanDerWaalsContact C-N 3.3Å; A38-D40 PolarHBondContact O-N 3.31Å
39D41.3Very low58.8Low119 Ų11992 Ų9264%0.63649%0.489SS*.  trans-85.376162.7-53.9-54.5000108V41D39-V41 PolarHBondContact O-N 2.86Å
40D53.6Low60.8Low124 Ų12491 Ų9166%0.66348%0.484SS*.  trans-79.9105.7174.6-70.9-35.2000109A38A38-D40 VanDerWaalsContact C-N 3.3Å; A38-D40 PolarHBondContact O-N 3.31Å
41V66.2Low62.8Low120 Ų12091.5 Ų91.573%0.72749%0.486SS*.PPolyproline II helixtrans-76.4121.7-179.7-179.80000109.5D39 T43D39-V41 PolarHBondContact O-N 2.86Å; V41-T43 PolarHBondContact O-N 2.96Å
42L72.6Confident65Low64 Ų6491.6 Ų91.634%0.33548%0.483SS..PPolyproline II helixtrans-58.2123.8179.2-176.367.2000111.1E46 Q47 L50 H101L42-E46 HydrophobicContact CD1-CB 3.6Å; L42-Q47 HydrophobicContact CD2-CB 4.08Å; L42-Q47 HydrophobicContact CG-CB 4.38Å; L42-L50 HydrophobicContact CD1-CD1 4.25Å; L42-L50 HydrophobicContact CD2-CD1 4.36Å; L42-H101 HydrophobicContact CD2-CB 3.99Å
43T75.1Confident67.2Low38 Ų3892 Ų9223%0.23348%0.476CS..PPolyproline II helixtrans-75.7158175.664.80000111.4V41 E45 E46 Q47V41-T43 PolarHBondContact O-N 2.96Å; T43-E45 PolarHBondContact O-N 3.44Å; T43-E46 WeakPolarHBondContact CB-OE2 3.44Å; T43-E46 WeakPolarHBondContact CG2-OE2 3.42Å; T43-E46 PolarHBondContact N-OE2 3.45Å; T43-E46 PolarHBondContact O-N 2.79Å; T43-E46 WeakPolarHBondContact OG1-CB 3.36Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-N 3.41Å; T43-E46 PolarHBondContact OG1-OE2 3.45Å; T43-Q47 WeakPolarHBondContact O-CB 3.43Å; T43-Q47 PolarHBondContact O-N 2.89Å
44K75.9Confident69.4Low146 Ų14688.6 Ų88.664%0.63546%0.46SS*.Hα-helixtrans-62.3-34.8175.8175.2-167.2168.5-146.50111.3Q47 I48K44-Q47 PolarHBondContact O-N 3.4Å; K44-I48 HydrophobicContact CG-CD1 4.2Å; K44-I48 VanDerWaalsContact O-CG1 3.29Å; K44-I48 WeakPolarHBondContact O-CG1 3.48Å; K44-I48 PolarHBondContact O-N 3.35Å
45E76.1Confident71.7Confident92 Ų9290.9 Ų90.943%0.4347%0.466SS..Hα-helixtrans-69.4-44.9-179.7-74.154.9-133.900110.8T43 Q47 I48 D49T43-E45 PolarHBondContact O-N 3.44Å; E45-Q47 VanDerWaalsContact C-N 3.34Å; E45-Q47 PolarHBondContact O-N 3.15Å; E45-I48 WeakPolarHBondContact O-CB 3.5Å; E45-I48 PolarHBondContact O-N 3.22Å; E45-I48 VanDerWaalsContact O-N 3.15Å; E45-D49 PolarHBondContact O-N 2.62Å
46E81.6Confident74.5Confident98 Ų9889.1 Ų89.146%0.45845%0.451SS..Hα-helixtrans-62.3-39.8170.8-69.8161.4137.200112L42 T43 I48 D49 L50L42-E46 HydrophobicContact CD1-CB 3.6Å; T43-E46 WeakPolarHBondContact CB-OE2 3.44Å; T43-E46 WeakPolarHBondContact CG2-OE2 3.42Å; T43-E46 PolarHBondContact N-OE2 3.45Å; T43-E46 PolarHBondContact O-N 2.79Å; T43-E46 WeakPolarHBondContact OG1-CB 3.36Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-N 3.41Å; T43-E46 PolarHBondContact OG1-OE2 3.45Å; E46-I48 VanDerWaalsContact C-N 3.27Å; E46-I48 PolarHBondContact O-N 2.19Å; E46-D49 PolarHBondContact O-N 2.67Å; E46-L50 WeakPolarHBondContact O-CB 3.39Å; E46-L50 WeakPolarHBondContact O-CG 3.06Å; E46-L50 PolarHBondContact O-N 3.34Å
47Q85.8Confident77Confident40 Ų4091 Ų9119%0.18745%0.454CS..Hα-helixtrans-63.9-30.2174.9-179.15997.400112.5L42 T43 K44 E45 L51 Y99L42-Q47 HydrophobicContact CD2-CB 4.08Å; L42-Q47 HydrophobicContact CG-CB 4.38Å; T43-Q47 WeakPolarHBondContact O-CB 3.43Å; T43-Q47 PolarHBondContact O-N 2.89Å; K44-Q47 PolarHBondContact O-N 3.4Å; E45-Q47 VanDerWaalsContact C-N 3.34Å; E45-Q47 PolarHBondContact O-N 3.15Å; Q47-L51 WeakPolarHBondContact O-CB 3.39Å; Q47-L51 PolarHBondContact O-N 3.49Å; Q47-Y99 PolarHBondContact NE2-O 3.5Å
48I86.5Confident79.7Confident81 Ų8181.2 Ų81.242%0.41542%0.416SS..Hα-helixtrans-71.9-46.7171.8-72.6162.1000110.6K44 E45 E46 L50 L51 V52K44-I48 HydrophobicContact CG-CD1 4.2Å; K44-I48 VanDerWaalsContact O-CG1 3.29Å; K44-I48 WeakPolarHBondContact O-CG1 3.48Å; K44-I48 PolarHBondContact O-N 3.35Å; E45-I48 WeakPolarHBondContact O-CB 3.5Å; E45-I48 PolarHBondContact O-N 3.22Å; E45-I48 VanDerWaalsContact O-N 3.15Å; E46-I48 VanDerWaalsContact C-N 3.27Å; E46-I48 PolarHBondContact O-N 2.19Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 2.8Å; I48-L51 PolarHBondContact O-N 3.27Å; I48-L51 VanDerWaalsContact O-N 3.09Å; I48-V52 HydrophobicContact CG2-CG2 4.34Å; I48-V52 WeakPolarHBondContact O-CG2 3.28Å; I48-V52 PolarHBondContact O-N 3.1Å
49D87.6Confident82.4Confident113 Ų11382.8 Ų82.860%0.60442%0.417SS*.Hα-helixtrans-61.6-41.2179.7-80.2-17.1000111.9E45 E46 L51 V52 E53E45-D49 PolarHBondContact O-N 2.62Å; E46-D49 PolarHBondContact O-N 2.67Å; D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 PolarHBondContact O-N 3.13Å; D49-V52 PolarHBondContact O-N 3.22Å; D49-E53 WeakPolarHBondContact O-CB 3.15Å; D49-E53 PolarHBondContact O-N 3.42Å
50L90.1Very high84.8Confident73 Ų7380.6 Ų80.638%0.38241%0.405SS..Hα-helixtrans-57.8-40.9172.2-74.8172.3000112.5L42 E46 I48 A54L42-L50 HydrophobicContact CD1-CD1 4.25Å; L42-L50 HydrophobicContact CD2-CD1 4.36Å; E46-L50 WeakPolarHBondContact O-CB 3.39Å; E46-L50 WeakPolarHBondContact O-CG 3.06Å; E46-L50 PolarHBondContact O-N 3.34Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 2.8Å; L50-A54 WeakPolarHBondContact O-CB 3.18Å; L50-A54 PolarHBondContact O-N 3.24Å
51L91.6Very high86.5Confident52 Ų5279.2 Ų79.227%0.27240%0.398SS..Hα-helixtrans-74.2-33.8179.7-170.5147.3000112.1Q47 I48 D49 K55 W77Q47-L51 WeakPolarHBondContact O-CB 3.39Å; Q47-L51 PolarHBondContact O-N 3.49Å; I48-L51 PolarHBondContact O-N 3.27Å; I48-L51 VanDerWaalsContact O-N 3.09Å; D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 PolarHBondContact O-N 3.13Å; L51-K55 VanDerWaalsContact O-CB 3.32Å; L51-K55 WeakPolarHBondContact O-CB 3.42Å; L51-K55 PolarHBondContact O-N 2.93Å; L51-W77 HydrophobicContact CD2-CZ2 4.11Å; L51-W77 HydrophobicContact CG-CZ2 4.14Å
52V92.3Very high87.6Confident81 Ų8176.1 Ų76.149%0.49138%0.376SS..Hα-helixtrans-67.3-43.2172.51710000111.2I48 D49 K55 K56I48-V52 HydrophobicContact CG2-CG2 4.34Å; I48-V52 WeakPolarHBondContact O-CG2 3.28Å; I48-V52 PolarHBondContact O-N 3.1Å; D49-V52 PolarHBondContact O-N 3.22Å; V52-K55 PolarHBondContact O-N 2.88Å; V52-K56 WeakPolarHBondContact O-CB 3.47Å; V52-K56 PolarHBondContact O-N 3.1Å
53E93.2Very high88.3Confident88 Ų8879.3 Ų79.341%0.41139%0.387SS..Hα-helixtrans-62.4-42.2174.6174.969.3177.600111.6D49 K56 K57D49-E53 WeakPolarHBondContact O-CB 3.15Å; D49-E53 PolarHBondContact O-N 3.42Å; E53-K56 PolarHBondContact O-N 3.28Å; E53-K57 HydrophobicContact CG-CD 4.49Å; E53-K57 VanDerWaalsContact CG-NZ 3.31Å; E53-K57 WeakPolarHBondContact O-CG 3.41Å; E53-K57 PolarHBondContact O-N 2.98Å; E53-K57 VanDerWaalsContact O-N 3.14Å; E53-K57 WeakPolarHBondContact OE1-CE 3.45Å; E53-K57 IonicContact OE1-NZ 3.62Å; E53-K57 PolarHBondContact OE1-NZ 3.27Å
54A92.6Very high88.7Confident14 Ų1481.9 Ų81.912%0.11641%0.407CS..Hα-helixtrans-64.4-46.117400000112.5L50 K56 K57 C58 W77 Y99L50-A54 WeakPolarHBondContact O-CB 3.18Å; L50-A54 PolarHBondContact O-N 3.24Å; A54-K56 VanDerWaalsContact C-N 3.35Å; A54-K56 PolarHBondContact O-N 3.04Å; A54-K57 PolarHBondContact O-N 3.37Å; A54-C58 PolarHBondContact O-N 3.27Å; A54-W77 HydrophobicContact CB-CH2 3.93Å; A54-W77 HydrophobicContact CB-CZ3 4.32Å; A54-Y99 HydrophobicContact CB-CD1 4.15Å; A54-Y99 HydrophobicContact CB-CD2 4.03Å; A54-Y99 HydrophobicContact CB-CE1 3.78Å; A54-Y99 HydrophobicContact CB-CE2 3.65Å; A54-Y99 HydrophobicContact CB-CG 4.26Å
55K93.6Very high88.6Confident88 Ų8880.8 Ų80.838%0.38340%0.399SS..Hα-helixtrans-56.8-47.5174.9176.4-178.1167.1-172.60111.4L51 V52 K57 C58 E59 W77L51-K55 VanDerWaalsContact O-CB 3.32Å; L51-K55 WeakPolarHBondContact O-CB 3.42Å; L51-K55 PolarHBondContact O-N 2.93Å; V52-K55 PolarHBondContact O-N 2.88Å; K55-K57 PolarHBondContact O-N 2.89Å; K55-C58 WeakPolarHBondContact O-CA 3.24Å; K55-C58 VanDerWaalsContact O-CB 3.3Å; K55-C58 WeakPolarHBondContact O-CB 3.46Å; K55-C58 PolarHBondContact O-N 3.15Å; K55-C58 VanDerWaalsContact O-N 3.1Å; K55-E59 WeakPolarHBondContact CE-OE1 3.23Å; K55-E59 IonicContact NZ-OE1 3.41Å; K55-E59 PolarHBondContact NZ-OE1 3.3Å; K55-E59 PolarHBondContact O-N 2.91Å; K55-W77 HydrophobicContact CB-CD2 4.02Å; K55-W77 HydrophobicContact CB-CG 4.47Å; K55-W77 HydrophobicContact CB-CH2 4.41Å; K55-W77 HydrophobicContact CB-CZ2 3.88Å; K55-W77 HydrophobicContact CG-CD2 4.09Å; K55-W77 HydrophobicContact CG-CG 4.01Å
56K94.4Very high88.3Confident119 Ų11979.5 Ų79.552%0.51741%0.411SS..Hα-helixtrans-59.8-45.8-179.9-177-175.9173.1-167.90111.5V52 E53 A54 C58 E59 D60V52-K56 WeakPolarHBondContact O-CB 3.47Å; V52-K56 PolarHBondContact O-N 3.1Å; E53-K56 PolarHBondContact O-N 3.28Å; A54-K56 VanDerWaalsContact C-N 3.35Å; A54-K56 PolarHBondContact O-N 3.04Å; K56-C58 VanDerWaalsContact C-N 3.27Å; K56-C58 PolarHBondContact O-N 2.77Å; K56-E59 PolarHBondContact O-N 2.7Å; K56-D60 PolarHBondContact O-N 3.44Å
57K93.3Very high87.8Confident113 Ų11385.1 Ų85.149%0.49143%0.433SS..Hα-helixtrans-58.5-38174-73165.6-177.61610112.1E53 A54 K55 N61E53-K57 HydrophobicContact CG-CD 4.49Å; E53-K57 VanDerWaalsContact CG-NZ 3.31Å; E53-K57 WeakPolarHBondContact O-CG 3.41Å; E53-K57 PolarHBondContact O-N 2.98Å; E53-K57 VanDerWaalsContact O-N 3.14Å; E53-K57 WeakPolarHBondContact OE1-CE 3.45Å; E53-K57 IonicContact OE1-NZ 3.62Å; E53-K57 PolarHBondContact OE1-NZ 3.27Å; A54-K57 PolarHBondContact O-N 3.37Å; K55-K57 PolarHBondContact O-N 2.89Å; K57-N61 VanDerWaalsContact O-CB 3.28Å; K57-N61 WeakPolarHBondContact O-CB 3.47Å; K57-N61 PolarHBondContact O-N 2.81Å; K57-N61 PolarHBondContact O-ND2 3.37Å
58C92.9Very high87.1Confident3 Ų386.1 Ų86.12%0.0244%0.439CS..Hα-helixtrans-64-51.7173.5-173.30000112.3A54 K55 K56 D60 N61 I62 W77 C82A54-C58 PolarHBondContact O-N 3.27Å; K55-C58 WeakPolarHBondContact O-CA 3.24Å; K55-C58 VanDerWaalsContact O-CB 3.3Å; K55-C58 WeakPolarHBondContact O-CB 3.46Å; K55-C58 PolarHBondContact O-N 3.15Å; K55-C58 VanDerWaalsContact O-N 3.1Å; K56-C58 VanDerWaalsContact C-N 3.27Å; K56-C58 PolarHBondContact O-N 2.77Å; C58-D60 VanDerWaalsContact C-N 3.31Å; C58-D60 PolarHBondContact O-N 2.92Å; C58-N61 PolarHBondContact O-N 2.86Å; C58-I62 WeakPolarHBondContact O-CG1 3.45Å; C58-I62 PolarHBondContact O-N 3.3Å; C58-W77 HydrophobicContact CB-CD2 4.43Å; C58-W77 HydrophobicContact CB-CE3 3.64Å; C58-W77 HydrophobicContact CB-CZ3 4.32Å; C58-C82 WeakPolarHBondContact CA-SG 3.3Å; C58-C82 HydrophobicContact CB-CB 3.54Å; C58-C82 WeakPolarHBondContact CB-SG 3.28Å; C58-C82 WeakPolarHBondContact SG-CA 3.39Å; C58-C82 WeakPolarHBondContact SG-CB 3.5Å; C58-C82 CovalentContact SG-SG 2.03Å; C58-C82 PolarHBondContact SG-SG 3.33Å
59E93.1Very high86.4Confident73 Ų7385.9 Ų85.934%0.34144%0.443SS..Hα-helixtrans-60.1-41-179.5-69.1-171.3-171.700112.5K55 K56 I62 K63K55-E59 WeakPolarHBondContact CE-OE1 3.23Å; K55-E59 IonicContact NZ-OE1 3.41Å; K55-E59 PolarHBondContact NZ-OE1 3.3Å; K55-E59 PolarHBondContact O-N 2.91Å; K56-E59 PolarHBondContact O-N 2.7Å; E59-I62 PolarHBondContact O-N 3.38Å; E59-K63 WeakPolarHBondContact O-CD 3.38Å; E59-K63 WeakPolarHBondContact O-CE 3.36Å; E59-K63 WeakPolarHBondContact O-CG 3.26Å; E59-K63 PolarHBondContact O-N 3.07Å; E59-K63 IonicContact OE2-NZ 3.74Å; E59-K63 PolarHBondContact OE2-NZ 3.14Å; E59-K63 VanDerWaalsContact OE2-NZ 3.07Å
60D92.3Very high85.7Confident72 Ų7288.5 Ų88.539%0.38546%0.457SS..Hα-helixtrans-73.3-33.9-179-65.5-16.7000111.6K56 C58 K63 S64K56-D60 PolarHBondContact O-N 3.44Å; C58-D60 VanDerWaalsContact C-N 3.31Å; C58-D60 PolarHBondContact O-N 2.92Å; D60-K63 PolarHBondContact O-N 2.78Å; D60-K63 IonicContact OD1-NZ 2.94Å; D60-K63 PolarHBondContact OD1-NZ 2.84Å; D60-S64 WeakPolarHBondContact O-CB 3.4Å; D60-S64 PolarHBondContact O-N 2.88Å; D60-S64 PolarHBondContact O-OG 3.39Å
61N89.6Confident85Confident96 Ų9686.9 Ų86.951%0.51346%0.458SS..Hα-helixtrans-61.8-42.5167.7-80-24.4000112.1K57 C58 S64 R65K57-N61 VanDerWaalsContact O-CB 3.28Å; K57-N61 WeakPolarHBondContact O-CB 3.47Å; K57-N61 PolarHBondContact O-N 2.81Å; K57-N61 PolarHBondContact O-ND2 3.37Å; C58-N61 PolarHBondContact O-N 2.86Å; N61-S64 PolarHBondContact O-N 3.31Å; N61-S64 PolarHBondContact O-OG 2.84Å; N61-R65 PolarHBondContact O-N 3.26Å
62I89.1Confident84.8Confident54 Ų5487.1 Ų87.128%0.27746%0.457SS..Hα-helixtrans-64.6-45.4176.6-67.5165.7000110.7C58 E59 S64 R65 P75C58-I62 WeakPolarHBondContact O-CG1 3.45Å; C58-I62 PolarHBondContact O-N 3.3Å; E59-I62 PolarHBondContact O-N 3.38Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 2.89Å; I62-R65 PolarHBondContact O-N 2.92Å; I62-P75 HydrophobicContact CD1-CB 4.49Å; I62-P75 HydrophobicContact CG1-CB 4.16Å; I62-P75 HydrophobicContact CG1-CG 4.15Å
63K87.2Confident84.6Confident132 Ų13283.3 Ų83.357%0.57443%0.434SS*.Hα-helixtrans-63.1-30.2177-67.2159.8-153.3157.70113.3E59 D60E59-K63 WeakPolarHBondContact O-CD 3.38Å; E59-K63 WeakPolarHBondContact O-CE 3.36Å; E59-K63 WeakPolarHBondContact O-CG 3.26Å; E59-K63 PolarHBondContact O-N 3.07Å; E59-K63 IonicContact OE2-NZ 3.74Å; E59-K63 PolarHBondContact OE2-NZ 3.14Å; E59-K63 VanDerWaalsContact OE2-NZ 3.07Å; D60-K63 PolarHBondContact O-N 2.78Å; D60-K63 IonicContact OD1-NZ 2.94Å; D60-K63 PolarHBondContact OD1-NZ 2.84Å
64S83.9Confident84.4Confident92 Ų9282.1 Ų82.164%0.64344%0.436SS*.Hα-helixtrans-78.9-20.3179.775.50000114D60 N61 I62D60-S64 WeakPolarHBondContact O-CB 3.4Å; D60-S64 PolarHBondContact O-N 2.88Å; D60-S64 PolarHBondContact O-OG 3.39Å; N61-S64 PolarHBondContact O-N 3.31Å; N61-S64 PolarHBondContact O-OG 2.84Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 2.89Å
65R74.4Confident84.3Confident122 Ų12282.2 Ų82.246%0.4644%0.435SS..SBendtrans-80.3141.2175.5-75.2167.1165.7-1095.4109.8N61 I62 E85N61-R65 PolarHBondContact O-N 3.26Å; I62-R65 PolarHBondContact O-N 2.92Å; R65-E85 IonicContact CZ-OE1 3.67Å; R65-E85 IonicContact NH1-OE1 2.7Å; R65-E85 PolarHBondContact NH1-OE1 3.47Å; R65-E85 IonicContact NH1-OE2 2.69Å; R65-E85 PolarHBondContact NH1-OE2 2.89Å; R65-E85 IonicContact NH2-OE1 2.9Å; R65-E85 PolarHBondContact NH2-OE1 2.93Å
66G69.9Low84.2Confident66 Ų6680.9 Ų80.968%0.6843%0.43SS*.  trans-74.6-165.2179.500000113.3I68G66-I68 PolarHBondContact O-N 3.36Å; G66-I68 VanDerWaalsContact O-N 3.17Å
67K69.8Low84.1Confident215 Ų21577.5 Ų77.594%0.93541%0.414SS*.PPolyproline II helixtrans-55.8122.5173.1-74.3-170.5173.9-171.10110.6
68I71.9Confident83.9Confident61 Ų6174.3 Ų74.331%0.31340%0.402SS..PPolyproline II helixtrans-68.1141.4173.2-58.9155000108.3G66 F72 S74G66-I68 PolarHBondContact O-N 3.36Å; G66-I68 VanDerWaalsContact O-N 3.17Å; I68-F72 HydrophobicContact CG2-CB 3.94Å; I68-S74 WeakPolarHBondContact CD1-OG 3.24Å
69P72.8Confident83.7Confident77 Ų7775.8 Ų75.850%0.542%0.418SS..PPolyproline II helixtrans-64.6143.5175.9-19.132000112.2G71 F72P69-G71 PolarHBondContact O-N 2.83Å; P69-F72 HydrophobicContact CB-CD2 3.81Å; P69-F72 HydrophobicContact CB-CE2 3.97Å; P69-F72 HydrophobicContact CG-CD2 4.37Å; P69-F72 HydrophobicContact CG-CE2 4.44Å; P69-F72 PolarHBondContact O-N 3.28Å
70D71.1Confident83.7Confident167 Ų16775.1 Ų75.189%0.89342%0.416SS*.THydrogen-bonded Turntrans-58.8133.1-179.2-64.5-57.3000111.7
71G76.5Confident83.7Confident39 Ų3971.9 Ų71.940%0.40240%0.399SS..THydrogen-bonded Turntrans93-6179.800000116P69 P88 G117P69-G71 PolarHBondContact O-N 2.83Å; G71-P88 WeakPolarHBondContact O-CB 3.42Å; G71-P88 WeakPolarHBondContact O-CG 3.42Å; G71-G117 WeakPolarHBondContact O-CA 3.36Å
72F86.3Confident83.9Confident58 Ų5869.4 Ų69.425%0.25439%0.389SS..SBendtrans-85.7145.4174-76.3-109.8000112.1I68 P69 S74 G86 H87I68-F72 HydrophobicContact CG2-CB 3.94Å; P69-F72 HydrophobicContact CB-CD2 3.81Å; P69-F72 HydrophobicContact CB-CE2 3.97Å; P69-F72 HydrophobicContact CG-CD2 4.37Å; P69-F72 HydrophobicContact CG-CE2 4.44Å; P69-F72 PolarHBondContact O-N 3.28Å; F72-S74 PolarHBondContact O-N 3.35Å; F72-G86 WeakPolarHBondContact CA-O 3.34Å; F72-G86 WeakPolarHBondContact CD1-O 3.43Å; F72-H87 HydrophobicContact CE1-CB 4.48Å; F72-H87 AromaticContact CE1-CD2 3.53Å; F72-H87 AromaticContact CE1-CE1 3.95Å; F72-H87 AromaticContact CE1-CG 3.77Å; F72-H87 AromaticContact CE1-NE2 3.66Å; F72-H87 AromaticContact CZ-CD2 3.98Å
73C89.3Confident84.1Confident0 Ų066.9 Ų66.90%038%0.376CS..BIsolated β-bridgetrans-68.6124169-71.30000110.5E85 G86 C113 G117 T118 W119C73-E85 WeakPolarHBondContact O-CA 3.25Å; C73-G86 PolarHBondContact N-O 3.42Å; C73-G86 PolarHBondContact O-N 3.41Å; C73-C113 HydrophobicContact CB-CB 3.82Å; C73-C113 WeakPolarHBondContact CB-SG 3.25Å; C73-C113 WeakPolarHBondContact SG-CA 3.49Å; C73-C113 WeakPolarHBondContact SG-CB 3.49Å; C73-C113 CovalentContact SG-SG 2.02Å; C73-C113 PolarHBondContact SG-SG 3.37Å; C73-G117 WeakPolarHBondContact CA-O 3.3Å; C73-T118 PolarHBondContact SG-O 2.91Å; C73-W119 HydrophobicContact CB-CD2 3.86Å; C73-W119 HydrophobicContact CB-CE3 4.1Å; C73-W119 HydrophobicContact CB-CG 4.45Å; C73-W119 HydrophobicContact CB-CH2 4.17Å; C73-W119 HydrophobicContact CB-CZ2 3.9Å; C73-W119 HydrophobicContact CB-CZ3 4.26Å
74S89.1Confident84.3Confident64 Ų6463 Ų6345%0.44836%0.364SS..PPolyproline II helixtrans-68.5139.7-178.8-64.40000111.9I68 F72 W119I68-S74 WeakPolarHBondContact CD1-OG 3.24Å; F72-S74 PolarHBondContact O-N 3.35Å; S74-W119 PolarHBondContact O-NE1 3.46Å
75P90.8Very high84.7Confident16 Ų1662.1 Ų62.110%0.10435%0.35CS..PPolyproline II helixtrans-64140.7173.728.8-35000110.8I62 W83I62-P75 HydrophobicContact CD1-CB 4.49Å; I62-P75 HydrophobicContact CG1-CB 4.16Å; I62-P75 HydrophobicContact CG1-CG 4.15Å; P75-W83 WeakPolarHBondContact CA-O 3.37Å; P75-W83 WeakPolarHBondContact CB-O 3.37Å
76E90.7Very high85.4Confident59 Ų5956.3 Ų56.328%0.27633%0.328SS..EExtended strand (participates in β ladder)trans-148.6160.3-177.460.8163.8-112.800112.2W83 R111 W119E76-W83 HydrophobicContact CG-CB 4.49Å; E76-W83 PolarHBondContact N-O 3.35Å; E76-W83 PolarHBondContact O-N 3.06Å; E76-R111 IonicContact OE1-CZ 2.85Å; E76-R111 IonicContact OE1-NH1 2.72Å; E76-R111 PolarHBondContact OE1-NH1 2.98Å; E76-R111 IonicContact OE1-NH2 3.15Å; E76-R111 PolarHBondContact OE1-NH2 2.89Å; E76-R111 IonicContact OE2-CZ 3.87Å; E76-R111 IonicContact OE2-NH2 2.95Å; E76-R111 PolarHBondContact OE2-NH2 3.38Å; E76-W119 PolarHBondContact OE2-NE1 2.92Å
77W91.9Very high86.4Confident48 Ų4858.2 Ų58.218%0.18232%0.319CS..EExtended strand (participates in β ladder)trans-96117.1168.2178.5-97.2000109.5L51 A54 K55 C58 G79 I80 V81 C82 Y99L51-W77 HydrophobicContact CD2-CZ2 4.11Å; L51-W77 HydrophobicContact CG-CZ2 4.14Å; A54-W77 HydrophobicContact CB-CH2 3.93Å; A54-W77 HydrophobicContact CB-CZ3 4.32Å; K55-W77 HydrophobicContact CB-CD2 4.02Å; K55-W77 HydrophobicContact CB-CG 4.47Å; K55-W77 HydrophobicContact CB-CH2 4.41Å; K55-W77 HydrophobicContact CB-CZ2 3.88Å; K55-W77 HydrophobicContact CG-CD2 4.09Å; K55-W77 HydrophobicContact CG-CG 4.01Å; C58-W77 HydrophobicContact CB-CD2 4.43Å; C58-W77 HydrophobicContact CB-CE3 3.64Å; C58-W77 HydrophobicContact CB-CZ3 4.32Å; W77-G79 VanDerWaalsContact C-N 3.35Å; W77-G79 VanDerWaalsContact NE1-CA 3.29Å; W77-I80 WeakPolarHBondContact CH2-O 3.21Å; W77-V81 VanDerWaalsContact CZ3-C 3.47Å; W77-C82 HydrophobicContact CE3-CB 4.16Å; W77-C82 HydrophobicContact CZ3-CB 4.44Å; W77-Y99 HydrophobicContact CH2-CE2 4.3Å
78D90.1Very high87.4Confident47 Ų4750.9 Ų50.925%0.25129%0.293SS..  trans-88.2-1.5-176.275-8.1000114.5I80 V81 W83 Y131D78-I80 WeakPolarHBondContact OD1-CA 3.37Å; D78-I80 PolarHBondContact OD1-N 3.41Å; D78-V81 PolarHBondContact N-O 3.46Å; D78-V81 PolarHBondContact OD1-N 3.5Å; D78-W83 VanDerWaalsContact CG-NE1 3.32Å; D78-W83 PolarHBondContact OD2-NE1 3.48Å; D78-Y131 PolarHBondContact OD1-OH 2.86Å; D78-Y131 PolarHBondContact OD2-OH 3.31Å
79G89.1Confident88.1Confident34 Ų3450.2 Ų50.235%0.35130%0.301SS..SBendtrans110.4-23.8-171.900000113.5W77W77-G79 VanDerWaalsContact C-N 3.35Å; W77-G79 VanDerWaalsContact NE1-CA 3.29Å
80I91.6Very high89Confident58 Ų5851 Ų5130%0.29730%0.301SS..SBendtrans-124.3-42.4-174.3-55.5-178.8000111.3W77 D78 Y99 I100 F103 Y131W77-I80 WeakPolarHBondContact CH2-O 3.21Å; D78-I80 WeakPolarHBondContact OD1-CA 3.37Å; D78-I80 PolarHBondContact OD1-N 3.41Å; I80-Y99 PolarHBondContact O-OH 2.93Å; I80-I100 HydrophobicContact CG2-CD1 3.64Å; I80-F103 HydrophobicContact CG2-CE2 4.01Å; I80-F103 HydrophobicContact CG2-CZ 4.38Å; I80-Y131 HydrophobicContact CG2-CE1 4.22Å
81V93.6Very high90.1Very high4 Ų446.8 Ų46.82%0.02428%0.278CS..  trans-136162.6-178.8-50.10000112.9W77 D78 W83 T94 P97 Y131W77-V81 VanDerWaalsContact CZ3-C 3.47Å; D78-V81 PolarHBondContact N-O 3.46Å; D78-V81 PolarHBondContact OD1-N 3.5Å; V81-W83 HydrophobicContact CG2-CD2 4.12Å; V81-W83 VanDerWaalsContact CG2-CE2 3.49Å; V81-W83 HydrophobicContact CG2-CG 4.29Å; V81-W83 HydrophobicContact CG2-CZ2 3.82Å; V81-W83 VanDerWaalsContact CG2-NE1 3.33Å; V81-T94 HydrophobicContact CG2-CG2 4.05Å; V81-P97 HydrophobicContact CG1-CG 4.07Å; V81-Y131 HydrophobicContact CG1-CE1 4.13Å; V81-Y131 VanDerWaalsContact CG2-OH 3.25Å; V81-Y131 WeakPolarHBondContact CG2-OH 3.44Å
82C93.6Very high91Very high44 Ų4445.7 Ų45.730%0.29726%0.264SS..EExtended strand (participates in β ladder)trans-92110.8170.3-160.80000109.7C58 W77C58-C82 WeakPolarHBondContact CA-SG 3.3Å; C58-C82 HydrophobicContact CB-CB 3.54Å; C58-C82 WeakPolarHBondContact CB-SG 3.28Å; C58-C82 WeakPolarHBondContact SG-CA 3.39Å; C58-C82 WeakPolarHBondContact SG-CB 3.5Å; C58-C82 CovalentContact SG-SG 2.03Å; C58-C82 PolarHBondContact SG-SG 3.33Å; W77-C82 HydrophobicContact CE3-CB 4.16Å; W77-C82 HydrophobicContact CZ3-CB 4.44Å
83W93.3Very high91.3Very high1 Ų149.1 Ų49.10%0.00428%0.279CS..EExtended strand (participates in β ladder)trans-79.9131.7177.9-71.994.2000111P75 E76 D78 V81 V92 T94 A109 R111 W119 A129P75-W83 WeakPolarHBondContact CA-O 3.37Å; P75-W83 WeakPolarHBondContact CB-O 3.37Å; E76-W83 HydrophobicContact CG-CB 4.49Å; E76-W83 PolarHBondContact N-O 3.35Å; E76-W83 PolarHBondContact O-N 3.06Å; D78-W83 VanDerWaalsContact CG-NE1 3.32Å; D78-W83 PolarHBondContact OD2-NE1 3.48Å; V81-W83 HydrophobicContact CG2-CD2 4.12Å; V81-W83 VanDerWaalsContact CG2-CE2 3.49Å; V81-W83 HydrophobicContact CG2-CG 4.29Å; V81-W83 HydrophobicContact CG2-CZ2 3.82Å; V81-W83 VanDerWaalsContact CG2-NE1 3.33Å; W83-V92 HydrophobicContact CE3-CG1 4.08Å; W83-V92 HydrophobicContact CZ3-CG1 4.37Å; W83-T94 HydrophobicContact CE3-CG2 4.34Å; W83-T94 HydrophobicContact CH2-CG2 3.92Å; W83-T94 HydrophobicContact CZ2-CG2 4.4Å; W83-T94 HydrophobicContact CZ3-CG2 3.89Å; W83-A109 HydrophobicContact CH2-CB 3.92Å; W83-A109 HydrophobicContact CZ2-CB 4.27Å; W83-R111 HydrophobicContact CD2-CB 4.02Å; W83-R111 HydrophobicContact CD2-CG 4.35Å; W83-R111 HydrophobicContact CE3-CB 3.63Å; W83-R111 HydrophobicContact CE3-CG 4.36Å; W83-R111 HydrophobicContact CH2-CB 3.52Å; W83-R111 HydrophobicContact CZ2-CB 3.88Å; W83-R111 HydrophobicContact CZ3-CB 3.37Å; W83-R111 HydrophobicContact CZ3-CG 4.5Å; W83-W119 HydrophobicContact CB-CH2 4.34Å; W83-W119 HydrophobicContact CB-CZ2 4.01Å; W83-A129 HydrophobicContact CZ2-CB 4.24Å
84P91.9Very high91.5Very high50 Ų5050.9 Ų50.933%0.32529%0.29SS..  trans-73.7176.217333-35.7000111.4V92 W119P84-V92 HydrophobicContact CG-CG1 3.71Å; P84-W119 WeakPolarHBondContact O-CZ2 3.25Å
85E90.9Very high91.8Very high75 Ų7553.3 Ų53.335%0.3530%0.297SS..PPolyproline II helixtrans-63.1134.5175.966.2-130.5123.900112.2R65 C73R65-E85 IonicContact CZ-OE1 3.67Å; R65-E85 IonicContact NH1-OE1 2.7Å; R65-E85 PolarHBondContact NH1-OE1 3.47Å; R65-E85 IonicContact NH1-OE2 2.69Å; R65-E85 PolarHBondContact NH1-OE2 2.89Å; R65-E85 IonicContact NH2-OE1 2.9Å; R65-E85 PolarHBondContact NH2-OE1 2.93Å; C73-E85 WeakPolarHBondContact O-CA 3.25Å
86G90.4Very high91.9Very high0 Ų052.7 Ų52.70%029%0.293CS..BIsolated β-bridgetrans-103.5129.9-178.700000112.6F72 C73F72-G86 WeakPolarHBondContact CA-O 3.34Å; F72-G86 WeakPolarHBondContact CD1-O 3.43Å; C73-G86 PolarHBondContact N-O 3.42Å; C73-G86 PolarHBondContact O-N 3.41Å
87H89.6Confident92Very high105 Ų10550.3 Ų50.349%0.48628%0.282SS..PPolyproline II helixtrans-71.9136.9169.2-70.472.6000109.5F72 G89 D90 C113F72-H87 HydrophobicContact CE1-CB 4.48Å; F72-H87 AromaticContact CE1-CD2 3.53Å; F72-H87 AromaticContact CE1-CE1 3.95Å; F72-H87 AromaticContact CE1-CG 3.77Å; F72-H87 AromaticContact CE1-NE2 3.66Å; F72-H87 AromaticContact CZ-CD2 3.98Å; H87-G89 PolarHBondContact O-N 2.69Å; H87-D90 HydrophobicContact CB-CB 4.17Å; H87-D90 WeakPolarHBondContact CB-OD2 3.36Å; H87-D90 PolarHBondContact O-N 3.4Å; H87-D90 VanDerWaalsContact O-N 3.09Å; H87-C113 WeakPolarHBondContact O-CB 3.34Å
88P90.4Very high91.9Very high62 Ų6254.1 Ų54.140%0.40331%0.307SS..THydrogen-bonded Turntrans-63.1119.1-175.321.6-31.3000112.4G71G71-P88 WeakPolarHBondContact O-CB 3.42Å; G71-P88 WeakPolarHBondContact O-CG 3.42Å
89G88.2Confident91.9Very high46 Ų4654.9 Ų54.947%0.47431%0.306SS..THydrogen-bonded Turntrans100.9-18.5-17700000114.9H87 C113H87-G89 PolarHBondContact O-N 2.69Å; G89-C113 CarbonylContact C-O 3.49Å; G89-C113 WeakPolarHBondContact CA-O 3.17Å; G89-C113 PolarHBondContact N-O 3.38Å
90D91.4Very high91.8Very high93 Ų9354.4 Ų54.450%0.49730%0.295SS..  trans-83.5159-172.3-80.4-22.4000114.4H87 C113H87-D90 HydrophobicContact CB-CB 4.17Å; H87-D90 WeakPolarHBondContact CB-OD2 3.36Å; H87-D90 PolarHBondContact O-N 3.4Å; H87-D90 VanDerWaalsContact O-N 3.09Å; D90-C113 PolarHBondContact O-N 2.94Å
91L93.4Very high91.4Very high79 Ų7957.8 Ų57.841%0.41431%0.31SS..EExtended strand (participates in β ladder)trans-91.7103.7168.5-169.574.2000109.5Y110 R111 R112 W128L91-Y110 HydrophobicContact CD2-CD1 3.84Å; L91-Y110 HydrophobicContact CD2-CG 4.48Å; L91-Y110 HydrophobicContact CG-CD1 4.35Å; L91-R111 CarbonylContact C-O 3.36Å; L91-R112 HydrophobicContact CD1-CB 4.32Å; L91-W128 HydrophobicContact CD1-CH2 4.16Å; L91-W128 HydrophobicContact CD1-CZ3 3.86Å
92V94.5Very high90.9Very high17 Ų1762 Ų6210%0.10333%0.332CS..EExtended strand (participates in β ladder)trans-76.3140.3173.1-176.70000109.2W83 P84 Y110 R111 W119W83-V92 HydrophobicContact CE3-CG1 4.08Å; W83-V92 HydrophobicContact CZ3-CG1 4.37Å; P84-V92 HydrophobicContact CG-CG1 3.71Å; V92-Y110 WeakPolarHBondContact O-CA 3.17Å; V92-R111 PolarHBondContact N-O 3.1Å; V92-R111 PolarHBondContact O-N 2.99Å; V92-R111 VanDerWaalsContact O-O 3.07Å; V92-W119 HydrophobicContact CB-CH2 4.16Å; V92-W119 HydrophobicContact CB-CZ3 4.07Å; V92-W119 HydrophobicContact CG1-CH2 4.25Å; V92-W119 HydrophobicContact CG2-CH2 3.87Å; V92-W119 HydrophobicContact CG2-CZ3 3.79Å
93F94.1Very high90.7Very high130 Ų13061.4 Ų61.457%0.5732%0.324SS*.EExtended strand (participates in β ladder)trans-131.5153.1175.959.9-88.6000111.1L108 A109 Y110F93-L108 HydrophobicContact CD2-CD1 4.19Å; F93-L108 HydrophobicContact CD2-CD2 4.26Å; F93-A109 CarbonylContact C-O 3.59Å; F93-A109 VanDerWaalsContact CA-O 3.26Å; F93-A109 WeakPolarHBondContact CA-O 3.31Å; F93-Y110 HydrophobicContact CB-CD1 3.93Å; F93-Y110 HydrophobicContact CB-CE1 4.22Å
94T93.5Very high90.4Very high37 Ų3762.5 Ų62.523%0.22733%0.33CS..EExtended strand (participates in β ladder)trans-141.1156.8170.9-176.40000109.7V81 W83 L108 A109V81-T94 HydrophobicContact CG2-CG2 4.05Å; W83-T94 HydrophobicContact CE3-CG2 4.34Å; W83-T94 HydrophobicContact CH2-CG2 3.92Å; W83-T94 HydrophobicContact CZ2-CG2 4.4Å; W83-T94 HydrophobicContact CZ3-CG2 3.89Å; T94-L108 CarbonylContact O-C 3.59Å; T94-L108 WeakPolarHBondContact O-CA 3.47Å; T94-A109 HydrophobicContact CG2-CB 4.04Å; T94-A109 PolarHBondContact N-O 2.69Å; T94-A109 PolarHBondContact O-N 3.09Å
95L93.9Very high90.3Very high115 Ų11563.7 Ų63.760%0.60233%0.331SS*.EExtended strand (participates in β ladder)trans-63.1146.2169.3-75.1158.6000110.5L108L95-L108 HydrophobicContact CD2-CD2 4.06Å; L95-L108 HydrophobicContact CG-CD2 4.31Å
96C93.7Very high90.3Very high2 Ų269.2 Ų69.21%0.01436%0.355CS..PPolyproline II helixtrans-62136167.4-570000109.7F103 N104 G107 C134C96-F103 HydrophobicContact CB-CD2 4.49Å; C96-N104 VanDerWaalsContact CB-O 3.25Å; C96-N104 WeakPolarHBondContact CB-O 3.43Å; C96-N104 PolarHBondContact SG-O 2.95Å; C96-N104 VanDerWaalsContact SG-O 3.36Å; C96-G107 PolarHBondContact N-O 3.05Å; C96-G107 VanDerWaalsContact N-O 3.1Å; C96-G107 PolarHBondContact SG-O 2.78Å; C96-C134 HydrophobicContact CB-CB 3.79Å; C96-C134 WeakPolarHBondContact CB-SG 3.41Å; C96-C134 WeakPolarHBondContact SG-CA 3.39Å; C96-C134 WeakPolarHBondContact SG-CB 3.3Å; C96-C134 CovalentContact SG-SG 2.03Å; C96-C134 PolarHBondContact SG-SG 3.47Å
97P92.9Very high90.3Very high9 Ų969.3 Ų69.36%0.05836%0.355CS..PPolyproline II helixtrans-64.7139.2-173.123.8-35.7000114.1V81 Y99 I100 F103 H105V81-P97 HydrophobicContact CG1-CG 4.07Å; P97-Y99 VanDerWaalsContact C-N 3.27Å; P97-Y99 HydrophobicContact CB-CD1 3.82Å; P97-Y99 HydrophobicContact CB-CD2 4.02Å; P97-Y99 HydrophobicContact CB-CE1 3.44Å; P97-Y99 VanDerWaalsContact CB-CE1 3.44Å; P97-Y99 HydrophobicContact CB-CE2 3.66Å; P97-Y99 HydrophobicContact CB-CG 4.09Å; P97-Y99 HydrophobicContact CG-CE2 4.22Å; P97-Y99 PolarHBondContact O-N 2.96Å; P97-I100 HydrophobicContact CG-CB 4.33Å; P97-I100 HydrophobicContact CG-CD1 3.74Å; P97-I100 HydrophobicContact CG-CG1 3.96Å; P97-F103 HydrophobicContact CG-CD2 3.9Å; P97-F103 HydrophobicContact CG-CE2 4.15Å; P97-H105 PolarHBondContact O-ND1 3.23Å; P97-H105 VanDerWaalsContact O-ND1 3.07Å
98D90.4Very high90.5Very high129 Ų12966.4 Ų66.469%0.6934%0.343SS*.THydrogen-bonded Turntrans-71-21.8172.6-57.2-52.4000112.9I100 H105D98-I100 VanDerWaalsContact C-N 3.29Å; D98-I100 PolarHBondContact O-N 3.29Å; D98-H105 IonicContact OD1-CG 3.52Å
99Y88.6Confident90.7Very high63 Ų6363.4 Ų63.425%0.24732%0.324CS..THydrogen-bonded Turntrans-86.411.4-178.654.9-97.1000114.2Q47 A54 W77 I80 P97Q47-Y99 PolarHBondContact NE2-O 3.5Å; A54-Y99 HydrophobicContact CB-CD1 4.15Å; A54-Y99 HydrophobicContact CB-CD2 4.03Å; A54-Y99 HydrophobicContact CB-CE1 3.78Å; A54-Y99 HydrophobicContact CB-CE2 3.65Å; A54-Y99 HydrophobicContact CB-CG 4.26Å; W77-Y99 HydrophobicContact CH2-CE2 4.3Å; I80-Y99 PolarHBondContact O-OH 2.93Å; P97-Y99 VanDerWaalsContact C-N 3.27Å; P97-Y99 HydrophobicContact CB-CD1 3.82Å; P97-Y99 HydrophobicContact CB-CD2 4.02Å; P97-Y99 HydrophobicContact CB-CE1 3.44Å; P97-Y99 VanDerWaalsContact CB-CE1 3.44Å; P97-Y99 HydrophobicContact CB-CE2 3.66Å; P97-Y99 HydrophobicContact CB-CG 4.09Å; P97-Y99 HydrophobicContact CG-CE2 4.22Å; P97-Y99 PolarHBondContact O-N 2.96Å
100I87.8Confident91Very high23 Ų2363.7 Ų63.712%0.11831%0.311CS..  trans-121107170.9-60.8-176.3000107.4I80 P97 D98 D102 F103 H105I80-I100 HydrophobicContact CG2-CD1 3.64Å; P97-I100 HydrophobicContact CG-CB 4.33Å; P97-I100 HydrophobicContact CG-CD1 3.74Å; P97-I100 HydrophobicContact CG-CG1 3.96Å; D98-I100 VanDerWaalsContact C-N 3.29Å; D98-I100 PolarHBondContact O-N 3.29Å; I100-D102 VanDerWaalsContact C-N 3.31Å; I100-D102 PolarHBondContact O-N 3.42Å; I100-F103 HydrophobicContact CB-CB 4.36Å; I100-F103 HydrophobicContact CB-CD2 4.05Å; I100-F103 HydrophobicContact CB-CG 4.07Å; I100-F103 HydrophobicContact CD1-CD2 4.21Å; I100-F103 HydrophobicContact CD1-CE2 3.87Å; I100-F103 HydrophobicContact CD1-CZ 4.26Å; I100-F103 HydrophobicContact CG2-CB 4.25Å; I100-F103 HydrophobicContact CG2-CD1 3.68Å; I100-F103 HydrophobicContact CG2-CD2 4.03Å; I100-F103 HydrophobicContact CG2-CE1 4Å; I100-F103 HydrophobicContact CG2-CE2 4.33Å; I100-F103 HydrophobicContact CG2-CG 3.71Å; I100-F103 HydrophobicContact CG2-CZ 4.31Å; I100-F103 PolarHBondContact O-N 3.48Å; I100-H105 PolarHBondContact O-CE1 3.37Å; I100-H105 VanDerWaalsContact O-CE1 3.28Å
