A0A087WRC8_MOUSE Loading...

Solute carrier family 39 (zinc transporter), member 10

AlphaFold DB , UniProt , Accession A0A087WRC8, Species MOUSE (Mus musculus, Mouse), Gene Slc39a10, Length 144 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.5Very low49.6Very low241 Ų241146.5 Ų146.5100%1.18782%0.822SS**  0105.60-74.5167.215300105.5
2I42.8Very low50.4Low167 Ų167147.6 Ų147.686%0.85681%0.811SS**  -142.6136.268.1-69.8-153.1000110.7
3Q44Very low50.9Low194 Ų194145.1 Ų145.191%0.90780%0.802SS**  trans-68.4142.3166.7-88.2156.7-29.400110.6
4G41.7Very low51.3Low81 Ų81144.6 Ų144.684%0.83579%0.791SS**  trans-15593170.900000109.1
5S48.4Very low51.8Low107 Ų107145.3 Ų145.375%0.74879%0.791SS**  trans-68.3152.6-177.638.10000114.2
6D51.8Low52.2Low167 Ų167144.6 Ų144.689%0.89378%0.78SS**  trans56.1126.6146.3-79.1-41.1000121
7G49.3Very low52.3Low67 Ų67144.1 Ų144.169%0.69178%0.783SS**  trans-178.350.4165.700000112.7V9G7-V9 VanDerWaalsContact C-N 3.32Å; G7-V9 PolarHBondContact O-N 2.91Å
8K54.1Low52.6Low166 Ų166146.6 Ų146.672%0.72279%0.786SS**  trans-57.8100.1159.7-178.6-167.9180-1570106.6E10K8-E10 WeakPolarHBondContact CE-OE2 3.46Å; K8-E10 HydrophobicContact CG-CB 4.47Å; K8-E10 IonicContact NZ-OE2 3.43Å; K8-E10 PolarHBondContact NZ-OE2 2.84Å; K8-E10 PolarHBondContact O-N 3.16Å
9V58.2Low52.9Low136 Ų136146.4 Ų146.482%0.82478%0.777SS**  trans-74.178.5171-174.70000107.1G7 M11G7-V9 VanDerWaalsContact C-N 3.32Å; G7-V9 PolarHBondContact O-N 2.91Å; V9-M11 PolarHBondContact O-N 2.82Å; V9-M11 VanDerWaalsContact O-N 3.16Å
10E53.1Low53.3Low119 Ų119141.6 Ų141.656%0.55676%0.755SS**  trans-72.998.6163.9-165.9175.2151.800106.1K8 K12K8-E10 WeakPolarHBondContact CE-OE2 3.46Å; K8-E10 HydrophobicContact CG-CB 4.47Å; K8-E10 IonicContact NZ-OE2 3.43Å; K8-E10 PolarHBondContact NZ-OE2 2.84Å; K8-E10 PolarHBondContact O-N 3.16Å; E10-K12 PolarHBondContact O-N 2.81Å
11M57.3Low54.2Low166 Ų166140.8 