101H83.4Confident91.1Very high129 Ų12959.3 Ų59.360%0.59729%0.287SS*.THydrogen-bonded Turntrans-56.9-41.5-169.5177.4-90.1000113.4L42 F103L42-H101 HydrophobicContact CD2-CB 3.99Å; H101-F103 PolarHBondContact O-N 3.44Å
102D83.7Confident91.1Very high94 Ų9460.7 Ų60.750%0.50329%0.287SS..THydrogen-bonded Turntrans-85.811.4-171.8-50.2-31.7000113.7I100 L138I100-D102 VanDerWaalsContact C-N 3.31Å; I100-D102 PolarHBondContact O-N 3.42Å; D102-L138 HydrophobicContact CB-CD2 3.82Å
103F88.3Confident91Very high30 Ų3059.9 Ų59.913%0.13228%0.282CS..SBendtrans-98.1145-179.6-85.515000112.8I80 C96 P97 I100 H101 H105 C134 L138I80-F103 HydrophobicContact CG2-CE2 4.01Å; I80-F103 HydrophobicContact CG2-CZ 4.38Å; C96-F103 HydrophobicContact CB-CD2 4.49Å; P97-F103 HydrophobicContact CG-CD2 3.9Å; P97-F103 HydrophobicContact CG-CE2 4.15Å; I100-F103 HydrophobicContact CB-CB 4.36Å; I100-F103 HydrophobicContact CB-CD2 4.05Å; I100-F103 HydrophobicContact CB-CG 4.07Å; I100-F103 HydrophobicContact CD1-CD2 4.21Å; I100-F103 HydrophobicContact CD1-CE2 3.87Å; I100-F103 HydrophobicContact CD1-CZ 4.26Å; I100-F103 HydrophobicContact CG2-CB 4.25Å; I100-F103 HydrophobicContact CG2-CD1 3.68Å; I100-F103 HydrophobicContact CG2-CD2 4.03Å; I100-F103 HydrophobicContact CG2-CE1 4Å; I100-F103 HydrophobicContact CG2-CE2 4.33Å; I100-F103 HydrophobicContact CG2-CG 3.71Å; I100-F103 HydrophobicContact CG2-CZ 4.31Å; I100-F103 PolarHBondContact O-N 3.48Å; H101-F103 PolarHBondContact O-N 3.44Å; F103-H105 PolarHBondContact O-N 2.9Å; F103-H105 PolarHBondContact O-ND1 3.24Å; F103-C134 HydrophobicContact CD2-CB 3.79Å; F103-C134 HydrophobicContact CE2-CB 4Å; F103-C134 HydrophobicContact CG-CB 4.08Å; F103-C134 HydrophobicContact CZ-CB 4.48Å; F103-L138 HydrophobicContact CE1-CD1 4.31Å
104N88.1Confident90.9Very high24 Ų2456.3 Ų56.313%0.12827%0.269CS..  trans-70.289.8165.5172.530.3000110.5C96 K106 G107 E133 C134 F137C96-N104 VanDerWaalsContact CB-O 3.25Å; C96-N104 WeakPolarHBondContact CB-O 3.43Å; C96-N104 PolarHBondContact SG-O 2.95Å; C96-N104 VanDerWaalsContact SG-O 3.36Å; N104-K106 PolarHBondContact O-N 3.5Å; N104-K106 PolarHBondContact OD1-N 2.94Å; N104-G107 PolarHBondContact ND2-N 3.1Å; N104-G107 PolarHBondContact O-N 3.2Å; N104-E133 VanDerWaalsContact CB-O 3.3Å; N104-E133 WeakPolarHBondContact CB-O 3.35Å; N104-E133 PolarHBondContact ND2-O 2.9Å; N104-C134 PolarHBondContact N-O 3.45Å; N104-F137 HydrophobicContact CB-CD2 3.65Å; N104-F137 HydrophobicContact CB-CE2 3.54Å
105H89.6Confident90.7Very high75 Ų7559 Ų5935%0.34729%0.289SS..THydrogen-bonded Turntrans-56.7-15.4178.9-42.9-57.4000114.5P97 D98 I100 F103P97-H105 PolarHBondContact O-ND1 3.23Å; P97-H105 VanDerWaalsContact O-ND1 3.07Å; D98-H105 IonicContact OD1-CG 3.52Å; I100-H105 PolarHBondContact O-CE1 3.37Å; I100-H105 VanDerWaalsContact O-CE1 3.28Å; F103-H105 PolarHBondContact O-N 2.9Å; F103-H105 PolarHBondContact O-ND1 3.24Å
106K90Very high90.4Very high192 Ų19259.6 Ų59.684%0.83529%0.293SS*.THydrogen-bonded Turntrans-89.6-5.2176.2-62.5178.5-178.2172.80114.1N104N104-K106 PolarHBondContact O-N 3.5Å; N104-K106 PolarHBondContact OD1-N 2.94Å
107G91Very high90Very high1 Ų160.3 Ų60.31%0.0130%0.3CS..SBendtrans-84.1170.6176.700000113C96 N104C96-G107 PolarHBondContact N-O 3.05Å; C96-G107 VanDerWaalsContact N-O 3.1Å; C96-G107 PolarHBondContact SG-O 2.78Å; N104-G107 PolarHBondContact ND2-N 3.1Å; N104-G107 PolarHBondContact O-N 3.2Å
108L94.1Very high89.8Confident44 Ų4463.5 Ų63.523%0.2332%0.32CS..EExtended strand (participates in β ladder)trans-112.8138.6171-62.3176.9000111.9F93 T94 L95 Y110 E133F93-L108 HydrophobicContact CD2-CD1 4.19Å; F93-L108 HydrophobicContact CD2-CD2 4.26Å; T94-L108 CarbonylContact O-C 3.59Å; T94-L108 WeakPolarHBondContact O-CA 3.47Å; L95-L108 HydrophobicContact CD2-CD2 4.06Å; L95-L108 HydrophobicContact CG-CD2 4.31Å; L108-Y110 HydrophobicContact CB-CE1 4.13Å; L108-Y110 HydrophobicContact CB-CE2 3.93Å; L108-Y110 HydrophobicContact CD1-CE1 4.31Å; L108-Y110 WeakPolarHBondContact O-CE2 3.28Å; L108-E133 PolarHBondContact N-OE2 3.03Å
109A94.4Very high89.8Confident0 Ų058.2 Ų58.20%029%0.29CS..EExtended strand (participates in β ladder)trans-92.4139.1162.500000109.3W83 F93 T94 N130 Y131W83-A109 HydrophobicContact CH2-CB 3.92Å; W83-A109 HydrophobicContact CZ2-CB 4.27Å; F93-A109 CarbonylContact C-O 3.59Å; F93-A109 VanDerWaalsContact CA-O 3.26Å; F93-A109 WeakPolarHBondContact CA-O 3.31Å; T94-A109 HydrophobicContact CG2-CB 4.04Å; T94-A109 PolarHBondContact N-O 2.69Å; T94-A109 PolarHBondContact O-N 3.09Å; A109-N130 WeakPolarHBondContact CA-O 3.44Å; A109-Y131 HydrophobicContact CB-CD1 3.69Å; A109-Y131 HydrophobicContact CB-CE1 3.55Å; A109-Y131 HydrophobicContact CB-CG 4.49Å
110Y94.4Very high89.9Confident52 Ų5258.2 Ų58.220%0.20429%0.292CS..EExtended strand (participates in β ladder)trans-121.9143.1-175.4-54.8-90.9000112.5L91 V92 F93 L108 A129 N130 E133L91-Y110 HydrophobicContact CD2-CD1 3.84Å; L91-Y110 HydrophobicContact CD2-CG 4.48Å; L91-Y110 HydrophobicContact CG-CD1 4.35Å; V92-Y110 WeakPolarHBondContact O-CA 3.17Å; F93-Y110 HydrophobicContact CB-CD1 3.93Å; F93-Y110 HydrophobicContact CB-CE1 4.22Å; L108-Y110 HydrophobicContact CB-CE1 4.13Å; L108-Y110 HydrophobicContact CB-CE2 3.93Å; L108-Y110 HydrophobicContact CD1-CE1 4.31Å; L108-Y110 WeakPolarHBondContact O-CE2 3.28Å; Y110-A129 CarbonylContact O-C 3.6Å; Y110-A129 WeakPolarHBondContact O-CA 3.22Å; Y110-N130 PolarHBondContact N-O 3.35Å; Y110-N130 PolarHBondContact O-N 2.99Å; Y110-E133 HydrophobicContact CE2-CG 4.36Å; Y110-E133 WeakPolarHBondContact CE2-OE1 3.27Å; Y110-E133 PolarHBondContact OH-OE1 3.34Å
111R93.9Very high90Very high0 Ų061.9 Ų61.90%031%0.311CS..EExtended strand (participates in β ladder)trans-147145178.9-170.1173.4177.3150.6-2110.1E76 W83 L91 V92 W119 W128E76-R111 IonicContact OE1-CZ 2.85Å; E76-R111 IonicContact OE1-NH1 2.72Å; E76-R111 PolarHBondContact OE1-NH1 2.98Å; E76-R111 IonicContact OE1-NH2 3.15Å; E76-R111 PolarHBondContact OE1-NH2 2.89Å; E76-R111 IonicContact OE2-CZ 3.87Å; E76-R111 IonicContact OE2-NH2 2.95Å; E76-R111 PolarHBondContact OE2-NH2 3.38Å; W83-R111 HydrophobicContact CD2-CB 4.02Å; W83-R111 HydrophobicContact CD2-CG 4.35Å; W83-R111 HydrophobicContact CE3-CB 3.63Å; W83-R111 HydrophobicContact CE3-CG 4.36Å; W83-R111 HydrophobicContact CH2-CB 3.52Å; W83-R111 HydrophobicContact CZ2-CB 3.88Å; W83-R111 HydrophobicContact CZ3-CB 3.37Å; W83-R111 HydrophobicContact CZ3-CG 4.5Å; L91-R111 CarbonylContact C-O 3.36Å; V92-R111 PolarHBondContact N-O 3.1Å; V92-R111 PolarHBondContact O-N 2.99Å; V92-R111 VanDerWaalsContact O-O 3.07Å; R111-W119 HydrophobicContact CB-CE3 4.48Å; R111-W119 HydrophobicContact CB-CZ3 4.2Å; R111-W119 HydrophobicContact CG-CD2 4.28Å; R111-W119 HydrophobicContact CG-CE3 3.56Å; R111-W119 HydrophobicContact CG-CZ3 3.74Å; R111-W119 VanDerWaalsContact NH2-CB 3.34Å; R111-W128 WeakPolarHBondContact CG-O 3.46Å
112R92.9Very high90.3Very high109 Ų10960.5 Ų60.541%0.41131%0.311SS..EExtended strand (participates in β ladder)trans-107.2131.5-178.8-175.4173.7-61.9-178.9-1.9111.6L91 K120 W128L91-R112 HydrophobicContact CD1-CB 4.32Å; R112-K120 HydrophobicContact CB-CB 4.08Å; R112-K120 HydrophobicContact CB-CD 4.26Å; R112-K120 WeakPolarHBondContact O-CB 3.36Å; R112-K120 PolarHBondContact O-N 3.33Å; R112-W128 HydrophobicContact CB-CE3 4.06Å; R112-W128 HydrophobicContact CB-CZ3 4.06Å
113C92.9Very high90.3Very high0 Ų059 Ų590%031%0.308CS..BIsolated β-bridgetrans-89124.1164.5-174.10000109.1C73 H87 G89 D90 W119C73-C113 HydrophobicContact CB-CB 3.82Å; C73-C113 WeakPolarHBondContact CB-SG 3.25Å; C73-C113 WeakPolarHBondContact SG-CA 3.49Å; C73-C113 WeakPolarHBondContact SG-CB 3.49Å; C73-C113 CovalentContact SG-SG 2.02Å; C73-C113 PolarHBondContact SG-SG 3.37Å; H87-C113 WeakPolarHBondContact O-CB 3.34Å; G89-C113 CarbonylContact C-O 3.49Å; G89-C113 WeakPolarHBondContact CA-O 3.17Å; G89-C113 PolarHBondContact N-O 3.38Å; D90-C113 PolarHBondContact O-N 2.94Å; C113-W119 HydrophobicContact CB-CE3 4.36Å; C113-W119 HydrophobicContact CB-CZ3 4.31Å
114D90.6Very high89.7Confident55 Ų5563.8 Ų63.829%0.29434%0.339SS..  trans-80.8163174.3-69.2-26.9000110.4N116 G117 T118 K120D114-N116 PolarHBondContact O-N 3.34Å; D114-G117 PolarHBondContact O-N 2.7Å; D114-G117 VanDerWaalsContact O-N 3.17Å; D114-T118 PolarHBondContact N-O 3.17Å; D114-K120 VanDerWaalsContact OD2-CA 3.3Å; D114-K120 WeakPolarHBondContact OD2-CA 3.16Å
115S89.4Confident89.4Confident92 Ų9270 Ų7064%0.64337%0.373SS*.THydrogen-bonded Turntrans-56.7-14.1-176.554.50000115.4
116N87.8Confident89.2Confident129 Ų12973.3 Ų73.369%0.6939%0.386SS*.THydrogen-bonded Turntrans-94.47.7-174.6-57-2.6000112.7D114 T118D114-N116 PolarHBondContact O-N 3.34Å; N116-T118 VanDerWaalsContact C-N 3.28Å; N116-T118 PolarHBondContact O-N 3.27Å
117G85.4Confident89.2Confident16 Ų1666.9 Ų66.917%0.16536%0.363CS..SBendtrans7417.4-174.800000114G71 C73 D114G71-G117 WeakPolarHBondContact O-CA 3.36Å; C73-G117 WeakPolarHBondContact CA-O 3.3Å; D114-G117 PolarHBondContact O-N 2.7Å; D114-G117 VanDerWaalsContact O-N 3.17Å
118T88.7Confident89.2Confident77 Ų7770.2 Ų70.247%0.47238%0.375SS..SBendtrans-115.4138.8-179.454.30000111C73 D114 N116 K120C73-T118 PolarHBondContact SG-O 2.91Å; D114-T118 PolarHBondContact N-O 3.17Å; N116-T118 VanDerWaalsContact C-N 3.28Å; N116-T118 PolarHBondContact O-N 3.27Å; T118-K120 PolarHBondContact O-N 2.97Å
119W90.8Very high89.1Confident18 Ų1869.7 Ų69.77%0.06838%0.377CS..BIsolated β-bridgetrans-61.5134.6171.4-65.2114.8000111C73 S74 E76 W83 P84 V92 R111 C113 L121 T127C73-W119 HydrophobicContact CB-CD2 3.86Å; C73-W119 HydrophobicContact CB-CE3 4.1Å; C73-W119 HydrophobicContact CB-CG 4.45Å; C73-W119 HydrophobicContact CB-CH2 4.17Å; C73-W119 HydrophobicContact CB-CZ2 3.9Å; C73-W119 HydrophobicContact CB-CZ3 4.26Å; S74-W119 PolarHBondContact O-NE1 3.46Å; E76-W119 PolarHBondContact OE2-NE1 2.92Å; W83-W119 HydrophobicContact CB-CH2 4.34Å; W83-W119 HydrophobicContact CB-CZ2 4.01Å; P84-W119 WeakPolarHBondContact O-CZ2 3.25Å; V92-W119 HydrophobicContact CB-CH2 4.16Å; V92-W119 HydrophobicContact CB-CZ3 4.07Å; V92-W119 HydrophobicContact CG1-CH2 4.25Å; V92-W119 HydrophobicContact CG2-CH2 3.87Å; V92-W119 HydrophobicContact CG2-CZ3 3.79Å; R111-W119 HydrophobicContact CB-CE3 4.48Å; R111-W119 HydrophobicContact CB-CZ3 4.2Å; R111-W119 HydrophobicContact CG-CD2 4.28Å; R111-W119 HydrophobicContact CG-CE3 3.56Å; R111-W119 HydrophobicContact CG-CZ3 3.74Å; R111-W119 VanDerWaalsContact NH2-CB 3.34Å; C113-W119 HydrophobicContact CB-CE3 4.36Å; C113-W119 HydrophobicContact CB-CZ3 4.31Å; W119-L121 PolarHBondContact O-N 3Å; W119-T127 HydrophobicContact CB-CG2 3.98Å
120K91.2Very high89Confident63 Ų6372.3 Ų72.327%0.27439%0.391SS..PPolyproline II helixtrans-53.7135.3180-179.3-175.1173.3-166.80111.5R112 D114 T118 T127 W128R112-K120 HydrophobicContact CB-CB 4.08Å; R112-K120 HydrophobicContact CB-CD 4.26Å; R112-K120 WeakPolarHBondContact O-CB 3.36Å; R112-K120 PolarHBondContact O-N 3.33Å; D114-K120 VanDerWaalsContact OD2-CA 3.3Å; D114-K120 WeakPolarHBondContact OD2-CA 3.16Å; T118-K120 PolarHBondContact O-N 2.97Å; K120-T127 CarbonylContact O-C 3.59Å; K120-T127 WeakPolarHBondContact O-CA 3.48Å; K120-W128 HydrophobicContact CB-CB 4.31Å; K120-W128 HydrophobicContact CD-CB 4.12Å; K120-W128 HydrophobicContact CD-CD2 4.32Å; K120-W128 HydrophobicContact CD-CE3 4.32Å; K120-W128 HydrophobicContact CD-CG 4.24Å; K120-W128 HydrophobicContact CG-CB 4.12Å; K120-W128 PolarHBondContact O-N 3.5Å
121L89.8Confident88.9Confident100 Ų10071.8 Ų71.852%0.52439%0.389SS..EExtended strand (participates in β ladder)trans-96.9151176.4-65.3169.9000112.4W119 K126 T127W119-L121 PolarHBondContact O-N 3Å; L121-K126 CarbonylContact C-O 3.16Å; L121-K126 WeakPolarHBondContact CA-O 3.39Å; L121-K126 WeakPolarHBondContact CD2-O 3.32Å; L121-T127 HydrophobicContact CD2-CG2 3.88Å
122V88.6Confident88.7Confident100 Ų10075 Ų7561%0.60641%0.411SS*.EExtended strand (participates in β ladder)trans-103.4-38.3168.4-1740000110.6K126 W128V122-K126 PolarHBondContact N-O 2.97Å; V122-W128 HydrophobicContact CG2-CB 3.5Å; V122-W128 VanDerWaalsContact CG2-CB 3.5Å; V122-W128 HydrophobicContact CG2-CG 4.02Å
123S84.7Confident88.5Confident61 Ų6172.9 Ų72.943%0.42741%0.406SS..EExtended strand (participates in β ladder)trans-149.1173.5175.170.70000109.8N125 K126S123-N125 PolarHBondContact O-N 3.37Å; S123-K126 PolarHBondContact N-O 3.46Å; S123-K126 PolarHBondContact O-N 3.14Å
124V76Confident88.4Confident131 Ų13172.9 Ų72.979%0.79441%0.406SS*.THydrogen-bonded Turntrans-47.8-33.8-165.6-173.60000114.6
125N80.8Confident88.2Confident155 Ų15572.7 Ų72.783%0.82941%0.409SS*.THydrogen-bonded Turntrans-131.835176.2-70.8-37.9000112.9S123S123-N125 PolarHBondContact O-N 3.37Å
126K85.2Confident87.8Confident144 Ų14475 Ų7563%0.62641%0.408SS*.EExtended strand (participates in β ladder)trans-137.9123.9174.5-67.9-168.3175.6-171.60112.2L121 V122 S123L121-K126 CarbonylContact C-O 3.16Å; L121-K126 WeakPolarHBondContact CA-O 3.39Å; L121-K126 WeakPolarHBondContact CD2-O 3.32Å; V122-K126 PolarHBondContact N-O 2.97Å; S123-K126 PolarHBondContact N-O 3.46Å; S123-K126 PolarHBondContact O-N 3.14Å
127T89.9Confident87Confident58 Ų5874.8 Ų74.836%0.35640%0.401SS..EExtended strand (participates in β ladder)trans-76.7155173.146.50000111.7W119 K120 L121W119-T127 HydrophobicContact CB-CG2 3.98Å; K120-T127 CarbonylContact O-C 3.59Å; K120-T127 WeakPolarHBondContact O-CA 3.48Å; L121-T127 HydrophobicContact CD2-CG2 3.88Å
128W91.6Very high86.3Confident71 Ų7178 Ų7827%0.26941%0.414SS..  trans-93.3116.4178.4-179.979.1000110.3L91 R111 R112 K120 V122 N130L91-W128 HydrophobicContact CD1-CH2 4.16Å; L91-W128 HydrophobicContact CD1-CZ3 3.86Å; R111-W128 WeakPolarHBondContact CG-O 3.46Å; R112-W128 HydrophobicContact CB-CE3 4.06Å; R112-W128 HydrophobicContact CB-CZ3 4.06Å; K120-W128 HydrophobicContact CB-CB 4.31Å; K120-W128 HydrophobicContact CD-CB 4.12Å; K120-W128 HydrophobicContact CD-CD2 4.32Å; K120-W128 HydrophobicContact CD-CE3 4.32Å; K120-W128 HydrophobicContact CD-CG 4.24Å; K120-W128 HydrophobicContact CG-CB 4.12Å; K120-W128 PolarHBondContact O-N 3.5Å; V122-W128 HydrophobicContact CG2-CB 3.5Å; V122-W128 VanDerWaalsContact CG2-CB 3.5Å; V122-W128 HydrophobicContact CG2-CG 4.02Å; W128-N130 HydrophobicContact CH2-CB 4.15Å; W128-N130 HydrophobicContact CZ2-CB 3.9Å
129A92Very high85.3Confident32 Ų3279.6 Ų79.626%0.26442%0.416SS..EExtended strand (participates in β ladder)trans-129.4151.3165.100000109.2W83 Y110 Y131W83-A129 HydrophobicContact CZ2-CB 4.24Å; Y110-A129 CarbonylContact O-C 3.6Å; Y110-A129 WeakPolarHBondContact O-CA 3.22Å; A129-Y131 HydrophobicContact CB-CD2 4.2Å; A129-Y131 HydrophobicContact CB-CE2 3.79Å
130N92.7Very high84Confident55 Ų5584.4 Ų84.429%0.29444%0.442SS..EExtended strand (participates in β ladder)trans-116.7119.8172.6-179.329.2000110.4A109 Y110 W128 S132A109-N130 WeakPolarHBondContact CA-O 3.44Å; Y110-N130 PolarHBondContact N-O 3.35Å; Y110-N130 PolarHBondContact O-N 2.99Å; W128-N130 HydrophobicContact CH2-CB 4.15Å; W128-N130 HydrophobicContact CZ2-CB 3.9Å; N130-S132 PolarHBondContact ND2-OG 2.99Å; N130-S132 VanDerWaalsContact OD1-CB 3.27Å; N130-S132 WeakPolarHBondContact OD1-CB 3.23Å; N130-S132 PolarHBondContact OD1-N 3.34Å; N130-S132 VanDerWaalsContact OD1-N 3.08Å; N130-S132 PolarHBondContact OD1-OG 3.4Å
131Y91.3Very high82.7Confident41 Ų4187 Ų8716%0.16146%0.458CS..  trans-109.613179.5-77.5-81.6000113D78 I80 V81 A109 A129 E133 C134 S135D78-Y131 PolarHBondContact OD1-OH 2.86Å; D78-Y131 PolarHBondContact OD2-OH 3.31Å; I80-Y131 HydrophobicContact CG2-CE1 4.22Å; V81-Y131 HydrophobicContact CG1-CE1 4.13Å; V81-Y131 VanDerWaalsContact CG2-OH 3.25Å; V81-Y131 WeakPolarHBondContact CG2-OH 3.44Å; A109-Y131 HydrophobicContact CB-CD1 3.69Å; A109-Y131 HydrophobicContact CB-CE1 3.55Å; A109-Y131 HydrophobicContact CB-CG 4.49Å; A129-Y131 HydrophobicContact CB-CD2 4.2Å; A129-Y131 HydrophobicContact CB-CE2 3.79Å; Y131-E133 PolarHBondContact O-N 3.1Å; Y131-E133 VanDerWaalsContact O-N 3.07Å; Y131-C134 HydrophobicContact CD1-CB 4.33Å; Y131-C134 WeakPolarHBondContact O-CB 3.19Å; Y131-C134 PolarHBondContact O-N 3.3Å; Y131-S135 PolarHBondContact O-N 2.94Å; Y131-S135 PolarHBondContact O-OG 3.44Å
132S89.6Confident81.7Confident67 Ų6786.2 Ų86.247%0.46946%0.455SS..THydrogen-bonded Turntrans-56.9-27-171.761.70000115.5N130N130-S132 PolarHBondContact ND2-OG 2.99Å; N130-S132 VanDerWaalsContact OD1-CB 3.27Å; N130-S132 WeakPolarHBondContact OD1-CB 3.23Å; N130-S132 PolarHBondContact OD1-N 3.34Å; N130-S132 VanDerWaalsContact OD1-N 3.08Å; N130-S132 PolarHBondContact OD1-OG 3.4Å
133E90.6Very high80.7Confident65 Ų6588.9 Ų88.930%0.30446%0.455SS..THydrogen-bonded Turntrans-82.2-31.5175-63.5-174.3-162.900112.9N104 L108 Y110 Y131 K136N104-E133 VanDerWaalsContact CB-O 3.3Å; N104-E133 WeakPolarHBondContact CB-O 3.35Å; N104-E133 PolarHBondContact ND2-O 2.9Å; L108-E133 PolarHBondContact N-OE2 3.03Å; Y110-E133 HydrophobicContact CE2-CG 4.36Å; Y110-E133 WeakPolarHBondContact CE2-OE1 3.27Å; Y110-E133 PolarHBondContact OH-OE1 3.34Å; Y131-E133 PolarHBondContact O-N 3.1Å; Y131-E133 VanDerWaalsContact O-N 3.07Å; E133-K136 WeakPolarHBondContact O-CB 3.43Å
134C89.8Confident80.1Confident0 Ų090.1 Ų90.10%046%0.456CS..G310 helixtrans-71.3-45.4177.5-52.50000111.1C96 F103 N104 Y131 K136C96-C134 HydrophobicContact CB-CB 3.79Å; C96-C134 WeakPolarHBondContact CB-SG 3.41Å; C96-C134 WeakPolarHBondContact SG-CA 3.39Å; C96-C134 WeakPolarHBondContact SG-CB 3.3Å; C96-C134 CovalentContact SG-SG 2.03Å; C96-C134 PolarHBondContact SG-SG 3.47Å; F103-C134 HydrophobicContact CD2-CB 3.79Å; F103-C134 HydrophobicContact CE2-CB 4Å; F103-C134 HydrophobicContact CG-CB 4.08Å; F103-C134 HydrophobicContact CZ-CB 4.48Å; N104-C134 PolarHBondContact N-O 3.45Å; Y131-C134 HydrophobicContact CD1-CB 4.33Å; Y131-C134 WeakPolarHBondContact O-CB 3.19Å; Y131-C134 PolarHBondContact O-N 3.3Å; C134-K136 PolarHBondContact O-N 2.88Å; C134-K136 VanDerWaalsContact O-N 3.1Å
135S87.3Confident80Confident51 Ų5189.3 Ų89.336%0.35744%0.443SS..G310 helixtrans-76.611.1-178.668.10000114.2Y131 F137 L138Y131-S135 PolarHBondContact O-N 2.94Å; Y131-S135 PolarHBondContact O-OG 3.44Å; S135-F137 VanDerWaalsContact C-N 3.26Å; S135-F137 PolarHBondContact O-N 3.1Å; S135-L138 PolarHBondContact O-N 3.06Å
136K79.5Confident79.8Confident141 Ų14185.3 Ų85.361%0.61342%0.42SS*.G310 helixtrans-65.5-25.3-169.6-173.5172.9179.2179.60114.2E133 C134E133-K136 WeakPolarHBondContact O-CB 3.43Å; C134-K136 PolarHBondContact O-N 2.88Å; C134-K136 VanDerWaalsContact O-N 3.1Å
137F71.8Confident79.5Confident124 Ų12484.8 Ų84.854%0.54442%0.417SS..G310 helixtrans-97.9-0.5178.1-59.9-55.3000113.9N104 S135 H139N104-F137 HydrophobicContact CB-CD2 3.65Å; N104-F137 HydrophobicContact CB-CE2 3.54Å; S135-F137 VanDerWaalsContact C-N 3.26Å; S135-F137 PolarHBondContact O-N 3.1Å; F137-H139 PolarHBondContact O-CD2 3.26Å; F137-H139 VanDerWaalsContact O-CD2 3.26Å; F137-H139 PolarHBondContact O-N 3.09Å
138L71.4Confident79.2Confident84 Ų8486.1 Ų86.144%0.4442%0.42SS..  trans-78.372.1176.4-72.3170.7000110.6D102 F103 S135 I140D102-L138 HydrophobicContact CB-CD2 3.82Å; F103-L138 HydrophobicContact CE1-CD1 4.31Å; S135-L138 PolarHBondContact O-N 3.06Å; L138-I140 PolarHBondContact O-N 2.98Å
139H66.1Low78.8Confident110 Ų11083.7 Ų83.751%0.50941%0.412SS..  trans-75.283.7-178.1-71.2-82.5000112F137 N141 D142 Y143F137-H139 PolarHBondContact O-CD2 3.26Å; F137-H139 VanDerWaalsContact O-CD2 3.26Å; F137-H139 PolarHBondContact O-N 3.09Å; H139-N141 PolarHBondContact O-N 3.45Å; H139-N141 VanDerWaalsContact O-N 3.11Å; H139-D142 HydrophobicContact CB-CB 4.13Å; H139-D142 WeakPolarHBondContact CB-OD2 3.45Å; H139-D142 IonicContact CG-OD2 2.71Å; H139-D142 PolarHBondContact O-N 2.97Å; H139-Y143 PolarHBondContact O-N 2.87Å
140I65.3Low78.5Confident120 Ų12087.2 Ų87.262%0.61542%0.422SS*.Hα-helixtrans-52.6-34.4179.4-61.3173.5000112.6L138 I144L138-I140 PolarHBondContact O-N 2.98Å; I140-I144 HydrophobicContact CG2-CD1 4.12Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.41Å
141N63.1Low78.1Confident116 Ų11688.6 Ų88.662%0.6243%0.426SS*.Hα-helixtrans-66-35.9178.1-71.24.7000112.9H139 I144 H145H139-N141 PolarHBondContact O-N 3.45Å; H139-N141 VanDerWaalsContact O-N 3.11Å; N141-I144 PolarHBondContact O-N 3.06Å; N141-H145 PolarHBondContact O-N 3.08Å
142D67.9Low77.9Confident84 Ų8491.6 Ų91.645%0.44944%0.437SS..Hα-helixtrans-72.3-43-176.8-61.4-19.9000109.6H139 I144 H145 E146H139-D142 HydrophobicContact CB-CB 4.13Å; H139-D142 WeakPolarHBondContact CB-OD2 3.45Å; H139-D142 IonicContact CG-OD2 2.71Å; H139-D142 PolarHBondContact O-N 2.97Å; D142-I144 VanDerWaalsContact C-N 3.27Å; D142-I144 PolarHBondContact O-N 3.35Å; D142-H145 PolarHBondContact O-N 3.26Å; D142-H145 VanDerWaalsContact O-N 3.1Å; D142-E146 WeakPolarHBondContact O-CB 3.31Å; D142-E146 WeakPolarHBondContact O-CG 3.38Å; D142-E146 PolarHBondContact O-N 3.37Å
143Y68.8Low77.9Confident157 Ų15788.9 Ų88.962%0.61642%0.418SS*.Hα-helixtrans-55.7-38.2170.8173-105.1000113.2H139 K147H139-Y143 PolarHBondContact O-N 2.87Å; Y143-K147 WeakPolarHBondContact O-CB 3.26Å; Y143-K147 PolarHBondContact O-N 2.7Å
144I71.3Confident77.7Confident87 Ų8787.7 Ų87.745%0.44641%0.411SS..Hα-helixtrans-66.6-47.5175.2-68.7166.3000110.5I140 N141 D142 K147 E148I140-I144 HydrophobicContact CG2-CD1 4.12Å; I140-I144 WeakPolarHBondContact O-CG1 3.25Å; I140-I144 PolarHBondContact O-N 3.41Å; N141-I144 PolarHBondContact O-N 3.06Å; D142-I144 VanDerWaalsContact C-N 3.27Å; D142-I144 PolarHBondContact O-N 3.35Å; I144-K147 PolarHBondContact O-N 3.42Å; I144-E148 PolarHBondContact O-N 3.42Å
145H74.3Confident77.7Confident113 Ų11391.6 Ų91.652%0.52343%0.431SS..Hα-helixtrans-63.7-40.6178-82.1-46000112.9N141 D142 E148 V149N141-H145 PolarHBondContact O-N 3.08Å; D142-H145 PolarHBondContact O-N 3.26Å; D142-H145 VanDerWaalsContact O-N 3.1Å; H145-E148 IonicContact ND1-OE2 2.75Å; H145-E148 PolarHBondContact O-N 3.49Å; H145-V149 WeakPolarHBondContact O-CG2 3.45Å; H145-V149 PolarHBondContact O-N 3.44Å
146E76.9Confident77.9Confident72 Ų7291.3 Ų91.334%0.33643%0.425SS..Hα-helixtrans-60.1-49.6173.9-75.1-178.6168.700111.3D142 E148 V149 F150D142-E146 WeakPolarHBondContact O-CB 3.31Å; D142-E146 WeakPolarHBondContact O-CG 3.38Å; D142-E146 PolarHBondContact O-N 3.37Å; E146-E148 VanDerWaalsContact C-N 3.29Å; E146-E148 PolarHBondContact O-N 3.02Å; E146-V149 WeakPolarHBondContact O-CA 3.49Å; E146-V149 WeakPolarHBondContact O-CB 3.49Å; E146-V149 PolarHBondContact O-N 3.26Å; E146-F150 HydrophobicContact CB-CD2 4.44Å; E146-F150 HydrophobicContact CB-CE2 4.17Å; E146-F150 WeakPolarHBondContact O-CD2 3.43Å; E146-F150 PolarHBondContact O-N 3.11Å
147K78.7Confident78.4Confident133 Ų13386.3 Ų86.358%0.57840%0.402SS*.Hα-helixtrans-56.6-42.3177-176.5177.1178.5-176.70111.9Y143 I144 H151Y143-K147 WeakPolarHBondContact O-CB 3.26Å; Y143-K147 PolarHBondContact O-N 2.7Å; I144-K147 PolarHBondContact O-N 3.42Å; K147-H151 WeakPolarHBondContact O-CB 3.48Å; K147-H151 PolarHBondContact O-N 3.25Å
148E82.4Confident79.4Confident86 Ų8681.9 Ų81.940%0.40239%0.386SS..Hα-helixtrans-64-40.1173.8-69.6-172.2170.700113I144 H145 E146 H151 R152I144-E148 PolarHBondContact O-N 3.42Å; H145-E148 IonicContact ND1-OE2 2.75Å; H145-E148 PolarHBondContact O-N 3.49Å; E146-E148 VanDerWaalsContact C-N 3.29Å; E146-E148 PolarHBondContact O-N 3.02Å; E148-H151 PolarHBondContact O-N 3.26Å; E148-R152 WeakPolarHBondContact O-CG 3.48Å; E148-R152 PolarHBondContact O-N 2.99Å; E148-R152 PolarHBondContact O-NE 3.23Å; E148-R152 IonicContact OE2-CZ 3.95Å; E148-R152 VanDerWaalsContact OE2-CZ 3.28Å; E148-R152 IonicContact OE2-NH1 2.7Å; E148-R152 PolarHBondContact OE2-NH1 3.44Å; E148-R152 IonicContact OE2-NH2 3.26Å; E148-R152 PolarHBondContact OE2-NH2 3.38Å
149V84.9Confident80.5Confident20 Ų2081.4 Ų81.412%0.12139%0.386CS..Hα-helixtrans-63.1-47.2178168.10000110.6H145 E146 H151 R152 L153 W400 L401H145-V149 WeakPolarHBondContact O-CG2 3.45Å; H145-V149 PolarHBondContact O-N 3.44Å; E146-V149 WeakPolarHBondContact O-CA 3.49Å; E146-V149 WeakPolarHBondContact O-CB 3.49Å; E146-V149 PolarHBondContact O-N 3.26Å; V149-H151 VanDerWaalsContact C-N 3.31Å; V149-H151 PolarHBondContact O-N 3.48Å; V149-R152 PolarHBondContact O-N 3.48Å; V149-L153 HydrophobicContact CG1-CD1 4.04Å; V149-L153 HydrophobicContact CG1-CG 4.48Å; V149-L153 WeakPolarHBondContact O-CG 3.43Å; V149-L153 PolarHBondContact O-N 2.96Å; V149-W400 HydrophobicContact CG1-CH2 4.38Å; V149-W400 HydrophobicContact CG1-CZ3 3.92Å; V149-L401 HydrophobicContact CB-CD1 4.34Å; V149-L401 HydrophobicContact CG1-CD1 3.54Å; V149-L401 HydrophobicContact CG2-CD1 3.74Å
150F84.2Confident81.8Confident105 Ų10576.1 Ų76.146%0.46136%0.361SS..Hα-helixtrans-61-39.5175.1-68.1-62.1000111.9E146 L153 Y154 W400E146-F150 HydrophobicContact CB-CD2 4.44Å; E146-F150 HydrophobicContact CB-CE2 4.17Å; E146-F150 WeakPolarHBondContact O-CD2 3.43Å; E146-F150 PolarHBondContact O-N 3.11Å; F150-L153 PolarHBondContact O-N 3.12Å; F150-Y154 WeakPolarHBondContact O-CB 3.44Å; F150-Y154 PolarHBondContact O-N 2.92Å; F150-W400 AromaticContact CE1-CH2 3.83Å; F150-W400 HydrophobicContact CE1-CH2 3.83Å; F150-W400 HydrophobicContact CE1-CZ2 4.2Å; F150-W400 HydrophobicContact CZ-CH2 4.03Å; F150-W400 HydrophobicContact CZ-CZ2 4.45Å
151H84.9Confident83.2Confident84 Ų8471 Ų7139%0.38934%0.335SS..Hα-helixtrans-65.5-37.6174.7-167.1-39.1000112.7K147 E148 V149 Y154 I155K147-H151 WeakPolarHBondContact O-CB 3.48Å; K147-H151 PolarHBondContact O-N 3.25Å; E148-H151 PolarHBondContact O-N 3.26Å; V149-H151 VanDerWaalsContact C-N 3.31Å; V149-H151 PolarHBondContact O-N 3.48Å; H151-Y154 PolarHBondContact O-N 3.03Å; H151-I155 WeakPolarHBondContact ND1-CD1 3.49Å; H151-I155 WeakPolarHBondContact O-CG1 3.49Å; H151-I155 PolarHBondContact O-N 3.5Å; H151-I155 VanDerWaalsContact O-N 3.16Å
152R87.9Confident84.8Confident104 Ų10468.3 Ų68.339%0.39232%0.324SS..Hα-helixtrans-64-46.1174.1-77.4-179.6-78.9-1031.5111.3E148 V149 Y154 I155 I156E148-R152 WeakPolarHBondContact O-CG 3.48Å; E148-R152 PolarHBondContact O-N 2.99Å; E148-R152 PolarHBondContact O-NE 3.23Å; E148-R152 IonicContact OE2-CZ 3.95Å; E148-R152 VanDerWaalsContact OE2-CZ 3.28Å; E148-R152 IonicContact OE2-NH1 2.7Å; E148-R152 PolarHBondContact OE2-NH1 3.44Å; E148-R152 IonicContact OE2-NH2 3.26Å; E148-R152 PolarHBondContact OE2-NH2 3.38Å; V149-R152 PolarHBondContact O-N 3.48Å; R152-Y154 PolarHBondContact O-N 2.87Å; R152-I155 PolarHBondContact O-N 2.74Å; R152-I156 WeakPolarHBondContact O-CD1 3.43Å; R152-I156 VanDerWaalsContact O-CG1 3.3Å; R152-I156 WeakPolarHBondContact O-CG1 3.44Å; R152-I156 PolarHBondContact O-N 2.95Å; R152-I156 VanDerWaalsContact O-N 3.16Å
153L88.4Confident86.2Confident10 Ų1067.7 Ų67.75%0.05232%0.32CS..Hα-helixtrans-61.4-42.6176.1-66.7171.3000111.9V149 F150 I155 I156 Y157 W400 M404 H405 M408V149-L153 HydrophobicContact CG1-CD1 4.04Å; V149-L153 HydrophobicContact CG1-CG 4.48Å; V149-L153 WeakPolarHBondContact O-CG 3.43Å; V149-L153 PolarHBondContact O-N 2.96Å; F150-L153 PolarHBondContact O-N 3.12Å; L153-I155 PolarHBondContact O-N 3.47Å; L153-I156 PolarHBondContact O-N 3.45Å; L153-Y157 WeakPolarHBondContact O-CD1 3.33Å; L153-Y157 PolarHBondContact O-N 3.44Å; L153-W400 HydrophobicContact CD1-CH2 4.47Å; L153-M404 HydrophobicContact CD1-CB 3.98Å; L153-M404 HydrophobicContact CD2-CB 4.11Å; L153-H405 HydrophobicContact CD2-CB 4.48Å; L153-M408 HydrophobicContact CD2-CB 4.29Å; L153-M408 HydrophobicContact CD2-CG 4.09Å
154Y87.8Confident87.5Confident40 Ų4060.3 Ų60.316%0.15729%0.292CS..Hα-helixtrans-55.7-49.3175.6175.2-99.3000112.6F150 H151 R152 I156 Y157 T158F150-Y154 WeakPolarHBondContact O-CB 3.44Å; F150-Y154 PolarHBondContact O-N 2.92Å; H151-Y154 PolarHBondContact O-N 3.03Å; R152-Y154 PolarHBondContact O-N 2.87Å; Y154-I156 PolarHBondContact O-N 3.14Å; Y154-Y157 HydrophobicContact CD2-CE1 4.49Å; Y154-Y157 HydrophobicContact CD2-CE2 4.26Å; Y154-Y157 AromaticContact CD2-CZ 3.83Å; Y154-Y157 WeakPolarHBondContact CD2-OH 3.5Å; Y154-T158 WeakPolarHBondContact O-CB 3.24Å; Y154-T158 PolarHBondContact O-N 3.33Å; Y154-T158 PolarHBondContact O-OG1 3.28Å
155I88.7Confident88.7Confident82 Ų8257.9 Ų57.942%0.42128%0.28SS..Hα-helixtrans-60-47.6176.9-64.9163.9000110.4H151 R152 L153 Y157 T158 V159H151-I155 WeakPolarHBondContact ND1-CD1 3.49Å; H151-I155 WeakPolarHBondContact O-CG1 3.49Å; H151-I155 PolarHBondContact O-N 3.5Å; H151-I155 VanDerWaalsContact O-N 3.16Å; R152-I155 PolarHBondContact O-N 2.74Å; L153-I155 PolarHBondContact O-N 3.47Å; I155-Y157 PolarHBondContact O-N 3.2Å; I155-T158 PolarHBondContact O-N 3.11Å; I155-V159 HydrophobicContact CG2-CG2 4.19Å; I155-V159 WeakPolarHBondContact O-CB 3.43Å; I155-V159 WeakPolarHBondContact O-CG2 3.33Å; I155-V159 PolarHBondContact O-N 3.25Å
156I90.8Very high89.8Confident46 Ų4654.4 Ų54.424%0.23627%0.274CS..Hα-helixtrans-57.7-52.4-175.9-69.8164.1000110.8R152 L153 Y154 G160 M408 L409R152-I156 WeakPolarHBondContact O-CD1 3.43Å; R152-I156 VanDerWaalsContact O-CG1 3.3Å; R152-I156 WeakPolarHBondContact O-CG1 3.44Å; R152-I156 PolarHBondContact O-N 2.95Å; R152-I156 VanDerWaalsContact O-N 3.16Å; L153-I156 PolarHBondContact O-N 3.45Å; Y154-I156 PolarHBondContact O-N 3.14Å; I156-G160 PolarHBondContact O-N 2.96Å; I156-G160 VanDerWaalsContact O-N 3.07Å; I156-M408 HydrophobicContact CG2-CB 4.47Å; I156-L409 HydrophobicContact CG2-CB 4.15Å; I156-L409 HydrophobicContact CG2-CD1 4.08Å
157Y91.9Very high90.7Very high36 Ų3651.8 Ų51.814%0.14126%0.263CS..Hα-helixtrans-72.6-36.7-178.474.5-116.4000112.5L153 Y154 I155 V159 G160 Y161 I203 D207 M408L153-Y157 WeakPolarHBondContact O-CD1 3.33Å; L153-Y157 PolarHBondContact O-N 3.44Å; Y154-Y157 HydrophobicContact CD2-CE1 4.49Å; Y154-Y157 HydrophobicContact CD2-CE2 4.26Å; Y154-Y157 AromaticContact CD2-CZ 3.83Å; Y154-Y157 WeakPolarHBondContact CD2-OH 3.5Å; I155-Y157 PolarHBondContact O-N 3.2Å; Y157-V159 PolarHBondContact O-N 2.9Å; Y157-G160 PolarHBondContact O-N 3Å; Y157-Y161 HydrophobicContact CD2-CD2 4.19Å; Y157-Y161 HydrophobicContact CD2-CE2 4.5Å; Y157-Y161 WeakPolarHBondContact O-CB 3.33Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.35Å; Y157-Y161 PolarHBondContact O-N 3.17Å; Y157-I203 HydrophobicContact CD2-CG2 4.18Å; Y157-I203 HydrophobicContact CE2-CG2 3.9Å; Y157-D207 PolarHBondContact OH-OD1 3.35Å; Y157-M408 HydrophobicContact CD1-SD 4.01Å
158T91.2Very high91.6Very high31 Ų3145.5 Ų45.519%0.1924%0.236CC..Hα-helixtrans-61.6-45.7179.9-64.10000111.3Y154 I155 S162 F204Y154-T158 WeakPolarHBondContact O-CB 3.24Å; Y154-T158 PolarHBondContact O-N 3.33Å; Y154-T158 PolarHBondContact O-OG1 3.28Å; I155-T158 PolarHBondContact O-N 3.11Å; T158-S162 VanDerWaalsContact O-CB 3.3Å; T158-S162 WeakPolarHBondContact O-CB 3.43Å; T158-S162 PolarHBondContact O-N 3.4Å; T158-S162 VanDerWaalsContact O-N 3.07Å; T158-S162 PolarHBondContact O-OG 3.46Å; T158-F204 HydrophobicContact CG2-CE1 4.23Å
159V94.1Very high92.3Very high73 Ų7346.6 Ų46.644%0.44224%0.243SC..Hα-helixtrans-67.1-45.7176.5173.40000111I155 Y157 S162 I163I155-V159 HydrophobicContact CG2-CG2 4.19Å; I155-V159 WeakPolarHBondContact O-CB 3.43Å; I155-V159 WeakPolarHBondContact O-CG2 3.33Å; I155-V159 PolarHBondContact O-N 3.25Å; Y157-V159 PolarHBondContact O-N 2.9Å; V159-S162 PolarHBondContact O-N 2.97Å; V159-I163 HydrophobicContact CG1-CD1 3.81Å; V159-I163 WeakPolarHBondContact O-CG1 3.41Å; V159-I163 PolarHBondContact O-N 2.83Å
160G94.8Very high92.8Very high0 Ų049.2 Ų49.20%026%0.259CS..Hα-helixtrans-61.3-49.2179.700000113.1I156 Y157 S162 I163 S164 S412I156-G160 PolarHBondContact O-N 2.96Å; I156-G160 VanDerWaalsContact O-N 3.07Å; Y157-G160 PolarHBondContact O-N 3Å; G160-S162 VanDerWaalsContact C-N 3.32Å; G160-S162 PolarHBondContact O-N 3.02Å; G160-I163 PolarHBondContact O-N 3.12Å; G160-S164 VanDerWaalsContact O-CB 3.26Å; G160-S164 WeakPolarHBondContact O-CB 3.42Å; G160-S164 PolarHBondContact O-N 3.5Å; G160-S412 CarbonylContact C-O 3.6Å
161Y95.2Very high93.3Very high13 Ų1344.2 Ų44.25%0.05124%0.237CC..Hα-helixtrans-66.8-31.2177.5-75.9-62.6000112.3Y157 S164 L165 R199 A200 I203Y157-Y161 HydrophobicContact CD2-CD2 4.19Å; Y157-Y161 HydrophobicContact CD2-CE2 4.5Å; Y157-Y161 WeakPolarHBondContact O-CB 3.33Å; Y157-Y161 WeakPolarHBondContact O-CD2 3.35Å; Y157-Y161 PolarHBondContact O-N 3.17Å; Y161-S164 PolarHBondContact O-N 2.89Å; Y161-L165 WeakPolarHBondContact O-CB 3.3Å; Y161-L165 PolarHBondContact O-N 2.93Å; Y161-R199 PolarHBondContact OH-NE 3.43Å; Y161-R199 PolarHBondContact OH-NH2 3.47Å; Y161-A200 HydrophobicContact CD1-CB 3.98Å; Y161-A200 HydrophobicContact CG-CB 4.41Å; Y161-I203 HydrophobicContact CD1-CD1 4.5Å; Y161-I203 HydrophobicContact CD2-CD1 3.95Å; Y161-I203 HydrophobicContact CE1-CD1 4Å; Y161-I203 HydrophobicContact CE2-CD1 3.39Å; Y161-I203 HydrophobicContact CG-CD1 4.49Å; Y161-I203 VanDerWaalsContact CZ-CD1 3.4Å
162S95.8Very high93.8Very high58 Ų5841.6 Ų41.641%0.40623%0.227SC..Hα-helixtrans-64.6-46.6173.8-63.60000112.2T158 V159 G160 L165 G166T158-S162 VanDerWaalsContact O-CB 3.3Å; T158-S162 WeakPolarHBondContact O-CB 3.43Å; T158-S162 PolarHBondContact O-N 3.4Å; T158-S162 VanDerWaalsContact O-N 3.07Å; T158-S162 PolarHBondContact O-OG 3.46Å; V159-S162 PolarHBondContact O-N 2.97Å; G160-S162 VanDerWaalsContact C-N 3.32Å; G160-S162 PolarHBondContact O-N 3.02Å; S162-L165 PolarHBondContact O-N 2.83Å; S162-G166 PolarHBondContact O-N 3.21Å; S162-G166 VanDerWaalsContact O-N 3.11Å
163I96.3Very high94.2Very high71 Ų7141.1 Ų41.136%0.36424%0.235SC..Hα-helixtrans-64.8-41.3176.3-67.1166.8000110.7V159 G160 S167 F413 F416V159-I163 HydrophobicContact CG1-CD1 3.81Å; V159-I163 WeakPolarHBondContact O-CG1 3.41Å; V159-I163 PolarHBondContact O-N 2.83Å; G160-I163 PolarHBondContact O-N 3.12Å; I163-S167 WeakPolarHBondContact O-CB 3.29Å; I163-S167 PolarHBondContact O-N 2.86Å; I163-S167 VanDerWaalsContact O-N 3.07Å; I163-S167 PolarHBondContact O-OG 3.45Å; I163-F413 HydrophobicContact CB-CE1 4.43Å; I163-F413 HydrophobicContact CD1-CE1 3.88Å; I163-F413 HydrophobicContact CD1-CZ 4.18Å; I163-F413 HydrophobicContact CG2-CE1 4.4Å; I163-F416 HydrophobicContact CG2-CB 4.48Å; I163-F416 HydrophobicContact CG2-CD2 3.66Å; I163-F416 HydrophobicContact CG2-CE2 3.9Å; I163-F416 HydrophobicContact CG2-CG 4.03Å; I163-F416 HydrophobicContact CG2-CZ 4.47Å
164S96.4Very high94.5Very high2 Ų242 Ų421%0.01424%0.239CC..Hα-helixtrans-61.4-50.2175.3-170.80000111.8G160 Y161 G166 S167 I168 S412 G415 F416G160-S164 VanDerWaalsContact O-CB 3.26Å; G160-S164 WeakPolarHBondContact O-CB 3.42Å; G160-S164 PolarHBondContact O-N 3.5Å; Y161-S164 PolarHBondContact O-N 2.89Å; S164-G166 PolarHBondContact O-N 3.46Å; S164-S167 PolarHBondContact O-N 3.44Å; S164-S167 PolarHBondContact O-OG 3.49Å; S164-I168 WeakPolarHBondContact O-CB 3.33Å; S164-I168 WeakPolarHBondContact O-CD1 3.49Å; S164-I168 WeakPolarHBondContact O-CG1 3.31Å; S164-I168 PolarHBondContact O-N 2.81Å; S164-I168 WeakPolarHBondContact OG-CD1 3.3Å; S164-S412 WeakPolarHBondContact CB-O 3.44Å; S164-G415 VanDerWaalsContact OG-CA 3.27Å; S164-G415 WeakPolarHBondContact OG-CA 3.32Å; S164-F416 PolarHBondContact OG-N 3.26Å
165L96.8Very high94.7Very high37 Ų3740.2 Ų40.219%0.19423%0.233CC..Hα-helixtrans-59-49.4179.8-175.469.5000111.8Y161 S162 M169 M197 A200 V201 F204Y161-L165 WeakPolarHBondContact O-CB 3.3Å; Y161-L165 PolarHBondContact O-N 2.93Å; S162-L165 PolarHBondContact O-N 2.83Å; L165-M169 WeakPolarHBondContact O-CB 3.29Å; L165-M169 PolarHBondContact O-N 3.44Å; L165-M197 HydrophobicContact CD1-CB 4Å; L165-M197 HydrophobicContact CD1-CE 3.52Å; L165-M197 HydrophobicContact CD1-CG 4.03Å; L165-M197 HydrophobicContact CG-CE 4.31Å; L165-A200 HydrophobicContact CB-CB 4.44Å; L165-A200 HydrophobicContact CD1-CB 4.26Å; L165-V201 HydrophobicContact CD1-CG2 4.07Å; L165-V201 HydrophobicContact CD2-CG2 4.37Å; L165-F204 HydrophobicContact CD2-CE2 4.19Å
166G97.3Very high94.8Very high39 Ų3937.7 Ų37.740%0.40223%0.227SC..Hα-helixtrans-63.2-44179.800000113.2S162 S164 M169 V170S162-G166 PolarHBondContact O-N 3.21Å; S162-G166 VanDerWaalsContact O-N 3.11Å; S164-G166 PolarHBondContact O-N 3.46Å; G166-M169 PolarHBondContact O-N 3.41Å; G166-V170 WeakPolarHBondContact O-CG2 3.17Å; G166-V170 PolarHBondContact O-N 3.42Å
167S96.8Very high95Very high17 Ų1743.7 Ų43.712%0.11925%0.248CC..Hα-helixtrans-68.7-40.4179.358.90000113I163 S164 V170 A171 F424I163-S167 WeakPolarHBondContact O-CB 3.29Å; I163-S167 PolarHBondContact O-N 2.86Å; I163-S167 VanDerWaalsContact O-N 3.07Å; I163-S167 PolarHBondContact O-OG 3.45Å; S164-S167 PolarHBondContact O-N 3.44Å; S164-S167 PolarHBondContact O-OG 3.49Å; S167-V170 PolarHBondContact O-N 2.89Å; S167-A171 PolarHBondContact O-N 3.41Å; S167-A171 VanDerWaalsContact O-N 3.1Å; S167-F424 WeakPolarHBondContact O-CZ 3.28Å
168I96.6Very high95Very high1 Ų143.4 Ų43.41%0.00525%0.247CC..Hα-helixtrans-66.4-41.2175.2-65163.4000111.1S164 V170 A171 V172 F193 Y196 M197 A419S164-I168 WeakPolarHBondContact O-CB 3.33Å; S164-I168 WeakPolarHBondContact O-CD1 3.49Å; S164-I168 WeakPolarHBondContact O-CG1 3.31Å; S164-I168 PolarHBondContact O-N 2.81Å; S164-I168 WeakPolarHBondContact OG-CD1 3.3Å; I168-V170 VanDerWaalsContact C-N 3.26Å; I168-V170 PolarHBondContact O-N 2.96Å; I168-A171 CarbonylContact O-C 3.6Å; I168-A171 WeakPolarHBondContact O-CA 3.43Å; I168-A171 WeakPolarHBondContact O-CB 3.38Å; I168-A171 PolarHBondContact O-N 3.31Å; I168-V172 HydrophobicContact CG2-CG2 4.04Å; I168-V172 WeakPolarHBondContact O-CG2 3.49Å; I168-V172 PolarHBondContact O-N 3.29Å; I168-F193 HydrophobicContact CG1-CD1 4.44Å; I168-F193 HydrophobicContact CG2-CB 3.59Å; I168-F193 HydrophobicContact CG2-CD1 4Å; I168-F193 HydrophobicContact CG2-CG 3.94Å; I168-Y196 HydrophobicContact CD1-CG 4.36Å; I168-M197 HydrophobicContact CB-CG 4.14Å; I168-M197 HydrophobicContact CG2-CG 3.57Å; I168-M197 HydrophobicContact CG2-SD 4.06Å; I168-A419 HydrophobicContact CG1-CB 4.04Å
169M96.5Very high94.9Very high110 Ų11052 Ų5254%0.54228%0.276SS..Hα-helixtrans-59.7-40-179.9-161.917181.300111.4L165 G166 V173 M197L165-M169 WeakPolarHBondContact O-CB 3.29Å; L165-M169 PolarHBondContact O-N 3.44Å; G166-M169 PolarHBondContact O-N 3.41Å; M169-V173 VanDerWaalsContact O-CG2 3.3Å; M169-V173 WeakPolarHBondContact O-CG2 3.5Å; M169-V173 PolarHBondContact O-N 2.99Å; M169-V173 VanDerWaalsContact O-N 3.11Å; M169-M197 HydrophobicContact CB-CE 3.63Å; M169-M197 HydrophobicContact CB-SD 4.15Å; M169-M197 HydrophobicContact CG-CE 3.69Å; M169-M197 HydrophobicContact CG-SD 4.34Å; M169-M197 HydrophobicContact SD-CE 3.98Å
170V96.5Very high94.6Very high75 Ų7557.9 Ų57.946%0.45529%0.29SS..Hα-helixtrans-64.4-42172.1175.60000111.6G166 S167 I168 V173 I174 F424G166-V170 WeakPolarHBondContact O-CG2 3.17Å; G166-V170 PolarHBondContact O-N 3.42Å; S167-V170 PolarHBondContact O-N 2.89Å; I168-V170 VanDerWaalsContact C-N 3.26Å; I168-V170 PolarHBondContact O-N 2.96Å; V170-V173 PolarHBondContact O-N 3.27Å; V170-I174 HydrophobicContact CG1-CD1 3.81Å; V170-I174 HydrophobicContact CG1-CG1 4.46Å; V170-I174 VanDerWaalsContact O-CG1 3.29Å; V170-I174 WeakPolarHBondContact O-CG1 3.46Å; V170-I174 PolarHBondContact O-N 3.42Å; V170-F424 HydrophobicContact CB-CZ 4.32Å; V170-F424 HydrophobicContact CG1-CE1 4.01Å; V170-F424 HydrophobicContact CG1-CZ 4.12Å
171A95.5Very high94.4Very high0 Ų058.2 Ų58.20%029%0.292CS..Hα-helixtrans-62.5-44.5177.700000113S167 I168 V173 I174 L175 F193 A419 C423 F424S167-A171 PolarHBondContact O-N 3.41Å; S167-A171 VanDerWaalsContact O-N 3.1Å; I168-A171 CarbonylContact O-C 3.6Å; I168-A171 WeakPolarHBondContact O-CA 3.43Å; I168-A171 WeakPolarHBondContact O-CB 3.38Å; I168-A171 PolarHBondContact O-N 3.31Å; A171-V173 PolarHBondContact O-N 3.36Å; A171-I174 PolarHBondContact O-N 2.94Å; A171-L175 PolarHBondContact O-N 3.05Å; A171-F193 HydrophobicContact CB-CD2 4.47Å; A171-F193 HydrophobicContact CB-CE2 4.04Å; A171-F193 HydrophobicContact CB-CZ 4.25Å; A171-A419 HydrophobicContact CB-CB 4.36Å; A171-C423 HydrophobicContact CB-CB 3.64Å; A171-F424 HydrophobicContact CB-CZ 4.35Å
172V95.4Very high94.1Very high29 Ų2961.9 Ų61.918%0.17631%0.309CS..Hα-helixtrans-62.2-43176.1174.10000111I168 I174 L175 G176 M190 F193I168-V172 HydrophobicContact CG2-CG2 4.04Å; I168-V172 WeakPolarHBondContact O-CG2 3.49Å; I168-V172 PolarHBondContact O-N 3.29Å; V172-I174 PolarHBondContact O-N 2.89Å; V172-L175 PolarHBondContact O-N 3.36Å; V172-G176 PolarHBondContact O-N 2.95Å; V172-M190 HydrophobicContact CG1-CE 4.14Å; V172-F193 HydrophobicContact CG2-CB 3.57Å; V172-F193 HydrophobicContact CG2-CD2 4.13Å; V172-F193 HydrophobicContact CG2-CG 4.21Å
173V95.1Very high93.8Very high94 Ų9461.9 Ų61.957%0.5731%0.309SS*.Hα-helixtrans-62.5-41.3175.7168.60000111.7M169 V170 A171 Y177M169-V173 VanDerWaalsContact O-CG2 3.3Å; M169-V173 WeakPolarHBondContact O-CG2 3.5Å; M169-V173 PolarHBondContact O-N 2.99Å; M169-V173 VanDerWaalsContact O-N 3.11Å; V170-V173 PolarHBondContact O-N 3.27Å; A171-V173 PolarHBondContact O-N 3.36Å; V173-Y177 WeakPolarHBondContact O-CB 3.23Å; V173-Y177 PolarHBondContact O-N 3.08Å
174I94.4Very high93.4Very high28 Ų2860.3 Ų60.314%0.14430%0.303CS..Hα-helixtrans-62.6-51.2177-72.9166.9000111.2V170 A171 V172 G176 Y177 F178 F424 V429 I433V170-I174 HydrophobicContact CG1-CD1 3.81Å; V170-I174 HydrophobicContact CG1-CG1 4.46Å; V170-I174 VanDerWaalsContact O-CG1 3.29Å; V170-I174 WeakPolarHBondContact O-CG1 3.46Å; V170-I174 PolarHBondContact O-N 3.42Å; A171-I174 PolarHBondContact O-N 2.94Å; V172-I174 PolarHBondContact O-N 2.89Å; I174-G176 PolarHBondContact O-N 3.4Å; I174-Y177 PolarHBondContact O-N 2.96Å; I174-F178 HydrophobicContact CG2-CD2 4.05Å; I174-F178 HydrophobicContact CG2-CE2 4.23Å; I174-F178 VanDerWaalsContact O-CD2 3.31Å; I174-F178 WeakPolarHBondContact O-CD2 3.44Å; I174-F178 PolarHBondContact O-N 3.37Å; I174-F424 HydrophobicContact CD1-CD1 4.47Å; I174-F424 HydrophobicContact CD1-CE1 3.92Å; I174-V429 HydrophobicContact CG2-CG1 3.61Å; I174-I433 HydrophobicContact CD1-CD1 4.35Å; I174-I433 HydrophobicContact CG2-CD1 4.34Å
175L92.6Very high93Very high3 Ų363.7 Ų63.72%0.01632%0.315CS..Hα-helixtrans-65.5-38.8-179.6-66-174.8000112.2A171 V172 L181 H182 M190 F193 V429A171-L175 PolarHBondContact O-N 3.05Å; V172-L175 PolarHBondContact O-N 3.36Å; L175-L181 HydrophobicContact CD2-CB 4.46Å; L175-L181 HydrophobicContact CD2-CD1 3.87Å; L175-H182 PolarHBondContact O-CD2 3.42Å; L175-H182 PolarHBondContact O-NE2 3.29Å; L175-M190 HydrophobicContact CB-CE 4.38Å; L175-M190 HydrophobicContact CB-CG 3.95Å; L175-M190 HydrophobicContact CB-SD 3.79Å; L175-M190 HydrophobicContact CD1-CG 3.85Å; L175-F193 HydrophobicContact CD1-CD2 4.24Å; L175-F193 HydrophobicContact CD1-CE2 3.8Å; L175-V429 HydrophobicContact CD2-CG2 4.22Å
176G91.6Very high92.8Very high29 Ų2962.1 Ų62.130%0.29931%0.307SS..Hα-helixtrans-65.7-43176.400000113.3V172 I174 H182V172-G176 PolarHBondContact O-N 2.95Å; I174-G176 PolarHBondContact O-N 3.4Å; G176-H182 WeakPolarHBondContact CA-NE2 3.5Å; G176-H182 PolarHBondContact O-CE1 2.83Å; G176-H182 PolarHBondContact O-NE2 3.49Å
177Y93.3Very high92.5Very high172 Ų17265.1 Ų65.168%0.67531%0.307SS*.Hα-helixtrans-68.5-44.8-176.8179.6-97.3000113.3V173 I174 R179V173-Y177 WeakPolarHBondContact O-CB 3.23Å; V173-Y177 PolarHBondContact O-N 3.08Å; I174-Y177 PolarHBondContact O-N 2.96Å; Y177-R179 PolarHBondContact O-N 3.35Å; Y177-R179 VanDerWaalsContact O-N 3.13Å
178F92.9Very high92.3Very high29 Ų2964.5 Ų64.513%0.12730%0.302CS..  trans-84.390.6-176.5-69.3-66.3000111.9I174 R180 L181 E432 I433I174-F178 HydrophobicContact CG2-CD2 4.05Å; I174-F178 HydrophobicContact CG2-CE2 4.23Å; I174-F178 VanDerWaalsContact O-CD2 3.31Å; I174-F178 WeakPolarHBondContact O-CD2 3.44Å; I174-F178 PolarHBondContact O-N 3.37Å; F178-R180 PolarHBondContact O-N 3.05Å; F178-L181 HydrophobicContact CB-CD1 3.82Å; F178-L181 HydrophobicContact CB-CG 3.91Å; F178-L181 HydrophobicContact CD2-CD1 4.33Å; F178-L181 HydrophobicContact CG-CD1 4.47Å; F178-L181 WeakPolarHBondContact O-CB 3.44Å; F178-L181 PolarHBondContact O-N 3.46Å; F178-E432 HydrophobicContact CD1-CB 4.48Å; F178-I433 HydrophobicContact CE2-CG1 3.85Å; F178-I433 HydrophobicContact CZ-CG1 4.2Å
179R89.4Confident92.1Very high211 Ų21165 Ų6580%0.79630%0.304SS*.G310 helixtrans-47.6-24.3174-71.8-178.7176.6151.4-0.6115.7Y177 L181 H182Y177-R179 PolarHBondContact O-N 3.35Å; Y177-R179 VanDerWaalsContact O-N 3.13Å; R179-L181 PolarHBondContact O-N 3.38Å; R179-H182 WeakPolarHBondContact O-CB 3.17Å; R179-H182 PolarHBondContact O-N 3.05Å
180R88.3Confident92Very high197 Ų19761.6 Ų61.674%0.74329%0.288SS*.G310 helixtrans-70.5-15.1174.4-79.4-176.6171.4-89.6-4.4114.2F178 E432F178-R180 PolarHBondContact O-N 3.05Å; R180-E432 HydrophobicContact CB-CG 4.44Å; R180-E432 WeakPolarHBondContact CD-OE1 3.41Å; R180-E432 IonicContact NE-OE1 2.8Å
181L89.3Confident92Very high7 Ų760.8 Ų60.84%0.03728%0.279CS..G310 helixtrans-97.74.7176.3-55.1-179.9000112.3L175 F178 R179 C183 N186 E428 V429L175-L181 HydrophobicContact CD2-CB 4.46Å; L175-L181 HydrophobicContact CD2-CD1 3.87Å; F178-L181 HydrophobicContact CB-CD1 3.82Å; F178-L181 HydrophobicContact CB-CG 3.91Å; F178-L181 HydrophobicContact CD2-CD1 4.33Å; F178-L181 HydrophobicContact CG-CD1 4.47Å; F178-L181 WeakPolarHBondContact O-CB 3.44Å; F178-L181 PolarHBondContact O-N 3.46Å; R179-L181 PolarHBondContact O-N 3.38Å; L181-C183 PolarHBondContact O-N 2.97Å; L181-N186 VanDerWaalsContact O-CB 3.28Å; L181-N186 WeakPolarHBondContact O-CB 3.5Å; L181-N186 PolarHBondContact O-ND2 2.89Å; L181-E428 HydrophobicContact CD2-CB 4.14Å; L181-V429 HydrophobicContact CD1-CG2 3.97Å
182H90.2Very high91.9Very high90 Ų9060.8 Ų60.842%0.41728%0.279SS..  trans-78.790.8179.8-69.3-169.1000110L175 G176 R179 Y187L175-H182 PolarHBondContact O-CD2 3.42Å; L175-H182 PolarHBondContact O-NE2 3.29Å; G176-H182 WeakPolarHBondContact CA-NE2 3.5Å; G176-H182 PolarHBondContact O-CE1 2.83Å; G176-H182 PolarHBondContact O-NE2 3.49Å; R179-H182 WeakPolarHBondContact O-CB 3.17Å; R179-H182 PolarHBondContact O-N 3.05Å; H182-Y187 HydrophobicContact CB-CE2 4.41Å
183C89.2Confident91.9Very high59 Ų5959.4 Ų59.440%0.39927%0.271SS..  trans-136.6154.2-177.6-179.30000109.7L181 R185 N186 Y187L181-C183 PolarHBondContact O-N 2.97Å; C183-R185 VanDerWaalsContact C-N 3.35Å; C183-R185 PolarHBondContact O-N 3.27Å; C183-N186 CarbonylContact O-C 3.43Å; C183-N186 WeakPolarHBondContact O-CA 3.47Å; C183-N186 PolarHBondContact O-N 3.4Å; C183-Y187 VanDerWaalsContact O-CD2 3.22Å; C183-Y187 WeakPolarHBondContact O-CD2 3.38Å; C183-Y187 PolarHBondContact O-N 3.35Å
184T87.9Confident92Very high37 Ų3757.5 Ų57.523%0.22726%0.259CS..Hα-helixtrans-51-48.6-177.846.80000113N186 Y187 I188 D280 L284T184-N186 VanDerWaalsContact C-N 3.3Å; T184-N186 PolarHBondContact O-N 2.82Å; T184-Y187 PolarHBondContact O-N 3.02Å; T184-I188 PolarHBondContact O-N 3.31Å; T184-I188 VanDerWaalsContact O-N 3.15Å; T184-D280 HydrophobicContact CG2-CB 4Å; T184-L284 HydrophobicContact CG2-CD1 4.48Å
185R88.4Confident92.1Very high73 Ų7356.2 Ų56.228%0.27525%0.252SS..Hα-helixtrans-49.3-49.9171.3-176.7-168.569.2-162.7-6.8112C183 I188 H189 Y268 E428C183-R185 VanDerWaalsContact C-N 3.35Å; C183-R185 PolarHBondContact O-N 3.27Å; R185-I188 PolarHBondContact O-N 3.02Å; R185-H189 WeakPolarHBondContact CG-NE2 3.39Å; R185-H189 PolarHBondContact O-CD2 3.11Å; R185-H189 PolarHBondContact O-N 3.5Å; R185-H189 VanDerWaalsContact O-N 3.07Å; R185-Y268 HydrophobicContact CB-CE1 4.12Å; R185-Y268 HydrophobicContact CG-CE1 4.2Å; R185-Y268 PolarHBondContact N-OH 3.38Å; R185-E428 IonicContact CZ-OE1 2.92Å; R185-E428 IonicContact CZ-OE2 3.89Å; R185-E428 IonicContact NH1-OE1 2.78Å; R185-E428 PolarHBondContact NH1-OE1 3.47Å; R185-E428 IonicContact NH2-OE1 3.9Å; R185-E428 PolarHBondContact NH2-OE1 2.91Å; R185-E428 IonicContact NH2-OE2 2.7Å; R185-E428 PolarHBondContact NH2-OE2 3.11Å
186N91.6Very high92.2Very high4 Ų456.3 Ų56.32%0.02125%0.252CS..Hα-helixtrans-75.1-28-174-64.12.5000112.1L181 C183 T184 H189 M190L181-N186 VanDerWaalsContact O-CB 3.28Å; L181-N186 WeakPolarHBondContact O-CB 3.5Å; L181-N186 PolarHBondContact O-ND2 2.89Å; C183-N186 CarbonylContact O-C 3.43Å; C183-N186 WeakPolarHBondContact O-CA 3.47Å; C183-N186 PolarHBondContact O-N 3.4Å; T184-N186 VanDerWaalsContact C-N 3.3Å; T184-N186 PolarHBondContact O-N 2.82Å; N186-H189 PolarHBondContact O-N 3.39Å; N186-M190 VanDerWaalsContact O-CG 3.3Å; N186-M190 WeakPolarHBondContact O-CG 3.4Å; N186-M190 PolarHBondContact O-N 3.28Å
187Y92Very high92.5Very high102 Ų10256.6 Ų56.640%0.425%0.246SC..Hα-helixtrans-64.9-39.5169.1-74.6-66.9000112H182 C183 T184 M190 H191H182-Y187 HydrophobicContact CB-CE2 4.41Å; C183-Y187 VanDerWaalsContact O-CD2 3.22Å; C183-Y187 WeakPolarHBondContact O-CD2 3.38Å; C183-Y187 PolarHBondContact O-N 3.35Å; T184-Y187 PolarHBondContact O-N 3.02Å; Y187-M190 PolarHBondContact O-N 3.02Å; Y187-H191 PolarHBondContact O-CD2 3.46Å; Y187-H191 VanDerWaalsContact O-CD2 3.28Å; Y187-H191 PolarHBondContact O-N 3.15Å
188I92.5Very high92.6Very high4 Ų450.9 Ų50.92%0.02123%0.227CC..Hα-helixtrans-64-47.4174.8-67.4169.5000110.3T184 R185 M190 H191 L192 W261 Y268 F287T184-I188 PolarHBondContact O-N 3.31Å; T184-I188 VanDerWaalsContact O-N 3.15Å; R185-I188 PolarHBondContact O-N 3.02Å; I188-M190 VanDerWaalsContact C-N 3.29Å; I188-M190 PolarHBondContact O-N 2.95Å; I188-H191 PolarHBondContact O-N 3.24Å; I188-H191 VanDerWaalsContact O-N 3.17Å; I188-L192 PolarHBondContact O-N 2.85Å; I188-W261 HydrophobicContact CG2-CZ3 4.27Å; I188-Y268 HydrophobicContact CD1-CD1 3.82Å; I188-Y268 HydrophobicContact CD1-CD2 3.36Å; I188-Y268 HydrophobicContact CD1-CE1 4.13Å; I188-Y268 HydrophobicContact CD1-CE2 3.69Å; I188-Y268 HydrophobicContact CD1-CG 3.43Å; I188-Y268 VanDerWaalsContact CD1-CG 3.43Å; I188-F287 HydrophobicContact CD1-CD2 4.5Å
189H92.4Very high92.7Very high12 Ų1249.9 Ų49.96%0.05622%0.223CC..Hα-helixtrans-58.5-37.8173.2-60.5-39.2000112.6R185 N186 L192 F193 E265 Y422R185-H189 WeakPolarHBondContact CG-NE2 3.39Å; R185-H189 PolarHBondContact O-CD2 3.11Å; R185-H189 PolarHBondContact O-N 3.5Å; R185-H189 VanDerWaalsContact O-N 3.07Å; N186-H189 PolarHBondContact O-N 3.39Å; H189-L192 PolarHBondContact O-N 3.45Å; H189-F193 WeakPolarHBondContact O-CB 3.45Å; H189-F193 VanDerWaalsContact O-CD2 3.26Å; H189-F193 WeakPolarHBondContact O-CD2 3.41Å; H189-F193 WeakPolarHBondContact O-CG 3.26Å; H189-F193 PolarHBondContact O-N 3.24Å; H189-E265 IonicContact CE1-OE1 2.76Å; H189-E265 PolarHBondContact CE1-OE1 2.92Å; H189-E265 VanDerWaalsContact CE1-OE1 3.26Å; H189-E265 IonicContact CG-OE1 2.81Å; H189-E265 IonicContact ND1-OE1 3.07Å; H189-E265 PolarHBondContact ND1-OE1 2.99Å; H189-Y422 AromaticContact CE1-CD1 3.86Å; H189-Y422 AromaticContact CE1-CD2 3.67Å; H189-Y422 AromaticContact CE1-CE1 3.7Å; H189-Y422 AromaticContact CE1-CE2 3.49Å; H189-Y422 VanDerWaalsContact CE1-CE2 3.49Å; H189-Y422 WeakPolarHBondContact CE1-CE2 3.46Å; H189-Y422 AromaticContact CE1-CG 3.84Å; H189-Y422 AromaticContact CE1-CZ 3.48Å; H189-Y422 VanDerWaalsContact CE1-CZ 3.48Å; H189-Y422 AromaticContact ND1-CD2 3.56Å; H189-Y422 AromaticContact ND1-CE2 3.56Å; H189-Y422 AromaticContact NE2-CD1 3.95Å
190M93.6Very high93Very high39 Ų3939.9 Ų39.919%0.19219%0.185CC..Hα-helixtrans-66.4-39.9175.4-74.8-17981.700112.7V172 L175 N186 Y187 I188 F193 V194V172-M190 HydrophobicContact CG1-CE 4.14Å; L175-M190 HydrophobicContact CB-CE 4.38Å; L175-M190 HydrophobicContact CB-CG 3.95Å; L175-M190 HydrophobicContact CB-SD 3.79Å; L175-M190 HydrophobicContact CD1-CG 3.85Å; N186-M190 VanDerWaalsContact O-CG 3.3Å; N186-M190 WeakPolarHBondContact O-CG 3.4Å; N186-M190 PolarHBondContact O-N 3.28Å; Y187-M190 PolarHBondContact O-N 3.02Å; I188-M190 VanDerWaalsContact C-N 3.29Å; I188-M190 PolarHBondContact O-N 2.95Å; M190-F193 PolarHBondContact O-N 2.89Å; M190-V194 VanDerWaalsContact O-CG2 3.31Å; M190-V194 WeakPolarHBondContact O-CG2 3.33Å; M190-V194 PolarHBondContact O-N 2.96Å
191H95.6Very high93.3Very high57 Ų5733.7 Ų33.726%0.26417%0.169SC..Hα-helixtrans-65.2-42.3173.3-78.6-66.1000112.2Y187 I188 V194 S195 W261 W292Y187-H191 PolarHBondContact O-CD2 3.46Å; Y187-H191 VanDerWaalsContact O-CD2 3.28Å; Y187-H191 PolarHBondContact O-N 3.15Å; I188-H191 PolarHBondContact O-N 3.24Å; I188-H191 VanDerWaalsContact O-N 3.17Å; H191-V194 PolarHBondContact O-N 3.42Å; H191-S195 PolarHBondContact O-N 3.28Å; H191-W261 HydrophobicContact CB-CD2 3.91Å; H191-W261 HydrophobicContact CB-CE3 3.68Å; H191-W261 HydrophobicContact CB-CH2 3.44Å; H191-W261 VanDerWaalsContact CB-CH2 3.44Å; H191-W261 HydrophobicContact CB-CZ2 3.66Å; H191-W261 HydrophobicContact CB-CZ3 3.44Å; H191-W261 VanDerWaalsContact CB-CZ3 3.44Å; H191-W261 AromaticContact CD2-CH2 3.8Å; H191-W261 AromaticContact CG-CH2 3.65Å; H191-W261 AromaticContact CG-CZ2 3.85Å; H191-W292 AromaticContact ND1-NE1 3.68Å
192L94.3Very high93.6Very high1 Ų133.6 Ų33.61%0.00517%0.169CC..Hα-helixtrans-58.5-48.6173.7178.170.2000111.4I188 H189 V194 S195 Y196 W261 I262 E265 V418I188-L192 PolarHBondContact O-N 2.85Å; H189-L192 PolarHBondContact O-N 3.45Å; L192-V194 VanDerWaalsContact C-N 3.34Å; L192-V194 PolarHBondContact O-N 2.88Å; L192-S195 WeakPolarHBondContact O-CB 3.25Å; L192-S195 PolarHBondContact O-N 3.42Å; L192-S195 VanDerWaalsContact O-N 3.1Å; L192-S195 PolarHBondContact O-OG 3.5Å; L192-Y196 HydrophobicContact CD1-CD2 4.18Å; L192-Y196 HydrophobicContact CD1-CE2 3.68Å; L192-Y196 HydrophobicContact CD2-CE2 4.16Å; L192-Y196 HydrophobicContact CG-CD2 3.99Å; L192-Y196 HydrophobicContact CG-CE2 3.7Å; L192-Y196 WeakPolarHBondContact O-CD2 3.19Å; L192-Y196 PolarHBondContact O-N 3.05Å; L192-W261 HydrophobicContact CD1-CB 3.86Å; L192-I262 HydrophobicContact CD1-CG1 3.83Å; L192-E265 WeakPolarHBondContact CD2-OE1 3.36Å; L192-E265 WeakPolarHBondContact CD2-OE2 3.41Å; L192-V418 HydrophobicContact CD2-CG1 4.08Å
193F95.9Very high93.6Very high0 Ų030 Ų300%015%0.153CC..Hα-helixtrans-57.4-44.2175.1-74.7-30.4000112.5I168 A171 V172 L175 H189 M190 S195 Y196 M197 V418 A419 C423I168-F193 HydrophobicContact CG1-CD1 4.44Å; I168-F193 HydrophobicContact CG2-CB 3.59Å; I168-F193 HydrophobicContact CG2-CD1 4Å; I168-F193 HydrophobicContact CG2-CG 3.94Å; A171-F193 HydrophobicContact CB-CD2 4.47Å; A171-F193 HydrophobicContact CB-CE2 4.04Å; A171-F193 HydrophobicContact CB-CZ 4.25Å; V172-F193 HydrophobicContact CG2-CB 3.57Å; V172-F193 HydrophobicContact CG2-CD2 4.13Å; V172-F193 HydrophobicContact CG2-CG 4.21Å; L175-F193 HydrophobicContact CD1-CD2 4.24Å; L175-F193 HydrophobicContact CD1-CE2 3.8Å; H189-F193 WeakPolarHBondContact O-CB 3.45Å; H189-F193 VanDerWaalsContact O-CD2 3.26Å; H189-F193 WeakPolarHBondContact O-CD2 3.41Å; H189-F193 WeakPolarHBondContact O-CG 3.26Å; H189-F193 PolarHBondContact O-N 3.24Å; M190-F193 PolarHBondContact O-N 2.89Å; F193-S195 VanDerWaalsContact C-N 3.32Å; F193-S195 PolarHBondContact O-N 3.43Å; F193-Y196 PolarHBondContact O-N 3.24Å; F193-M197 WeakPolarHBondContact O-CG 3.3Å; F193-M197 PolarHBondContact O-N 3.49Å; F193-V418 HydrophobicContact CE1-CG1 3.94Å; F193-A419 HydrophobicContact CE1-CB 4.26Å; F193-C423 HydrophobicContact CZ-CB 4.41Å
194V96.4Very high93.8Very high54 Ų5429.5 Ų29.533%0.32714%0.144SC..Hα-helixtrans-63.2-36.9175.2171.30000111.4M190 H191 L192 Y196 M197 L198 W292M190-V194 VanDerWaalsContact O-CG2 3.31Å; M190-V194 WeakPolarHBondContact O-CG2 3.33Å; M190-V194 PolarHBondContact O-N 2.96Å; H191-V194 PolarHBondContact O-N 3.42Å; L192-V194 VanDerWaalsContact C-N 3.34Å; L192-V194 PolarHBondContact O-N 2.88Å; V194-Y196 PolarHBondContact O-N 2.92Å; V194-M197 PolarHBondContact O-N 2.98Å; V194-L198 HydrophobicContact CG1-CD1 3.76Å; V194-L198 HydrophobicContact CG1-CG 4.36Å; V194-L198 WeakPolarHBondContact O-CB 3.38Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 3.36Å; V194-W292 HydrophobicContact CG1-CH2 4.09Å; V194-W292 HydrophobicContact CG1-CZ2 4.4Å
195S96.6Very high93.9Very high0 Ų030.5 Ų30.50%015%0.15CC..Hα-helixtrans-62.8-40.717482.90000112.7H191 L192 F193 L198 R199 N258H191-S195 PolarHBondContact O-N 3.28Å; L192-S195 WeakPolarHBondContact O-CB 3.25Å; L192-S195 PolarHBondContact O-N 3.42Å; L192-S195 VanDerWaalsContact O-N 3.1Å; L192-S195 PolarHBondContact O-OG 3.5Å; F193-S195 VanDerWaalsContact C-N 3.32Å; F193-S195 PolarHBondContact O-N 3.43Å; S195-L198 PolarHBondContact O-N 3.27Å; S195-R199 WeakPolarHBondContact O-CB 3.34Å; S195-R199 PolarHBondContact O-N 3.04Å; S195-N258 PolarHBondContact OG-ND2 3.47Å
196Y95.7Very high93.9Very high5 Ų528.3 Ų28.32%0.0214%0.143CC..Hα-helixtrans-67.5-39.7175.2-79.3-68.6000112.2I168 L192 F193 V194 R199 A200 N258 I262 Q414 V418I168-Y196 HydrophobicContact CD1-CG 4.36Å; L192-Y196 HydrophobicContact CD1-CD2 4.18Å; L192-Y196 HydrophobicContact CD1-CE2 3.68Å; L192-Y196 HydrophobicContact CD2-CE2 4.16Å; L192-Y196 HydrophobicContact CG-CD2 3.99Å; L192-Y196 HydrophobicContact CG-CE2 3.7Å; L192-Y196 WeakPolarHBondContact O-CD2 3.19Å; L192-Y196 PolarHBondContact O-N 3.05Å; F193-Y196 PolarHBondContact O-N 3.24Å; V194-Y196 PolarHBondContact O-N 2.92Å; Y196-R199 PolarHBondContact O-N 2.96Å; Y196-A200 WeakPolarHBondContact O-CB 3.38Å; Y196-A200 PolarHBondContact O-N 2.85Å; Y196-N258 WeakPolarHBondContact CD1-ND2 3.16Å; Y196-N258 WeakPolarHBondContact CE1-ND2 3.22Å; Y196-N258 WeakPolarHBondContact CE1-OD1 3.45Å; Y196-I262 WeakPolarHBondContact OH-CD1 3.36Å; Y196-Q414 HydrophobicContact CE1-CB 4.25Å; Y196-Q414 HydrophobicContact CE1-CG 4.21Å; Y196-Q414 VanDerWaalsContact OH-CD 3.27Å; Y196-Q414 PolarHBondContact OH-NE2 3.47Å; Y196-V418 HydrophobicContact CE2-CG2 4.45Å
197M96.5Very high93.7Very high35 Ų3528.6 Ų28.617%0.17214%0.144CC..Hα-helixtrans-62.4-44.6174.9-70.3-163.272.200111.7L165 I168 M169 F193 V194 A200 V201L165-M197 HydrophobicContact CD1-CB 4Å; L165-M197 HydrophobicContact CD1-CE 3.52Å; L165-M197 HydrophobicContact CD1-CG 4.03Å; L165-M197 HydrophobicContact CG-CE 4.31Å; I168-M197 HydrophobicContact CB-CG 4.14Å; I168-M197 HydrophobicContact CG2-CG 3.57Å; I168-M197 HydrophobicContact CG2-SD 4.06Å; M169-M197 HydrophobicContact CB-CE 3.63Å; M169-M197 HydrophobicContact CB-SD 4.15Å; M169-M197 HydrophobicContact CG-CE 3.69Å; M169-M197 HydrophobicContact CG-SD 4.34Å; M169-M197 HydrophobicContact SD-CE 3.98Å; F193-M197 WeakPolarHBondContact O-CG 3.3Å; F193-M197 PolarHBondContact O-N 3.49Å; V194-M197 PolarHBondContact O-N 2.98Å; M197-A200 PolarHBondContact O-N 2.9Å; M197-V201 WeakPolarHBondContact O-CB 3.44Å; M197-V201 WeakPolarHBondContact O-CG2 3.35Å; M197-V201 PolarHBondContact O-N 3.1Å
198L96.4Very high93.3Very high53 Ų5328.8 Ų28.828%0.27715%0.151SC..Hα-helixtrans-68-38.8178.7-68.7166.5000112.1V194 S195 V201 S202 F254 W292V194-L198 HydrophobicContact CG1-CD1 3.76Å; V194-L198 HydrophobicContact CG1-CG 4.36Å; V194-L198 WeakPolarHBondContact O-CB 3.38Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 3.36Å; S195-L198 PolarHBondContact O-N 3.27Å; L198-V201 PolarHBondContact O-N 3.44Å; L198-S202 VanDerWaalsContact O-CB 3.27Å; L198-S202 WeakPolarHBondContact O-CB 3.3Å; L198-S202 PolarHBondContact O-N 3.35Å; L198-S202 PolarHBondContact O-OG 3.24Å; L198-F254 HydrophobicContact CB-CB 4.42Å; L198-F254 HydrophobicContact CB-CD1 3.69Å; L198-F254 HydrophobicContact CB-CD2 4.21Å; L198-F254 HydrophobicContact CB-CE1 3.89Å; L198-F254 HydrophobicContact CB-CE2 4.33Å; L198-F254 HydrophobicContact CB-CG 3.86Å; L198-F254 HydrophobicContact CB-CZ 4.2Å; L198-F254 HydrophobicContact CD1-CD1 4.13Å; L198-F254 HydrophobicContact CD1-CE1 3.7Å; L198-F254 HydrophobicContact CD1-CZ 4.25Å; L198-F254 HydrophobicContact CD2-CE1 4.26Å; L198-F254 HydrophobicContact CD2-CE2 4.39Å; L198-F254 HydrophobicContact CD2-CZ 3.98Å; L198-F254 HydrophobicContact CG-CD1 4.43Å; L198-F254 HydrophobicContact CG-CE1 4.16Å; L198-F254 HydrophobicContact CG-CZ 4.37Å; L198-W292 HydrophobicContact CD1-CH2 3.79Å; L198-W292 HydrophobicContact CD1-CZ3 3.91Å
199R95.3Very high92.8Very high7 Ų731.2 Ų31.23%0.02617%0.165CC..Hα-helixtrans-56.5-52.3170.5178.6176.8171.1173.12.1110.9Y161 S195 Y196 S202 I203 N258 Y384Y161-R199 PolarHBondContact OH-NE 3.43Å; Y161-R199 PolarHBondContact OH-NH2 3.47Å; S195-R199 WeakPolarHBondContact O-CB 3.34Å; S195-R199 PolarHBondContact O-N 3.04Å; Y196-R199 PolarHBondContact O-N 2.96Å; R199-S202 PolarHBondContact O-N 2.96Å; R199-S202 PolarHBondContact O-OG 3Å; R199-I203 HydrophobicContact CG-CD1 4.24Å; R199-I203 WeakPolarHBondContact O-CG1 3.22Å; R199-I203 PolarHBondContact O-N 3.34Å; R199-I203 VanDerWaalsContact O-N 3.11Å; R199-N258 HydrophobicContact CB-CB 4.43Å; R199-N258 WeakPolarHBondContact CD-OD1 3.27Å; R199-N258 PolarHBondContact NH1-OD1 2.88Å; R199-Y384 PolarHBondContact NH1-OH 2.91Å; R199-Y384 VanDerWaalsContact NH1-OH 3.11Å; R199-Y384 PolarHBondContact NH2-OH 2.97Å
200A95.2Very high91.9Very high1 Ų132.4 Ų32.41%0.00817%0.172CC..Hα-helixtrans-61.4-45.3179.800000112.9Y161 L165 Y196 M197 S202 I203 F204Y161-A200 HydrophobicContact CD1-CB 3.98Å; Y161-A200 HydrophobicContact CG-CB 4.41Å; L165-A200 HydrophobicContact CB-CB 4.44Å; L165-A200 HydrophobicContact CD1-CB 4.26Å; Y196-A200 WeakPolarHBondContact O-CB 3.38Å; Y196-A200 PolarHBondContact O-N 2.85Å; M197-A200 PolarHBondContact O-N 2.9Å; A200-S202 VanDerWaalsContact C-N 3.33Å; A200-S202 PolarHBondContact O-N 3.29Å; A200-I203 PolarHBondContact O-N 3.47Å; A200-F204 VanDerWaalsContact O-CD2 3.28Å; A200-F204 WeakPolarHBondContact O-CD2 3.28Å; A200-F204 PolarHBondContact O-N 3.15Å
201V95.1Very high90.9Very high67 Ų6736.6 Ų36.641%0.40619%0.187SC..Hα-helixtrans-62.5-40175.8170.20000111.5L165 M197 L198 I203 F204 V205L165-V201 HydrophobicContact CD1-CG2 4.07Å; L165-V201 HydrophobicContact CD2-CG2 4.37Å; M197-V201 WeakPolarHBondContact O-CB 3.44Å; M197-V201 WeakPolarHBondContact O-CG2 3.35Å; M197-V201 PolarHBondContact O-N 3.1Å; L198-V201 PolarHBondContact O-N 3.44Å; V201-I203 VanDerWaalsContact C-N 3.3Å; V201-I203 PolarHBondContact O-N 3.32Å; V201-F204 PolarHBondContact O-N 2.89Å; V201-V205 HydrophobicContact CG1-CG2 4.37Å; V201-V205 WeakPolarHBondContact O-CG2 3.44Å; V201-V205 PolarHBondContact O-N 2.98Å
202S94Very high89.3Confident5 Ų538 Ų384%0.03520%0.201CC..Hα-helixtrans-67.5-29179.673.30000113.9L198 R199 A200 K206L198-S202 VanDerWaalsContact O-CB 3.27Å; L198-S202 WeakPolarHBondContact O-CB 3.3Å; L198-S202 PolarHBondContact O-N 3.35Å; L198-S202 PolarHBondContact O-OG 3.24Å; R199-S202 PolarHBondContact O-N 2.96Å; R199-S202 PolarHBondContact O-OG 3Å; A200-S202 VanDerWaalsContact C-N 3.33Å; A200-S202 PolarHBondContact O-N 3.29Å; S202-K206 WeakPolarHBondContact O-CB 3.5Å; S202-K206 PolarHBondContact O-N 2.66Å
203I91.7Very high87.3Confident14 Ų1440.2 Ų40.27%0.07222%0.224CC..Hα-helixtrans-66.8-54.6173.1-71.5166.9000109Y157 Y161 R199 A200 V201 V205 K206 D207 F251Y157-I203 HydrophobicContact CD2-CG2 4.18Å; Y157-I203 HydrophobicContact CE2-CG2 3.9Å; Y161-I203 HydrophobicContact CD1-CD1 4.5Å; Y161-I203 HydrophobicContact CD2-CD1 3.95Å; Y161-I203 HydrophobicContact CE1-CD1 4Å; Y161-I203 HydrophobicContact CE2-CD1 3.39Å; Y161-I203 HydrophobicContact CG-CD1 4.49Å; Y161-I203 VanDerWaalsContact CZ-CD1 3.4Å; R199-I203 HydrophobicContact CG-CD1 4.24Å; R199-I203 WeakPolarHBondContact O-CG1 3.22Å; R199-I203 PolarHBondContact O-N 3.34Å; R199-I203 VanDerWaalsContact O-N 3.11Å; A200-I203 PolarHBondContact O-N 3.47Å; V201-I203 VanDerWaalsContact C-N 3.3Å; V201-I203 PolarHBondContact O-N 3.32Å; I203-V205 VanDerWaalsContact C-N 3.25Å; I203-V205 PolarHBondContact O-N 3.33Å; I203-K206 CarbonylContact O-C 3.52Å; I203-K206 WeakPolarHBondContact O-CA 3.47Å; I203-K206 WeakPolarHBondContact O-CB 3.37Å; I203-K206 PolarHBondContact O-N 3.15Å; I203-D207 VanDerWaalsContact CG2-OD2 3.23Å; I203-D207 WeakPolarHBondContact CG2-OD2 3.49Å; I203-D207 PolarHBondContact O-N 3.09Å; I203-D207 VanDerWaalsContact O-OD2 3.11Å; I203-F251 HydrophobicContact CD1-CE2 4.35Å; I203-F251 HydrophobicContact CG1-CD2 3.94Å; I203-F251 HydrophobicContact CG1-CE2 3.65Å
204F91.9Very high85.1Confident49 Ų4941.8 Ų41.822%0.21524%0.235CC..Hα-helixtrans-57.4-36.5177.2-58.6-44.6000113.3T158 L165 A200 V201 I208T158-F204 HydrophobicContact CG2-CE1 4.23Å; L165-F204 HydrophobicContact CD2-CE2 4.19Å; A200-F204 VanDerWaalsContact O-CD2 3.28Å; A200-F204 WeakPolarHBondContact O-CD2 3.28Å; A200-F204 PolarHBondContact O-N 3.15Å; V201-F204 PolarHBondContact O-N 2.89Å; F204-I208 WeakPolarHBondContact O-CB 3.43Å; F204-I208 WeakPolarHBondContact O-CD1 3.5Å; F204-I208 WeakPolarHBondContact O-CG1 3.3Å; F204-I208 PolarHBondContact O-N 3.22Å
205V90.1Very high82.8Confident59 Ų5941.1 Ų41.136%0.35824%0.235SC..Hα-helixtrans-69.9-36.7174.5175.70000112.1V201 I203 V209 V247V201-V205 HydrophobicContact CG1-CG2 4.37Å; V201-V205 WeakPolarHBondContact O-CG2 3.44Å; V201-V205 PolarHBondContact O-N 2.98Å; I203-V205 VanDerWaalsContact C-N 3.25Å; I203-V205 PolarHBondContact O-N 3.33Å; V205-V209 WeakPolarHBondContact O-CB 3.44Å; V205-V209 VanDerWaalsContact O-CG2 3.24Å; V205-V209 WeakPolarHBondContact O-CG2 3.35Å; V205-V209 PolarHBondContact O-N 2.97Å; V205-V247 HydrophobicContact CG1-CG1 3.98Å; V205-V247 HydrophobicContact CG1-CG2 3.96Å
206K88.8Confident80.3Confident27 Ų2745.1 Ų45.112%0.11726%0.256CS..Hα-helixtrans-62.3-48.8171.4-171.7-175.3115.5830110.6S202 I203 I208 V209 L210 V247 F251 D316S202-K206 WeakPolarHBondContact O-CB 3.5Å; S202-K206 PolarHBondContact O-N 2.66Å; I203-K206 CarbonylContact O-C 3.52Å; I203-K206 WeakPolarHBondContact O-CA 3.47Å; I203-K206 WeakPolarHBondContact O-CB 3.37Å; I203-K206 PolarHBondContact O-N 3.15Å; K206-I208 PolarHBondContact O-N 3.27Å; K206-V209 PolarHBondContact O-N 2.95Å; K206-V209 VanDerWaalsContact O-N 3.15Å; K206-L210 HydrophobicContact CD-CD2 4.34Å; K206-L210 HydrophobicContact CG-CD1 4.1Å; K206-L210 HydrophobicContact CG-CD2 3.87Å; K206-L210 WeakPolarHBondContact O-CB 3.38Å; K206-L210 WeakPolarHBondContact O-CD1 3.23Å; K206-L210 PolarHBondContact O-N 3.29Å; K206-V247 HydrophobicContact CB-CG1 4.19Å; K206-F251 HydrophobicContact CD-CD1 3.91Å; K206-F251 HydrophobicContact CD-CD2 4.49Å; K206-F251 HydrophobicContact CD-CE1 4.24Å; K206-F251 HydrophobicContact CD-CG 4.05Å; K206-D316 IonicContact NZ-OD1 2.73Å; K206-D316 PolarHBondContact NZ-OD1 3.47Å; K206-D316 IonicContact NZ-OD2 4Å; K206-D316 PolarHBondContact NZ-OD2 2.89Å
207D86.8Confident78.1Confident10 Ų1051.8 Ų51.85%0.05329%0.287CS..Hα-helixtrans-65.9-40.9-173.8-55.3-29.7000111.8Y157 I203 V209 Y211Y157-D207 PolarHBondContact OH-OD1 3.35Å; I203-D207 VanDerWaalsContact CG2-OD2 3.23Å; I203-D207 WeakPolarHBondContact CG2-OD2 3.49Å; I203-D207 PolarHBondContact O-N 3.09Å; I203-D207 VanDerWaalsContact O-OD2 3.11Å; D207-V209 VanDerWaalsContact C-N 3.3Å; D207-V209 PolarHBondContact O-N 3.35Å; D207-Y211 CarbonylContact O-C 3.59Å; D207-Y211 WeakPolarHBondContact O-CA 3.41Å; D207-Y211 WeakPolarHBondContact O-CB 3.42Å; D207-Y211 PolarHBondContact O-N 2.94Å
208I84.3Confident75.8Confident106 Ų10655.6 Ų55.654%0.54431%0.308SS..Hα-helixtrans-62.6-35174.4-70.8165.9000112.2F204 K206F204-I208 WeakPolarHBondContact O-CB 3.43Å; F204-I208 WeakPolarHBondContact O-CD1 3.5Å; F204-I208 WeakPolarHBondContact O-CG1 3.3Å; F204-I208 PolarHBondContact O-N 3.22Å; K206-I208 PolarHBondContact O-N 3.27Å
209V82.8Confident73.3Confident54 Ų5461.2 Ų61.233%0.32734%0.335SS..Hα-helixtrans-86.4-30.8-174.9172.30000112.7V205 K206 D207 T243 C244 V247V205-V209 WeakPolarHBondContact O-CB 3.44Å; V205-V209 VanDerWaalsContact O-CG2 3.24Å; V205-V209 WeakPolarHBondContact O-CG2 3.35Å; V205-V209 PolarHBondContact O-N 2.97Å; K206-V209 PolarHBondContact O-N 2.95Å; K206-V209 VanDerWaalsContact O-N 3.15Å; D207-V209 VanDerWaalsContact C-N 3.3Å; D207-V209 PolarHBondContact O-N 3.35Å; V209-T243 HydrophobicContact CG1-CG2 4.41Å; V209-C244 HydrophobicContact CG1-CB 4.4Å; V209-V247 HydrophobicContact CB-CG1 4.43Å; V209-V247 HydrophobicContact CG2-CG2 4.32Å
210L73.4Confident70.7Confident38 Ų3866.1 Ų66.120%0.19936%0.359CS..Hα-helixtrans-92.5-35.4178.1-84.259.6000113K206 P212 D316K206-L210 HydrophobicContact CD-CD2 4.34Å; K206-L210 HydrophobicContact CG-CD1 4.1Å; K206-L210 HydrophobicContact CG-CD2 3.87Å; K206-L210 WeakPolarHBondContact O-CB 3.38Å; K206-L210 WeakPolarHBondContact O-CD1 3.23Å; K206-L210 PolarHBondContact O-N 3.29Å; L210-P212 WeakPolarHBondContact O-CD 3.44Å; L210-D316 HydrophobicContact CD2-CB 4.03Å; L210-D316 VanDerWaalsContact CD2-CG 3.46Å; L210-D316 WeakPolarHBondContact CD2-OD2 3.37Å
211Y71.3Confident68.1Low126 Ų12678 Ų7849%0.49440%0.403SS..  trans-126.558-174.3-54.4-70.4000112.4D207 G213 S214D207-Y211 CarbonylContact O-C 3.59Å; D207-Y211 WeakPolarHBondContact O-CA 3.41Å; D207-Y211 WeakPolarHBondContact O-CB 3.42Å; D207-Y211 PolarHBondContact O-N 2.94Å; Y211-G213 PolarHBondContact O-N 3.01Å; Y211-S214 WeakPolarHBondContact CB-OG 3.34Å; Y211-S214 PolarHBondContact O-N 3.25Å; Y211-S214 PolarHBondContact O-OG 3.34Å
212P62Low65.5Low88 Ų8879.3 Ų79.357%0.57141%0.411SS*.Hα-helixtrans-57.5-24-178.823.5-34.3000113.8L210L210-P212 WeakPolarHBondContact O-CD 3.44Å
213G53.6Low62.6Low46 Ų4683.5 Ų83.547%0.47444%0.436SS..Hα-helixtrans-72.4-43.317700000115.1Y211 A215 L216 E217Y211-G213 PolarHBondContact O-N 3.01Å; G213-A215 PolarHBondContact O-N 3.28Å; G213-L216 PolarHBondContact O-N 3.31Å; G213-L216 VanDerWaalsContact O-N 3.15Å; G213-E217 PolarHBondContact O-N 3.18Å; G213-E217 VanDerWaalsContact O-N 3.11Å
214S49.6Very low60.4Low34 Ų3489.5 Ų89.524%0.23847%0.473CS..Hα-helixtrans-76.2-25.9-17359.70000113.3Y211 L216 N218Y211-S214 WeakPolarHBondContact CB-OG 3.34Å; Y211-S214 PolarHBondContact O-N 3.25Å; Y211-S214 PolarHBondContact O-OG 3.34Å; S214-L216 VanDerWaalsContact C-N 3.35Å; S214-N218 PolarHBondContact O-ND2 3.31Å
215A48.2Very low57.9Low40 Ų4095 Ų9533%0.33150%0.5SS..Hα-helixtrans-67-36.8168.100000111.7G213G213-A215 PolarHBondContact O-N 3.28Å
216L44.1Very low55.5Low83 Ų8398.4 Ų98.444%0.43552%0.516SS..Hα-helixtrans-77.8-38.4-175-165.369.2000113.3G213 S214 N218 M219 E220G213-L216 PolarHBondContact O-N 3.31Å; G213-L216 VanDerWaalsContact O-N 3.15Å; S214-L216 VanDerWaalsContact C-N 3.35Å; L216-N218 PolarHBondContact O-N 2.94Å; L216-M219 PolarHBondContact O-N 3.42Å; L216-E220 HydrophobicContact CD1-CB 4.46Å; L216-E220 HydrophobicContact CG-CB 4.38Å; L216-E220 PolarHBondContact O-N 3.23Å
217E49.5Very low53.1Low146 Ų146104 Ų10468%0.68254%0.541SS*.THydrogen-bonded Turntrans-55-22.7176.2-76.7-174128.900113.6G213G213-E217 PolarHBondContact O-N 3.18Å; G213-E217 VanDerWaalsContact O-N 3.11Å
218N46.8Very low50.7Low115 Ų115114 Ų11462%0.61558%0.577SS**THydrogen-bonded Turntrans-91.9-5.2179.6-73.2-81.9000114.3S214 L216S214-N218 PolarHBondContact O-ND2 3.31Å; L216-N218 PolarHBondContact O-N 2.94Å
219M45Very low48.1Very low170 Ų170113.3 Ų113.384%0.83758%0.582SS**THydrogen-bonded Turntrans-121.4-31.3-179.9-168.4164.2-70.500113.6L216L216-M219 PolarHBondContact O-N 3.42Å
220E39.7Very low46.2Very low111 Ų111116.1 Ų116.152%0.51959%0.594SS.*  trans-105.496.6-173-169.2133-121.200113.1L216L216-E220 HydrophobicContact CD1-CB 4.46Å; L216-E220 HydrophobicContact CG-CB 4.38Å; L216-E220 PolarHBondContact O-N 3.23Å
221R42.1Very low44.3Very low250 Ų250119.8 Ų119.894%0.94362%0.619SS**  trans-107.334.2166.7-150.6-177-171.395.22.1111.6
222V38.8Very low42.5Very low95 Ų95122.1 Ų122.158%0.57663%0.634SS**SBendtrans-130.1133.2-166.8-171.90000110.2
223T34.3Very low41.3Very low92 Ų92122.1 Ų122.156%0.56464%0.642SS**  trans39.7104.7167.950.30000119.2E225T223-E225 PolarHBondContact O-N 3.39Å
224V45.1Very low40.6Very low140 Ų140124.3 Ų124.385%0.84865%0.648SS**THydrogen-bonded Turntrans-70.521173.5-1740000113.2
225E40.1Very low40.1Very low166 Ų166128.3 Ų128.378%0.77667%0.673SS**THydrogen-bonded Turntrans-105.2-31.7-170.8-63.2-164.8120.600114.2T223 F227T223-E225 PolarHBondContact O-N 3.39Å; E225-F227 VanDerWaalsContact C-N 3.26Å; E225-F227 PolarHBondContact O-N 3.22Å
226D39.4Very low40.2Very low130 Ų130130 Ų13070%0.69569%0.686SS**G310 helixtrans-72.1-20176.8-109.3-26.9000113.1R228 S229D226-R228 PolarHBondContact O-N 2.93Å; D226-S229 WeakPolarHBondContact O-CB 3.45Å; D226-S229 PolarHBondContact O-N 3.26Å; D226-S229 PolarHBondContact O-OG 2.95Å
227F38.7Very low40.8Very low145 Ų145128.1 Ų128.164%0.63668%0.68SS**G310 helixtrans-61.3-14.4179.5-113.6-85.2000114.4E225 S229E225-F227 VanDerWaalsContact C-N 3.26Å; E225-F227 PolarHBondContact O-N 3.22Å; F227-S229 VanDerWaalsContact C-N 3.28Å
228R35.5Very low41.5Very low218 Ų218129.7 Ų129.782%0.82369%0.685SS**G310 helixtrans-76.8-11173.4-175.1166.1-78.4149.3-2.9113.4D226 T231D226-R228 PolarHBondContact O-N 2.93Å; R228-T231 PolarHBondContact O-OG1 2.89Å
229S30.1Very low42.7Very low92 Ų92128.8 Ų128.864%0.64368%0.683SS**G310 helixtrans-78.4-21.9173.2660000113.5D226 F227D226-S229 WeakPolarHBondContact O-CB 3.45Å; D226-S229 PolarHBondContact O-N 3.26Å; D226-S229 PolarHBondContact O-OG 2.95Å; F227-S229 VanDerWaalsContact C-N 3.28Å
230I42.2Very low44.1Very low113 Ų113125.7 Ų125.758%0.57967%0.667SS**  trans-103.638.3-175.4-35-179000111.2
231T35Very low45.9Very low116 Ų116123.7 Ų123.771%0.71266%0.657SS**  trans-97.2-6.5176.4-38.50000113.2R228R228-T231 PolarHBondContact O-OG1 2.89Å
232E31.7Very low47.9Very low174 Ų174116.8 Ų116.881%0.81364%0.637SS**SBendtrans-91.4114.5151.9-71.8-167.5136.100108.4P234E232-P234 WeakPolarHBondContact O-CD 3.42Å
233A37.6Very low50.1Low89 Ų89115.3 Ų115.374%0.73663%0.629SS**PPolyproline II helixtrans-67.4120.3164.700000107.9
234P38.3Very low52.7Low92 Ų92111.7 Ų111.760%0.59761%0.607SS**PPolyproline II helixtrans-60130.8179.6-23.133.9000109.8E232 A236E232-P234 WeakPolarHBondContact O-CD 3.42Å; P234-A236 PolarHBondContact O-N 3.36Å; P234-A236 VanDerWaalsContact O-N 3.15Å
235P40.9Very low54.7Low118 Ų118106.4 Ų106.477%0.76657%0.573SS**PPolyproline II helixtrans-59.5123.5178.224.2-33.2000108.9S237P235-S237 PolarHBondContact O-N 3.42Å
236A48.6Very low57.1Low74 Ų74102.9 Ų102.961%0.61256%0.562SS**  trans-51.5101.4-167.800000111.4P234 F241P234-A236 PolarHBondContact O-N 3.36Å; P234-A236 VanDerWaalsContact O-N 3.15Å; A236-F241 HydrophobicContact CB-CE2 3.81Å; A236-F241 HydrophobicContact CB-CZ 4.05Å
237S56.7Low59.6Low44 Ų4497.3 Ų97.331%0.30853%0.533SS..  trans-80.9144.3-164.467.20000110.4P235 T239 Q240 F241P235-S237 PolarHBondContact O-N 3.42Å; S237-T239 PolarHBondContact O-N 3.38Å; S237-Q240 PolarHBondContact O-N 3.03Å; S237-Q240 WeakPolarHBondContact OG-CG 3.37Å; S237-Q240 PolarHBondContact OG-N 3.08Å; S237-Q240 PolarHBondContact OG-OE1 3.36Å; S237-F241 WeakPolarHBondContact O-CD2 3.45Å; S237-F241 PolarHBondContact O-N 3.45Å
238K65.5Low62.1Low179 Ų17990.4 Ų90.478%0.77850%0.503SS*.Hα-helixtrans-52-32.7175.7-63.7-174.7178.8-175.90111.8F241 I242K238-F241 PolarHBondContact O-N 3.45Å; K238-I242 WeakPolarHBondContact O-CD1 3.41Å; K238-I242 VanDerWaalsContact O-CG1 3.24Å; K238-I242 WeakPolarHBondContact O-CG1 3.35Å; K238-I242 PolarHBondContact O-N 2.82Å
239T70.9Confident64.8Low96 Ų9681.6 Ų81.659%0.58947%0.473SS*.Hα-helixtrans-59.2-41.1174.4-43.30000113.4S237 T243S237-T239 PolarHBondContact O-N 3.38Å; T239-T243 WeakPolarHBondContact O-CB 3.49Å; T239-T243 PolarHBondContact O-N 3.22Å; T239-T243 PolarHBondContact O-OG1 3.37Å
240Q74.6Confident67.8Low105 Ų10580.8 Ų80.849%0.49146%0.461SS..Hα-helixtrans-67.2-46178.8-75.6160.5-65.500111.3S237 I242 T243 C244S237-Q240 PolarHBondContact O-N 3.03Å; S237-Q240 WeakPolarHBondContact OG-CG 3.37Å; S237-Q240 PolarHBondContact OG-N 3.08Å; S237-Q240 PolarHBondContact OG-OE1 3.36Å; Q240-I242 PolarHBondContact O-N 3.37Å; Q240-T243 PolarHBondContact O-N 3.34Å; Q240-C244 WeakPolarHBondContact O-CB 3.43Å; Q240-C244 PolarHBondContact O-N 2.83Å
241F78.1Confident70.2Confident70 Ų7077 Ų7731%0.30744%0.441SS..Hα-helixtrans-60.6-45.6175.4-66.1-73.8000112.1A236 S237 K238 T243 C244 K245 E313A236-F241 HydrophobicContact CB-CE2 3.81Å; A236-F241 HydrophobicContact CB-CZ 4.05Å; S237-F241 WeakPolarHBondContact O-CD2 3.45Å; S237-F241 PolarHBondContact O-N 3.45Å; K238-F241 PolarHBondContact O-N 3.45Å; F241-T243 VanDerWaalsContact C-N 3.34Å; F241-T243 PolarHBondContact O-N 3.03Å; F241-C244 PolarHBondContact O-N 3.02Å; F241-K245 WeakPolarHBondContact O-CG 3.24Å; F241-K245 PolarHBondContact O-N 3.22Å; F241-E313 HydrophobicContact CE1-CB 4.44Å
242I84.2Confident72.9Confident104 Ų10472.5 Ų72.553%0.53341%0.412SS..Hα-helixtrans-59.6-44.7175.4-67.8164.4000110.9K238 Q240 C244 K245 V246K238-I242 WeakPolarHBondContact O-CD1 3.41Å; K238-I242 VanDerWaalsContact O-CG1 3.24Å; K238-I242 WeakPolarHBondContact O-CG1 3.35Å; K238-I242 PolarHBondContact O-N 2.82Å; Q240-I242 PolarHBondContact O-N 3.37Å; I242-C244 PolarHBondContact O-N 3.47Å; I242-K245 PolarHBondContact O-N 2.88Å; I242-V246 WeakPolarHBondContact O-CG2 3.33Å; I242-V246 PolarHBondContact O-N 3.44Å
243T85.1Confident76Confident64 Ų6466.9 Ų66.939%0.39338%0.384SS..Hα-helixtrans-60.8-45.8178-57.30000111.1V209 T239 Q240 F241 V246 V247V209-T243 HydrophobicContact CG1-CG2 4.41Å; T239-T243 WeakPolarHBondContact O-CB 3.49Å; T239-T243 PolarHBondContact O-N 3.22Å; T239-T243 PolarHBondContact O-OG1 3.37Å; Q240-T243 PolarHBondContact O-N 3.34Å; F241-T243 VanDerWaalsContact C-N 3.34Å; F241-T243 PolarHBondContact O-N 3.03Å; T243-V246 PolarHBondContact O-N 3.1Å; T243-V247 HydrophobicContact CG2-CG2 4.42Å; T243-V247 WeakPolarHBondContact O-CB 3.32Å; T243-V247 VanDerWaalsContact O-CG2 3.29Å; T243-V247 WeakPolarHBondContact O-CG2 3.38Å; T243-V247 PolarHBondContact O-N 2.98Å
244C88Confident78.8Confident17 Ų1764 Ų6412%0.11535%0.354CS..Hα-helixtrans-63.2-46.1178.7-168.30000112V209 Q240 F241 I242 V246 V247 V248 C314V209-C244 HydrophobicContact CG1-CB 4.4Å; Q240-C244 WeakPolarHBondContact O-CB 3.43Å; Q240-C244 PolarHBondContact O-N 2.83Å; F241-C244 PolarHBondContact O-N 3.02Å; I242-C244 PolarHBondContact O-N 3.47Å; C244-V246 PolarHBondContact O-N 3.25Å; C244-V247 PolarHBondContact O-N 3.25Å; C244-V248 WeakPolarHBondContact O-CG2 3.34Å; C244-V248 PolarHBondContact O-N 3.2Å; C244-C314 HydrophobicContact CB-CB 3.76Å; C244-C314 WeakPolarHBondContact CB-SG 3.21Å; C244-C314 WeakPolarHBondContact SG-CB 3.41Å; C244-C314 CovalentContact SG-SG 2.03Å; C244-C314 PolarHBondContact SG-SG 3.47Å
245K88.4Confident81.4Confident28 Ų2860.9 Ų60.912%0.12233%0.333CS..Hα-helixtrans-57.5-44.5174.4-70.1177.3-176.9-173.30112.4F241 I242 T249 D311 E313 W315F241-K245 WeakPolarHBondContact O-CG 3.24Å; F241-K245 PolarHBondContact O-N 3.22Å; I242-K245 PolarHBondContact O-N 2.88Å; K245-T249 WeakPolarHBondContact O-CB 3.49Å; K245-T249 PolarHBondContact O-N 2.89Å; K245-T249 VanDerWaalsContact O-N 3.09Å; K245-T249 PolarHBondContact O-OG1 3.42Å; K245-D311 PolarHBondContact NZ-O 3.36Å; K245-D311 IonicContact NZ-OD1 2.9Å; K245-D311 PolarHBondContact NZ-OD1 2.7Å; K245-D311 IonicContact NZ-OD2 3.28Å; K245-D311 PolarHBondContact NZ-OD2 3.32Å; K245-E313 WeakPolarHBondContact CE-O 3.23Å; K245-W315 HydrophobicContact CB-CD2 4.05Å; K245-W315 HydrophobicContact CB-CE3 4.12Å; K245-W315 HydrophobicContact CB-CZ3 4.43Å; K245-W315 HydrophobicContact CD-CD2 4.26Å; K245-W315 HydrophobicContact CD-CZ2 4Å; K245-W315 HydrophobicContact CG-CD2 3.84Å; K245-W315 HydrophobicContact CG-CE3 4.42Å; K245-W315 HydrophobicContact CG-CG 3.95Å; K245-W315 HydrophobicContact CG-CZ2 4.43Å
246V90.4Very high83.9Confident92 Ų9255.4 Ų55.456%0.55830%0.297SS*.Hα-helixtrans-65.1-44.4177.2170.50000111.5I242 T243 C244 T249 L250I242-V246 WeakPolarHBondContact O-CG2 3.33Å; I242-V246 PolarHBondContact O-N 3.44Å; T243-V246 PolarHBondContact O-N 3.1Å; C244-V246 PolarHBondContact O-N 3.25Å; V246-T249 PolarHBondContact O-N 2.95Å; V246-L250 WeakPolarHBondContact O-CB 3.49Å; V246-L250 PolarHBondContact O-N 3.35Å
247V91.3Very high86.2Confident14 Ų1451.9 Ų51.99%0.08527%0.268CS..Hα-helixtrans-66.1-44.2-178.8166.50000112.1V205 K206 V209 T243 C244 T249 L250 F251V205-V247 HydrophobicContact CG1-CG1 3.98Å; V205-V247 HydrophobicContact CG1-CG2 3.96Å; K206-V247 HydrophobicContact CB-CG1 4.19Å; V209-V247 HydrophobicContact CB-CG1 4.43Å; V209-V247 HydrophobicContact CG2-CG2 4.32Å; T243-V247 HydrophobicContact CG2-CG2 4.42Å; T243-V247 WeakPolarHBondContact O-CB 3.32Å; T243-V247 VanDerWaalsContact O-CG2 3.29Å; T243-V247 WeakPolarHBondContact O-CG2 3.38Å; T243-V247 PolarHBondContact O-N 2.98Å; C244-V247 PolarHBondContact O-N 3.25Å; V247-T249 VanDerWaalsContact C-N 3.35Å; V247-T249 PolarHBondContact O-N 3.15Å; V247-L250 PolarHBondContact O-N 3.02Å; V247-F251 WeakPolarHBondContact O-CB 3.5Å; V247-F251 PolarHBondContact O-N 3.06Å
248V90.4Very high88Confident0 Ų049.8 Ų49.80%025%0.254CS..Hα-helixtrans-62.3-42.7174.8174.10000110.9C244 L250 F251 M252 W302 W315 D316C244-V248 WeakPolarHBondContact O-CG2 3.34Å; C244-V248 PolarHBondContact O-N 3.2Å; V248-L250 VanDerWaalsContact C-N 3.33Å; V248-L250 PolarHBondContact O-N 2.9Å; V248-F251 PolarHBondContact O-N 2.96Å; V248-M252 WeakPolarHBondContact O-CG 3.38Å; V248-M252 PolarHBondContact O-N 2.8Å; V248-W302 HydrophobicContact CG1-CH2 4.46Å; V248-W315 HydrophobicContact CG1-CB 4.43Å; V248-D316 HydrophobicContact CG2-CB 4.14Å
249T91.9Very high89.3Confident32 Ų3242.9 Ų42.920%0.19622%0.223CC..Hα-helixtrans-62-40.7176.7-55.50000112K245 V246 V247 M252 Y253 V299 A303 W315K245-T249 WeakPolarHBondContact O-CB 3.49Å; K245-T249 PolarHBondContact O-N 2.89Å; K245-T249 VanDerWaalsContact O-N 3.09Å; K245-T249 PolarHBondContact O-OG1 3.42Å; V246-T249 PolarHBondContact O-N 2.95Å; V247-T249 VanDerWaalsContact C-N 3.35Å; V247-T249 PolarHBondContact O-N 3.15Å; T249-M252 PolarHBondContact O-N 3.48Å; T249-Y253 WeakPolarHBondContact O-CB 3.27Å; T249-Y253 PolarHBondContact O-N 3.43Å; T249-V299 HydrophobicContact CG2-CG1 3.78Å; T249-A303 HydrophobicContact CG2-CB 4.17Å; T249-W315 VanDerWaalsContact OG1-CZ3 3.32Å; T249-W315 WeakPolarHBondContact OG1-CZ3 3.32Å
250L93.7Very high90.5Very high75 Ų7539.3 Ų39.339%0.39320%0.199SC..Hα-helixtrans-67-41177.9-172.265.8000112.1V246 V247 V248 Y253 F254V246-L250 WeakPolarHBondContact O-CB 3.49Å; V246-L250 PolarHBondContact O-N 3.35Å; V247-L250 PolarHBondContact O-N 3.02Å; V248-L250 VanDerWaalsContact C-N 3.33Å; V248-L250 PolarHBondContact O-N 2.9Å; L250-Y253 PolarHBondContact O-N 2.76Å; L250-F254 HydrophobicContact CD1-CD2 4.02Å; L250-F254 HydrophobicContact CD1-CE2 3.37Å; L250-F254 HydrophobicContact CD1-CZ 3.81Å; L250-F254 HydrophobicContact CD2-CE2 4.12Å; L250-F254 HydrophobicContact CG-CD2 3.9Å; L250-F254 HydrophobicContact CG-CE2 3.53Å; L250-F254 HydrophobicContact CG-CZ 4.45Å; L250-F254 VanDerWaalsContact O-CD2 3.28Å; L250-F254 WeakPolarHBondContact O-CD2 3.16Å; L250-F254 PolarHBondContact O-N 3.36Å
251F93.3Very high91.5Very high34 Ų3434.4 Ų34.415%0.14918%0.176CC..Hα-helixtrans-59.6-49.9171.9162.4-105.3000111.5I203 K206 V247 V248 Y253 F254 L255I203-F251 HydrophobicContact CD1-CE2 4.35Å; I203-F251 HydrophobicContact CG1-CD2 3.94Å; I203-F251 HydrophobicContact CG1-CE2 3.65Å; K206-F251 HydrophobicContact CD-CD1 3.91Å; K206-F251 HydrophobicContact CD-CD2 4.49Å; K206-F251 HydrophobicContact CD-CE1 4.24Å; K206-F251 HydrophobicContact CD-CG 4.05Å; V247-F251 WeakPolarHBondContact O-CB 3.5Å; V247-F251 PolarHBondContact O-N 3.06Å; V248-F251 PolarHBondContact O-N 2.96Å; F251-Y253 VanDerWaalsContact C-N 3.31Å; F251-Y253 PolarHBondContact O-N 2.72Å; F251-F254 PolarHBondContact O-N 2.92Å; F251-L255 HydrophobicContact CE1-CD2 4.33Å; F251-L255 HydrophobicContact CZ-CD2 4.03Å; F251-L255 VanDerWaalsContact O-CB 3.27Å; F251-L255 WeakPolarHBondContact O-CB 3.37Å; F251-L255 PolarHBondContact O-N 2.72Å
252M92.1Very high92.2Very high22 Ų2231.3 Ų31.311%0.10816%0.162CC..Hα-helixtrans-59.6-40.6177.5-69.2-61.6-174.600112.1V248 T249 L255 A256 W302 Y326V248-M252 WeakPolarHBondContact O-CG 3.38Å; V248-M252 PolarHBondContact O-N 2.8Å; T249-M252 PolarHBondContact O-N 3.48Å; M252-L255 HydrophobicContact SD-CD2 4.48Å; M252-A256 WeakPolarHBondContact O-CB 3.47Å; M252-A256 PolarHBondContact O-N 3.09Å; M252-W302 HydrophobicContact CG-CH2 4.45Å; M252-Y326 HydrophobicContact CE-CE1 4.25Å; M252-Y326 HydrophobicContact CE-CE2 4.41Å; M252-Y326 HydrophobicContact SD-CD2 4.41Å; M252-Y326 HydrophobicContact SD-CE2 3.93Å
253Y95.6Very high92.6Very high56 Ų5627 Ų2722%0.2214%0.14CC..Hα-helixtrans-62.1-48.4175.4171.6-115.6000112.9T249 L250 F251 A256 T257 P295 A296T249-Y253 WeakPolarHBondContact O-CB 3.27Å; T249-Y253 PolarHBondContact O-N 3.43Å; L250-Y253 PolarHBondContact O-N 2.76Å; F251-Y253 VanDerWaalsContact C-N 3.31Å; F251-Y253 PolarHBondContact O-N 2.72Å; Y253-A256 PolarHBondContact O-N 2.94Å; Y253-T257 WeakPolarHBondContact CE2-OG1 3.43Å; Y253-T257 WeakPolarHBondContact O-CB 3.27Å; Y253-T257 PolarHBondContact O-N 3.26Å; Y253-T257 PolarHBondContact O-OG1 2.88Å; Y253-P295 HydrophobicContact CD2-CB 4.19Å; Y253-P295 HydrophobicContact CE2-CB 4.11Å; Y253-A296 HydrophobicContact CD2-CB 4.39Å; Y253-A296 HydrophobicContact CE2-CB 3.76Å
254F96.6Very high93Very high28 Ų2824 Ų2412%0.12312%0.121CC..Hα-helixtrans-72.7-30.9-179.9-67.6-47.8000113.2L198 L250 F251 N258L198-F254 HydrophobicContact CB-CB 4.42Å; L198-F254 HydrophobicContact CB-CD1 3.69Å; L198-F254 HydrophobicContact CB-CD2 4.21Å; L198-F254 HydrophobicContact CB-CE1 3.89Å; L198-F254 HydrophobicContact CB-CE2 4.33Å; L198-F254 HydrophobicContact CB-CG 3.86Å; L198-F254 HydrophobicContact CB-CZ 4.2Å; L198-F254 HydrophobicContact CD1-CD1 4.13Å; L198-F254 HydrophobicContact CD1-CE1 3.7Å; L198-F254 HydrophobicContact CD1-CZ 4.25Å; L198-F254 HydrophobicContact CD2-CE1 4.26Å; L198-F254 HydrophobicContact CD2-CE2 4.39Å; L198-F254 HydrophobicContact CD2-CZ 3.98Å; L198-F254 HydrophobicContact CG-CD1 4.43Å; L198-F254 HydrophobicContact CG-CE1 4.16Å; L198-F254 HydrophobicContact CG-CZ 4.37Å; L250-F254 HydrophobicContact CD1-CD2 4.02Å; L250-F254 HydrophobicContact CD1-CE2 3.37Å; L250-F254 HydrophobicContact CD1-CZ 3.81Å; L250-F254 HydrophobicContact CD2-CE2 4.12Å; L250-F254 HydrophobicContact CG-CD2 3.9Å; L250-F254 HydrophobicContact CG-CE2 3.53Å; L250-F254 HydrophobicContact CG-CZ 4.45Å; L250-F254 VanDerWaalsContact O-CD2 3.28Å; L250-F254 WeakPolarHBondContact O-CD2 3.16Å; L250-F254 PolarHBondContact O-N 3.36Å; F251-F254 PolarHBondContact O-N 2.92Å; F254-N258 WeakPolarHBondContact O-CB 3.46Å; F254-N258 PolarHBondContact O-N 3.45Å
255L92.9Very high93.1Very high27 Ų2723.2 Ų23.214%0.14112%0.116CC..Hα-helixtrans-60.8-54.3169.9-179.564.4000111F251 M252 T257 N258 Y259F251-L255 HydrophobicContact CE1-CD2 4.33Å; F251-L255 HydrophobicContact CZ-CD2 4.03Å; F251-L255 VanDerWaalsContact O-CB 3.27Å; F251-L255 WeakPolarHBondContact O-CB 3.37Å; F251-L255 PolarHBondContact O-N 2.72Å; M252-L255 HydrophobicContact SD-CD2 4.48Å; L255-T257 PolarHBondContact O-N 2.93Å; L255-N258 PolarHBondContact O-N 3.32Å; L255-Y259 HydrophobicContact CD1-CD2 4.48Å; L255-Y259 HydrophobicContact CD1-CE2 3.71Å; L255-Y259 HydrophobicContact CG-CD2 4.45Å; L255-Y259 HydrophobicContact CG-CE2 3.94Å; L255-Y259 WeakPolarHBondContact O-CD2 3.38Å; L255-Y259 PolarHBondContact O-N 3.41Å
256A93.8Very high93.2Very high3 Ų321.9 Ų21.93%0.02511%0.111CC..Hα-helixtrans-59.8-46.4177.400000111.7M252 Y253 N258 Y259 Y260 P295 I330M252-A256 WeakPolarHBondContact O-CB 3.47Å; M252-A256 PolarHBondContact O-N 3.09Å; Y253-A256 PolarHBondContact O-N 2.94Å; A256-N258 VanDerWaalsContact C-N 3.27Å; A256-N258 PolarHBondContact O-N 3.3Å; A256-Y259 PolarHBondContact O-N 3.28Å; A256-Y259 VanDerWaalsContact O-N 3.15Å; A256-Y260 WeakPolarHBondContact O-CD2 3.41Å; A256-Y260 PolarHBondContact O-N 3.43Å; A256-P295 HydrophobicContact CB-CB 4.09Å; A256-I330 HydrophobicContact CB-CD1 3.97Å; A256-I330 HydrophobicContact CB-CG1 4.32Å
257T96.1Very high93.2Very high0 Ų019.8 Ų19.80%010%0.096CC..Hα-helixtrans-54.9-40.7176.3-65.20000112.5Y253 L255 Y260 W261 W292Y253-T257 WeakPolarHBondContact CE2-OG1 3.43Å; Y253-T257 WeakPolarHBondContact O-CB 3.27Å; Y253-T257 PolarHBondContact O-N 3.26Å; Y253-T257 PolarHBondContact O-OG1 2.88Å; L255-T257 PolarHBondContact O-N 2.93Å; T257-Y260 PolarHBondContact O-N 3.48Å; T257-W261 PolarHBondContact O-N 3.25Å; T257-W292 HydrophobicContact CG2-CD2 4.1Å; T257-W292 HydrophobicContact CG2-CE3 3.45Å; T257-W292 VanDerWaalsContact CG2-CE3 3.45Å; T257-W292 HydrophobicContact CG2-CH2 4.1Å; T257-W292 HydrophobicContact CG2-CZ3 3.47Å; T257-W292 VanDerWaalsContact CG2-CZ3 3.47Å
258N95.1Very high93.1Very high0 Ų021 Ų210%010%0.1CC..Hα-helixtrans-65.3-42.6178.2-178-125.6000112.2S195 Y196 R199 F254 L255 A256 W261 I262S195-N258 PolarHBondContact OG-ND2 3.47Å; Y196-N258 WeakPolarHBondContact CD1-ND2 3.16Å; Y196-N258 WeakPolarHBondContact CE1-ND2 3.22Å; Y196-N258 WeakPolarHBondContact CE1-OD1 3.45Å; R199-N258 HydrophobicContact CB-CB 4.43Å; R199-N258 WeakPolarHBondContact CD-OD1 3.27Å; R199-N258 PolarHBondContact NH1-OD1 2.88Å; F254-N258 WeakPolarHBondContact O-CB 3.46Å; F254-N258 PolarHBondContact O-N 3.45Å; L255-N258 PolarHBondContact O-N 3.32Å; A256-N258 VanDerWaalsContact C-N 3.27Å; A256-N258 PolarHBondContact O-N 3.3Å; N258-W261 PolarHBondContact O-N 3.33Å; N258-I262 VanDerWaalsContact O-CG1 3.3Å; N258-I262 WeakPolarHBondContact O-CG1 3.47Å; N258-I262 PolarHBondContact O-N 3.26Å; N258-I262 VanDerWaalsContact O-N 3.08Å
259Y93.1Very high93Very high33 Ų3323.4 Ų23.413%0.12911%0.112CC..Hα-helixtrans-62.5-42.1172.5-69.4-70.8000112.7L255 A256 W261 I262 L263 I330 V334 Y384L255-Y259 HydrophobicContact CD1-CD2 4.48Å; L255-Y259 HydrophobicContact CD1-CE2 3.71Å; L255-Y259 HydrophobicContact CG-CD2 4.45Å; L255-Y259 HydrophobicContact CG-CE2 3.94Å; L255-Y259 WeakPolarHBondContact O-CD2 3.38Å; L255-Y259 PolarHBondContact O-N 3.41Å; A256-Y259 PolarHBondContact O-N 3.28Å; A256-Y259 VanDerWaalsContact O-N 3.15Å; Y259-W261 VanDerWaalsContact C-N 3.34Å; Y259-W261 PolarHBondContact O-N 2.87Å; Y259-I262 PolarHBondContact O-N 3.37Å; Y259-L263 PolarHBondContact O-N 2.95Å; Y259-I330 HydrophobicContact CD1-CG2 4.4Å; Y259-I330 HydrophobicContact CD2-CG2 3.53Å; Y259-I330 HydrophobicContact CE2-CG2 3.87Å; Y259-I330 HydrophobicContact CG-CG2 3.83Å; Y259-V334 HydrophobicContact CD1-CG2 3.82Å; Y259-V334 HydrophobicContact CE1-CG2 4.24Å; Y259-Y384 HydrophobicContact CD1-CE2 4.45Å; Y259-Y384 HydrophobicContact CE1-CD1 4.05Å; Y259-Y384 AromaticContact CE1-CD2 3.82Å; Y259-Y384 HydrophobicContact CE1-CD2 3.82Å; Y259-Y384 AromaticContact CE1-CE1 3.79Å; Y259-Y384 HydrophobicContact CE1-CE1 3.79Å; Y259-Y384 AromaticContact CE1-CE2 3.63Å; Y259-Y384 HydrophobicContact CE1-CE2 3.63Å; Y259-Y384 HydrophobicContact CE1-CG 4.07Å; Y259-Y384 AromaticContact CE1-CZ 3.61Å; Y259-Y384 AromaticContact CZ-CE1 3.85Å; Y259-Y384 AromaticContact CZ-CZ 3.98Å; Y259-Y384 WeakPolarHBondContact OH-CE1 3.42Å
260Y95.1Very high92.8Very high22 Ų2223.8 Ų23.89%0.08611%0.111CC..Hα-helixtrans-67.1-32.8177.7-86.6-103000112.5A256 T257 L263 V264 I290 V294 P295 I298 A333A256-Y260 WeakPolarHBondContact O-CD2 3.41Å; A256-Y260 PolarHBondContact O-N 3.43Å; T257-Y260 PolarHBondContact O-N 3.48Å; Y260-L263 PolarHBondContact O-N 3.38Å; Y260-V264 WeakPolarHBondContact O-CB 3.45Å; Y260-V264 VanDerWaalsContact O-CG2 3.3Å; Y260-V264 WeakPolarHBondContact O-CG2 3.49Å; Y260-V264 PolarHBondContact O-N 3.47Å; Y260-I290 HydrophobicContact CD1-CG2 4.29Å; Y260-V294 HydrophobicContact CD1-CB 4.22Å; Y260-V294 HydrophobicContact CD1-CG1 4.25Å; Y260-V294 HydrophobicContact CE1-CB 3.94Å; Y260-V294 HydrophobicContact CE1-CG1 3.48Å; Y260-V294 VanDerWaalsContact CE1-CG1 3.48Å; Y260-P295 HydrophobicContact CD1-CG 4.26Å; Y260-P295 HydrophobicContact CD2-CG 3.82Å; Y260-P295 HydrophobicContact CG-CG 3.65Å; Y260-I298 HydrophobicContact CE2-CD1 4.23Å; Y260-I298 VanDerWaalsContact OH-CD1 3.3Å; Y260-I298 WeakPolarHBondContact OH-CD1 3.29Å; Y260-A333 HydrophobicContact CD2-CB 4.48Å; Y260-A333 HydrophobicContact CE2-CB 4.08Å
261W95.9Very high92.5Very high2 Ų221.4 Ų21.41%0.00810%0.101CC..Hα-helixtrans-70.4-34.1171.9-88.198.1000113.7I188 H191 L192 T257 N258 Y259 V264 E265 G291 W292I188-W261 HydrophobicContact CG2-CZ3 4.27Å; H191-W261 HydrophobicContact CB-CD2 3.91Å; H191-W261 HydrophobicContact CB-CE3 3.68Å; H191-W261 HydrophobicContact CB-CH2 3.44Å; H191-W261 VanDerWaalsContact CB-CH2 3.44Å; H191-W261 HydrophobicContact CB-CZ2 3.66Å; H191-W261 HydrophobicContact CB-CZ3 3.44Å; H191-W261 VanDerWaalsContact CB-CZ3 3.44Å; H191-W261 AromaticContact CD2-CH2 3.8Å; H191-W261 AromaticContact CG-CH2 3.65Å; H191-W261 AromaticContact CG-CZ2 3.85Å; L192-W261 HydrophobicContact CD1-CB 3.86Å; T257-W261 PolarHBondContact O-N 3.25Å; N258-W261 PolarHBondContact O-N 3.33Å; Y259-W261 VanDerWaalsContact C-N 3.34Å; Y259-W261 PolarHBondContact O-N 2.87Å; W261-V264 HydrophobicContact CE3-CB 4.18Å; W261-V264 HydrophobicContact CE3-CG1 3.81Å; W261-V264 HydrophobicContact CH2-CG1 4.31Å; W261-V264 HydrophobicContact CZ3-CB 4.42Å; W261-V264 HydrophobicContact CZ3-CG1 3.59Å; W261-V264 PolarHBondContact O-N 2.93Å; W261-E265 PolarHBondContact O-N 2.74Å; W261-G291 VanDerWaalsContact NE1-C 3.33Å; W261-G291 PolarHBondContact NE1-O 3.26Å; W261-W292 AromaticContact CE2-CD1 3.84Å; W261-W292 AromaticContact CE2-CE2 3.91Å; W261-W292 AromaticContact CE2-NE1 3.41Å; W261-W292 AromaticContact CZ2-CD1 3.54Å; W261-W292 AromaticContact CZ2-NE1 3.22Å; W261-W292 AromaticContact NE1-CD1 3.54Å; W261-W292 AromaticContact NE1-CD2 3.69Å; W261-W292 AromaticContact NE1-CE2 3.26Å; W261-W292 VanDerWaalsContact NE1-CE2 3.26Å; W261-W292 AromaticContact NE1-CG 3.82Å; W261-W292 AromaticContact NE1-CZ2 3.71Å; W261-W292 AromaticContact NE1-NE1 3.19Å; W261-W292 VanDerWaalsContact NE1-NE1 3.19Å
262I92.8Very high92.1Very high5 Ų524.9 Ų24.93%0.02612%0.12CC..Hα-helixtrans-64-42.7171-65162.7000110.4L192 Y196 N258 Y259 E265 G266L192-I262 HydrophobicContact CD1-CG1 3.83Å; Y196-I262 WeakPolarHBondContact OH-CD1 3.36Å; N258-I262 VanDerWaalsContact O-CG1 3.3Å; N258-I262 WeakPolarHBondContact O-CG1 3.47Å; N258-I262 PolarHBondContact O-N 3.26Å; N258-I262 VanDerWaalsContact O-N 3.08Å; Y259-I262 PolarHBondContact O-N 3.37Å; I262-E265 PolarHBondContact O-N 3.11Å; I262-G266 PolarHBondContact O-N 3.48Å
263L92.5Very high91.7Very high13 Ų1327 Ų277%0.06813%0.132CC..Hα-helixtrans-63.6-41.7173.4172.863000112.3Y259 Y260 E265 G266 L267 A333 I336 N337 L340Y259-L263 PolarHBondContact O-N 2.95Å; Y260-L263 PolarHBondContact O-N 3.38Å; L263-E265 VanDerWaalsContact C-N 3.29Å; L263-E265 PolarHBondContact O-N 3.49Å; L263-G266 PolarHBondContact O-N 2.98Å; L263-L267 HydrophobicContact CD1-CD1 4.07Å; L263-L267 HydrophobicContact CD1-CG 4.05Å; L263-L267 HydrophobicContact CG-CD1 3.91Å; L263-L267 HydrophobicContact CG-CG 4.37Å; L263-L267 WeakPolarHBondContact O-CB 3.5Å; L263-L267 WeakPolarHBondContact O-CG 3.3Å; L263-L267 PolarHBondContact O-N 3.1Å; L263-A333 HydrophobicContact CD2-CB 3.83Å; L263-I336 HydrophobicContact CD1-CB 4.26Å; L263-I336 HydrophobicContact CD1-CG2 3.77Å; L263-N337 HydrophobicContact CD1-CB 3.99Å; L263-L340 HydrophobicContact CD1-CD1 3.95Å
264V93.8Very high91.1Very high0 Ų029.2 Ų29.20%014%0.143CC..Hα-helixtrans-60.6-38.9176160.90000111.5Y260 W261 Y268 F287 I290Y260-V264 WeakPolarHBondContact O-CB 3.45Å; Y260-V264 VanDerWaalsContact O-CG2 3.3Å; Y260-V264 WeakPolarHBondContact O-CG2 3.49Å; Y260-V264 PolarHBondContact O-N 3.47Å; W261-V264 HydrophobicContact CE3-CB 4.18Å; W261-V264 HydrophobicContact CE3-CG1 3.81Å; W261-V264 HydrophobicContact CH2-CG1 4.31Å; W261-V264 HydrophobicContact CZ3-CB 4.42Å; W261-V264 HydrophobicContact CZ3-CG1 3.59Å; W261-V264 PolarHBondContact O-N 2.93Å; V264-Y268 VanDerWaalsContact O-CB 3.28Å; V264-Y268 WeakPolarHBondContact O-CB 3.42Å; V264-Y268 PolarHBondContact O-N 2.96Å; V264-F287 HydrophobicContact CG1-CB 3.74Å; V264-F287 HydrophobicContact CG1-CD1 4Å; V264-F287 HydrophobicContact CG1-CG 4.06Å; V264-I290 HydrophobicContact CG2-CB 4.01Å; V264-I290 HydrophobicContact CG2-CG2 3.69Å
265E91.3Very high90.2Very high2 Ų233.7 Ų33.71%0.00917%0.165CC..Hα-helixtrans-67.5-42.2175.1-175165.4-105.300112.5H189 L192 W261 I262 L263 Y268 L269 L379 Y422H189-E265 IonicContact CE1-OE1 2.76Å; H189-E265 PolarHBondContact CE1-OE1 2.92Å; H189-E265 VanDerWaalsContact CE1-OE1 3.26Å; H189-E265 IonicContact CG-OE1 2.81Å; H189-E265 IonicContact ND1-OE1 3.07Å; H189-E265 PolarHBondContact ND1-OE1 2.99Å; L192-E265 WeakPolarHBondContact CD2-OE1 3.36Å; L192-E265 WeakPolarHBondContact CD2-OE2 3.41Å; W261-E265 PolarHBondContact O-N 2.74Å; I262-E265 PolarHBondContact O-N 3.11Å; L263-E265 VanDerWaalsContact C-N 3.29Å; L263-E265 PolarHBondContact O-N 3.49Å; E265-Y268 PolarHBondContact O-N 3.15Å; E265-L269 WeakPolarHBondContact O-CB 3.5Å; E265-L269 PolarHBondContact O-N 3.41Å; E265-L379 WeakPolarHBondContact OE2-CD2 3Å; E265-Y422 VanDerWaalsContact OE1-CE2 3.25Å; E265-Y422 WeakPolarHBondContact OE1-CE2 3.04Å; E265-Y422 WeakPolarHBondContact OE2-CE2 3.37Å
266G89.9Confident88.9Confident0 Ų038.2 Ų38.20%019%0.194CC..Hα-helixtrans-60.7-45.4172.700000112.9I262 L263 L269 H270 F380I262-G266 PolarHBondContact O-N 3.48Å; L263-G266 PolarHBondContact O-N 2.98Å; G266-L269 PolarHBondContact O-N 2.79Å; G266-H270 VanDerWaalsContact O-CB 3.24Å; G266-H270 WeakPolarHBondContact O-CB 3.47Å; G266-H270 PolarHBondContact O-N 3.38Å; G266-F380 VanDerWaalsContact CA-CE1 3.5Å
267L90.6Very high87.2Confident48 Ų4847.1 Ų47.125%0.25123%0.233SC..Hα-helixtrans-62.5-42.8175-76.3168.6000112.1L263 S271 F287 L340L263-L267 HydrophobicContact CD1-CD1 4.07Å; L263-L267 HydrophobicContact CD1-CG 4.05Å; L263-L267 HydrophobicContact CG-CD1 3.91Å; L263-L267 HydrophobicContact CG-CG 4.37Å; L263-L267 WeakPolarHBondContact O-CB 3.5Å; L263-L267 WeakPolarHBondContact O-CG 3.3Å; L263-L267 PolarHBondContact O-N 3.1Å; L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.01Å; L267-S271 PolarHBondContact O-OG 3.23Å; L267-F287 HydrophobicContact CB-CE1 4.05Å; L267-L340 HydrophobicContact CB-CD1 4.49Å; L267-L340 HydrophobicContact CD2-CD1 3.57Å; L267-L340 HydrophobicContact CD2-CD2 4.3Å; L267-L340 HydrophobicContact CG-CD1 3.72Å
268Y89.5Confident85.6Confident40 Ų4050.7 Ų50.716%0.15725%0.249CC..Hα-helixtrans-64-46.5177.4172.7-105000111.9R185 I188 V264 E265 S271 L272 F287R185-Y268 HydrophobicContact CB-CE1 4.12Å; R185-Y268 HydrophobicContact CG-CE1 4.2Å; R185-Y268 PolarHBondContact N-OH 3.38Å; I188-Y268 HydrophobicContact CD1-CD1 3.82Å; I188-Y268 HydrophobicContact CD1-CD2 3.36Å; I188-Y268 HydrophobicContact CD1-CE1 4.13Å; I188-Y268 HydrophobicContact CD1-CE2 3.69Å; I188-Y268 HydrophobicContact CD1-CG 3.43Å; I188-Y268 VanDerWaalsContact CD1-CG 3.43Å; V264-Y268 VanDerWaalsContact O-CB 3.28Å; V264-Y268 WeakPolarHBondContact O-CB 3.42Å; V264-Y268 PolarHBondContact O-N 2.96Å; E265-Y268 PolarHBondContact O-N 3.15Å; Y268-S271 WeakPolarHBondContact O-CB 3.48Å; Y268-S271 PolarHBondContact O-N 3.21Å; Y268-L272 HydrophobicContact CE1-CD1 4.38Å; Y268-L272 WeakPolarHBondContact O-CB 3.33Å; Y268-L272 PolarHBondContact O-N 3.25Å; Y268-F287 AromaticContact CD2-CE2 3.99Å; Y268-F287 HydrophobicContact CD2-CE2 3.99Å
269L87.3Confident84.4Confident49 Ų4953.7 Ų53.726%0.25727%0.27SS..Hα-helixtrans-68.1-40.4-179.8-164.6151.1000111.5E265 G266 L272 I273 I344 F380E265-L269 WeakPolarHBondContact O-CB 3.5Å; E265-L269 PolarHBondContact O-N 3.41Å; G266-L269 PolarHBondContact O-N 2.79Å; L269-L272 PolarHBondContact O-N 2.84Å; L269-I273 HydrophobicContact CD2-CD1 3.68Å; L269-I273 WeakPolarHBondContact O-CG1 3.21Å; L269-I273 PolarHBondContact O-N 3.28Å; L269-I344 HydrophobicContact CD2-CB 4.45Å; L269-I344 HydrophobicContact CD2-CD1 3.83Å; L269-I344 HydrophobicContact CD2-CG1 3.92Å; L269-I344 HydrophobicContact CD2-CG2 3.63Å; L269-F380 HydrophobicContact CD1-CZ 4.4Å
270H87.4Confident83.4Confident40 Ų4056.8 Ų56.819%0.18529%0.288CS..Hα-helixtrans-61.1-45.7171.7-174.5-81000111.6G266 L272 I273 F274 L340 I344G266-H270 VanDerWaalsContact O-CB 3.24Å; G266-H270 WeakPolarHBondContact O-CB 3.47Å; G266-H270 PolarHBondContact O-N 3.38Å; H270-L272 PolarHBondContact O-N 3.31Å; H270-I273 PolarHBondContact O-N 2.91Å; H270-F274 AromaticContact CD2-CD2 3.94Å; H270-F274 AromaticContact CD2-CE2 3.75Å; H270-F274 AromaticContact CE1-CD2 3.44Å; H270-F274 VanDerWaalsContact CE1-CD2 3.44Å; H270-F274 WeakPolarHBondContact CE1-CD2 3.49Å; H270-F274 AromaticContact CE1-CE2 3.69Å; H270-F274 AromaticContact CG-CD2 3.98Å; H270-F274 AromaticContact ND1-CD2 3.68Å; H270-F274 AromaticContact NE2-CD2 3.61Å; H270-F274 AromaticContact NE2-CE2 3.37Å; H270-F274 WeakPolarHBondContact NE2-CE2 3.32Å; H270-F274 WeakPolarHBondContact O-CD2 3.22Å; H270-F274 PolarHBondContact O-N 3.45Å; H270-F274 VanDerWaalsContact O-N 3.15Å; H270-L340 HydrophobicContact CB-CD2 4.03Å; H270-I344 HydrophobicContact CB-CD1 4.19Å; H270-I344 HydrophobicContact CB-CG1 4.25Å
271S87.9Confident82.6Confident26 Ų2664.7 Ų64.718%0.18232%0.323CS..Hα-helixtrans-57.1-47.6177.1-67.10000111.7L267 Y268 I273 F274 M275 F278L267-S271 WeakPolarHBondContact O-CB 3.47Å; L267-S271 PolarHBondContact O-N 3.01Å; L267-S271 PolarHBondContact O-OG 3.23Å; Y268-S271 WeakPolarHBondContact O-CB 3.48Å; Y268-S271 PolarHBondContact O-N 3.21Å; S271-I273 PolarHBondContact O-N 3.13Å; S271-F274 PolarHBondContact O-N 3.43Å; S271-M275 WeakPolarHBondContact O-CB 3.15Å; S271-M275 PolarHBondContact O-N 3.45Å; S271-F278 WeakPolarHBondContact O-CE2 3.24Å
272L84.7Confident82Confident106 Ų10672.3 Ų72.356%0.55536%0.356SS*.Hα-helixtrans-61.2-30.1179.8-174.6150.9000113.2Y268 L269 H270Y268-L272 HydrophobicContact CE1-CD1 4.38Å; Y268-L272 WeakPolarHBondContact O-CB 3.33Å; Y268-L272 PolarHBondContact O-N 3.25Å; L269-L272 PolarHBondContact O-N 2.84Å; H270-L272 PolarHBondContact O-N 3.31Å
273I84.4Confident81.5Confident67 Ų6777.5 Ų77.534%0.34438%0.376SS..Hα-helixtrans-78.7-41.2178.1-70.8173.1000112.1L269 H270 S271 I344 V347L269-I273 HydrophobicContact CD2-CD1 3.68Å; L269-I273 WeakPolarHBondContact O-CG1 3.21Å; L269-I273 PolarHBondContact O-N 3.28Å; H270-I273 PolarHBondContact O-N 2.91Å; S271-I273 PolarHBondContact O-N 3.13Å; I273-I344 HydrophobicContact CD1-CG1 4.42Å; I273-I344 HydrophobicContact CD1-CG2 4.25Å; I273-V347 HydrophobicContact CG2-CB 4.19Å; I273-V347 HydrophobicContact CG2-CG1 3.65Å
274F81.8Confident81.2Confident102 Ų10279.2 Ų79.245%0.44739%0.385SS..Hα-helixtrans-97.6-18.2-169.1-79.1-79.2000115.3H270 S271 V347H270-F274 AromaticContact CD2-CD2 3.94Å; H270-F274 AromaticContact CD2-CE2 3.75Å; H270-F274 AromaticContact CE1-CD2 3.44Å; H270-F274 VanDerWaalsContact CE1-CD2 3.44Å; H270-F274 WeakPolarHBondContact CE1-CD2 3.49Å; H270-F274 AromaticContact CE1-CE2 3.69Å; H270-F274 AromaticContact CG-CD2 3.98Å; H270-F274 AromaticContact ND1-CD2 3.68Å; H270-F274 AromaticContact NE2-CD2 3.61Å; H270-F274 AromaticContact NE2-CE2 3.37Å; H270-F274 WeakPolarHBondContact NE2-CE2 3.32Å; H270-F274 WeakPolarHBondContact O-CD2 3.22Å; H270-F274 PolarHBondContact O-N 3.45Å; H270-F274 VanDerWaalsContact O-N 3.15Å; S271-F274 PolarHBondContact O-N 3.43Å; F274-V347 HydrophobicContact CE1-CG2 4.04Å; F274-V347 HydrophobicContact CE2-CG2 4.08Å; F274-V347 HydrophobicContact CZ-CG2 3.45Å; F274-V347 VanDerWaalsContact CZ-CG2 3.45Å
275M78.6Confident81.1Confident122 Ų12287.8 Ų87.860%0.60142%0.418SS*.  trans-131.3131.2-170.4-65.6-73.7178.400110.9S271 F278S271-M275 WeakPolarHBondContact O-CB 3.15Å; S271-M275 PolarHBondContact O-N 3.45Å; M275-F278 HydrophobicContact CB-CE1 4.11Å; M275-F278 HydrophobicContact CB-CE2 3.56Å; M275-F278 HydrophobicContact CB-CZ 3.27Å; M275-F278 HydrophobicContact CG-CZ 4.02Å; M275-F278 WeakPolarHBondContact O-CE2 3.46Å
276T65.4Low81.1Confident122 Ų12288.9 Ų88.975%0.74843%0.429SS*.  trans-105.9-7.3-164.948.90000115.4
277F57.3Low81.2Confident191 Ų19189.9 Ų89.984%0.83843%0.434SS*.  trans-133.198-174.8-60.4-71.7000111.3
278F63.6Low81.3Confident75 Ų7589.4 Ų89.433%0.32943%0.433SS..  trans-119150.9-177-76-57.9000114S271 M275 Y283S271-F278 WeakPolarHBondContact O-CE2 3.24Å; M275-F278 HydrophobicContact CB-CE1 4.11Å; M275-F278 HydrophobicContact CB-CE2 3.56Å; M275-F278 HydrophobicContact CB-CZ 3.27Å; M275-F278 HydrophobicContact CG-CZ 4.02Å; M275-F278 WeakPolarHBondContact O-CE2 3.46Å; F278-Y283 HydrophobicContact CD1-CD1 4.04Å; F278-Y283 AromaticContact CD1-CD2 3.87Å; F278-Y283 HydrophobicContact CD1-CD2 3.87Å; F278-Y283 AromaticContact CD1-CE1 3.76Å; F278-Y283 HydrophobicContact CD1-CE1 3.76Å; F278-Y283 AromaticContact CD1-CE2 3.59Å; F278-Y283 HydrophobicContact CD1-CE2 3.59Å; F278-Y283 HydrophobicContact CD1-CG 4.09Å; F278-Y283 AromaticContact CD1-CZ 3.52Å; F278-Y283 HydrophobicContact CE1-CD1 4.02Å; F278-Y283 AromaticContact CE1-CE1 3.49Å; F278-Y283 HydrophobicContact CE1-CE1 3.49Å; F278-Y283 VanDerWaalsContact CE1-CE1 3.49Å; F278-Y283 HydrophobicContact CE1-CE2 4.13Å; F278-Y283 AromaticContact CE1-CZ 3.55Å
279S69.7Low81.5Confident63 Ų6391.9 Ų91.944%0.44145%0.449SS..  trans-105.287.2171.2-170.70000109K281 K282 Y283S279-K281 VanDerWaalsContact C-N 3.25Å; S279-K281 PolarHBondContact O-N 3.47Å; S279-K282 PolarHBondContact O-N 3.05Å; S279-Y283 PolarHBondContact O-N 2.83Å
280D72.4Confident81.9Confident98 Ų9892.4 Ų92.452%0.52445%0.451SS..Hα-helixtrans-39.9-49.2-169.8-69-41.6000114.3T184 K282 Y283 L284T184-D280 HydrophobicContact CG2-CB 4Å; D280-K282 PolarHBondContact O-N 3.39Å; D280-Y283 PolarHBondContact O-N 3.11Å; D280-L284 VanDerWaalsContact O-CB 3.25Å; D280-L284 WeakPolarHBondContact O-CB 3.37Å; D280-L284 PolarHBondContact O-N 3.23Å
281K78.2Confident82.2Confident187 Ų18790.5 Ų90.581%0.81344%0.442SS*.Hα-helixtrans-65.4-37.8-176.4-67.4-172.6177.2-176.50113.5S279 W285S279-K281 VanDerWaalsContact C-N 3.25Å; S279-K281 PolarHBondContact O-N 3.47Å; K281-W285 PolarHBondContact O-N 3.02Å
282K82.9Confident82.6Confident163 Ų16391.5 Ų91.571%0.70944%0.442SS*.Hα-helixtrans-73.2-42.8179.8-69.5-171176.5-173.90111S279 D280 G286S279-K282 PolarHBondContact O-N 3.05Å; D280-K282 PolarHBondContact O-N 3.39Å; K282-G286 PolarHBondContact O-N 2.8Å; K282-G286 VanDerWaalsContact O-N 3.1Å
283Y82.8Confident83.2Confident113 Ų11387.6 Ų87.644%0.44343%0.427SS..Hα-helixtrans-68-43.6178.7-82.8-95.2000112F278 S279 D280 W285 G286 F287F278-Y283 HydrophobicContact CD1-CD1 4.04Å; F278-Y283 AromaticContact CD1-CD2 3.87Å; F278-Y283 HydrophobicContact CD1-CD2 3.87Å; F278-Y283 AromaticContact CD1-CE1 3.76Å; F278-Y283 HydrophobicContact CD1-CE1 3.76Å; F278-Y283 AromaticContact CD1-CE2 3.59Å; F278-Y283 HydrophobicContact CD1-CE2 3.59Å; F278-Y283 HydrophobicContact CD1-CG 4.09Å; F278-Y283 AromaticContact CD1-CZ 3.52Å; F278-Y283 HydrophobicContact CE1-CD1 4.02Å; F278-Y283 AromaticContact CE1-CE1 3.49Å; F278-Y283 HydrophobicContact CE1-CE1 3.49Å; F278-Y283 VanDerWaalsContact CE1-CE1 3.49Å; F278-Y283 HydrophobicContact CE1-CE2 4.13Å; F278-Y283 AromaticContact CE1-CZ 3.55Å; S279-Y283 PolarHBondContact O-N 2.83Å; D280-Y283 PolarHBondContact O-N 3.11Å; Y283-W285 VanDerWaalsContact C-N 3.35Å; Y283-W285 PolarHBondContact O-N 3.16Å; Y283-G286 PolarHBondContact O-N 3.03Å; Y283-F287 HydrophobicContact CD1-CE2 4.26Å; Y283-F287 HydrophobicContact CD1-CZ 4.42Å; Y283-F287 WeakPolarHBondContact O-CD2 3.42Å; Y283-F287 WeakPolarHBondContact O-CG 3.4Å; Y283-F287 PolarHBondContact O-N 3.1Å
284L86.1Confident83.6Confident49 Ų4987.1 Ų87.126%0.25743%0.427SS..Hα-helixtrans-59.4-44.3176.8-171.3150.6000111.6T184 D280 G286 F287 T288T184-L284 HydrophobicContact CG2-CD1 4.48Å; D280-L284 VanDerWaalsContact O-CB 3.25Å; D280-L284 WeakPolarHBondContact O-CB 3.37Å; D280-L284 PolarHBondContact O-N 3.23Å; L284-G286 PolarHBondContact O-N 3.23Å; L284-F287 PolarHBondContact O-N 2.82Å; L284-T288 PolarHBondContact O-N 3.2Å; L284-T288 PolarHBondContact O-OG1 3.31Å
285W90.1Very high84.3Confident180 Ų18082.2 Ų82.268%0.68241%0.406SS*.Hα-helixtrans-63.7-41176.4-169.481.4000112.7K281 Y283 T288 L289K281-W285 PolarHBondContact O-N 3.02Å; Y283-W285 VanDerWaalsContact C-N 3.35Å; Y283-W285 PolarHBondContact O-N 3.16Å; W285-T288 PolarHBondContact O-N 3.2Å; W285-L289 HydrophobicContact CH2-CD2 4.29Å; W285-L289 HydrophobicContact CZ3-CD2 4.11Å; W285-L289 PolarHBondContact O-N 3.07Å
286G91.6Very high85.1Confident25 Ų2578.3 Ų78.326%0.25839%0.393SS..Hα-helixtrans-61.9-43.2173.700000113K282 Y283 L284 L289 I290K282-G286 PolarHBondContact O-N 2.8Å; K282-G286 VanDerWaalsContact O-N 3.1Å; Y283-G286 PolarHBondContact O-N 3.03Å; L284-G286 PolarHBondContact O-N 3.23Å; G286-L289 PolarHBondContact O-N 3.42Å; G286-I290 WeakPolarHBondContact O-CG1 3.47Å; G286-I290 PolarHBondContact O-N 2.94Å
287F92.8Very high86.5Confident21 Ų2176.7 Ų76.79%0.09238%0.383CS..Hα-helixtrans-64-39.8174.3-72.3-48.4000112.3I188 V264 L267 Y268 Y283 L284 L289 I290 G291I188-F287 HydrophobicContact CD1-CD2 4.5Å; V264-F287 HydrophobicContact CG1-CB 3.74Å; V264-F287 HydrophobicContact CG1-CD1 4Å; V264-F287 HydrophobicContact CG1-CG 4.06Å; L267-F287 HydrophobicContact CB-CE1 4.05Å; Y268-F287 AromaticContact CD2-CE2 3.99Å; Y268-F287 HydrophobicContact CD2-CE2 3.99Å; Y283-F287 HydrophobicContact CD1-CE2 4.26Å; Y283-F287 HydrophobicContact CD1-CZ 4.42Å; Y283-F287 WeakPolarHBondContact O-CD2 3.42Å; Y283-F287 WeakPolarHBondContact O-CG 3.4Å; Y283-F287 PolarHBondContact O-N 3.1Å; L284-F287 PolarHBondContact O-N 2.82Å; F287-L289 VanDerWaalsContact C-N 3.33Å; F287-L289 PolarHBondContact O-N 3.14Å; F287-I290 PolarHBondContact O-N 3.36Å; F287-G291 PolarHBondContact O-N 3.08Å
288T92.7Very high88.1Confident38 Ų3868.8 Ų68.823%0.23335%0.349CS..Hα-helixtrans-62.5-39.5173-54.90000111.9L284 W285 G291 W292L284-T288 PolarHBondContact O-N 3.2Å; L284-T288 PolarHBondContact O-OG1 3.31Å; W285-T288 PolarHBondContact O-N 3.2Å; T288-G291 PolarHBondContact O-N 2.77Å; T288-W292 PolarHBondContact O-N 3.29Å; T288-W292 VanDerWaalsContact O-N 3.1Å
289L94.3Very high89.5Confident93 Ų9365.5 Ų65.549%0.48734%0.335SS..Iπ-helixtrans-66.4-40.3176.7-175.665.2000112.2W285 G286 F287 G293 V294W285-L289 HydrophobicContact CH2-CD2 4.29Å; W285-L289 HydrophobicContact CZ3-CD2 4.11Å; W285-L289 PolarHBondContact O-N 3.07Å; G286-L289 PolarHBondContact O-N 3.42Å; F287-L289 VanDerWaalsContact C-N 3.33Å; F287-L289 PolarHBondContact O-N 3.14Å; L289-G293 WeakPolarHBondContact O-CA 3.3Å; L289-G293 PolarHBondContact O-N 3.04Å; L289-V294 PolarHBondContact O-N 3.26Å
290I94.1Very high90.5Very high59 Ų5965.1 Ų65.130%0.30334%0.335SS..Iπ-helixtrans-65.4-45.1173.7-66.2163.9000110.6Y260 V264 G286 F287 P295Y260-I290 HydrophobicContact CD1-CG2 4.29Å; V264-I290 HydrophobicContact CG2-CB 4.01Å; V264-I290 HydrophobicContact CG2-CG2 3.69Å; G286-I290 WeakPolarHBondContact O-CG1 3.47Å; G286-I290 PolarHBondContact O-N 2.94Å; F287-I290 PolarHBondContact O-N 3.36Å; I290-P295 WeakPolarHBondContact O-CD 3.25Å
291G95Very high91.4Very high0 Ų064.9 Ų64.90%033%0.333CS..Iπ-helixtrans-70.2-34.9-173.300000115.4W261 F287 T288W261-G291 VanDerWaalsContact NE1-C 3.33Å; W261-G291 PolarHBondContact NE1-O 3.26Å; F287-G291 PolarHBondContact O-N 3.08Å; T288-G291 PolarHBondContact O-N 2.77Å
292W96.9Very high91.9Very high47 Ų4756.2 Ų56.218%0.17830%0.296CS..Iπ-helixtrans-111.1-37.7178.7-5896.6000113.5H191 V194 L198 T257 W261 T288 A296H191-W292 AromaticContact ND1-NE1 3.68Å; V194-W292 HydrophobicContact CG1-CH2 4.09Å; V194-W292 HydrophobicContact CG1-CZ2 4.4Å; L198-W292 HydrophobicContact CD1-CH2 3.79Å; L198-W292 HydrophobicContact CD1-CZ3 3.91Å; T257-W292 HydrophobicContact CG2-CD2 4.1Å; T257-W292 HydrophobicContact CG2-CE3 3.45Å; T257-W292 VanDerWaalsContact CG2-CE3 3.45Å; T257-W292 HydrophobicContact CG2-CH2 4.1Å; T257-W292 HydrophobicContact CG2-CZ3 3.47Å; T257-W292 VanDerWaalsContact CG2-CZ3 3.47Å; W261-W292 AromaticContact CE2-CD1 3.84Å; W261-W292 AromaticContact CE2-CE2 3.91Å; W261-W292 AromaticContact CE2-NE1 3.41Å; W261-W292 AromaticContact CZ2-CD1 3.54Å; W261-W292 AromaticContact CZ2-NE1 3.22Å; W261-W292 AromaticContact NE1-CD1 3.54Å; W261-W292 AromaticContact NE1-CD2 3.69Å; W261-W292 AromaticContact NE1-CE2 3.26Å; W261-W292 VanDerWaalsContact NE1-CE2 3.26Å; W261-W292 AromaticContact NE1-CG 3.82Å; W261-W292 AromaticContact NE1-CZ2 3.71Å; W261-W292 AromaticContact NE1-NE1 3.19Å; W261-W292 VanDerWaalsContact NE1-NE1 3.19Å; T288-W292 PolarHBondContact O-N 3.29Å; T288-W292 VanDerWaalsContact O-N 3.1Å; W292-A296 PolarHBondContact O-N 3.43Å
293G95.8Very high92.2Very high24 Ų2449.2 Ų49.225%0.24727%0.268CS..Iπ-helixtrans-74.8-45.2-171.200000113.9L289 A296 V297L289-G293 WeakPolarHBondContact O-CA 3.3Å; L289-G293 PolarHBondContact O-N 3.04Å; G293-A296 WeakPolarHBondContact O-CB 3.16Å; G293-A296 PolarHBondContact O-N 3.21Å; G293-V297 WeakPolarHBondContact O-CG2 3.34Å; G293-V297 PolarHBondContact O-N 3.45Å; G293-V297 VanDerWaalsContact O-N 3.1Å
294V93.9Very high92.4Very high57 Ų5748 Ų4835%0.34527%0.273SS..Hα-helixtrans-63.9-45.7-179.7179.90000112Y260 L289 A296 V297 I298Y260-V294 HydrophobicContact CD1-CB 4.22Å; Y260-V294 HydrophobicContact CD1-CG1 4.25Å; Y260-V294 HydrophobicContact CE1-CB 3.94Å; Y260-V294 HydrophobicContact CE1-CG1 3.48Å; Y260-V294 VanDerWaalsContact CE1-CG1 3.48Å; L289-V294 PolarHBondContact O-N 3.26Å; V294-A296 VanDerWaalsContact C-N 3.32Å; V294-A296 PolarHBondContact O-N 3.24Å; V294-V297 PolarHBondContact O-N 3.03Å; V294-I298 HydrophobicContact CG1-CD1 3.77Å; V294-I298 WeakPolarHBondContact O-CD1 3.43Å; V294-I298 WeakPolarHBondContact O-CG1 3.4Å; V294-I298 PolarHBondContact O-N 3.47Å; V294-I298 VanDerWaalsContact O-N 3.1Å
295P95.7Very high92.4Very high0 Ų047.5 Ų47.50%027%0.272CS..Hα-helixtrans-55.2-41.2170-27.834.9000114.2Y253 A256 Y260 I290 V297 I298 V299Y253-P295 HydrophobicContact CD2-CB 4.19Å; Y253-P295 HydrophobicContact CE2-CB 4.11Å; A256-P295 HydrophobicContact CB-CB 4.09Å; Y260-P295 HydrophobicContact CD1-CG 4.26Å; Y260-P295 HydrophobicContact CD2-CG 3.82Å; Y260-P295 HydrophobicContact CG-CG 3.65Å; I290-P295 WeakPolarHBondContact O-CD 3.25Å; P295-V297 PolarHBondContact O-N 2.88Å; P295-I298 PolarHBondContact O-N 3.27Å; P295-V299 WeakPolarHBondContact O-CG2 3.35Å; P295-V299 PolarHBondContact O-N 2.86Å
296A95.3Very high92.1Very high40 Ų4039.6 Ų39.633%0.33124%0.242SC..Hα-helixtrans-63.3-41.6179.500000111.9Y253 W292 G293 V294 A300Y253-A296 HydrophobicContact CD2-CB 4.39Å; Y253-A296 HydrophobicContact CE2-CB 3.76Å; W292-A296 PolarHBondContact O-N 3.43Å; G293-A296 WeakPolarHBondContact O-CB 3.16Å; G293-A296 PolarHBondContact O-N 3.21Å; V294-A296 VanDerWaalsContact C-N 3.32Å; V294-A296 PolarHBondContact O-N 3.24Å; A296-A300 WeakPolarHBondContact O-CB 3.42Å; A296-A300 PolarHBondContact O-N 3.28Å
297V94.5Very high91.7Very high88 Ų8840.7 Ų40.753%0.53325%0.248SC..Hα-helixtrans-64.9-46.1176.4174.60000111.3G293 V294 P295 A300 I301G293-V297 WeakPolarHBondContact O-CG2 3.34Å; G293-V297 PolarHBondContact O-N 3.45Å; G293-V297 VanDerWaalsContact O-N 3.1Å; V294-V297 PolarHBondContact O-N 3.03Å; P295-V297 PolarHBondContact O-N 2.88Å; V297-A300 PolarHBondContact O-N 3.39Å; V297-I301 HydrophobicContact CG1-CD1 3.86Å; V297-I301 VanDerWaalsContact O-CG1 3.32Å; V297-I301 WeakPolarHBondContact O-CG1 3.24Å; V297-I301 PolarHBondContact O-N 3.46Å
298I91.3Very high91.2Very high25 Ų2544.6 Ų44.613%0.12827%0.274CS..Hα-helixtrans-61.5-47.7-179.7-66.5158.6000111.1Y260 V294 P295 I301 W302 P329Y260-I298 HydrophobicContact CE2-CD1 4.23Å; Y260-I298 VanDerWaalsContact OH-CD1 3.3Å; Y260-I298 WeakPolarHBondContact OH-CD1 3.29Å; V294-I298 HydrophobicContact CG1-CD1 3.77Å; V294-I298 WeakPolarHBondContact O-CD1 3.43Å; V294-I298 WeakPolarHBondContact O-CG1 3.4Å; V294-I298 PolarHBondContact O-N 3.47Å; V294-I298 VanDerWaalsContact O-N 3.1Å; P295-I298 PolarHBondContact O-N 3.27Å; I298-I301 PolarHBondContact O-N 2.88Å; I298-W302 PolarHBondContact O-N 2.71Å; I298-P329 HydrophobicContact CD1-CB 3.67Å; I298-P329 HydrophobicContact CD1-CG 4.34Å; I298-P329 HydrophobicContact CG1-CB 4.33Å; I298-P329 HydrophobicContact CG1-CG 4.48Å; I298-P329 HydrophobicContact CG2-CB 4.32Å; I298-P329 HydrophobicContact CG2-CG 4.11Å
299V92.9Very high90.4Very high6 Ų648.8 Ų48.84%0.03629%0.294CS..Hα-helixtrans-71.9-32.3-179.1176.10000111.8T249 P295 W302 A303T249-V299 HydrophobicContact CG2-CG1 3.78Å; P295-V299 WeakPolarHBondContact O-CG2 3.35Å; P295-V299 PolarHBondContact O-N 2.86Å; V299-W302 HydrophobicContact CG1-CE3 4.37Å; V299-W302 PolarHBondContact O-N 3.02Å; V299-A303 VanDerWaalsContact O-CB 3.23Å; V299-A303 WeakPolarHBondContact O-CB 3.01Å; V299-A303 PolarHBondContact O-N 3.02Å
300A91.1Very high89.1Confident54 Ų5445.3 Ų45.345%0.44628%0.279SS..Hα-helixtrans-64.5-41.1171.800000112.4A296 V297 T304A296-A300 WeakPolarHBondContact O-CB 3.42Å; A296-A300 PolarHBondContact O-N 3.28Å; V297-A300 PolarHBondContact O-N 3.39Å; A300-T304 WeakPolarHBondContact O-CB 3.03Å; A300-T304 PolarHBondContact O-N 2.97Å; A300-T304 PolarHBondContact O-OG1 3.29Å
301I90.4Very high88.1Confident94 Ų9446.5 Ų46.548%0.48229%0.286SS..Hα-helixtrans-62.8-50.2174-68.9165.2000110.1V297 I298 A303 T304 V305 I325V297-I301 HydrophobicContact CG1-CD1 3.86Å; V297-I301 VanDerWaalsContact O-CG1 3.32Å; V297-I301 WeakPolarHBondContact O-CG1 3.24Å; V297-I301 PolarHBondContact O-N 3.46Å; I298-I301 PolarHBondContact O-N 2.88Å; I301-A303 PolarHBondContact O-N 3.49Å; I301-T304 PolarHBondContact O-N 3.03Å; I301-V305 WeakPolarHBondContact O-CG2 3.43Å; I301-V305 PolarHBondContact O-N 3.44Å; I301-I325 HydrophobicContact CG2-CG2 4.44Å
302W89Confident86.7Confident4 Ų451.6 Ų51.62%0.01532%0.318CS..Hα-helixtrans-57.4-49177.9171.481.5000112.6V248 M252 I298 V299 T304 V305 R306 W315 L322 I325 Y326V248-W302 HydrophobicContact CG1-CH2 4.46Å; M252-W302 HydrophobicContact CG-CH2 4.45Å; I298-W302 PolarHBondContact O-N 2.71Å; V299-W302 HydrophobicContact CG1-CE3 4.37Å; V299-W302 PolarHBondContact O-N 3.02Å; W302-T304 VanDerWaalsContact C-N 3.32Å; W302-T304 PolarHBondContact O-N 2.92Å; W302-V305 PolarHBondContact O-N 3.47Å; W302-R306 HydrophobicContact CD2-CG 4.14Å; W302-R306 HydrophobicContact CH2-CG 4.45Å; W302-R306 HydrophobicContact CZ2-CG 3.85Å; W302-R306 WeakPolarHBondContact O-CG 2.95Å; W302-R306 PolarHBondContact O-N 2.89Å; W302-W315 HydrophobicContact CH2-CB 4.22Å; W302-W315 HydrophobicContact CH2-CE3 4.25Å; W302-W315 HydrophobicContact CZ3-CE3 4.18Å; W302-L322 VanDerWaalsContact CD1-O 3.23Å; W302-L322 PolarHBondContact NE1-O 2.92Å; W302-I325 HydrophobicContact CB-CG2 4.2Å; W302-Y326 AromaticContact CD1-CD1 3.75Å; W302-Y326 HydrophobicContact CG-CD1 4.3Å; W302-Y326 AromaticContact NE1-CD1 3.57Å
303A89.1Confident85.5Confident16 Ų1653 Ų5313%0.13233%0.326CS..Hα-helixtrans-64.1-37.4179.900000112T249 V299 I301 A307 W315T249-A303 HydrophobicContact CG2-CB 4.17Å; V299-A303 VanDerWaalsContact O-CB 3.23Å; V299-A303 WeakPolarHBondContact O-CB 3.01Å; V299-A303 PolarHBondContact O-N 3.02Å; I301-A303 PolarHBondContact O-N 3.49Å; A303-A307 VanDerWaalsContact O-CB 3.29Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 2.93Å; A303-W315 HydrophobicContact CB-CH2 4.4Å; A303-W315 HydrophobicContact CB-CZ3 3.95Å
304T87.7Confident84.6Confident88 Ų8852.9 Ų52.954%0.5432%0.321SS..Hα-helixtrans-63.4-47.6174.2-560000110.8A300 I301 W302 A307 T308A300-T304 WeakPolarHBondContact O-CB 3.03Å; A300-T304 PolarHBondContact O-N 2.97Å; A300-T304 PolarHBondContact O-OG1 3.29Å; I301-T304 PolarHBondContact O-N 3.03Å; W302-T304 VanDerWaalsContact C-N 3.32Å; W302-T304 PolarHBondContact O-N 2.92Å; T304-A307 PolarHBondContact O-N 3.37Å; T304-T308 WeakPolarHBondContact O-CG2 3.28Å; T304-T308 PolarHBondContact O-N 2.03Å; T304-T308 PolarHBondContact O-OG1 3.32Å
305V86.5Confident83.9Confident39 Ų3951.4 Ų51.424%0.23631%0.309CS..Hα-helixtrans-64.1-42179.51740000111.5I301 W302 T308 L309 L322 I325I301-V305 WeakPolarHBondContact O-CG2 3.43Å; I301-V305 PolarHBondContact O-N 3.44Å; W302-V305 PolarHBondContact O-N 3.47Å; V305-T308 WeakPolarHBondContact CA-OG1 3.38Å; V305-T308 PolarHBondContact O-N 2.94Å; V305-T308 PolarHBondContact O-OG1 3Å; V305-L309 HydrophobicContact CG1-CD1 3.7Å; V305-L309 HydrophobicContact CG1-CG 4.34Å; V305-L309 WeakPolarHBondContact O-CB 3.4Å; V305-L309 WeakPolarHBondContact O-CG 3.43Å; V305-L309 PolarHBondContact O-N 3.17Å; V305-L322 HydrophobicContact CG1-CD2 4.03Å; V305-I325 HydrophobicContact CB-CD1 4.38Å; V305-I325 HydrophobicContact CG1-CD1 3.86Å
306R83.3Confident82.9Confident13 Ų1354.4 Ų54.45%0.04933%0.325CS..Hα-helixtrans-58.9-49.7172.6-71.7-66.1-67.3-128.1-1.4111.2W302 T308 L309 A310 W315 L317W302-R306 HydrophobicContact CD2-CG 4.14Å; W302-R306 HydrophobicContact CH2-CG 4.45Å; W302-R306 HydrophobicContact CZ2-CG 3.85Å; W302-R306 WeakPolarHBondContact O-CG 2.95Å; W302-R306 PolarHBondContact O-N 2.89Å; R306-T308 PolarHBondContact O-N 2.95Å; R306-L309 PolarHBondContact O-N 3.37Å; R306-A310 CarbonylContact O-C 3.5Å; R306-A310 PolarHBondContact O-N 3.41Å; R306-W315 HydrophobicContact CB-CD2 4.35Å; R306-W315 HydrophobicContact CB-CZ2 4.42Å; R306-L317 PolarHBondContact NH1-O 3.24Å; R306-L317 VanDerWaalsContact NH1-O 3.15Å; R306-L317 PolarHBondContact NH2-O 3.11Å
307A84.3Confident81.4Confident48 Ų4856.8 Ų56.840%0.39733%0.332SS..Hα-helixtrans-63.3-24.5179.500000114.1A303 T304 W315A303-A307 VanDerWaalsContact O-CB 3.29Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 2.93Å; T304-A307 PolarHBondContact O-N 3.37Å; A307-W315 HydrophobicContact CB-CH2 4.13Å; A307-W315 HydrophobicContact CB-CZ2 3.89Å
308T82.2Confident79.9Confident104 Ų10455.9 Ų55.964%0.63833%0.329SS*.Hα-helixtrans-91.1-27.1176.8530000115T304 V305 R306T304-T308 WeakPolarHBondContact O-CG2 3.28Å; T304-T308 PolarHBondContact O-N 2.03Å; T304-T308 PolarHBondContact O-OG1 3.32Å; V305-T308 WeakPolarHBondContact CA-OG1 3.38Å; V305-T308 PolarHBondContact O-N 2.94Å; V305-T308 PolarHBondContact O-OG1 3Å; R306-T308 PolarHBondContact O-N 2.95Å
309L74.5Confident78.3Confident125 Ų12556 Ų5665%0.65434%0.335SS*.Hα-helixtrans-110.3-29.1-172.7-61.5-177.8000114.1V305 R306 L322V305-L309 HydrophobicContact CG1-CD1 3.7Å; V305-L309 HydrophobicContact CG1-CG 4.34Å; V305-L309 WeakPolarHBondContact O-CB 3.4Å; V305-L309 WeakPolarHBondContact O-CG 3.43Å; V305-L309 PolarHBondContact O-N 3.17Å; R306-L309 PolarHBondContact O-N 3.37Å; L309-L322 HydrophobicContact CD1-CD2 4.28Å
310A68.7Low77.1Confident21 Ų2156 Ų5617%0.17434%0.336CS..  trans-153.467.4-172.400000110.7R306 T312 L322R306-A310 CarbonylContact O-C 3.5Å; R306-A310 PolarHBondContact O-N 3.41Å; A310-T312 PolarHBondContact O-N 2.96Å; A310-L322 HydrophobicContact CB-CD1 4.41Å
311D72.3Confident76.2Confident84 Ų8455.3 Ų55.345%0.44932%0.324SS..  trans-85.816.6179.1-157.948.7000114.1K245 W315K245-D311 PolarHBondContact NZ-O 3.36Å; K245-D311 IonicContact NZ-OD1 2.9Å; K245-D311 PolarHBondContact NZ-OD1 2.7Å; K245-D311 IonicContact NZ-OD2 3.28Å; K245-D311 PolarHBondContact NZ-OD2 3.32Å; D311-W315 WeakPolarHBondContact OD1-CZ2 3.44Å; D311-W315 PolarHBondContact OD1-NE1 3.28Å
312T66.4Low75.4Confident107 Ų10752.3 Ų52.366%0.65631%0.309SS*.SBendtrans-67.7148.1173.243.10000111.9A310A310-T312 PolarHBondContact O-N 2.96Å
313E70.9Confident74.9Confident77 Ų7754.3 Ų54.336%0.3632%0.318SS..SBendtrans45.9-129.8169.8-55.1-147.6103.100116.1F241 K245 L317F241-E313 HydrophobicContact CE1-CB 4.44Å; K245-E313 WeakPolarHBondContact CE-O 3.23Å; E313-L317 WeakPolarHBondContact OE2-CD1 3.2Å
314C77.3Confident74.6Confident21 Ų2155.7 Ų55.714%0.14232%0.32CS..  trans-116.8142.1173.8179.70000110.7C244 D316C244-C314 HydrophobicContact CB-CB 3.76Å; C244-C314 WeakPolarHBondContact CB-SG 3.21Å; C244-C314 WeakPolarHBondContact SG-CB 3.41Å; C244-C314 CovalentContact SG-SG 2.03Å; C244-C314 PolarHBondContact SG-SG 3.47Å; C314-D316 PolarHBondContact O-N 2.8Å
315W78.8Confident74.4Confident26 Ų2653.4 Ų53.410%0.09830%0.304CS..THydrogen-bonded Turntrans-73.814.7-171.7-59.2-18.3000115.9K245 V248 T249 W302 A303 R306 A307 D311 L317K245-W315 HydrophobicContact CB-CD2 4.05Å; K245-W315 HydrophobicContact CB-CE3 4.12Å; K245-W315 HydrophobicContact CB-CZ3 4.43Å; K245-W315 HydrophobicContact CD-CD2 4.26Å; K245-W315 HydrophobicContact CD-CZ2 4Å; K245-W315 HydrophobicContact CG-CD2 3.84Å; K245-W315 HydrophobicContact CG-CE3 4.42Å; K245-W315 HydrophobicContact CG-CG 3.95Å; K245-W315 HydrophobicContact CG-CZ2 4.43Å; V248-W315 HydrophobicContact CG1-CB 4.43Å; T249-W315 VanDerWaalsContact OG1-CZ3 3.32Å; T249-W315 WeakPolarHBondContact OG1-CZ3 3.32Å; W302-W315 HydrophobicContact CH2-CB 4.22Å; W302-W315 HydrophobicContact CH2-CE3 4.25Å; W302-W315 HydrophobicContact CZ3-CE3 4.18Å; A303-W315 HydrophobicContact CB-CH2 4.4Å; A303-W315 HydrophobicContact CB-CZ3 3.95Å; R306-W315 HydrophobicContact CB-CD2 4.35Å; R306-W315 HydrophobicContact CB-CZ2 4.42Å; A307-W315 HydrophobicContact CB-CH2 4.13Å; A307-W315 HydrophobicContact CB-CZ2 3.89Å; D311-W315 WeakPolarHBondContact OD1-CZ2 3.44Å; D311-W315 PolarHBondContact OD1-NE1 3.28Å; W315-L317 VanDerWaalsContact C-N 3.3Å
316D73.8Confident74.3Confident63 Ų6353.8 Ų53.834%0.33730%0.301SS..THydrogen-bonded Turntrans-74.5-24.3170.5-144.957.3000111.7K206 L210 V248 C314 S318K206-D316 IonicContact NZ-OD1 2.73Å; K206-D316 PolarHBondContact NZ-OD1 3.47Å; K206-D316 IonicContact NZ-OD2 4Å; K206-D316 PolarHBondContact NZ-OD2 2.89Å; L210-D316 HydrophobicContact CD2-CB 4.03Å; L210-D316 VanDerWaalsContact CD2-CG 3.46Å; L210-D316 WeakPolarHBondContact CD2-OD2 3.37Å; V248-D316 HydrophobicContact CG2-CB 4.14Å; C314-D316 PolarHBondContact O-N 2.8Å; D316-S318 PolarHBondContact O-N 3.39Å
317L64.3Low74.4Confident90 Ų9054.5 Ų54.547%0.47131%0.305SS..SBendtrans-66.9126.6174.9-73.6167.1000112R306 E313 W315 A319R306-L317 PolarHBondContact NH1-O 3.24Å; R306-L317 VanDerWaalsContact NH1-O 3.15Å; R306-L317 PolarHBondContact NH2-O 3.11Å; E313-L317 WeakPolarHBondContact OE2-CD1 3.2Å; W315-L317 VanDerWaalsContact C-N 3.3Å; L317-A319 VanDerWaalsContact C-N 3.3Å; L317-A319 PolarHBondContact O-N 3.07Å
318S63.5Low74.4Confident68 Ų6852.9 Ų52.948%0.47629%0.291SS..  trans-7964.4-176.2172.70000112.8D316 G320D316-S318 PolarHBondContact O-N 3.39Å; S318-G320 PolarHBondContact O-N 3.45Å
319A58.2Low74.8Confident29 Ų2949 Ų4924%0.2427%0.267CS..  trans-57.296.4175.300000112.8L317 N321 L322L317-A319 VanDerWaalsContact C-N 3.3Å; L317-A319 PolarHBondContact O-N 3.07Å; A319-N321 PolarHBondContact O-N 2.98Å; A319-L322 PolarHBondContact O-N 2.88Å
320G67.9Low75.5Confident6 Ų644 Ų446%0.06224%0.241CC..G310 helixtrans36.7-124.3174.300000116.3S318 L322 K323S318-G320 PolarHBondContact O-N 3.45Å; G320-L322 VanDerWaalsContact C-N 3.27Å; G320-L322 PolarHBondContact O-N 3.29Å; G320-K323 WeakPolarHBondContact O-CG 3.39Å
321N71.1Confident76.3Confident38 Ų3845.5 Ų45.520%0.20325%0.246CC..G310 helixtrans-71.2-14-173.5-74.7-63.5000114.9C34 V36 A319 K323 W324C34-N321 PolarHBondContact O-ND2 2.99Å; C34-N321 PolarHBondContact O-OD1 3.3Å; V36-N321 WeakPolarHBondContact CB-OD1 3.26Å; V36-N321 PolarHBondContact N-OD1 2.95Å; V36-N321 PolarHBondContact O-ND2 2.78Å; V36-N321 PolarHBondContact O-OD1 3.45Å; A319-N321 PolarHBondContact O-N 2.98Å; N321-K323 PolarHBondContact O-N 2.85Å; N321-W324 PolarHBondContact O-N 3.06Å
322L73.4Confident77.1Confident31 Ų3144.8 Ų44.816%0.16224%0.244CC..G310 helixtrans-67.7-12.2-173.4-56.8-177.8000113.1W302 V305 L309 A310 A319 G320 I325W302-L322 VanDerWaalsContact CD1-O 3.23Å; W302-L322 PolarHBondContact NE1-O 2.92Å; V305-L322 HydrophobicContact CG1-CD2 4.03Å; L309-L322 HydrophobicContact CD1-CD2 4.28Å; A310-L322 HydrophobicContact CB-CD1 4.41Å; A319-L322 PolarHBondContact O-N 2.88Å; G320-L322 VanDerWaalsContact C-N 3.27Å; G320-L322 PolarHBondContact O-N 3.29Å; L322-I325 HydrophobicContact CD2-CD1 3.92Å
323K78.6Confident78.2Confident46 Ų4639.9 Ų39.920%0.221%0.214CC..G310 helixtrans-68.3-35.5169.766.9-165.5171.3-169.70113.6G320 N321 I325 Y326 Q327G320-K323 WeakPolarHBondContact O-CG 3.39Å; N321-K323 PolarHBondContact O-N 2.85Å; K323-I325 PolarHBondContact O-N 2.87Å; K323-Y326 HydrophobicContact CB-CE1 4.01Å; K323-Y326 WeakPolarHBondContact O-CD1 3.35Å; K323-Y326 WeakPolarHBondContact O-CE1 3.43Å; K323-Y326 PolarHBondContact O-N 3.41Å; K323-Q327 WeakPolarHBondContact O-CB 3.41Å; K323-Q327 PolarHBondContact O-N 3.37Å
324W83.1Confident79Confident45 Ų4537.2 Ų37.217%0.1720%0.203CC..Hα-helixtrans-64.8-28.1-176.5-66.4118.8000113.2V36 N321 Y326 Q327 V328V36-W324 HydrophobicContact CG2-CZ2 4.29Å; N321-W324 PolarHBondContact O-N 3.06Å; W324-Y326 VanDerWaalsContact C-N 3.28Å; W324-Y326 PolarHBondContact O-N 3.31Å; W324-Q327 HydrophobicContact CE3-CB 4.45Å; W324-Q327 HydrophobicContact CE3-CG 4.5Å; W324-Q327 PolarHBondContact O-N 3.43Å; W324-V328 HydrophobicContact CB-CG2 4.19Å; W324-V328 HydrophobicContact CE3-CG2 3.9Å; W324-V328 WeakPolarHBondContact O-CB 3.45Å; W324-V328 WeakPolarHBondContact O-CG2 3.09Å; W324-V328 PolarHBondContact O-N 2.84Å
325I83.9Confident79.5Confident40 Ų4039 Ų3921%0.20521%0.214CC..Hα-helixtrans-56.1-39.7177.5-58.8174.6000111.8I301 W302 V305 L322 K323 P329I301-I325 HydrophobicContact CG2-CG2 4.44Å; W302-I325 HydrophobicContact CB-CG2 4.2Å; V305-I325 HydrophobicContact CB-CD1 4.38Å; V305-I325 HydrophobicContact CG1-CD1 3.86Å; L322-I325 HydrophobicContact CD2-CD1 3.92Å; K323-I325 PolarHBondContact O-N 2.87Å; I325-P329 WeakPolarHBondContact O-CD 3.45Å
326Y83.9Confident80Confident47 Ų4741.3 Ų41.318%0.18423%0.227CC..Hα-helixtrans-96.2-31.417681.3-97.4000112.9M252 W302 K323 W324 I330M252-Y326 HydrophobicContact CE-CE1 4.25Å; M252-Y326 HydrophobicContact CE-CE2 4.41Å; M252-Y326 HydrophobicContact SD-CD2 4.41Å; M252-Y326 HydrophobicContact SD-CE2 3.93Å; W302-Y326 AromaticContact CD1-CD1 3.75Å; W302-Y326 HydrophobicContact CG-CD1 4.3Å; W302-Y326 AromaticContact NE1-CD1 3.57Å; K323-Y326 HydrophobicContact CB-CE1 4.01Å; K323-Y326 WeakPolarHBondContact O-CD1 3.35Å; K323-Y326 WeakPolarHBondContact O-CE1 3.43Å; K323-Y326 PolarHBondContact O-N 3.41Å; W324-Y326 VanDerWaalsContact C-N 3.28Å; W324-Y326 PolarHBondContact O-N 3.31Å; Y326-I330 HydrophobicContact CD2-CD1 4.06Å; Y326-I330 WeakPolarHBondContact O-CG1 3.19Å
327Q84.5Confident80.7Confident28 Ų2838.5 Ų38.513%0.13121%0.212CC..Hα-helixtrans-74.3-37.5-174.9-172.7170.2-18.200113.1K323 W324 I330 L331 H388 Y392K323-Q327 WeakPolarHBondContact O-CB 3.41Å; K323-Q327 PolarHBondContact O-N 3.37Å; W324-Q327 HydrophobicContact CE3-CB 4.45Å; W324-Q327 HydrophobicContact CE3-CG 4.5Å; W324-Q327 PolarHBondContact O-N 3.43Å; Q327-I330 PolarHBondContact O-N 3.26Å; Q327-L331 WeakPolarHBondContact O-CB 3.31Å; Q327-L331 PolarHBondContact O-N 3.3Å; Q327-H388 PolarHBondContact NE2-NE2 2.93Å; Q327-Y392 PolarHBondContact NE2-OH 3.19Å
328V86.1Confident81.8Confident15 Ų1537.3 Ų37.39%0.09120%0.203CC..Hα-helixtrans-64.1-46.3179.9175.10000112.3L30 L33 W324 I330 L331 V332L30-V328 HydrophobicContact CD2-CB 3.69Å; L30-V328 HydrophobicContact CD2-CG1 3.6Å; L30-V328 HydrophobicContact CD2-CG2 4.43Å; L33-V328 HydrophobicContact CD1-CG1 4.08Å; L33-V328 HydrophobicContact CD1-CG2 4.37Å; W324-V328 HydrophobicContact CB-CG2 4.19Å; W324-V328 HydrophobicContact CE3-CG2 3.9Å; W324-V328 WeakPolarHBondContact O-CB 3.45Å; W324-V328 WeakPolarHBondContact O-CG2 3.09Å; W324-V328 PolarHBondContact O-N 2.84Å; V328-I330 VanDerWaalsContact C-N 3.31Å; V328-I330 PolarHBondContact O-N 3.02Å; V328-L331 PolarHBondContact O-N 2.81Å; V328-V332 HydrophobicContact CG1-CG2 4.34Å; V328-V332 WeakPolarHBondContact O-CG2 3.49Å; V328-V332 PolarHBondContact O-N 2.91Å
329P90.5Very high83Confident22 Ų2238.4 Ų38.414%0.14320%0.203CC..Hα-helixtrans-57.4-38.9173.7-28.236.3000114.2I298 I325 V332 A333I298-P329 HydrophobicContact CD1-CB 3.67Å; I298-P329 HydrophobicContact CD1-CG 4.34Å; I298-P329 HydrophobicContact CG1-CB 4.33Å; I298-P329 HydrophobicContact CG1-CG 4.48Å; I298-P329 HydrophobicContact CG2-CB 4.32Å; I298-P329 HydrophobicContact CG2-CG 4.11Å; I325-P329 WeakPolarHBondContact O-CD 3.45Å; P329-V332 PolarHBondContact O-N 3.4Å; P329-A333 WeakPolarHBondContact O-CB 3.46Å; P329-A333 PolarHBondContact O-N 3.04Å
330I88.8Confident84.5Confident21 Ų2137.9 Ų37.911%0.10820%0.196CC..Hα-helixtrans-66.7-44.7176.4-64.4172.3000110.6A256 Y259 Y326 Q327 V328 V332 A333 V334A256-I330 HydrophobicContact CB-CD1 3.97Å; A256-I330 HydrophobicContact CB-CG1 4.32Å; Y259-I330 HydrophobicContact CD1-CG2 4.4Å; Y259-I330 HydrophobicContact CD2-CG2 3.53Å; Y259-I330 HydrophobicContact CE2-CG2 3.87Å; Y259-I330 HydrophobicContact CG-CG2 3.83Å; Y326-I330 HydrophobicContact CD2-CD1 4.06Å; Y326-I330 WeakPolarHBondContact O-CG1 3.19Å; Q327-I330 PolarHBondContact O-N 3.26Å; V328-I330 VanDerWaalsContact C-N 3.31Å; V328-I330 PolarHBondContact O-N 3.02Å; I330-V332 VanDerWaalsContact C-N 3.35Å; I330-V332 PolarHBondContact O-N 3.15Å; I330-A333 WeakPolarHBondContact O-CB 3.49Å; I330-A333 PolarHBondContact O-N 2.8Å; I330-V334 HydrophobicContact CG2-CG2 4.5Å; I330-V334 WeakPolarHBondContact O-CG2 3.37Å; I330-V334 PolarHBondContact O-N 2.79Å
331L85.8Confident85.3Confident51 Ų5138.1 Ų38.127%0.26720%0.195SC..Hα-helixtrans-59.3-44.7175.8176.861.3000111.6Q327 V328 A333 V334 V335Q327-L331 WeakPolarHBondContact O-CB 3.31Å; Q327-L331 PolarHBondContact O-N 3.3Å; V328-L331 PolarHBondContact O-N 2.81Å; L331-A333 PolarHBondContact O-N 3.43Å; L331-V334 PolarHBondContact O-N 3.48Å; L331-V335 HydrophobicContact CD1-CG2 4.16Å; L331-V335 WeakPolarHBondContact O-CG2 3.42Å; L331-V335 PolarHBondContact O-N 2.84Å
332V88.6Confident86Confident69 Ų6940.4 Ų40.442%0.41821%0.207SC..Hα-helixtrans-60.6-44.4175.9170.50000111.1V328 P329 I330 V334 V335 I336V328-V332 HydrophobicContact CG1-CG2 4.34Å; V328-V332 WeakPolarHBondContact O-CG2 3.49Å; V328-V332 PolarHBondContact O-N 2.91Å; P329-V332 PolarHBondContact O-N 3.4Å; I330-V332 VanDerWaalsContact C-N 3.35Å; I330-V332 PolarHBondContact O-N 3.15Å; V332-V334 VanDerWaalsContact C-N 3.35Å; V332-V334 PolarHBondContact O-N 2.84Å; V332-V335 PolarHBondContact O-N 2.85Å; V332-I336 HydrophobicContact CG1-CD1 3.79Å; V332-I336 HydrophobicContact CG1-CG1 4.47Å; V332-I336 VanDerWaalsContact O-CG1 3.26Å; V332-I336 WeakPolarHBondContact O-CG1 3.45Å; V332-I336 PolarHBondContact O-N 3.46Å
333A89.9Confident86.8Confident4 Ų441.8 Ų41.83%0.03321%0.214CC..Hα-helixtrans-60.2-42.417600000112.5Y260 L263 P329 I330 L331 N337Y260-A333 HydrophobicContact CD2-CB 4.48Å; Y260-A333 HydrophobicContact CE2-CB 4.08Å; L263-A333 HydrophobicContact CD2-CB 3.83Å; P329-A333 WeakPolarHBondContact O-CB 3.46Å; P329-A333 PolarHBondContact O-N 3.04Å; I330-A333 WeakPolarHBondContact O-CB 3.49Å; I330-A333 PolarHBondContact O-N 2.8Å; L331-A333 PolarHBondContact O-N 3.43Å; A333-N337 WeakPolarHBondContact O-CB 3.36Å; A333-N337 PolarHBondContact O-N 3.06Å
334V87.1Confident87.1Confident21 Ų2139.8 Ų39.813%0.12721%0.206CC..Hα-helixtrans-66.6-43.8177.4168.80000111.7Y259 I330 L331 V332 N337 F338 I385Y259-V334 HydrophobicContact CD1-CG2 3.82Å; Y259-V334 HydrophobicContact CE1-CG2 4.24Å; I330-V334 HydrophobicContact CG2-CG2 4.5Å; I330-V334 WeakPolarHBondContact O-CG2 3.37Å; I330-V334 PolarHBondContact O-N 2.79Å; L331-V334 PolarHBondContact O-N 3.48Å; V332-V334 VanDerWaalsContact C-N 3.35Å; V332-V334 PolarHBondContact O-N 2.84Å; V334-N337 PolarHBondContact O-N 2.99Å; V334-F338 PolarHBondContact O-N 3.31Å; V334-I385 HydrophobicContact CG1-CD1 3.94Å; V334-I385 HydrophobicContact CG1-CG1 3.47Å; V334-I385 VanDerWaalsContact CG1-CG1 3.47Å
335V87Confident87.2Confident60 Ų6039.1 Ų39.136%0.36421%0.205SC..Hα-helixtrans-62.9-43.6176.5169.30000111.5L331 V332 N337 F338 I339 I385L331-V335 HydrophobicContact CD1-CG2 4.16Å; L331-V335 WeakPolarHBondContact O-CG2 3.42Å; L331-V335 PolarHBondContact O-N 2.84Å; V332-V335 PolarHBondContact O-N 2.85Å; V335-N337 VanDerWaalsContact C-N 3.31Å; V335-N337 PolarHBondContact O-N 3.47Å; V335-F338 PolarHBondContact O-N 3.34Å; V335-I339 HydrophobicContact CG1-CD1 4.19Å; V335-I339 WeakPolarHBondContact O-CG1 3.2Å; V335-I339 PolarHBondContact O-N 2.71Å; V335-I339 VanDerWaalsContact O-N 3.11Å; V335-I385 HydrophobicContact CG2-CD1 4.47Å
336I89.9Confident87.3Confident73 Ų7346 Ų4637%0.37423%0.229SC..Hα-helixtrans-59.1-45.2173.9-68.1165.9000110.1L263 V332 F338 I339 L340L263-I336 HydrophobicContact CD1-CB 4.26Å; L263-I336 HydrophobicContact CD1-CG2 3.77Å; V332-I336 HydrophobicContact CG1-CD1 3.79Å; V332-I336 HydrophobicContact CG1-CG1 4.47Å; V332-I336 VanDerWaalsContact O-CG1 3.26Å; V332-I336 WeakPolarHBondContact O-CG1 3.45Å; V332-I336 PolarHBondContact O-N 3.46Å; I336-F338 VanDerWaalsContact C-N 3.29Å; I336-F338 PolarHBondContact O-N 3.07Å; I336-I339 PolarHBondContact O-N 3.31Å; I336-I339 VanDerWaalsContact O-N 3.17Å; I336-L340 HydrophobicContact CG2-CD1 4.15Å; I336-L340 HydrophobicContact CG2-CG 4.46Å; I336-L340 WeakPolarHBondContact O-CG 3.42Å; I336-L340 PolarHBondContact O-N 3.42Å
337N89.3Confident87.4Confident4 Ų445.5 Ų45.52%0.02123%0.23CC..Hα-helixtrans-63.1-34.5-179.4-16048.2000113.1L263 A333 V334 V335 L340 F341 F380L263-N337 HydrophobicContact CD1-CB 3.99Å; A333-N337 WeakPolarHBondContact O-CB 3.36Å; A333-N337 PolarHBondContact O-N 3.06Å; V334-N337 PolarHBondContact O-N 2.99Å; V335-N337 VanDerWaalsContact C-N 3.31Å; V335-N337 PolarHBondContact O-N 3.47Å; N337-L340 PolarHBondContact O-N 3.33Å; N337-F341 WeakPolarHBondContact O-CB 3.2Å; N337-F341 PolarHBondContact O-N 3.28Å; N337-F380 WeakPolarHBondContact ND2-CB 3.48Å; N337-F380 PolarHBondContact ND2-O 2.87Å
338F87.3Confident87.3Confident66 Ų6646.9 Ų46.929%0.28924%0.238SC..Hα-helixtrans-68.6-38.8173.8176.9-111.5000113.2V334 V335 I336 L340 F341 L342 V382 I385V334-F338 PolarHBondContact O-N 3.31Å; V335-F338 PolarHBondContact O-N 3.34Å; I336-F338 VanDerWaalsContact C-N 3.29Å; I336-F338 PolarHBondContact O-N 3.07Å; F338-L340 VanDerWaalsContact C-N 3.31Å; F338-L340 PolarHBondContact O-N 3.47Å; F338-F341 HydrophobicContact CD2-CD1 4.01Å; F338-F341 HydrophobicContact CE2-CD1 4.23Å; F338-F341 WeakPolarHBondContact O-CB 3.43Å; F338-F341 PolarHBondContact O-N 2.67Å; F338-L342 HydrophobicContact CD1-CD1 4.21Å; F338-L342 HydrophobicContact CE1-CD1 3.7Å; F338-L342 HydrophobicContact CE1-CG 4.35Å; F338-L342 HydrophobicContact CE2-CD1 4.44Å; F338-L342 HydrophobicContact CE2-CD2 4.26Å; F338-L342 HydrophobicContact CE2-CG 4.27Å; F338-L342 HydrophobicContact CZ-CD1 3.84Å; F338-L342 HydrophobicContact CZ-CD2 4.22Å; F338-L342 HydrophobicContact CZ-CG 4.15Å; F338-L342 WeakPolarHBondContact O-CG 3.19Å; F338-L342 PolarHBondContact O-N 3.38Å; F338-V382 HydrophobicContact CD2-CG1 3.79Å; F338-V382 HydrophobicContact CD2-CG2 4.29Å; F338-V382 HydrophobicContact CE2-CG1 3.82Å; F338-I385 HydrophobicContact CB-CD1 3.28Å; F338-I385 HydrophobicContact CD1-CD1 3.96Å; F338-I385 HydrophobicContact CD2-CD1 4.28Å; F338-I385 HydrophobicContact CG-CD1 3.61Å
339I88.6Confident87Confident91 Ų9147.7 Ų47.747%0.46725%0.246SC..Hα-helixtrans-62.2-42173-65.1165.1000110.3V335 I336 L342 N343V335-I339 HydrophobicContact CG1-CD1 4.19Å; V335-I339 WeakPolarHBondContact O-CG1 3.2Å; V335-I339 PolarHBondContact O-N 2.71Å; V335-I339 VanDerWaalsContact O-N 3.11Å; I336-I339 PolarHBondContact O-N 3.31Å; I336-I339 VanDerWaalsContact O-N 3.17Å; I339-L342 PolarHBondContact O-N 2.99Å; I339-N343 PolarHBondContact O-N 2.84Å; I339-N343 VanDerWaalsContact O-N 3.12Å
340L88.3Confident86.7Confident17 Ų1749.8 Ų49.89%0.08926%0.259CS..Hα-helixtrans-61.5-45.4173.7-63.5170.4000111.5L263 L267 H270 I336 N337 F338 L342 N343 I344L263-L340 HydrophobicContact CD1-CD1 3.95Å; L267-L340 HydrophobicContact CB-CD1 4.49Å; L267-L340 HydrophobicContact CD2-CD1 3.57Å; L267-L340 HydrophobicContact CD2-CD2 4.3Å; L267-L340 HydrophobicContact CG-CD1 3.72Å; H270-L340 HydrophobicContact CB-CD2 4.03Å; I336-L340 HydrophobicContact CG2-CD1 4.15Å; I336-L340 HydrophobicContact CG2-CG 4.46Å; I336-L340 WeakPolarHBondContact O-CG 3.42Å; I336-L340 PolarHBondContact O-N 3.42Å; N337-L340 PolarHBondContact O-N 3.33Å; F338-L340 VanDerWaalsContact C-N 3.31Å; F338-L340 PolarHBondContact O-N 3.47Å; L340-L342 PolarHBondContact O-N 3.07Å; L340-N343 PolarHBondContact O-N 3.07Å; L340-I344 HydrophobicContact CB-CD1 4.47Å; L340-I344 WeakPolarHBondContact O-CB 3.15Å; L340-I344 WeakPolarHBondContact O-CD1 3.32Å; L340-I344 WeakPolarHBondContact O-CG1 3.24Å; L340-I344 PolarHBondContact O-N 3.31Å
341F86.1Confident86.2Confident12 Ų1253.7 Ų53.75%0.05328%0.275CS..Hα-helixtrans-57.3-45.5176.6167.6-110.3000113N337 F338 N343 I344 I345 T373 L376 M377 F380 V382N337-F341 WeakPolarHBondContact O-CB 3.2Å; N337-F341 PolarHBondContact O-N 3.28Å; F338-F341 HydrophobicContact CD2-CD1 4.01Å; F338-F341 HydrophobicContact CE2-CD1 4.23Å; F338-F341 WeakPolarHBondContact O-CB 3.43Å; F338-F341 PolarHBondContact O-N 2.67Å; F341-N343 PolarHBondContact O-N 2.89Å; F341-I344 PolarHBondContact O-N 2.94Å; F341-I345 HydrophobicContact CD1-CD1 4.38Å; F341-I345 HydrophobicContact CD2-CD1 3.87Å; F341-I345 HydrophobicContact CD2-CG1 4.29Å; F341-I345 HydrophobicContact CE1-CD1 3.83Å; F341-I345 HydrophobicContact CE2-CD1 3.31Å; F341-I345 HydrophobicContact CE2-CG1 4.12Å; F341-I345 HydrophobicContact CG-CD1 4.42Å; F341-I345 HydrophobicContact CZ-CD1 3.29Å; F341-I345 HydrophobicContact CZ-CG1 4.49Å; F341-I345 WeakPolarHBondContact O-CB 3.3Å; F341-I345 PolarHBondContact O-N 3.46Å; F341-T373 HydrophobicContact CZ-CG2 4.29Å; F341-L376 HydrophobicContact CD2-CD2 4.21Å; F341-L376 HydrophobicContact CD2-CG 4.26Å; F341-L376 HydrophobicContact CE2-CB 4.2Å; F341-L376 HydrophobicContact CE2-CD2 4.04Å; F341-L376 HydrophobicContact CE2-CG 3.98Å; F341-M377 HydrophobicContact CZ-CB 4.46Å; F341-F380 HydrophobicContact CB-CD2 4.23Å; F341-F380 AromaticContact CD2-CD2 3.51Å; F341-F380 HydrophobicContact CD2-CD2 3.51Å; F341-F380 HydrophobicContact CD2-CE2 4.08Å; F341-F380 HydrophobicContact CE2-CD2 4.23Å; F341-F380 HydrophobicContact CG-CD2 4.28Å; F341-V382 HydrophobicContact CB-CG2 4.38Å; F341-V382 HydrophobicContact CD1-CG1 4.34Å; F341-V382 HydrophobicContact CD1-CG2 3.55Å; F341-V382 HydrophobicContact CD2-CG2 4.16Å; F341-V382 HydrophobicContact CE1-CB 4.34Å; F341-V382 HydrophobicContact CE1-CG1 3.94Å; F341-V382 HydrophobicContact CE1-CG2 3.63Å; F341-V382 HydrophobicContact CE2-CG2 4.18Å; F341-V382 HydrophobicContact CG-CG2 3.8Å; F341-V382 HydrophobicContact CZ-CG2 3.92Å
342L86.3Confident85.6Confident85 Ų8554.4 Ų54.445%0.44528%0.279SS..Hα-helixtrans-62.7-41.5176.2-68.1178.8000111.8F338 I339 L340 I345 R346F338-L342 HydrophobicContact CD1-CD1 4.21Å; F338-L342 HydrophobicContact CE1-CD1 3.7Å; F338-L342 HydrophobicContact CE1-CG 4.35Å; F338-L342 HydrophobicContact CE2-CD1 4.44Å; F338-L342 HydrophobicContact CE2-CD2 4.26Å; F338-L342 HydrophobicContact CE2-CG 4.27Å; F338-L342 HydrophobicContact CZ-CD1 3.84Å; F338-L342 HydrophobicContact CZ-CD2 4.22Å; F338-L342 HydrophobicContact CZ-CG 4.15Å; F338-L342 WeakPolarHBondContact O-CG 3.19Å; F338-L342 PolarHBondContact O-N 3.38Å; I339-L342 PolarHBondContact O-N 2.99Å; L340-L342 PolarHBondContact O-N 3.07Å; L342-I345 PolarHBondContact O-N 2.82Å; L342-R346 WeakPolarHBondContact O-CB 3.38Å; L342-R346 PolarHBondContact O-N 3.17Å
343N88.8Confident85Confident60 Ų6056.5 Ų56.532%0.32129%0.287SS..Hα-helixtrans-65.5-42.8175.7-72.9-19.6000112.4I339 L340 F341 R346 V347I339-N343 PolarHBondContact O-N 2.84Å; I339-N343 VanDerWaalsContact O-N 3.12Å; L340-N343 PolarHBondContact O-N 3.07Å; F341-N343 PolarHBondContact O-N 2.89Å; N343-R346 PolarHBondContact O-N 3.36Å; N343-V347 PolarHBondContact O-N 3.18Å
344I86.3Confident84.5Confident4 Ų461.3 Ų61.32%0.02131%0.309CS..Hα-helixtrans-59.8-49.4175.5-71.8158.5000110.3L269 H270 I273 L340 F341 R346 V347 L348 F380L269-I344 HydrophobicContact CD2-CB 4.45Å; L269-I344 HydrophobicContact CD2-CD1 3.83Å; L269-I344 HydrophobicContact CD2-CG1 3.92Å; L269-I344 HydrophobicContact CD2-CG2 3.63Å; H270-I344 HydrophobicContact CB-CD1 4.19Å; H270-I344 HydrophobicContact CB-CG1 4.25Å; I273-I344 HydrophobicContact CD1-CG1 4.42Å; I273-I344 HydrophobicContact CD1-CG2 4.25Å; L340-I344 HydrophobicContact CB-CD1 4.47Å; L340-I344 WeakPolarHBondContact O-CB 3.15Å; L340-I344 WeakPolarHBondContact O-CD1 3.32Å; L340-I344 WeakPolarHBondContact O-CG1 3.24Å; L340-I344 PolarHBondContact O-N 3.31Å; F341-I344 PolarHBondContact O-N 2.94Å; I344-R346 PolarHBondContact O-N 2.85Å; I344-V347 PolarHBondContact O-N 2.96Å; I344-L348 VanDerWaalsContact O-CB 3.25Å; I344-L348 WeakPolarHBondContact O-CB 3.25Å; I344-L348 PolarHBondContact O-N 3.01Å; I344-F380 HydrophobicContact CD1-CE2 4.28Å; I344-F380 HydrophobicContact CD1-CZ 4.08Å
345I83.8Confident83.7Confident31 Ų3165.3 Ų65.316%0.15933%0.334CS..Hα-helixtrans-62.9-41.7178.1-77.7-178.5000111.3F341 L342 V347 L348 A349 T373 L376F341-I345 HydrophobicContact CD1-CD1 4.38Å; F341-I345 HydrophobicContact CD2-CD1 3.87Å; F341-I345 HydrophobicContact CD2-CG1 4.29Å; F341-I345 HydrophobicContact CE1-CD1 3.83Å; F341-I345 HydrophobicContact CE2-CD1 3.31Å; F341-I345 HydrophobicContact CE2-CG1 4.12Å; F341-I345 HydrophobicContact CG-CD1 4.42Å; F341-I345 HydrophobicContact CZ-CD1 3.29Å; F341-I345 HydrophobicContact CZ-CG1 4.49Å; F341-I345 WeakPolarHBondContact O-CB 3.3Å; F341-I345 PolarHBondContact O-N 3.46Å; L342-I345 PolarHBondContact O-N 2.82Å; I345-V347 PolarHBondContact O-N 2.95Å; I345-L348 PolarHBondContact O-N 3.25Å; I345-A349 VanDerWaalsContact O-CB 3.24Å; I345-A349 WeakPolarHBondContact O-CB 3.19Å; I345-A349 PolarHBondContact O-N 2.66Å; I345-T373 HydrophobicContact CD1-CG2 3.65Å; I345-L376 HydrophobicContact CG1-CD2 4.33Å
346R87.1Confident82.6Confident186 Ų18665 Ų6570%0.70233%0.33SS*.Hα-helixtrans-57-51.6177.1-177.8178.5179.2173.30.8111.2L342 N343 I344 A349 T350L342-R346 WeakPolarHBondContact O-CB 3.38Å; L342-R346 PolarHBondContact O-N 3.17Å; N343-R346 PolarHBondContact O-N 3.36Å; I344-R346 PolarHBondContact O-N 2.85Å; R346-A349 PolarHBondContact O-N 2.93Å; R346-T350 PolarHBondContact O-N 3.25Å; R346-T350 PolarHBondContact O-OG1 3.38Å; R346-T350 VanDerWaalsContact O-OG1 3.09Å
347V85.9Confident81.1Confident36 Ų3666.1 Ų66.122%0.21835%0.35CS..Hα-helixtrans-68-40.6179.7178.60000111.8I273 F274 N343 I344 I345 A349 T350 K351I273-V347 HydrophobicContact CG2-CB 4.19Å; I273-V347 HydrophobicContact CG2-CG1 3.65Å; F274-V347 HydrophobicContact CE1-CG2 4.04Å; F274-V347 HydrophobicContact CE2-CG2 4.08Å; F274-V347 HydrophobicContact CZ-CG2 3.45Å; F274-V347 VanDerWaalsContact CZ-CG2 3.45Å; N343-V347 PolarHBondContact O-N 3.18Å; I344-V347 PolarHBondContact O-N 2.96Å; I345-V347 PolarHBondContact O-N 2.95Å; V347-A349 VanDerWaalsContact C-N 3.35Å; V347-A349 PolarHBondContact O-N 2.91Å; V347-T350 PolarHBondContact O-N 3.15Å; V347-K351 HydrophobicContact CG1-CG 4.13Å; V347-K351 WeakPolarHBondContact O-CB 3.41Å; V347-K351 WeakPolarHBondContact O-CG 3.46Å; V347-K351 PolarHBondContact O-N 3.21Å
348L81.4Confident79.6Confident56 Ų5669.2 Ų69.229%0.29338%0.383SS..Hα-helixtrans-61.4-42.7176.9-179.760.7000111.6I344 I345 K351 L352I344-L348 VanDerWaalsContact O-CB 3.25Å; I344-L348 WeakPolarHBondContact O-CB 3.25Å; I344-L348 PolarHBondContact O-N 3.01Å; I345-L348 PolarHBondContact O-N 3.25Å; L348-K351 PolarHBondContact O-N 3.49Å; L348-L352 HydrophobicContact CD1-CD1 4.06Å; L348-L352 HydrophobicContact CD1-CG 4.19Å; L348-L352 HydrophobicContact CG-CD1 3.98Å; L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 VanDerWaalsContact O-CG 3.25Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.4Å
349A80.4Confident78.1Confident32 Ų3277.4 Ų77.426%0.26441%0.412SS..Hα-helixtrans-63.3-45.9175.400000111.6I345 R346 V347 K351 L352 L353 L369I345-A349 VanDerWaalsContact O-CB 3.24Å; I345-A349 WeakPolarHBondContact O-CB 3.19Å; I345-A349 PolarHBondContact O-N 2.66Å; R346-A349 PolarHBondContact O-N 2.93Å; V347-A349 VanDerWaalsContact C-N 3.35Å; V347-A349 PolarHBondContact O-N 2.91Å; A349-K351 PolarHBondContact O-N 2.99Å; A349-L352 PolarHBondContact O-N 3.19Å; A349-L353 WeakPolarHBondContact O-CB 3.44Å; A349-L353 PolarHBondContact O-N 3.41Å; A349-L369 HydrophobicContact CB-CD1 4.2Å; A349-L369 HydrophobicContact CB-CD2 4.02Å
350T83.4Confident76.5Confident67 Ų6775.3 Ų75.341%0.41141%0.405SS..Hα-helixtrans-60-45.8174.9-580000111.8R346 V347 L353 E354R346-T350 PolarHBondContact O-N 3.25Å; R346-T350 PolarHBondContact O-OG1 3.38Å; R346-T350 VanDerWaalsContact O-OG1 3.09Å; V347-T350 PolarHBondContact O-N 3.15Å; T350-L353 WeakPolarHBondContact O-CB 3.4Å; T350-L353 PolarHBondContact O-N 3.36Å; T350-E354 WeakPolarHBondContact O-CG 2.96Å; T350-E354 PolarHBondContact O-N 3.25Å
351K80Confident75.5Confident103 Ų10379.2 Ų79.245%0.44843%0.426SS..Hα-helixtrans-69.3-34-179.8-69.4-71.5163.4-132.40113.2V347 L348 A349 E354 T355V347-K351 HydrophobicContact CG1-CG 4.13Å; V347-K351 WeakPolarHBondContact O-CB 3.41Å; V347-K351 WeakPolarHBondContact O-CG 3.46Å; V347-K351 PolarHBondContact O-N 3.21Å; L348-K351 PolarHBondContact O-N 3.49Å; A349-K351 PolarHBondContact O-N 2.99Å; K351-E354 WeakPolarHBondContact CD-OE2 3.34Å; K351-E354 IonicContact NZ-OE1 2.79Å; K351-E354 PolarHBondContact NZ-OE1 3.47Å; K351-E354 IonicContact NZ-OE2 2.62Å; K351-E354 PolarHBondContact NZ-OE2 2.98Å; K351-T355 WeakPolarHBondContact O-CB 3.48Å; K351-T355 WeakPolarHBondContact O-CG2 3.33Å; K351-T355 PolarHBondContact O-N 3.15Å; K351-T355 VanDerWaalsContact O-N 3.1Å; K351-T355 PolarHBondContact O-OG1 2.89Å
352L71.7Confident74.6Confident66 Ų6683.2 Ų83.235%0.34645%0.452SS..Hα-helixtrans-67.8-35.6171.6-74.4170.5000112.2L348 A349 T355 N356 L369L348-L352 HydrophobicContact CD1-CD1 4.06Å; L348-L352 HydrophobicContact CD1-CG 4.19Å; L348-L352 HydrophobicContact CG-CD1 3.98Å; L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 VanDerWaalsContact O-CG 3.25Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.4Å; A349-L352 PolarHBondContact O-N 3.19Å; L352-T355 PolarHBondContact O-OG1 3.48Å; L352-N356 WeakPolarHBondContact O-CB 3.33Å; L352-N356 PolarHBondContact O-N 3.49Å; L352-N356 PolarHBondContact O-ND2 3.16Å; L352-L369 HydrophobicContact CD1-CD1 4.12Å
353L76.2Confident73.6Confident113 Ų11388.1 Ų88.159%0.59246%0.464SS*.Hα-helixtrans-67.6-50.5175.4-175.763.6000111.4A349 T350 T355 N356 A357A349-L353 WeakPolarHBondContact O-CB 3.44Å; A349-L353 PolarHBondContact O-N 3.41Å; T350-L353 WeakPolarHBondContact O-CB 3.4Å; T350-L353 PolarHBondContact O-N 3.36Å; L353-T355 PolarHBondContact O-N 2.76Å; L353-N356 PolarHBondContact O-N 3.24Å; L353-A357 PolarHBondContact O-N 2.62Å
354E80.3Confident72.6Confident105 Ų10590 Ų9049%0.49147%0.471SS..Hα-helixtrans-54.6-49176-73.4172.3-159.900112.2T350 K351 N356T350-E354 WeakPolarHBondContact O-CG 2.96Å; T350-E354 PolarHBondContact O-N 3.25Å; K351-E354 WeakPolarHBondContact CD-OE2 3.34Å; K351-E354 IonicContact NZ-OE1 2.79Å; K351-E354 PolarHBondContact NZ-OE1 3.47Å; K351-E354 IonicContact NZ-OE2 2.62Å; K351-E354 PolarHBondContact NZ-OE2 2.98Å; E354-N356 VanDerWaalsContact C-N 3.28Å; E354-N356 PolarHBondContact O-N 3.49Å
355T69.3Low71.6Confident104 Ų10492 Ų9264%0.63848%0.48SS*.Hα-helixtrans-74.4-11-173.549.80000114.9K351 L352 L353K351-T355 WeakPolarHBondContact O-CB 3.48Å; K351-T355 WeakPolarHBondContact O-CG2 3.33Å; K351-T355 PolarHBondContact O-N 3.15Å; K351-T355 VanDerWaalsContact O-N 3.1Å; K351-T355 PolarHBondContact O-OG1 2.89Å; L352-T355 PolarHBondContact O-OG1 3.48Å; L353-T355 PolarHBondContact O-N 2.76Å
356N64.1Low70.7Confident53 Ų5398.8 Ų98.828%0.28351%0.505SS..THydrogen-bonded Turntrans-120.612.2-174.3-69.1-94.9000114.2L352 L353 E354 G358 R359L352-N356 WeakPolarHBondContact O-CB 3.33Å; L352-N356 PolarHBondContact O-N 3.49Å; L352-N356 PolarHBondContact O-ND2 3.16Å; L353-N356 PolarHBondContact O-N 3.24Å; E354-N356 VanDerWaalsContact C-N 3.28Å; E354-N356 PolarHBondContact O-N 3.49Å; N356-G358 PolarHBondContact O-N 3.39Å; N356-R359 PolarHBondContact O-N 3.47Å
357A59Low69.9Low98 Ų9898.4 Ų98.481%0.8150%0.504SS*.THydrogen-bonded Turntrans-62.49.9-17300000117L353L353-A357 PolarHBondContact O-N 2.62Å
358G56.7Low69.3Low69 Ų69102.3 Ų102.371%0.71152%0.518SS*.THydrogen-bonded Turntrans-1425.5-179.900000117.4N356N356-G358 PolarHBondContact O-N 3.39Å
359R56.9Low68.6Low237 Ų237101.4 Ų101.489%0.89451%0.513SS*.THydrogen-bonded Turntrans-157.222.8-172-147.589.2-179.21281.7118.4N356N356-R359 PolarHBondContact O-N 3.47Å
360C54.5Low68Low47 Ų47105.1 Ų105.132%0.31853%0.528SS..  trans-148142.7177.1-97.30000114.7Q365C360-Q365 HydrophobicContact CB-CG 4.07Å; C360-Q365 PolarHBondContact O-NE2 2.91Å
361D67.6Low67.6Low100 Ų100109.4 Ų109.454%0.53554%0.541SS..  trans-53.2132164.7-108.3-34.4000111.6R363 Q364 Q365D361-R363 PolarHBondContact O-N 3.39Å; D361-Q364 HydrophobicContact CB-CB 3.98Å; D361-Q364 HydrophobicContact CB-CG 3.74Å; D361-Q364 PolarHBondContact O-N 3.16Å; D361-Q365 WeakPolarHBondContact O-CG 3.41Å; D361-Q365 PolarHBondContact O-N 3.26Å
362T66.9Low67.1Low96 Ų96106.8 Ų106.859%0.58954%0.535SS*.Hα-helixtrans-57.3-36.4172.253.90000111.6Q364 Q365 Y366T362-Q364 VanDerWaalsContact C-N 3.31Å; T362-Q364 PolarHBondContact O-N 2.96Å; T362-Q365 WeakPolarHBondContact O-CB 3.44Å; T362-Q365 PolarHBondContact O-N 2.81Å; T362-Y366 PolarHBondContact O-N 2.97Å
363R65.9Low67Low187 Ų187105.3 Ų105.371%0.70653%0.529SS*.Hα-helixtrans-64-31.7175-162.2177.4-169.7-172.74.7113.1D361 R367D361-R363 PolarHBondContact O-N 3.39Å; R363-R367 WeakPolarHBondContact O-CG 3.33Å; R363-R367 PolarHBondContact O-N 3.47Å
364Q67.9Low66.6Low101 Ų101105.5 Ų105.547%0.47253%0.53SS..Hα-helixtrans-79.8-35.8174.1-65.5-170.83200111.9D361 T362 R367 K368D361-Q364 HydrophobicContact CB-CB 3.98Å; D361-Q364 HydrophobicContact CB-CG 3.74Å; D361-Q364 PolarHBondContact O-N 3.16Å; T362-Q364 VanDerWaalsContact C-N 3.31Å; T362-Q364 PolarHBondContact O-N 2.96Å; Q364-R367 PolarHBondContact O-N 3.43Å; Q364-K368 WeakPolarHBondContact O-CG 3.15Å; Q364-K368 PolarHBondContact O-N 3.42Å
365Q64.5Low66Low44 Ų44103.3 Ų103.321%0.20652%0.524CS..Hα-helixtrans-60.5-49.8172.5-66.1169-8.100110.9C360 D361 T362 R367 K368 L369C360-Q365 HydrophobicContact CB-CG 4.07Å; C360-Q365 PolarHBondContact O-NE2 2.91Å; D361-Q365 WeakPolarHBondContact O-CG 3.41Å; D361-Q365 PolarHBondContact O-N 3.26Å; T362-Q365 WeakPolarHBondContact O-CB 3.44Å; T362-Q365 PolarHBondContact O-N 2.81Å; Q365-R367 VanDerWaalsContact C-N 3.32Å; Q365-R367 PolarHBondContact O-N 3.11Å; Q365-K368 PolarHBondContact O-N 3.08Å; Q365-K368 VanDerWaalsContact O-N 3.1Å; Q365-L369 PolarHBondContact O-N 3.07Å
366Y64.2Low66Low175 Ų17599.4 Ų99.469%0.68650%0.499SS*.Hα-helixtrans-58.3-40.1174.8-97.3-82.9000112.7T362 L369 L370T362-Y366 PolarHBondContact O-N 2.97Å; Y366-L369 PolarHBondContact O-N 3Å; Y366-L370 WeakPolarHBondContact O-CB 3.34Å; Y366-L370 PolarHBondContact O-N 2.94Å
367R71.4Confident66.4Low178 Ų17899.4 Ų99.467%0.67250%0.498SS*.Hα-helixtrans-65-37.9174.2-79.9179.1169.1-172.5-3.8113.1R363 Q364 Q365 K371R363-R367 WeakPolarHBondContact O-CG 3.33Å; R363-R367 PolarHBondContact O-N 3.47Å; Q364-R367 PolarHBondContact O-N 3.43Å; Q365-R367 VanDerWaalsContact C-N 3.32Å; Q365-R367 PolarHBondContact O-N 3.11Å; R367-K371 VanDerWaalsContact O-CB 3.3Å; R367-K371 WeakPolarHBondContact O-CB 3.37Å; R367-K371 PolarHBondContact O-N 3.11Å
368K72.9Confident66.6Low117 Ų11795.6 Ų95.651%0.50947%0.465SS..Hα-helixtrans-66.8-46.4174.6-72.7171.4-179173.40111.3Q364 Q365 K371 S372Q364-K368 WeakPolarHBondContact O-CG 3.15Å; Q364-K368 PolarHBondContact O-N 3.42Å; Q365-K368 PolarHBondContact O-N 3.08Å; Q365-K368 VanDerWaalsContact O-N 3.1Å; K368-K371 PolarHBondContact O-N 3.35Å; K368-S372 PolarHBondContact O-N 3.15Å
369L66.1Low67.2Low37 Ų3792.4 Ų92.419%0.19443%0.432CS..Hα-helixtrans-62.6-50.1177.3-176.764.4000111.1A349 L352 Q365 Y366 K371 S372 T373A349-L369 HydrophobicContact CB-CD1 4.2Å; A349-L369 HydrophobicContact CB-CD2 4.02Å; L352-L369 HydrophobicContact CD1-CD1 4.12Å; Q365-L369 PolarHBondContact O-N 3.07Å; Y366-L369 PolarHBondContact O-N 3Å; L369-K371 VanDerWaalsContact C-N 3.33Å; L369-K371 PolarHBondContact O-N 3.04Å; L369-S372 CarbonylContact O-C 3.6Å; L369-S372 WeakPolarHBondContact O-CA 3.43Å; L369-S372 WeakPolarHBondContact O-CB 3.47Å; L369-S372 PolarHBondContact O-N 2.94Å; L369-T373 PolarHBondContact O-N 2.96Å; L369-T373 PolarHBondContact O-OG1 3.39Å
370L67.7Low67.8Low110 Ų11081.5 Ų81.558%0.57639%0.391SS*.Hα-helixtrans-59-41.9177.6-178.763.2000112Y366 S372 T373 L374Y366-L370 WeakPolarHBondContact O-CB 3.34Å; Y366-L370 PolarHBondContact O-N 2.94Å; L370-S372 VanDerWaalsContact C-N 3.32Å; L370-S372 PolarHBondContact O-N 3.14Å; L370-T373 PolarHBondContact O-N 2.9Å; L370-L374 VanDerWaalsContact O-CB 3.25Å; L370-L374 WeakPolarHBondContact O-CB 3.3Å; L370-L374 PolarHBondContact O-N 2.93Å
371K75.8Confident68.6Low157 Ų15779.4 Ų79.468%0.68338%0.377SS*.Hα-helixtrans-61.8-39.6174-175.5175.2-179.9178.30111.8R367 K368 L369 V375R367-K371 VanDerWaalsContact O-CB 3.3Å; R367-K371 WeakPolarHBondContact O-CB 3.37Å; R367-K371 PolarHBondContact O-N 3.11Å; K368-K371 PolarHBondContact O-N 3.35Å; L369-K371 VanDerWaalsContact C-N 3.33Å; L369-K371 PolarHBondContact O-N 3.04Å; K371-V375 WeakPolarHBondContact O-CB 3.36Å; K371-V375 VanDerWaalsContact O-CG2 3.24Å; K371-V375 WeakPolarHBondContact O-CG2 3.47Å; K371-V375 PolarHBondContact O-N 3.29Å
372S69.3Low68.8Low48 Ų4875.3 Ų75.334%0.33636%0.356SS..Hα-helixtrans-65.1-48.3174.7-1610000111.3K368 L369 L370 V375 L376K368-S372 PolarHBondContact O-N 3.15Å; L369-S372 CarbonylContact O-C 3.6Å; L369-S372 WeakPolarHBondContact O-CA 3.43Å; L369-S372 WeakPolarHBondContact O-CB 3.47Å; L369-S372 PolarHBondContact O-N 2.94Å; L370-S372 VanDerWaalsContact C-N 3.32Å; L370-S372 PolarHBondContact O-N 3.14Å; S372-V375 PolarHBondContact O-N 3.5Å; S372-L376 VanDerWaalsContact O-CB 3.23Å; S372-L376 WeakPolarHBondContact O-CB 3.47Å; S372-L376 PolarHBondContact O-N 3.39Å
373T70.1Confident69.3Low35 Ų3570.9 Ų70.922%0.21533%0.328CS..Hα-helixtrans-63.5-42.1-179.4-63.10000112.8F341 I345 L369 L370 V375 L376 M377F341-T373 HydrophobicContact CZ-CG2 4.29Å; I345-T373 HydrophobicContact CD1-CG2 3.65Å; L369-T373 PolarHBondContact O-N 2.96Å; L369-T373 PolarHBondContact O-OG1 3.39Å; L370-T373 PolarHBondContact O-N 2.9Å; T373-V375 VanDerWaalsContact C-N 3.32Å; T373-V375 PolarHBondContact O-N 2.9Å; T373-L376 CarbonylContact O-C 3.58Å; T373-L376 PolarHBondContact O-N 3.09Å; T373-L376 VanDerWaalsContact O-N 3.08Å; T373-M377 WeakPolarHBondContact O-CB 3.49Å; T373-M377 PolarHBondContact O-N 3.43Å
374L67.4Low69.6Low117 Ų11762.8 Ų62.861%0.61330%0.298SS*.Hα-helixtrans-68.3-32.7179.9-166.7154.3000111.8L370 L376 P378L370-L374 VanDerWaalsContact O-CB 3.25Å; L370-L374 WeakPolarHBondContact O-CB 3.3Å; L370-L374 PolarHBondContact O-N 2.93Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L374-P378 WeakPolarHBondContact O-CD 3.33Å
375V68.4Low69.8Low59 Ų5959.7 Ų59.736%0.35828%0.284SS..Hα-helixtrans-70.4-30.6170.2167.40000112K371 S372 T373 I421K371-V375 WeakPolarHBondContact O-CB 3.36Å; K371-V375 VanDerWaalsContact O-CG2 3.24Å; K371-V375 WeakPolarHBondContact O-CG2 3.47Å; K371-V375 PolarHBondContact O-N 3.29Å; S372-V375 PolarHBondContact O-N 3.5Å; T373-V375 VanDerWaalsContact C-N 3.32Å; T373-V375 PolarHBondContact O-N 2.9Å; V375-I421 HydrophobicContact CG1-CD1 3.68Å; V375-I421 HydrophobicContact CG1-CG1 3.86Å; V375-I421 HydrophobicContact CG1-CG2 4.01Å
376L69.4Low70.2Confident22 Ų2262 Ų6212%0.11530%0.297CS..Hα-helixtrans-88.7-23.3-173.9-16364000113.7F341 I345 S372 T373 L374 L379 F380F341-L376 HydrophobicContact CD2-CD2 4.21Å; F341-L376 HydrophobicContact CD2-CG 4.26Å; F341-L376 HydrophobicContact CE2-CB 4.2Å; F341-L376 HydrophobicContact CE2-CD2 4.04Å; F341-L376 HydrophobicContact CE2-CG 3.98Å; I345-L376 HydrophobicContact CG1-CD2 4.33Å; S372-L376 VanDerWaalsContact O-CB 3.23Å; S372-L376 WeakPolarHBondContact O-CB 3.47Å; S372-L376 PolarHBondContact O-N 3.39Å; T373-L376 CarbonylContact O-C 3.58Å; T373-L376 PolarHBondContact O-N 3.09Å; T373-L376 VanDerWaalsContact O-N 3.08Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L376-L379 WeakPolarHBondContact O-CB 3.34Å; L376-L379 PolarHBondContact O-N 3.35Å; L376-F380 HydrophobicContact CD1-CD2 3.92Å; L376-F380 HydrophobicContact CD1-CE2 3.44Å; L376-F380 VanDerWaalsContact CD1-CE2 3.44Å; L376-F380 HydrophobicContact CD1-CZ 4.11Å; L376-F380 HydrophobicContact CD2-CD2 4.41Å; L376-F380 HydrophobicContact CD2-CE2 3.93Å; L376-F380 HydrophobicContact CG-CD2 3.71Å; L376-F380 HydrophobicContact CG-CE2 3.53Å; L376-F380 PolarHBondContact O-N 3.01Å
377M71.6Confident70.3Confident53 Ų5355.1 Ų55.126%0.26127%0.271SS..THydrogen-bonded Turntrans-63.5-51.2-179.6161.6-173.7172.200113.7F341 T373 L379 G381 V382 H383 I386F341-M377 HydrophobicContact CZ-CB 4.46Å; T373-M377 WeakPolarHBondContact O-CB 3.49Å; T373-M377 PolarHBondContact O-N 3.43Å; M377-L379 PolarHBondContact O-N 2.78Å; M377-G381 PolarHBondContact O-N 2.87Å; M377-V382 HydrophobicContact CG-CB 4.1Å; M377-V382 HydrophobicContact CG-CG1 4.42Å; M377-V382 PolarHBondContact O-N 2.94Å; M377-V382 VanDerWaalsContact O-N 3.08Å; M377-H383 HydrophobicContact CE-CB 4.2Å; M377-I386 HydrophobicContact CE-CD1 4.2Å
378P63.6Low70.1Confident18 Ų1850.2 Ų50.212%0.11726%0.255CS..THydrogen-bonded Turntrans-66.3-27.7175.7-19.632.3000112.4L374 G381 Q414 L417L374-P378 WeakPolarHBondContact O-CD 3.33Å; P378-G381 PolarHBondContact O-N 3.4Å; P378-Q414 WeakPolarHBondContact O-CG 3.18Å; P378-Q414 PolarHBondContact O-NE2 2.73Å; P378-L417 HydrophobicContact CB-CD1 4.16Å; P378-L417 HydrophobicContact CG-CD1 4.45Å
379L68.4Low69.6Low3 Ų348.3 Ų48.32%0.01626%0.262CS..THydrogen-bonded Turntrans-68.7-47.3-174.5-165.6150000111.3E265 L376 M377 G381 V418 I421 Y422E265-L379 WeakPolarHBondContact OE2-CD2 3Å; L376-L379 WeakPolarHBondContact O-CB 3.34Å; L376-L379 PolarHBondContact O-N 3.35Å; M377-L379 PolarHBondContact O-N 2.78Å; L379-G381 VanDerWaalsContact C-N 3.29Å; L379-G381 PolarHBondContact O-N 3.34Å; L379-V418 HydrophobicContact CG-CG2 4.19Å; L379-I421 HydrophobicContact CD1-CD1 4.22Å; L379-I421 HydrophobicContact CD1-CG2 4.02Å; L379-Y422 HydrophobicContact CD1-CD2 4.39Å; L379-Y422 HydrophobicContact CD1-CE1 4.11Å; L379-Y422 HydrophobicContact CD1-CE2 3.69Å; L379-Y422 HydrophobicContact CD2-CE2 3.98Å; L379-Y422 VanDerWaalsContact CD2-OH 3.31Å; L379-Y422 WeakPolarHBondContact CD2-OH 3.25Å; L379-Y422 HydrophobicContact CG-CE2 4.12Å
380F70.1Confident69.5Low7 Ų750.5 Ų50.53%0.03127%0.272CS..THydrogen-bonded Turntrans-84.75.1175.1-69.7-50000114.7G266 L269 N337 F341 I344 L376 V382G266-F380 VanDerWaalsContact CA-CE1 3.5Å; L269-F380 HydrophobicContact CD1-CZ 4.4Å; N337-F380 WeakPolarHBondContact ND2-CB 3.48Å; N337-F380 PolarHBondContact ND2-O 2.87Å; F341-F380 HydrophobicContact CB-CD2 4.23Å; F341-F380 AromaticContact CD2-CD2 3.51Å; F341-F380 HydrophobicContact CD2-CD2 3.51Å; F341-F380 HydrophobicContact CD2-CE2 4.08Å; F341-F380 HydrophobicContact CE2-CD2 4.23Å; F341-F380 HydrophobicContact CG-CD2 4.28Å; I344-F380 HydrophobicContact CD1-CE2 4.28Å; I344-F380 HydrophobicContact CD1-CZ 4.08Å; L376-F380 HydrophobicContact CD1-CD2 3.92Å; L376-F380 HydrophobicContact CD1-CE2 3.44Å; L376-F380 VanDerWaalsContact CD1-CE2 3.44Å; L376-F380 HydrophobicContact CD1-CZ 4.11Å; L376-F380 HydrophobicContact CD2-CD2 4.41Å; L376-F380 HydrophobicContact CD2-CE2 3.93Å; L376-F380 HydrophobicContact CG-CD2 3.71Å; L376-F380 HydrophobicContact CG-CE2 3.53Å; L376-F380 PolarHBondContact O-N 3.01Å; F380-V382 VanDerWaalsContact C-N 3.28Å; F380-V382 HydrophobicContact CB-CG2 4.07Å; F380-V382 PolarHBondContact O-N 3.17Å
381G70.6Confident69.1Low4 Ų450 Ų504%0.04128%0.275CS..THydrogen-bonded Turntrans6628.5-179.600000113.6M377 P378 L379 H383 Y384M377-G381 PolarHBondContact O-N 2.87Å; P378-G381 PolarHBondContact O-N 3.4Å; L379-G381 VanDerWaalsContact C-N 3.29Å; L379-G381 PolarHBondContact O-N 3.34Å; G381-H383 PolarHBondContact O-N 3.42Å; G381-H383 VanDerWaalsContact O-N 3.14Å; G381-Y384 WeakPolarHBondContact O-CB 3.45Å; G381-Y384 VanDerWaalsContact O-CD2 3.22Å; G381-Y384 WeakPolarHBondContact O-CD2 3.29Å; G381-Y384 PolarHBondContact O-N 3.48Å
382V72.3Confident68.3Low14 Ų1450.5 Ų50.59%0.08527%0.274CS..Hα-helixtrans-62.4-24.9-177.7173.80000111.5F338 F341 M377 F380 Y384 I385F338-V382 HydrophobicContact CD2-CG1 3.79Å; F338-V382 HydrophobicContact CD2-CG2 4.29Å; F338-V382 HydrophobicContact CE2-CG1 3.82Å; F341-V382 HydrophobicContact CB-CG2 4.38Å; F341-V382 HydrophobicContact CD1-CG1 4.34Å; F341-V382 HydrophobicContact CD1-CG2 3.55Å; F341-V382 HydrophobicContact CD2-CG2 4.16Å; F341-V382 HydrophobicContact CE1-CB 4.34Å; F341-V382 HydrophobicContact CE1-CG1 3.94Å; F341-V382 HydrophobicContact CE1-CG2 3.63Å; F341-V382 HydrophobicContact CE2-CG2 4.18Å; F341-V382 HydrophobicContact CG-CG2 3.8Å; F341-V382 HydrophobicContact CZ-CG2 3.92Å; M377-V382 HydrophobicContact CG-CB 4.1Å; M377-V382 HydrophobicContact CG-CG1 4.42Å; M377-V382 PolarHBondContact O-N 2.94Å; M377-V382 VanDerWaalsContact O-N 3.08Å; F380-V382 VanDerWaalsContact C-N 3.28Å; F380-V382 HydrophobicContact CB-CG2 4.07Å; F380-V382 PolarHBondContact O-N 3.17Å; V382-Y384 VanDerWaalsContact C-N 3.31Å; V382-Y384 PolarHBondContact O-N 3.27Å; V382-I385 PolarHBondContact O-N 3.03Å
383H77.3Confident67.7Low2 Ų250.7 Ų50.71%0.00927%0.273CS..Hα-helixtrans-62.9-32175.267-81.2000113.4M377 G381 I385 I386 F387 Y406 N411M377-H383 HydrophobicContact CE-CB 4.2Å; G381-H383 PolarHBondContact O-N 3.42Å; G381-H383 VanDerWaalsContact O-N 3.14Å; H383-I385 VanDerWaalsContact C-N 3.26Å; H383-I385 PolarHBondContact O-N 3.3Å; H383-I386 PolarHBondContact O-N 2.95Å; H383-F387 WeakPolarHBondContact O-CD2 3.42Å; H383-Y406 HydrophobicContact CB-CE1 4.01Å; H383-N411 PolarHBondContact NE2-OD1 3.32Å
384Y73.7Confident67.1Low17 Ų1756.3 Ų56.37%0.06730%0.297CS..Hα-helixtrans-59.8-33.5-179.6-67.7-76.4000112.7R199 Y259 G381 V382 H388 N411 Q414R199-Y384 PolarHBondContact NH1-OH 2.91Å; R199-Y384 VanDerWaalsContact NH1-OH 3.11Å; R199-Y384 PolarHBondContact NH2-OH 2.97Å; Y259-Y384 HydrophobicContact CD1-CE2 4.45Å; Y259-Y384 HydrophobicContact CE1-CD1 4.05Å; Y259-Y384 AromaticContact CE1-CD2 3.82Å; Y259-Y384 HydrophobicContact CE1-CD2 3.82Å; Y259-Y384 AromaticContact CE1-CE1 3.79Å; Y259-Y384 HydrophobicContact CE1-CE1 3.79Å; Y259-Y384 AromaticContact CE1-CE2 3.63Å; Y259-Y384 HydrophobicContact CE1-CE2 3.63Å; Y259-Y384 HydrophobicContact CE1-CG 4.07Å; Y259-Y384 AromaticContact CE1-CZ 3.61Å; Y259-Y384 AromaticContact CZ-CE1 3.85Å; Y259-Y384 AromaticContact CZ-CZ 3.98Å; Y259-Y384 WeakPolarHBondContact OH-CE1 3.42Å; G381-Y384 WeakPolarHBondContact O-CB 3.45Å; G381-Y384 VanDerWaalsContact O-CD2 3.22Å; G381-Y384 WeakPolarHBondContact O-CD2 3.29Å; G381-Y384 PolarHBondContact O-N 3.48Å; V382-Y384 VanDerWaalsContact C-N 3.31Å; V382-Y384 PolarHBondContact O-N 3.27Å; Y384-H388 WeakPolarHBondContact O-CB 3.42Å; Y384-H388 PolarHBondContact O-N 3.23Å; Y384-N411 VanDerWaalsContact CE1-CG 3.4Å; Y384-N411 WeakPolarHBondContact CE1-ND2 3.38Å; Y384-N411 WeakPolarHBondContact CE1-OD1 3.32Å; Y384-N411 PolarHBondContact OH-OD1 3.37Å; Y384-Q414 PolarHBondContact OH-OE1 3.44Å
385I72.2Confident66.6Low36 Ų3654.7 Ų54.719%0.18529%0.292CS..Hα-helixtrans-70.6-36.4-179.8-65-175.2000112.1V334 V335 F338 V382 H383 F387 H388 A389V334-I385 HydrophobicContact CG1-CD1 3.94Å; V334-I385 HydrophobicContact CG1-CG1 3.47Å; V334-I385 VanDerWaalsContact CG1-CG1 3.47Å; V335-I385 HydrophobicContact CG2-CD1 4.47Å; F338-I385 HydrophobicContact CB-CD1 3.28Å; F338-I385 HydrophobicContact CD1-CD1 3.96Å; F338-I385 HydrophobicContact CD2-CD1 4.28Å; F338-I385 HydrophobicContact CG-CD1 3.61Å; V382-I385 PolarHBondContact O-N 3.03Å; H383-I385 VanDerWaalsContact C-N 3.26Å; H383-I385 PolarHBondContact O-N 3.3Å; I385-F387 PolarHBondContact O-N 2.99Å; I385-H388 PolarHBondContact O-N 3.48Å; I385-A389 WeakPolarHBondContact O-CB 3.37Å; I385-A389 PolarHBondContact O-N 2.97Å
386I71.3Confident66.1Low93 Ų9356.6 Ų56.648%0.47731%0.308SS..Hα-helixtrans-60.4-36.8-176.6-59.4175.8000110.3M377 H383M377-I386 HydrophobicContact CE-CD1 4.2Å; H383-I386 PolarHBondContact O-N 2.95Å
387F67.2Low66.2Low30 Ų3056.4 Ų56.413%0.13231%0.311CS..Hα-helixtrans-93.9-30.4-178.9-64.3-82.3000113.4H383 I385 A389 M390 Q403 Y406 E407H383-F387 WeakPolarHBondContact O-CD2 3.42Å; I385-F387 PolarHBondContact O-N 2.99Å; F387-A389 PolarHBondContact O-N 3.34Å; F387-M390 VanDerWaalsContact O-CB 3.31Å; F387-M390 WeakPolarHBondContact O-CB 3.49Å; F387-M390 PolarHBondContact O-N 3.13Å; F387-Q403 HydrophobicContact CB-CG 4.03Å; F387-Q403 HydrophobicContact CD1-CB 3.97Å; F387-Q403 HydrophobicContact CD1-CG 3.75Å; F387-Q403 HydrophobicContact CG-CG 4.22Å; F387-Q403 PolarHBondContact O-NE2 3.21Å; F387-Y406 AromaticContact CD2-CD1 3.84Å; F387-Y406 HydrophobicContact CD2-CD1 3.84Å; F387-Y406 HydrophobicContact CD2-CE1 4.01Å; F387-Y406 HydrophobicContact CE1-CD1 4.43Å; F387-Y406 HydrophobicContact CE1-CG 4.3Å; F387-Y406 AromaticContact CE2-CD1 3.22Å; F387-Y406 HydrophobicContact CE2-CD1 3.22Å; F387-Y406 HydrophobicContact CE2-CD2 4.2Å; F387-Y406 AromaticContact CE2-CE1 3.28Å; F387-Y406 HydrophobicContact CE2-CE1 3.28Å; F387-Y406 HydrophobicContact CE2-CE2 4.21Å; F387-Y406 AromaticContact CE2-CG 3.73Å; F387-Y406 HydrophobicContact CE2-CG 3.73Å; F387-Y406 AromaticContact CE2-CZ 3.78Å; F387-Y406 AromaticContact CZ-CD1 3.56Å; F387-Y406 HydrophobicContact CZ-CD1 3.56Å; F387-Y406 AromaticContact CZ-CD2 3.86Å; F387-Y406 HydrophobicContact CZ-CD2 3.86Å; F387-Y406 AromaticContact CZ-CE1 3.95Å; F387-Y406 HydrophobicContact CZ-CE1 3.95Å; F387-Y406 HydrophobicContact CZ-CE2 4.19Å; F387-Y406 AromaticContact CZ-CG 3.53Å; F387-Y406 HydrophobicContact CZ-CG 3.53Å; F387-E407 HydrophobicContact CB-CG 4.37Å; F387-E407 WeakPolarHBondContact CB-OE1 3.4Å; F387-E407 HydrophobicContact CG-CG 4.49Å
388H67.1Low66.4Low75 Ų7559.9 Ų59.935%0.34733%0.33SS..Hα-helixtrans-68.4-16.4170.4-159.9-49.1000112.7Q327 Y384 I385 M390Q327-H388 PolarHBondContact NE2-NE2 2.93Å; Y384-H388 WeakPolarHBondContact O-CB 3.42Å; Y384-H388 PolarHBondContact O-N 3.23Å; I385-H388 PolarHBondContact O-N 3.48Å; H388-M390 VanDerWaalsContact C-N 3.3Å
389A62.4Low67.2Low78 Ų7861.8 Ų61.865%0.64534%0.342SS*.THydrogen-bonded Turntrans-77.7-12.5169.900000113.7I385 F387I385-A389 WeakPolarHBondContact O-CB 3.37Å; I385-A389 PolarHBondContact O-N 2.97Å; F387-A389 PolarHBondContact O-N 3.34Å
390M63.3Low67.8Low83 Ų8363.8 Ų63.841%0.40935%0.349SS..SBendtrans-81130.6171.2-60.7-84.5-75.800108.7F387 H388 P399F387-M390 VanDerWaalsContact O-CB 3.31Å; F387-M390 WeakPolarHBondContact O-CB 3.49Å; F387-M390 PolarHBondContact O-N 3.13Å; H388-M390 VanDerWaalsContact C-N 3.3Å; M390-P399 HydrophobicContact CE-CB 4.06Å
391P60.6Low68.5Low98 Ų9866.4 Ų66.464%0.63636%0.363SS*.  trans-66.7153.517030.1-34.5000110.1T393P391-T393 PolarHBondContact O-N 2.73Å
392Y57.9Low69.1Low168 Ų16871.2 Ų71.266%0.65939%0.387SS*.  trans-59.2105.6171.1-66.3-81.9000109.5Q327Q327-Y392 PolarHBondContact NE2-OH 3.19Å
393T56.5Low69.7Low52 Ų5271.7 Ų71.732%0.31939%0.388SS..  trans-82.5164.9169.861.70000110.5P391 P399P391-T393 PolarHBondContact O-N 2.73Å; T393-P399 HydrophobicContact CG2-CB 4.22Å; T393-P399 HydrophobicContact CG2-CG 4.49Å
394E57.9Low70Confident154 Ų15473.2 Ų73.272%0.7240%0.395SS*.  trans-39.2137.4169.5-57.6-57.3156.200112.9S396 G397E394-S396 PolarHBondContact O-N 2.76Å; E394-S396 VanDerWaalsContact O-N 3.13Å; E394-G397 PolarHBondContact O-N 3.02Å
395V57.1Low70.7Confident83 Ų8375 Ų7550%0.50340%0.404SS..THydrogen-bonded Turntrans-59.7-29.4-169.2-178.70000112.9W400V395-W400 HydrophobicContact CG1-CZ2 4.5Å; V395-W400 WeakPolarHBondContact O-CZ3 3.48Å
396S57.1Low71.4Confident99 Ų9976 Ų7669%0.69241%0.406SS*.THydrogen-bonded Turntrans-94.82.6178.156.20000114.3E394E394-S396 PolarHBondContact O-N 2.76Å; E394-S396 VanDerWaalsContact O-N 3.13Å
397G71.6Confident72.1Confident18 Ų1873.3 Ų73.319%0.18639%0.392CS..  trans-69.3142.6-174.500000114.4E394 P399 W400 L401E394-G397 PolarHBondContact O-N 3.02Å; G397-P399 VanDerWaalsContact C-N 3.28Å; G397-W400 WeakPolarHBondContact O-CB 3.41Å; G397-W400 PolarHBondContact O-N 3.07Å; G397-W400 VanDerWaalsContact O-N 3.08Å; G397-L401 PolarHBondContact O-N 2.81Å
398I77.3Confident73.1Confident126 Ų12674.6 Ų74.665%0.64640%0.399SS*.Hα-helixtrans-50.2-40.4172.3-60174.6000112.7L401 I402I398-L401 PolarHBondContact O-N 2.99Å; I398-I402 HydrophobicContact CG2-CD1 3.77Å; I398-I402 HydrophobicContact CG2-CG1 4.42Å; I398-I402 WeakPolarHBondContact O-CG1 3.5Å; I398-I402 PolarHBondContact O-N 3.04Å
399P78.5Confident74.2Confident57 Ų5774.9 Ų74.937%0.3740%0.402SS..Hα-helixtrans-61.6-46.8175.5-23.735.6000113.3M390 T393 G397 L401 I402 Q403M390-P399 HydrophobicContact CE-CB 4.06Å; T393-P399 HydrophobicContact CG2-CB 4.22Å; T393-P399 HydrophobicContact CG2-CG 4.49Å; G397-P399 VanDerWaalsContact C-N 3.28Å; P399-L401 VanDerWaalsContact C-N 3.34Å; P399-L401 PolarHBondContact O-N 3.44Å; P399-I402 PolarHBondContact O-N 3.28Å; P399-Q403 WeakPolarHBondContact O-CB 3.09Å; P399-Q403 PolarHBondContact O-N 2.96Å
400W82.7Confident75.4Confident46 Ų4674.2 Ų74.217%0.17439%0.385CS..Hα-helixtrans-60.1-44.1176.4179.595000111.5V149 F150 L153 V395 G397 I402 Q403 M404V149-W400 HydrophobicContact CG1-CH2 4.38Å; V149-W400 HydrophobicContact CG1-CZ3 3.92Å; F150-W400 AromaticContact CE1-CH2 3.83Å; F150-W400 HydrophobicContact CE1-CH2 3.83Å; F150-W400 HydrophobicContact CE1-CZ2 4.2Å; F150-W400 HydrophobicContact CZ-CH2 4.03Å; F150-W400 HydrophobicContact CZ-CZ2 4.45Å; L153-W400 HydrophobicContact CD1-CH2 4.47Å; V395-W400 HydrophobicContact CG1-CZ2 4.5Å; V395-W400 WeakPolarHBondContact O-CZ3 3.48Å; G397-W400 WeakPolarHBondContact O-CB 3.41Å; G397-W400 PolarHBondContact O-N 3.07Å; G397-W400 VanDerWaalsContact O-N 3.08Å; W400-I402 PolarHBondContact O-N 3.49Å; W400-Q403 PolarHBondContact O-N 3.44Å; W400-M404 HydrophobicContact CD2-CG 3.88Å; W400-M404 HydrophobicContact CE3-CG 4.34Å; W400-M404 HydrophobicContact CG-CG 4.39Å; W400-M404 HydrophobicContact CH2-CG 4.23Å; W400-M404 HydrophobicContact CZ2-CG 3.74Å; W400-M404 WeakPolarHBondContact O-CB 3.36Å; W400-M404 WeakPolarHBondContact O-CG 3.49Å; W400-M404 PolarHBondContact O-N 3.23Å
401L83Confident76.6Confident62 Ų6270.8 Ų70.833%0.32537%0.368SS..Hα-helixtrans-59.7-46.2178.9-172.970.6000111.7V149 G397 I398 P399 H405V149-L401 HydrophobicContact CB-CD1 4.34Å; V149-L401 HydrophobicContact CG1-CD1 3.54Å; V149-L401 HydrophobicContact CG2-CD1 3.74Å; G397-L401 PolarHBondContact O-N 2.81Å; I398-L401 PolarHBondContact O-N 2.99Å; P399-L401 VanDerWaalsContact C-N 3.34Å; P399-L401 PolarHBondContact O-N 3.44Å; L401-H405 WeakPolarHBondContact O-CB 3.41Å; L401-H405 PolarHBondContact O-N 3.35Å; L401-H405 VanDerWaalsContact O-N 3.11Å; L401-H405 PolarHBondContact O-ND1 2.94Å
402I84.4Confident78.2Confident105 Ų10566.1 Ų66.154%0.53834%0.338SS..Hα-helixtrans-65.2-44.8177.3-69168.5000110.6I398 P399 W400 Y406I398-I402 HydrophobicContact CG2-CD1 3.77Å; I398-I402 HydrophobicContact CG2-CG1 4.42Å; I398-I402 WeakPolarHBondContact O-CG1 3.5Å; I398-I402 PolarHBondContact O-N 3.04Å; P399-I402 PolarHBondContact O-N 3.28Å; W400-I402 PolarHBondContact O-N 3.49Å; I402-Y406 WeakPolarHBondContact O-CB 3.5Å; I402-Y406 PolarHBondContact O-N 3.1Å
403Q83.6Confident79.8Confident24 Ų2460.8 Ų60.811%0.11232%0.318CS..Hα-helixtrans-59.7-52178.6174166.6-3.600111.6F387 P399 W400 H405 Y406 E407F387-Q403 HydrophobicContact CB-CG 4.03Å; F387-Q403 HydrophobicContact CD1-CB 3.97Å; F387-Q403 HydrophobicContact CD1-CG 3.75Å; F387-Q403 HydrophobicContact CG-CG 4.22Å; F387-Q403 PolarHBondContact O-NE2 3.21Å; P399-Q403 WeakPolarHBondContact O-CB 3.09Å; P399-Q403 PolarHBondContact O-N 2.96Å; W400-Q403 PolarHBondContact O-N 3.44Å; Q403-H405 PolarHBondContact O-N 3.36Å; Q403-Y406 PolarHBondContact O-N 3.32Å; Q403-E407 HydrophobicContact CG-CG 4.36Å; Q403-E407 WeakPolarHBondContact CG-OE1 2.92Å; Q403-E407 PolarHBondContact NE2-OE1 3.32Å; Q403-E407 WeakPolarHBondContact O-CB 3.43Å; Q403-E407 WeakPolarHBondContact O-CG 3.41Å; Q403-E407 PolarHBondContact O-N 2.92Å
404M84.9Confident81.4Confident33 Ų3358.3 Ų58.316%0.16330%0.303CS..Hα-helixtrans-64.2-40-179.5-71.1-65.499.700112.7L153 W400 M408L153-M404 HydrophobicContact CD1-CB 3.98Å; L153-M404 HydrophobicContact CD2-CB 4.11Å; W400-M404 HydrophobicContact CD2-CG 3.88Å; W400-M404 HydrophobicContact CE3-CG 4.34Å; W400-M404 HydrophobicContact CG-CG 4.39Å; W400-M404 HydrophobicContact CH2-CG 4.23Å; W400-M404 HydrophobicContact CZ2-CG 3.74Å; W400-M404 WeakPolarHBondContact O-CB 3.36Å; W400-M404 WeakPolarHBondContact O-CG 3.49Å; W400-M404 PolarHBondContact O-N 3.23Å; M404-M408 VanDerWaalsContact O-CB 3.32Å; M404-M408 WeakPolarHBondContact O-CB 3.36Å; M404-M408 VanDerWaalsContact O-CG 3.24Å; M404-M408 WeakPolarHBondContact O-CG 3.28Å; M404-M408 PolarHBondContact O-N 3.44Å; M404-M408 HydrophobicContact SD-CE 4.45Å
405H88.3Confident83.1Confident54 Ų5451 Ų5125%0.2527%0.269CS..Hα-helixtrans-65.2-40.9174.9-78.478.8000112.1L153 L401 Q403 L409L153-H405 HydrophobicContact CD2-CB 4.48Å; L401-H405 WeakPolarHBondContact O-CB 3.41Å; L401-H405 PolarHBondContact O-N 3.35Å; L401-H405 VanDerWaalsContact O-N 3.11Å; L401-H405 PolarHBondContact O-ND1 2.94Å; Q403-H405 PolarHBondContact O-N 3.36Å; H405-L409 WeakPolarHBondContact O-CB 3.3Å; H405-L409 PolarHBondContact O-N 2.89Å
406Y87Confident84.9Confident58 Ų5850.1 Ų50.123%0.22726%0.259CS..Hα-helixtrans-65-51.2175.9-175.9-75.8000111.2H383 F387 I402 Q403 L409 F410H383-Y406 HydrophobicContact CB-CE1 4.01Å; F387-Y406 AromaticContact CD2-CD1 3.84Å; F387-Y406 HydrophobicContact CD2-CD1 3.84Å; F387-Y406 HydrophobicContact CD2-CE1 4.01Å; F387-Y406 HydrophobicContact CE1-CD1 4.43Å; F387-Y406 HydrophobicContact CE1-CG 4.3Å; F387-Y406 AromaticContact CE2-CD1 3.22Å; F387-Y406 HydrophobicContact CE2-CD1 3.22Å; F387-Y406 HydrophobicContact CE2-CD2 4.2Å; F387-Y406 AromaticContact CE2-CE1 3.28Å; F387-Y406 HydrophobicContact CE2-CE1 3.28Å; F387-Y406 HydrophobicContact CE2-CE2 4.21Å; F387-Y406 AromaticContact CE2-CG 3.73Å; F387-Y406 HydrophobicContact CE2-CG 3.73Å; F387-Y406 AromaticContact CE2-CZ 3.78Å; F387-Y406 AromaticContact CZ-CD1 3.56Å; F387-Y406 HydrophobicContact CZ-CD1 3.56Å; F387-Y406 AromaticContact CZ-CD2 3.86Å; F387-Y406 HydrophobicContact CZ-CD2 3.86Å; F387-Y406 AromaticContact CZ-CE1 3.95Å; F387-Y406 HydrophobicContact CZ-CE1 3.95Å; F387-Y406 HydrophobicContact CZ-CE2 4.19Å; F387-Y406 AromaticContact CZ-CG 3.53Å; F387-Y406 HydrophobicContact CZ-CG 3.53Å; I402-Y406 WeakPolarHBondContact O-CB 3.5Å; I402-Y406 PolarHBondContact O-N 3.1Å; Q403-Y406 PolarHBondContact O-N 3.32Å; Y406-L409 PolarHBondContact O-N 2.99Å; Y406-F410 HydrophobicContact CD1-CB 4.48Å; Y406-F410 AromaticContact CD1-CD2 3.82Å; Y406-F410 HydrophobicContact CD1-CD2 3.82Å; Y406-F410 HydrophobicContact CD1-CE2 4.48Å; Y406-F410 HydrophobicContact CD1-CG 4.36Å; Y406-F410 AromaticContact CD2-CD2 3.91Å; Y406-F410 HydrophobicContact CD2-CD2 3.91Å; Y406-F410 AromaticContact CD2-CE2 3.81Å; Y406-F410 HydrophobicContact CD2-CE2 3.81Å; Y406-F410 HydrophobicContact CE1-CB 4.09Å; Y406-F410 HydrophobicContact CE1-CD1 4.5Å; Y406-F410 AromaticContact CE1-CD2 3.47Å; Y406-F410 HydrophobicContact CE1-CD2 3.47Å; Y406-F410 VanDerWaalsContact CE1-CD2 3.47Å; Y406-F410 HydrophobicContact CE1-CE2 4.02Å; Y406-F410 AromaticContact CE1-CG 3.75Å; Y406-F410 HydrophobicContact CE1-CG 3.75Å; Y406-F410 AromaticContact CE2-CD2 3.62Å; Y406-F410 HydrophobicContact CE2-CD2 3.62Å; Y406-F410 AromaticContact CE2-CE2 3.3Å; Y406-F410 HydrophobicContact CE2-CE2 3.3Å; Y406-F410 AromaticContact CE2-CZ 3.98Å; Y406-F410 HydrophobicContact CE2-CZ 3.98Å; Y406-F410 HydrophobicContact CG-CD2 4Å; Y406-F410 HydrophobicContact CG-CE2 4.37Å; Y406-F410 AromaticContact CZ-CD2 3.39Å; Y406-F410 AromaticContact CZ-CE2 3.42Å; Y406-F410 VanDerWaalsContact CZ-CE2 3.42Å; Y406-F410 AromaticContact CZ-CG 3.86Å; Y406-F410 AromaticContact CZ-CZ 3.91Å; Y406-F410 WeakPolarHBondContact O-CD2 3.39Å; Y406-F410 PolarHBondContact O-N 3.07Å
407E85.6Confident86.5Confident37 Ų3748.2 Ų48.217%0.17324%0.24CC..Hα-helixtrans-61-51.1-178.3-76.3-174.2-149.700111.3F387 Q403 L409 F410 N411F387-E407 HydrophobicContact CB-CG 4.37Å; F387-E407 WeakPolarHBondContact CB-OE1 3.4Å; F387-E407 HydrophobicContact CG-CG 4.49Å; Q403-E407 HydrophobicContact CG-CG 4.36Å; Q403-E407 WeakPolarHBondContact CG-OE1 2.92Å; Q403-E407 PolarHBondContact NE2-OE1 3.32Å; Q403-E407 WeakPolarHBondContact O-CB 3.43Å; Q403-E407 WeakPolarHBondContact O-CG 3.41Å; Q403-E407 PolarHBondContact O-N 2.92Å; E407-L409 VanDerWaalsContact C-N 3.27Å; E407-L409 PolarHBondContact O-N 3.02Å; E407-F410 PolarHBondContact O-N 3.46Å; E407-N411 WeakPolarHBondContact O-CB 3Å; E407-N411 PolarHBondContact O-N 3.27Å; E407-N411 PolarHBondContact O-ND2 3.28Å; E407-N411 PolarHBondContact O-OD1 3.23Å
408M89.2Confident87.5Confident57 Ų5747.4 Ų47.428%0.28123%0.232SC..Hα-helixtrans-62.8-34.8-179.2-66.2-59.3168.500112.4L153 I156 Y157 M404 S412L153-M408 HydrophobicContact CD2-CB 4.29Å; L153-M408 HydrophobicContact CD2-CG 4.09Å; I156-M408 HydrophobicContact CG2-CB 4.47Å; Y157-M408 HydrophobicContact CD1-SD 4.01Å; M404-M408 VanDerWaalsContact O-CB 3.32Å; M404-M408 WeakPolarHBondContact O-CB 3.36Å; M404-M408 VanDerWaalsContact O-CG 3.24Å; M404-M408 WeakPolarHBondContact O-CG 3.28Å; M404-M408 PolarHBondContact O-N 3.44Å; M404-M408 HydrophobicContact SD-CE 4.45Å; M408-S412 VanDerWaalsContact O-CB 3.25Å; M408-S412 WeakPolarHBondContact O-CB 3.49Å; M408-S412 PolarHBondContact O-N 3.42Å; M408-S412 PolarHBondContact O-OG 2.82Å
409L89.9Confident88.2Confident80 Ų8041.4 Ų41.442%0.41920%0.201SC..Hα-helixtrans-67.8-56.8174-175.371.2000111.7I156 H405 Y406 E407 N411 S412 F413I156-L409 HydrophobicContact CG2-CB 4.15Å; I156-L409 HydrophobicContact CG2-CD1 4.08Å; H405-L409 WeakPolarHBondContact O-CB 3.3Å; H405-L409 PolarHBondContact O-N 2.89Å; Y406-L409 PolarHBondContact O-N 2.99Å; E407-L409 VanDerWaalsContact C-N 3.27Å; E407-L409 PolarHBondContact O-N 3.02Å; L409-N411 PolarHBondContact O-N 3.28Å; L409-S412 PolarHBondContact O-OG 3.1Å; L409-F413 HydrophobicContact CD1-CD2 3.84Å; L409-F413 HydrophobicContact CD1-CE2 3.83Å; L409-F413 WeakPolarHBondContact O-CD2 3.32Å; L409-F413 PolarHBondContact O-N 3.35Å
410F87.9Confident88.9Confident64 Ų6441.2 Ų41.228%0.28120%0.196SC..Hα-helixtrans-66.9-36-175.1-86.7-93.8000112.5Y406 E407 Q414Y406-F410 HydrophobicContact CD1-CB 4.48Å; Y406-F410 AromaticContact CD1-CD2 3.82Å; Y406-F410 HydrophobicContact CD1-CD2 3.82Å; Y406-F410 HydrophobicContact CD1-CE2 4.48Å; Y406-F410 HydrophobicContact CD1-CG 4.36Å; Y406-F410 AromaticContact CD2-CD2 3.91Å; Y406-F410 HydrophobicContact CD2-CD2 3.91Å; Y406-F410 AromaticContact CD2-CE2 3.81Å; Y406-F410 HydrophobicContact CD2-CE2 3.81Å; Y406-F410 HydrophobicContact CE1-CB 4.09Å; Y406-F410 HydrophobicContact CE1-CD1 4.5Å; Y406-F410 AromaticContact CE1-CD2 3.47Å; Y406-F410 HydrophobicContact CE1-CD2 3.47Å; Y406-F410 VanDerWaalsContact CE1-CD2 3.47Å; Y406-F410 HydrophobicContact CE1-CE2 4.02Å; Y406-F410 AromaticContact CE1-CG 3.75Å; Y406-F410 HydrophobicContact CE1-CG 3.75Å; Y406-F410 AromaticContact CE2-CD2 3.62Å; Y406-F410 HydrophobicContact CE2-CD2 3.62Å; Y406-F410 AromaticContact CE2-CE2 3.3Å; Y406-F410 HydrophobicContact CE2-CE2 3.3Å; Y406-F410 AromaticContact CE2-CZ 3.98Å; Y406-F410 HydrophobicContact CE2-CZ 3.98Å; Y406-F410 HydrophobicContact CG-CD2 4Å; Y406-F410 HydrophobicContact CG-CE2 4.37Å; Y406-F410 AromaticContact CZ-CD2 3.39Å; Y406-F410 AromaticContact CZ-CE2 3.42Å; Y406-F410 VanDerWaalsContact CZ-CE2 3.42Å; Y406-F410 AromaticContact CZ-CG 3.86Å; Y406-F410 AromaticContact CZ-CZ 3.91Å; Y406-F410 WeakPolarHBondContact O-CD2 3.39Å; Y406-F410 PolarHBondContact O-N 3.07Å; E407-F410 PolarHBondContact O-N 3.46Å; F410-Q414 WeakPolarHBondContact O-CA 3.32Å; F410-Q414 VanDerWaalsContact O-CB 3.3Å; F410-Q414 WeakPolarHBondContact O-CB 3.41Å; F410-Q414 PolarHBondContact O-N 3.06Å
411N88Confident89.2Confident12 Ų1241.2 Ų41.26%0.06420%0.199CC..Hα-helixtrans-73.2-37.4-177.5-61.4-16000112.4H383 Y384 E407 L409H383-N411 PolarHBondContact NE2-OD1 3.32Å; Y384-N411 VanDerWaalsContact CE1-CG 3.4Å; Y384-N411 WeakPolarHBondContact CE1-ND2 3.38Å; Y384-N411 WeakPolarHBondContact CE1-OD1 3.32Å; Y384-N411 PolarHBondContact OH-OD1 3.37Å; E407-N411 WeakPolarHBondContact O-CB 3Å; E407-N411 PolarHBondContact O-N 3.27Å; E407-N411 PolarHBondContact O-ND2 3.28Å; E407-N411 PolarHBondContact O-OD1 3.23Å; L409-N411 PolarHBondContact O-N 3.28Å
412S92.9Very high89.4Confident0 Ų039.9 Ų39.90%019%0.19CC..Hα-helixtrans-73.7-40.4178.662.50000112.4G160 S164 M408 L409G160-S412 CarbonylContact C-O 3.6Å; S164-S412 WeakPolarHBondContact CB-O 3.44Å; M408-S412 VanDerWaalsContact O-CB 3.25Å; M408-S412 WeakPolarHBondContact O-CB 3.49Å; M408-S412 PolarHBondContact O-N 3.42Å; M408-S412 PolarHBondContact O-OG 2.82Å; L409-S412 PolarHBondContact O-OG 3.1Å
413F92.1Very high89.8Confident55 Ų5534.9 Ų34.924%0.24117%0.165CC..Hα-helixtrans-82.2-8.5175.3-74.8-81.3000114.5I163 L409 G415 F416 L417I163-F413 HydrophobicContact CB-CE1 4.43Å; I163-F413 HydrophobicContact CD1-CE1 3.88Å; I163-F413 HydrophobicContact CD1-CZ 4.18Å; I163-F413 HydrophobicContact CG2-CE1 4.4Å; L409-F413 HydrophobicContact CD1-CD2 3.84Å; L409-F413 HydrophobicContact CD1-CE2 3.83Å; L409-F413 WeakPolarHBondContact O-CD2 3.32Å; L409-F413 PolarHBondContact O-N 3.35Å; F413-G415 VanDerWaalsContact C-N 3.34Å; F413-G415 PolarHBondContact O-N 2.95Å; F413-F416 HydrophobicContact CD1-CD1 4.11Å; F413-F416 WeakPolarHBondContact O-CB 2.97Å; F413-F416 PolarHBondContact O-N 2.88Å; F413-F416 VanDerWaalsContact O-N 3.13Å; F413-L417 PolarHBondContact O-N 2.89Å; F413-L417 VanDerWaalsContact O-N 3.1Å
414Q91.3Very high90.2Very high1 Ų137 Ų371%0.00517%0.174CC..Hα-helixtrans-51.1-51.4-177.8-161.6178300111.8Y196 P378 Y384 F410 F416 L417 V418Y196-Q414 HydrophobicContact CE1-CB 4.25Å; Y196-Q414 HydrophobicContact CE1-CG 4.21Å; Y196-Q414 VanDerWaalsContact OH-CD 3.27Å; Y196-Q414 PolarHBondContact OH-NE2 3.47Å; P378-Q414 WeakPolarHBondContact O-CG 3.18Å; P378-Q414 PolarHBondContact O-NE2 2.73Å; Y384-Q414 PolarHBondContact OH-OE1 3.44Å; F410-Q414 WeakPolarHBondContact O-CA 3.32Å; F410-Q414 VanDerWaalsContact O-CB 3.3Å; F410-Q414 WeakPolarHBondContact O-CB 3.41Å; F410-Q414 PolarHBondContact O-N 3.06Å; Q414-F416 PolarHBondContact O-N 3.36Å; Q414-L417 WeakPolarHBondContact O-CB 3.15Å; Q414-L417 PolarHBondContact O-N 3.05Å; Q414-V418 WeakPolarHBondContact O-CG2 3.07Å; Q414-V418 PolarHBondContact O-N 2.9Å
415G93.3Very high90.5Very high0 Ų039.3 Ų39.30%019%0.192CC..Hα-helixtrans-66.7-32.3-178.100000114.6S164 F413 V418 A419S164-G415 VanDerWaalsContact OG-CA 3.27Å; S164-G415 WeakPolarHBondContact OG-CA 3.32Å; F413-G415 VanDerWaalsContact C-N 3.34Å; F413-G415 PolarHBondContact O-N 2.95Å; G415-V418 PolarHBondContact O-N 2.93Å; G415-A419 WeakPolarHBondContact O-CB 3.01Å; G415-A419 PolarHBondContact O-N 3.38Å
416F94.1Very high90.5Very high65 Ų6538.1 Ų38.129%0.28519%0.187SC..Hα-helixtrans-64-44172.1168.2-109.2000111.3I163 S164 F413 Q414 A419 I420I163-F416 HydrophobicContact CG2-CB 4.48Å; I163-F416 HydrophobicContact CG2-CD2 3.66Å; I163-F416 HydrophobicContact CG2-CE2 3.9Å; I163-F416 HydrophobicContact CG2-CG 4.03Å; I163-F416 HydrophobicContact CG2-CZ 4.47Å; S164-F416 PolarHBondContact OG-N 3.26Å; F413-F416 HydrophobicContact CD1-CD1 4.11Å; F413-F416 WeakPolarHBondContact O-CB 2.97Å; F413-F416 PolarHBondContact O-N 2.88Å; F413-F416 VanDerWaalsContact O-N 3.13Å; Q414-F416 PolarHBondContact O-N 3.36Å; F416-A419 PolarHBondContact O-N 2.92Å; F416-I420 HydrophobicContact CD1-CD1 4.11Å; F416-I420 HydrophobicContact CD2-CD1 4.26Å; F416-I420 HydrophobicContact CE1-CD1 3.64Å; F416-I420 HydrophobicContact CE2-CD1 3.81Å; F416-I420 HydrophobicContact CE2-CG1 4.46Å; F416-I420 HydrophobicContact CG-CD1 4.42Å; F416-I420 HydrophobicContact CZ-CD1 3.49Å; F416-I420 VanDerWaalsContact CZ-CD1 3.49Å; F416-I420 WeakPolarHBondContact O-CG1 3.48Å; F416-I420 PolarHBondContact O-N 3.37Å
417L91.5Very high90.7Very high59 Ų5937.6 Ų37.631%0.30920%0.199SC..Hα-helixtrans-62.6-45.8175.7-63.3175000111.3P378 F413 Q414 A419 I420 I421P378-L417 HydrophobicContact CB-CD1 4.16Å; P378-L417 HydrophobicContact CG-CD1 4.45Å; F413-L417 PolarHBondContact O-N 2.89Å; F413-L417 VanDerWaalsContact O-N 3.1Å; Q414-L417 WeakPolarHBondContact O-CB 3.15Å; Q414-L417 PolarHBondContact O-N 3.05Å; L417-A419 VanDerWaalsContact C-N 3.35Å; L417-A419 PolarHBondContact O-N 2.03Å; L417-I420 WeakPolarHBondContact O-CB 3.25Å; L417-I420 PolarHBondContact O-N 3.23Å; L417-I421 WeakPolarHBondContact O-CD1 3.36Å; L417-I421 WeakPolarHBondContact O-CG1 3.49Å; L417-I421 PolarHBondContact O-N 3.28Å
418V91.4Very high90.9Very high1 Ų140 Ų401%0.00621%0.211CC..Hα-helixtrans-64-38.4178-178.30000111.5L192 F193 Y196 L379 Q414 G415 I421 Y422L192-V418 HydrophobicContact CD2-CG1 4.08Å; F193-V418 HydrophobicContact CE1-CG1 3.94Å; Y196-V418 HydrophobicContact CE2-CG2 4.45Å; L379-V418 HydrophobicContact CG-CG2 4.19Å; Q414-V418 WeakPolarHBondContact O-CG2 3.07Å; Q414-V418 PolarHBondContact O-N 2.9Å; G415-V418 PolarHBondContact O-N 2.93Å; V418-I421 PolarHBondContact O-N 3.33Å; V418-Y422 HydrophobicContact CG1-CD2 3.62Å; V418-Y422 HydrophobicContact CG1-CE2 4.08Å; V418-Y422 PolarHBondContact O-N 3.35Å
419A93.5Very high91.1Very high0 Ų037.3 Ų37.30%020%0.198CC..Hα-helixtrans-63.1-40.3174.100000112.6I168 A171 F193 G415 F416 L417 C423 F424I168-A419 HydrophobicContact CG1-CB 4.04Å; A171-A419 HydrophobicContact CB-CB 4.36Å; F193-A419 HydrophobicContact CE1-CB 4.26Å; G415-A419 WeakPolarHBondContact O-CB 3.01Å; G415-A419 PolarHBondContact O-N 3.38Å; F416-A419 PolarHBondContact O-N 2.92Å; L417-A419 VanDerWaalsContact C-N 3.35Å; L417-A419 PolarHBondContact O-N 2.03Å; A419-C423 WeakPolarHBondContact O-CA 3.27Å; A419-C423 VanDerWaalsContact O-CB 3.3Å; A419-C423 WeakPolarHBondContact O-CB 3.36Å; A419-C423 PolarHBondContact O-N 2.86Å; A419-C423 VanDerWaalsContact O-N 3.09Å; A419-F424 HydrophobicContact CB-CE2 4.16Å; A419-F424 WeakPolarHBondContact O-CD2 3.3Å; A419-F424 PolarHBondContact O-N 3.41Å; A419-F424 VanDerWaalsContact O-N 3.15Å
420I91.7Very high91.2Very high52 Ų5238.4 Ų38.427%0.26720%0.201SC..Iπ-helixtrans-60.6-52.1171.5-72.3169.7000110.8F416 L417 F424 C425F416-I420 HydrophobicContact CD1-CD1 4.11Å; F416-I420 HydrophobicContact CD2-CD1 4.26Å; F416-I420 HydrophobicContact CE1-CD1 3.64Å; F416-I420 HydrophobicContact CE2-CD1 3.81Å; F416-I420 HydrophobicContact CE2-CG1 4.46Å; F416-I420 HydrophobicContact CG-CD1 4.42Å; F416-I420 HydrophobicContact CZ-CD1 3.49Å; F416-I420 VanDerWaalsContact CZ-CD1 3.49Å; F416-I420 WeakPolarHBondContact O-CG1 3.48Å; F416-I420 PolarHBondContact O-N 3.37Å; L417-I420 WeakPolarHBondContact O-CB 3.25Å; L417-I420 PolarHBondContact O-N 3.23Å; I420-F424 HydrophobicContact CG1-CD2 4.13Å; I420-F424 PolarHBondContact O-N 2.03Å; I420-C425 VanDerWaalsContact O-CB 3.32Å; I420-C425 WeakPolarHBondContact O-CB 3.46Å; I420-C425 PolarHBondContact O-N 2.84Å
421I88.9Confident91.5Very high47 Ų4738.1 Ų38.124%0.24121%0.21CC..Iπ-helixtrans-65.7-51-172-65.3158.7000111.6V375 L379 L417 V418V375-I421 HydrophobicContact CG1-CD1 3.68Å; V375-I421 HydrophobicContact CG1-CG1 3.86Å; V375-I421 HydrophobicContact CG1-CG2 4.01Å; L379-I421 HydrophobicContact CD1-CD1 4.22Å; L379-I421 HydrophobicContact CD1-CG2 4.02Å; L417-I421 WeakPolarHBondContact O-CD1 3.36Å; L417-I421 WeakPolarHBondContact O-CG1 3.49Å; L417-I421 PolarHBondContact O-N 3.28Å; V418-I421 PolarHBondContact O-N 3.33Å
422Y87.7Confident91.7Very high34 Ų3438.5 Ų38.513%0.13321%0.211CC..Iπ-helixtrans-90.4-23-172.4-71.4-35.8000115.4H189 E265 L379 V418 N426H189-Y422 AromaticContact CE1-CD1 3.86Å; H189-Y422 AromaticContact CE1-CD2 3.67Å; H189-Y422 AromaticContact CE1-CE1 3.7Å; H189-Y422 AromaticContact CE1-CE2 3.49Å; H189-Y422 VanDerWaalsContact CE1-CE2 3.49Å; H189-Y422 WeakPolarHBondContact CE1-CE2 3.46Å; H189-Y422 AromaticContact CE1-CG 3.84Å; H189-Y422 AromaticContact CE1-CZ 3.48Å; H189-Y422 VanDerWaalsContact CE1-CZ 3.48Å; H189-Y422 AromaticContact ND1-CD2 3.56Å; H189-Y422 AromaticContact ND1-CE2 3.56Å; H189-Y422 AromaticContact NE2-CD1 3.95Å; E265-Y422 VanDerWaalsContact OE1-CE2 3.25Å; E265-Y422 WeakPolarHBondContact OE1-CE2 3.04Å; E265-Y422 WeakPolarHBondContact OE2-CE2 3.37Å; L379-Y422 HydrophobicContact CD1-CD2 4.39Å; L379-Y422 HydrophobicContact CD1-CE1 4.11Å; L379-Y422 HydrophobicContact CD1-CE2 3.69Å; L379-Y422 HydrophobicContact CD2-CE2 3.98Å; L379-Y422 VanDerWaalsContact CD2-OH 3.31Å; L379-Y422 WeakPolarHBondContact CD2-OH 3.25Å; L379-Y422 HydrophobicContact CG-CE2 4.12Å; V418-Y422 HydrophobicContact CG1-CD2 3.62Å; V418-Y422 HydrophobicContact CG1-CE2 4.08Å; V418-Y422 PolarHBondContact O-N 3.35Å; Y422-N426 VanDerWaalsContact O-CB 3.28Å; Y422-N426 WeakPolarHBondContact O-CB 3.35Å; Y422-N426 PolarHBondContact O-ND2 2.98Å; Y422-N426 VanDerWaalsContact O-ND2 3.1Å
423C92.2Very high91.7Very high0 Ų041.7 Ų41.70%023%0.228CC..Iπ-helixtrans-108.6-64.4177.4-173.10000112.6A171 F193 A419 N426 V429A171-C423 HydrophobicContact CB-CB 3.64Å; F193-C423 HydrophobicContact CZ-CB 4.41Å; A419-C423 WeakPolarHBondContact O-CA 3.27Å; A419-C423 VanDerWaalsContact O-CB 3.3Å; A419-C423 WeakPolarHBondContact O-CB 3.36Å; A419-C423 PolarHBondContact O-N 2.86Å; A419-C423 VanDerWaalsContact O-N 3.09Å; C423-N426 WeakPolarHBondContact O-CB 3.49Å; C423-N426 PolarHBondContact O-N 3.45Å; C423-V429 WeakPolarHBondContact O-CB 3.49Å
424F92.6Very high91.7Very high69 Ų6946.8 Ų46.830%0.30325%0.25SC..Iπ-helixtrans-73.6-34.6-167.2-56-52.8000114.4S167 V170 A171 I174 A419 I420 Q430S167-F424 WeakPolarHBondContact O-CZ 3.28Å; V170-F424 HydrophobicContact CB-CZ 4.32Å; V170-F424 HydrophobicContact CG1-CE1 4.01Å; V170-F424 HydrophobicContact CG1-CZ 4.12Å; A171-F424 HydrophobicContact CB-CZ 4.35Å; I174-F424 HydrophobicContact CD1-CD1 4.47Å; I174-F424 HydrophobicContact CD1-CE1 3.92Å; A419-F424 HydrophobicContact CB-CE2 4.16Å; A419-F424 WeakPolarHBondContact O-CD2 3.3Å; A419-F424 PolarHBondContact O-N 3.41Å; A419-F424 VanDerWaalsContact O-N 3.15Å; I420-F424 HydrophobicContact CG1-CD2 4.13Å; I420-F424 PolarHBondContact O-N 2.03Å; F424-Q430 PolarHBondContact O-NE2 3.04Å
425C90.9Very high91.8Very high81 Ų8151.3 Ų51.355%0.54727%0.269SS..THydrogen-bonded Turntrans-88-2.7175.8-70.70000113.9I420 G427I420-C425 VanDerWaalsContact O-CB 3.32Å; I420-C425 WeakPolarHBondContact O-CB 3.46Å; I420-C425 PolarHBondContact O-N 2.84Å; C425-G427 PolarHBondContact O-N 3.11Å
426N89.7Confident91.6Very high28 Ų2852.8 Ų52.815%0.1528%0.28CS..  trans-76.9120-176.5-177.5-20000111.3Y422 C423 E428 V429 Q430Y422-N426 VanDerWaalsContact O-CB 3.28Å; Y422-N426 WeakPolarHBondContact O-CB 3.35Å; Y422-N426 PolarHBondContact O-ND2 2.98Å; Y422-N426 VanDerWaalsContact O-ND2 3.1Å; C423-N426 WeakPolarHBondContact O-CB 3.49Å; C423-N426 PolarHBondContact O-N 3.45Å; N426-E428 VanDerWaalsContact C-N 3.28Å; N426-E428 PolarHBondContact O-N 3.1Å; N426-E428 WeakPolarHBondContact OD1-CB 3.48Å; N426-E428 PolarHBondContact OD1-N 2.85Å; N426-V429 HydrophobicContact CB-CB 4.19Å; N426-V429 HydrophobicContact CB-CG2 3.76Å; N426-V429 WeakPolarHBondContact O-CB 3.07Å; N426-V429 PolarHBondContact O-N 3.18Å; N426-V429 VanDerWaalsContact O-N 3.09Å; N426-Q430 WeakPolarHBondContact O-CG 3.18Å; N426-Q430 PolarHBondContact O-N 2.97Å
427G89.4Confident91.5Very high47 Ų4758.4 Ų58.449%0.48530%0.299SS..Hα-helixtrans-60.5-31.3-176.800000114.5C425 A431C425-G427 PolarHBondContact O-N 3.11Å; G427-A431 VanDerWaalsContact O-CB 3.23Å; G427-A431 WeakPolarHBondContact O-CB 3.26Å; G427-A431 PolarHBondContact O-N 3.43Å
428E90.6Very high91.6Very high87 Ų8758.4 Ų58.441%0.40730%0.304SS..Hα-helixtrans-64.3-44.5174.7-61.6168.9-144.800110.9L181 R185 N426 A431 E432L181-E428 HydrophobicContact CD2-CB 4.14Å; R185-E428 IonicContact CZ-OE1 2.92Å; R185-E428 IonicContact CZ-OE2 3.89Å; R185-E428 IonicContact NH1-OE1 2.78Å; R185-E428 PolarHBondContact NH1-OE1 3.47Å; R185-E428 IonicContact NH2-OE1 3.9Å; R185-E428 PolarHBondContact NH2-OE1 2.91Å; R185-E428 IonicContact NH2-OE2 2.7Å; R185-E428 PolarHBondContact NH2-OE2 3.11Å; N426-E428 VanDerWaalsContact C-N 3.28Å; N426-E428 PolarHBondContact O-N 3.1Å; N426-E428 WeakPolarHBondContact OD1-CB 3.48Å; N426-E428 PolarHBondContact OD1-N 2.85Å; E428-A431 PolarHBondContact O-N 3.36Å; E428-E432 PolarHBondContact O-N 2.89Å; E428-E432 VanDerWaalsContact O-N 3.14Å
429V93.2Very high91.5Very high2 Ų263.9 Ų63.91%0.01233%0.325CS..Hα-helixtrans-67.1-48.8179.7-177.30000110I174 L175 L181 C423 N426 A431 E432 I433I174-V429 HydrophobicContact CG2-CG1 3.61Å; L175-V429 HydrophobicContact CD2-CG2 4.22Å; L181-V429 HydrophobicContact CD1-CG2 3.97Å; C423-V429 WeakPolarHBondContact O-CB 3.49Å; N426-V429 HydrophobicContact CB-CB 4.19Å; N426-V429 HydrophobicContact CB-CG2 3.76Å; N426-V429 WeakPolarHBondContact O-CB 3.07Å; N426-V429 PolarHBondContact O-N 3.18Å; N426-V429 VanDerWaalsContact O-N 3.09Å; V429-A431 VanDerWaalsContact C-N 3.29Å; V429-A431 PolarHBondContact O-N 2.92Å; V429-E432 PolarHBondContact O-N 3.17Å; V429-I433 HydrophobicContact CG1-CD1 3.74Å; V429-I433 HydrophobicContact CG1-CG1 4.37Å; V429-I433 WeakPolarHBondContact O-CB 3.48Å; V429-I433 VanDerWaalsContact O-CG1 3.3Å; V429-I433 WeakPolarHBondContact O-CG1 3.44Å; V429-I433 PolarHBondContact O-N 3.17Å
430Q92.4Very high91.4Very high103 Ų10372.7 Ų72.748%0.48136%0.358SS..Hα-helixtrans-59.3-38.9176.9-68.5-177.43.200112.2F424 N426 K434F424-Q430 PolarHBondContact O-NE2 3.04Å; N426-Q430 WeakPolarHBondContact O-CG 3.18Å; N426-Q430 PolarHBondContact O-N 2.97Å; Q430-K434 VanDerWaalsContact O-CB 3.25Å; Q430-K434 WeakPolarHBondContact O-CB 3.02Å; Q430-K434 PolarHBondContact O-N 3.44Å
431A93.4Very high91.5Very high57 Ų5772.5 Ų72.547%0.47136%0.359SS..Hα-helixtrans-65.6-49.2177.800000112.5G427 E428 V429 K434 K435G427-A431 VanDerWaalsContact O-CB 3.23Å; G427-A431 WeakPolarHBondContact O-CB 3.26Å; G427-A431 PolarHBondContact O-N 3.43Å; E428-A431 PolarHBondContact O-N 3.36Å; V429-A431 VanDerWaalsContact C-N 3.29Å; V429-A431 PolarHBondContact O-N 2.92Å; A431-K434 PolarHBondContact O-N 2.95Å; A431-K435 WeakPolarHBondContact O-CB 3.34Å; A431-K435 PolarHBondContact O-N 3.1Å
432E93.1Very high91.6Very high20 Ų2074.9 Ų74.99%0.09337%0.372CS..Hα-helixtrans-70.3-31.5176.7-83.1-63.9156.100112.9F178 R180 E428 V429 K435 S436 R439F178-E432 HydrophobicContact CD1-CB 4.48Å; R180-E432 HydrophobicContact CB-CG 4.44Å; R180-E432 WeakPolarHBondContact CD-OE1 3.41Å; R180-E432 IonicContact NE-OE1 2.8Å; E428-E432 PolarHBondContact O-N 2.89Å; E428-E432 VanDerWaalsContact O-N 3.14Å; V429-E432 PolarHBondContact O-N 3.17Å; E432-K435 WeakPolarHBondContact OE1-CD 3.34Å; E432-K435 WeakPolarHBondContact OE1-CE 3.35Å; E432-K435 IonicContact OE1-NZ 2.66Å; E432-K435 PolarHBondContact OE1-NZ 3.25Å; E432-S436 WeakPolarHBondContact O-CB 3.48Å; E432-S436 PolarHBondContact O-N 2.71Å; E432-R439 IonicContact OE2-CZ 3.32Å; E432-R439 IonicContact OE2-NH1 3.55Å; E432-R439 IonicContact OE2-NH2 3.86Å; E432-R439 PolarHBondContact OE2-NH2 3.08Å
433I91.9Very high91.6Very high67 Ų6776 Ų7634%0.34439%0.389SS..Hα-helixtrans-61.8-52.7170.3-71.5174000110.5I174 F178 V429 K435 S436 W437I174-I433 HydrophobicContact CD1-CD1 4.35Å; I174-I433 HydrophobicContact CG2-CD1 4.34Å; F178-I433 HydrophobicContact CE2-CG1 3.85Å; F178-I433 HydrophobicContact CZ-CG1 4.2Å; V429-I433 HydrophobicContact CG1-CD1 3.74Å; V429-I433 HydrophobicContact CG1-CG1 4.37Å; V429-I433 WeakPolarHBondContact O-CB 3.48Å; V429-I433 VanDerWaalsContact O-CG1 3.3Å; V429-I433 WeakPolarHBondContact O-CG1 3.44Å; V429-I433 PolarHBondContact O-N 3.17Å; I433-K435 VanDerWaalsContact C-N 3.29Å; I433-K435 PolarHBondContact O-N 2.85Å; I433-S436 WeakPolarHBondContact O-CB 3.27Å; I433-S436 PolarHBondContact O-N 2.85Å; I433-S436 VanDerWaalsContact O-N 3.1Å; I433-W437 WeakPolarHBondContact O-CB 3.37Å; I433-W437 PolarHBondContact O-N 2.8Å
434K92.8Very high91.4Very high163 Ų16380.9 Ų80.971%0.70941%0.414SS*.Hα-helixtrans-58.4-40.7179.2-176.8173.6-178.6175.40112Q430 A431 S438Q430-K434 VanDerWaalsContact O-CB 3.25Å; Q430-K434 WeakPolarHBondContact O-CB 3.02Å; Q430-K434 PolarHBondContact O-N 3.44Å; A431-K434 PolarHBondContact O-N 2.95Å; K434-S438 WeakPolarHBondContact O-CB 3.46Å; K434-S438 PolarHBondContact O-N 2.98Å
435K92.8Very high91.2Very high95 Ų9580.4 Ų80.441%0.41342%0.415SS..Hα-helixtrans-69.3-37.6176-171.6179.1173.8-173.60112.3A431 E432 I433 R439A431-K435 WeakPolarHBondContact O-CB 3.34Å; A431-K435 PolarHBondContact O-N 3.1Å; E432-K435 WeakPolarHBondContact OE1-CD 3.34Å; E432-K435 WeakPolarHBondContact OE1-CE 3.35Å; E432-K435 IonicContact OE1-NZ 2.66Å; E432-K435 PolarHBondContact OE1-NZ 3.25Å; I433-K435 VanDerWaalsContact C-N 3.29Å; I433-K435 PolarHBondContact O-N 2.85Å; K435-R439 WeakPolarHBondContact O-CB 3.46Å; K435-R439 VanDerWaalsContact O-CG 3.27Å; K435-R439 WeakPolarHBondContact O-CG 3.17Å; K435-R439 PolarHBondContact O-N 2.75Å; K435-R439 PolarHBondContact O-NE 3.42Å
436S90.4Very high90.9Very high32 Ų3283.6 Ų83.622%0.22442%0.419CS..Hα-helixtrans-66.4-45.1173.9-157.70000111.8E432 I433 R439 R440E432-S436 WeakPolarHBondContact O-CB 3.48Å; E432-S436 PolarHBondContact O-N 2.71Å; I433-S436 WeakPolarHBondContact O-CB 3.27Å; I433-S436 PolarHBondContact O-N 2.85Å; I433-S436 VanDerWaalsContact O-N 3.1Å; S436-R439 VanDerWaalsContact CA-NH2 3.34Å; S436-R439 PolarHBondContact O-N 2.69Å; S436-R440 WeakPolarHBondContact O-CB 3.48Å; S436-R440 PolarHBondContact O-N 3.07Å
437W92Very high90.4Very high182 Ų18288.7 Ų88.769%0.68944%0.441SS*.Hα-helixtrans-60.9-49.4175-172.481000111.3I433 R439 R440 T441I433-W437 WeakPolarHBondContact O-CB 3.37Å; I433-W437 PolarHBondContact O-N 2.8Å; W437-R439 PolarHBondContact O-N 2.63Å; W437-R440 PolarHBondContact O-N 2.93Å; W437-T441 PolarHBondContact O-N 2.7Å; W437-T441 PolarHBondContact O-OG1 2.94Å; W437-T441 VanDerWaalsContact O-OG1 3.11Å
438S92.1Very high89.8Confident59 Ų5994.7 Ų94.741%0.41345%0.449SS..Hα-helixtrans-55.4-47.6174.8174.40000112.9K434 R440 T441 L442K434-S438 WeakPolarHBondContact O-CB 3.46Å; K434-S438 PolarHBondContact O-N 2.98Å; S438-R440 VanDerWaalsContact C-N 3.32Å; S438-R440 PolarHBondContact O-N 2.88Å; S438-T441 PolarHBondContact O-N 3.36Å; S438-L442 WeakPolarHBondContact O-CG 3.45Å; S438-L442 PolarHBondContact O-N 2.84Å
439R91.2Very high89.2Confident116 Ų11697.9 Ų97.944%0.43846%0.461SS..Hα-helixtrans-57.8-42.4173.7-73.3176.1-64.9-137.8-3.7112E432 K435 S436 W437 A443E432-R439 IonicContact OE2-CZ 3.32Å; E432-R439 IonicContact OE2-NH1 3.55Å; E432-R439 IonicContact OE2-NH2 3.86Å; E432-R439 PolarHBondContact OE2-NH2 3.08Å; K435-R439 WeakPolarHBondContact O-CB 3.46Å; K435-R439 VanDerWaalsContact O-CG 3.27Å; K435-R439 WeakPolarHBondContact O-CG 3.17Å; K435-R439 PolarHBondContact O-N 2.75Å; K435-R439 PolarHBondContact O-NE 3.42Å; S436-R439 VanDerWaalsContact CA-NH2 3.34Å; S436-R439 PolarHBondContact O-N 2.69Å; W437-R439 PolarHBondContact O-N 2.63Å; R439-A443 WeakPolarHBondContact O-CB 3.19Å; R439-A443 PolarHBondContact O-N 2.95Å
440R91.3Very high88.2Confident185 Ų185101.5 Ų101.570%0.69849%0.491SS*.Hα-helixtrans-70.1-40.8-178.9-168.6171.9-177.2162.1-0.4112.2S436 W437 S438 A443 L444S436-R440 WeakPolarHBondContact O-CB 3.48Å; S436-R440 PolarHBondContact O-N 3.07Å; W437-R440 PolarHBondContact O-N 2.93Å; S438-R440 VanDerWaalsContact C-N 3.32Å; S438-R440 PolarHBondContact O-N 2.88Å; R440-A443 PolarHBondContact O-N 2.86Å; R440-L444 HydrophobicContact CG-CD1 4.39Å; R440-L444 VanDerWaalsContact O-CG 3.3Å; R440-L444 WeakPolarHBondContact O-CG 3.44Å; R440-L444 PolarHBondContact O-N 2.85Å
441T92.9Very high86.8Confident48 Ų48105.9 Ų105.929%0.29450%0.503SS..Hα-helixtrans-61.9-49.2174.6-570000110.8W437 S438 A443 L444 D445W437-T441 PolarHBondContact O-N 2.7Å; W437-T441 PolarHBondContact O-OG1 2.94Å; W437-T441 VanDerWaalsContact O-OG1 3.11Å; S438-T441 PolarHBondContact O-N 3.36Å; T441-A443 VanDerWaalsContact C-N 3.33Å; T441-A443 PolarHBondContact O-N 3Å; T441-L444 WeakPolarHBondContact O-CB 3.49Å; T441-L444 PolarHBondContact O-N 2.8Å; T441-L444 VanDerWaalsContact O-N 3.08Å; T441-D445 PolarHBondContact O-N 3.45Å
442L90.7Very high85.2Confident97 Ų97107.6 Ų107.651%0.50851%0.512SS..Hα-helixtrans-57.7-43.5175.7-70.9170000112.3S438 L444 D445 F446S438-L442 WeakPolarHBondContact O-CG 3.45Å; S438-L442 PolarHBondContact O-N 2.84Å; L442-L444 VanDerWaalsContact C-N 3.33Å; L442-L444 PolarHBondContact O-N 3.2Å; L442-D445 PolarHBondContact O-N 2.96Å; L442-F446 VanDerWaalsContact O-CD2 3.28Å; L442-F446 WeakPolarHBondContact O-CD2 3.49Å; L442-F446 PolarHBondContact O-N 3.34Å
443A88.7Confident83.5Confident59 Ų59109.1 Ų109.149%0.48853%0.533SS..Hα-helixtrans-64.3-35.5176.400000113R439 R440 T441 K447R439-A443 WeakPolarHBondContact O-CB 3.19Å; R439-A443 PolarHBondContact O-N 2.95Å; R440-A443 PolarHBondContact O-N 2.86Å; T441-A443 VanDerWaalsContact C-N 3.33Å; T441-A443 PolarHBondContact O-N 3Å; A443-K447 WeakPolarHBondContact O-CB 3.3Å; A443-K447 PolarHBondContact O-N 2.79Å
444L87.5Confident81.7Confident101 Ų101109.9 Ų109.953%0.52954%0.544SS..Hα-helixtrans-69.5-38.8173.8-72.2169.8000112R440 T441 L442 K447 R448R440-L444 HydrophobicContact CG-CD1 4.39Å; R440-L444 VanDerWaalsContact O-CG 3.3Å; R440-L444 WeakPolarHBondContact O-CG 3.44Å; R440-L444 PolarHBondContact O-N 2.85Å; T441-L444 WeakPolarHBondContact O-CB 3.49Å; T441-L444 PolarHBondContact O-N 2.8Å; T441-L444 VanDerWaalsContact O-N 3.08Å; L442-L444 VanDerWaalsContact C-N 3.33Å; L442-L444 PolarHBondContact O-N 3.2Å; L444-K447 CarbonylContact O-C 3.6Å; L444-K447 PolarHBondContact O-N 3.43Å; L444-R448 WeakPolarHBondContact O-CB 2.98Å; L444-R448 PolarHBondContact O-N 2.95Å
445D87.7Confident79.6Confident59 Ų59109.2 Ų109.232%0.31655%0.548SS..Hα-helixtrans-68.5-39.3176.3-74.2-35.9000112.3T441 L442 R448 K449T441-D445 PolarHBondContact O-N 3.45Å; L442-D445 PolarHBondContact O-N 2.96Å; D445-R448 PolarHBondContact O-N 2.9Å; D445-R448 IonicContact OD1-NH1 3.49Å; D445-K449 WeakPolarHBondContact O-CB 3.33Å; D445-K449 WeakPolarHBondContact O-CG 3.37Å; D445-K449 PolarHBondContact O-N 3.41Å
446F84.6Confident77.6Confident148 Ų148110.5 Ų110.565%0.64956%0.564SS**Hα-helixtrans-60.9-44.9168.8-85.6-69000111.5L442 R448 K449 A450L442-F446 VanDerWaalsContact O-CD2 3.28Å; L442-F446 WeakPolarHBondContact O-CD2 3.49Å; L442-F446 PolarHBondContact O-N 3.34Å; F446-R448 VanDerWaalsContact C-N 3.32Å; F446-R448 PolarHBondContact O-N 3.17Å; F446-K449 PolarHBondContact O-N 3.48Å; F446-A450 WeakPolarHBondContact O-CB 3.32Å; F446-A450 PolarHBondContact O-N 3.45Å
447K79.1Confident75.4Confident136 Ų136119.2 Ų119.259%0.59159%0.593SS**Hα-helixtrans-65.1-33.5177.6-167.9173.3-175.5176.80112.7A443 L444 R451A443-K447 WeakPolarHBondContact O-CB 3.3Å; A443-K447 PolarHBondContact O-N 2.79Å; L444-K447 CarbonylContact O-C 3.6Å; L444-K447 PolarHBondContact O-N 3.43Å; K447-R451 PolarHBondContact O-N 2.02Å
448R77.8Confident72.9Confident173 Ų173115.5 Ų115.565%0.65360%0.595SS**Hα-helixtrans-68.5-50.3173.1178.3-178.2-88.4152.4-13.8110.9L444 D445 F446 A450 R451 S452L444-R448 WeakPolarHBondContact O-CB 2.98Å; L444-R448 PolarHBondContact O-N 2.95Å; D445-R448 PolarHBondContact O-N 2.9Å; D445-R448 IonicContact OD1-NH1 3.49Å; F446-R448 VanDerWaalsContact C-N 3.32Å; F446-R448 PolarHBondContact O-N 3.17Å; R448-A450 VanDerWaalsContact C-N 3.34Å; R448-A450 PolarHBondContact O-N 3.45Å; R448-R451 PolarHBondContact O-N 2.96Å; R448-S452 PolarHBondContact O-N 2.75Å
449K78.1Confident70.8Confident154 Ų154123.6 Ų123.667%0.6762%0.618SS**Hα-helixtrans-58.7-43.4176.9-73.9176.1179-1790112.1D445 F446 R451 S452 G453D445-K449 WeakPolarHBondContact O-CB 3.33Å; D445-K449 WeakPolarHBondContact O-CG 3.37Å; D445-K449 PolarHBondContact O-N 3.41Å; F446-K449 PolarHBondContact O-N 3.48Å; K449-R451 VanDerWaalsContact C-N 3.28Å; K449-R451 PolarHBondContact O-N 3.44Å; K449-S452 PolarHBondContact O-N 2.81Å; K449-G453 PolarHBondContact O-N 2.92Å
450A71.5Confident68.2Low78 Ų78121 Ų12165%0.64563%0.628SS**Hα-helixtrans-62.5-31.8174.900000113.3F446 R448F446-A450 WeakPolarHBondContact O-CB 3.32Å; F446-A450 PolarHBondContact O-N 3.45Å; R448-A450 VanDerWaalsContact C-N 3.34Å; R448-A450 PolarHBondContact O-N 3.45Å
451R64.1Low66.1Low194 Ų194118.1 Ų118.173%0.73263%0.634SS**Hα-helixtrans-76.2-37.9175-127.3173.4177.880.7-3.7112.6K447 R448 K449K447-R451 PolarHBondContact O-N 2.02Å; R448-R451 PolarHBondContact O-N 2.96Å; K449-R451 VanDerWaalsContact C-N 3.28Å; K449-R451 PolarHBondContact O-N 3.44Å
452S59Low64Low94 Ų94124.8 Ų124.866%0.65766%0.664SS**Hα-helixtrans-73-26.3176.4-66.40000113.7R448 K449 S454R448-S452 PolarHBondContact O-N 2.75Å; K449-S452 PolarHBondContact O-N 2.81Å; S452-S454 PolarHBondContact O-N 2.95Å; S452-S454 VanDerWaalsContact O-N 3.15Å
453G58Low61.5Low51 Ų51125.7 Ų125.753%0.52667%0.673SS.*G310 helixtrans-69-4.2179.500000115.7K449 N455K449-G453 PolarHBondContact O-N 2.92Å; G453-N455 VanDerWaalsContact C-N 3.34Å; G453-N455 PolarHBondContact O-N 3.05Å
454S52.8Low59.2Low83 Ų83127.6 Ų127.658%0.5868%0.682SS**G310 helixtrans-80.3-6.1-171.9-163.50000115.4S452S452-S454 PolarHBondContact O-N 2.95Å; S452-S454 VanDerWaalsContact O-N 3.15Å
455N50.2Low56.8Low150 Ų150131 Ų13180%0.80270%0.695SS**G310 helixtrans-113.615.5-169.3-9434.2000115.6G453G453-N455 VanDerWaalsContact C-N 3.34Å; G453-N455 PolarHBondContact O-N 3.05Å
456T49.7Very low54.4Low121 Ų121134 Ų13474%0.74272%0.716SS**  trans-142.558.7175.7-36.60000113.8S458T456-S458 VanDerWaalsContact C-N 3.33Å; T456-S458 PolarHBondContact O-N 3.21Å
457Y44.2Very low52.1Low215 Ų215132.8 Ų132.884%0.84373%0.726SS**  trans-86.576.2158-78.6-74.4000110
458S40.3Very low50Low104 Ų104132 Ų13273%0.72773%0.732SS**  trans-95122.4163.4-168.90000108.8T456 G460T456-S458 VanDerWaalsContact C-N 3.33Å; T456-S458 PolarHBondContact O-N 3.21Å; S458-G460 PolarHBondContact O-N 3.09Å
459Y47.7Very low47.8Very low229 Ų229129.4 Ų129.490%0.89874%0.736SS**  trans-69.6125173.5-92.7-106.3000109.9
460G36.3Very low45.5Very low63 Ų63128.8 Ų128.865%0.64974%0.74SS**  trans-123.2138.2167.300000109.4S458S458-G460 PolarHBondContact O-N 3.09Å
461P48.2Very low43.7Very low124 Ų124132.1 Ų132.181%0.80575%0.752SS**  trans-71.1148-166.1-20.133.4000114.4V463P461-V463 PolarHBondContact O-N 2.89Å
462M46.8Very low42.3Very low188 Ų188129.1 Ų129.193%0.92676%0.755SS**  trans-65.4123.8158.6-71.2-179.2171.300109.3
463V39.7Very low41.1Very low116 Ų116129.5 Ų129.570%0.70376%0.764SS**  trans-101.8101164.5-179.40000108.2P461P461-V463 PolarHBondContact O-N 2.89Å
464S39.2Very low40Very low98 Ų98139.1 Ų139.169%0.68578%0.784SS**  trans-85112.5179.252.10000111.4
465H38.2Very low39Very low173 Ų173138.6 Ų138.680%0.80179%0.792SS**  trans-106.383.9166.2-79.5-71.8000110.9
466T37.7Very low38.9Very low123 Ų123136.8 Ų136.876%0.75579%0.789SS**  trans-95.798.8164.548.70000109.5
467S34.8Very low38Very low121 Ų121138.9 Ų138.985%0.84679%0.794SS**  trans-88.7129.4161.643.50000109.4
468V34.7Very low37.3Very low119 Ų119132.3 Ų132.372%0.72179%0.785SS**  trans-126.4162.9179.31800000107.8
469T32.3Very low36.8Very low120 Ų120133.3 Ų133.374%0.73679%0.786SS**  trans78.3136.1-175.778.50000113.3
470N31.1Very low35.9Very low141 Ų141130 Ų13075%0.75478%0.778SS**  cis-143.9144.9-0.7-90.1-41.5000111.1
471V33.6Very low35.4Very low147 Ų147133.6 Ų133.689%0.89178%0.782SS**  trans-140.1129.7148.7-176.40000108.1
472T34.3Very low34.5Very low132 Ų132133.1 Ų133.181%0.8178%0.777SS**  trans-88.3149.7-179.243.90000112.1
473A34.3Very low33.6Very low102 Ų102129.8 Ų129.884%0.84377%0.768SS**  trans-82.9133.3-178.500000113
474R34.5Very low33.1Very low252 Ų252134.3 Ų134.395%0.95177%0.772SS**  trans-159.4128.5156.6-102.5167.2-176.9149.11.2108
475G30.9Very low32.6Very low72 Ų72136.5 Ų136.574%0.74278%0.775SS**  trans-102.8-153.9167.100000110.6
476P48.8Very low32.1Very low113 Ų113131.5 Ų131.573%0.73477%0.77SS**  cis-130.5-157.6-6.939.8-21.3000112.7
477L30Very low32.4Very low164 Ų164131.5 Ų131.586%0.85977%0.772SS**  trans74.4157.9173.7-57.6127.1000117.1
478A28.7Very low32.2Very low78 Ų78132 Ų13265%0.64577%0.77SS**  cis-172.9177.3-35.400000110.7
479V29.9Very low32.6Very low124 Ų124131.9 Ų131.975%0.75277%0.772SS**  trans78111.6154.2175.50000120.5
480H28.8Very low32.5Very low160 Ų160133.2 Ų133.274%0.74178%0.779SS**  trans64144.1144.7-74.6-121.8000120.8
481L26.4Very low32.4Very low139 Ų139134.5 Ų134.573%0.72879%0.786SS**  67.5132.858.5-115.578000112
482T29.2Very low32.3Very low113 Ų113131.3 Ų131.369%0.69378%0.783SS**  cis-157.1161.317.4-32.30000113.3
483T28.1Very low32Very low119 Ų119134.4 Ų134.473%0.7379%0.788SS**  trans-33139.8164.6-27.90000118.8
484R29.4Very low31.9Very low210 Ų210140.4 Ų140.479%0.79279%0.788SS**  167.1143.8112.2-95.3-172.5161.8-134.8-2.6117.8
485L28.1Very low31.6Very low145 Ų145134.8 Ų134.876%0.75978%0.777SS**  trans60.8145.8149.9-89.164.2000122
486G27.9Very low31.7Very low67 Ų67139.2 Ų139.269%0.69178%0.783SS**  trans-106-141.6162.700000110.9
487P43.9Very low31.4Very low124 Ų124140 Ų14081%0.80579%0.789SS**  cis-137.4-144.44.941.5-20.1000113.6
488V30.8Very low31.4Very low131 Ų131135.4 Ų135.479%0.79478%0.781SS**  trans96.7135.5167.8-172.10000117.1
489P43.6Very low31.5Very low117 Ų117142 Ų14276%0.7679%0.79SS**  trans-113165.7-174.642.3-34.2000115.8
490V31Very low31.6Very low147 Ų147142.3 Ų142.389%0.89179%0.792SS**  trans-144.6146.8170.7-174.60000111.6
491N29Very low31.8Very low169 Ų169142.3 Ų142.390%0.90479%0.79SS**  trans-82.9156.3176.2-89-24.4000113.8
492G29.7Very low31.9Very low79 Ų79142.7 Ų142.781%0.81479%0.793SS**  trans-172.7121.5165.800000115.1
493H28.5Very low32Very low198 Ų198140.7 Ų140.792%0.91780%0.795SS**  trans-102.6148174.8-86.9-80.8000112.2
494R31.6Very low32.3Very low227 Ų227140.7 Ų140.786%0.85780%0.799SS**  trans-162.7116148.8-123.2170.8161.9167-6.2116
495N29.5Very low32.3Very low134 Ų134137.1 Ų137.172%0.71780%0.801SS**  trans55.8111.5139.8-56.48.1000124
496L32Very low32.4Very low166 Ų166134.8 Ų134.887%0.86980%0.797SS**  36.3163.1113.6-97.278.7000122.6
497P42.5Very low32.4Very low130 Ų130140.2 Ų140.284%0.84480%0.804SS**  cis-145.9177.832.142.7-22.2000120.5
498G30.5Very low31.9Very low67 Ų67141.1 Ų141.169%0.69180%0.802SS**  trans137.195.1164.400000114.2
499Y30.5Very low31.7Very low215 Ų215140.6 Ų140.684%0.84381%0.805SS**  64.7125.878.8-137.1-116.7000113.4
500V32.1Very low31.2Very low132 Ų132141.5 Ų141.580%0.881%0.808SS**  cis-134.8-172.746.4176.80000112.6
501K33.4Very low31.8Very low159 Ų159139.9 Ų139.969%0.69180%0.8SS**  trans-141149.3-157.6173.8-160.2173.6-171.30114.4
502N29.5Very low31.7Very low147 Ų147136.9 Ų136.979%0.78679%0.792SS**  trans165.3141.3137.1-83.2-13.4000110.3
503G29.6Very low31.6Very low71 Ų71138.9 Ų138.973%0.73279%0.794SS**  cis117.2136.72.500000111.9
504S34.6Very low31.4Very low119 Ų119133.2 Ų133.283%0.83279%0.789SS**  cis-123.6-143.65.139.50000111
505V29.5Very low31.2Very low135 Ų135131.2 Ų131.282%0.81879%0.789SS**  cis-147.7162.513.8-179.40000109.1
506S29.7Very low31Very low97 Ų97133.3 Ų133.368%0.67880%0.795SS**  trans-164.9155.9179.459.60000114.1
507E29.8Very low30.8Very low181 Ų181132.5 Ų132.585%0.84679%0.79SS**  trans-159.4114.7154.7-106.3156-156.600108.3
508N32.2Very low29.9Very low142 Ų142133.8 Ų133.876%0.75979%0.785SS**  69.5115.281.5-66.1-23.8000113.5
509S26.8Very low29.8Very low121 Ų121137.4 Ų137.485%0.84679%0.787SS**  -165.7-170.872.745.90000113.4
510V32.7Very low30.4Very low136 Ų136132 Ų13282%0.82478%0.779SS**  trans-136.5-164-156.7-141.20000113.3
511P44.6Very low30.1Very low112 Ų112134 Ų13473%0.72778%0.779SS**  -132.1-177.4-116.146.3-29000120.1
512S26.6Very low29.8Very low106 Ų106135.4 Ų135.474%0.74179%0.788SS**  trans101.7147.1134.3-162.30000122.6
513S26.6Very low29.8Very low122 Ų122136.2 Ų136.285%0.85379%0.787SS**  trans63.3146.2171.9580000117.5
514G25.7Very low29.6Very low79 Ų79139.6 Ų139.681%0.81478%0.784SS**  cis141.2144.3-0.600000108.4
515Q27.6Very low29.2Very low185 Ų185139.3 Ų139.386%0.86478%0.782SS**  cis-175.2178.2-2.2168.7167.3-9.300105.6
516E25.3Very low29.1Very low177 Ų177136.9 Ų136.983%0.82778%0.776SS**  trans86.1124.4-179.4-51.9-169.3105.500115.1
517L27.4Very low28.9Very low149 Ų149140.9 Ų140.978%0.7878%0.784SS**  81.4135.161.1-123.665000112.6
518H22.7Very low28.7Very low158 Ų158138.5 Ų138.573%0.73178%0.782SS**  cis-147.4156.421.6-156.1-71.7000113.8
519I28.8Very low28.3Very low143 Ų143142.6 Ų142.673%0.73379%0.787SS**  trans-77.5161.2172.532.8166.3000112.5
520P42.3Very low29.2Very low102 Ų102141.5 Ų141.566%0.66278%0.777SS**  -146.1-151.853.638.5-12.6000114.5
521E27.6Very low28.9Very low174 Ų174142.3 Ų142.381%0.81378%0.775SS**  cis-160.5-164.56.7-153.760.6-79.500111.2
522E27.2Very low28.1Very low188 Ų188142.5 Ų142.588%0.87977%0.774SS**  trans95139.1161.7-73.5-159.7135.500123.5
523E28.6Very low28.2Very low164 Ų164145.4 Ų145.477%0.76678%0.776SS**  trans-90-163.9-169-49.4-177.38300113.7
524Q25.7Very low28.2Very low141 Ų141148.9 Ų148.966%0.65978%0.778SS**  cis-165.4158.9-0.3-142.4177.56500110.3
525S25.1Very low28.3Very low113 Ų113153.5 Ų153.579%0.7978%0.776SS**  trans63.8176.9153.9820000119.6
526A27.1Very low28.9Very low85 Ų85149.7 Ų149.770%0.70277%0.768SS**  -160.7150.8-52.500000112.9
527Q26.7Very low29Very low180 Ų180146.6 Ų146.684%0.84176%0.761SS**  trans45.5125.9141.2-168.3175.34.100122.8
528T24.8Very low29.5Very low132 Ų132145.1 Ų145.181%0.8176%0.76SS**  trans164.5163.5131.1-720000114.2
529R24.3Very low29.7Very low228 Ų228143.4 Ų143.486%0.8676%0.761SS**  trans-138.8-172.8-174-124.5-173.4-167.9-163.87.1108.2
530P45.2Very low29.7Very low98 Ų98143.5 Ų143.564%0.63677%0.767SS**  cis-135.2-138.7-14.830-2.8000112
531I26.9Very low29Very low153 Ų153147.1 Ų147.179%0.78578%0.776SS**  trans83.9131.1158.4-69.8163.4000116
532V29Very low29.1Very low116 Ų116148.2 Ų148.270%0.70378%0.78SS**  cis-149-171.92.3102.30000114.5
533E27.5Very low29.3Very low167 Ų167147.4 Ų147.478%0.7878%0.777SS**  trans-50.5165-172.7-62.5148.7122.700118.2
534E26.9Very low29.3Very low194 Ų194151.5 Ų151.591%0.90779%0.785SS**  -156.1172.878.7-121.8-177.2165.200117.2
535K27.3Very low29.7Very low177 Ų177152 Ų15277%0.7779%0.788SS**  trans-153163.3179.5-138.4-154.9159.9-170.30106.6
536P39.8Very low30Very low105 Ų105152.2 Ų152.268%0.68278%0.784SS**  cis-148.8-170.615.645.9-23.9000119.4
537T28.2Very low30.2Very low111 Ų111154.3 Ų154.368%0.68179%0.788SS**  trans-32.6156.5161.345.50000117.8
538P38.7Very low30.6Very low118 Ų118157.6 Ų157.677%0.76681%0.806SS**  -156.5169.262.843.3-22000122
539V25.9Very low30.9Very low123 Ų123158.9 Ų158.975%0.74581%0.806SS**  trans42.1129.5143.3176.80000121.6
540V28Very low31.2Very low145 Ų145155.2 Ų155.288%0.87980%0.803SS**  trans-135.4147.6141.91760000108.5
541E28.7Very low30.4Very low178 Ų178158.4 Ų158.483%0.83281%0.812SS**  trans-126.9142.4-179.5-176.9168.2-155.900107
542E29.8Very low30.6Very low196 Ų196158.7 Ų158.792%0.91681%0.814SS**  trans-124.3134-176.7-166.9174176.400112.1
543E30.5Very low30.7Very low172 Ų172161.4 Ų161.480%0.80482%0.821SS**  trans-104.7149.2-166.7174.4-178-147.700111.4
544R29.4Very low31Very low249 Ų249161 Ų16194%0.9482%0.824SS**  trans-153.5116.1164.4-151.4173.2-148.4-98.3-2113.2
545E33.7Very low31.2Very low153 Ų153158.6 Ų158.672%0.71582%0.818SS**  trans-117.8153.2-177.5-143.2-166.8-155.400112.9
546T30.6Very low31.5Very low116 Ų116157.2 Ų157.271%0.71282%0.821SS**  trans61.7133.4163.370.80000120.6
547V32.9Very low30.9Very low129 Ų129161.6 Ų161.678%0.78283%0.833SS**  -146.3134.6111.4161.90000107.2
548M33.8Very low31.1Very low249 Ų249166.2 Ų166.2100%1.22785%0.847SS**  trans2.60167.6-65175.9-72.300118.9

Retrieved 548 of 548 residues in 1614.7 ms (Link to these results)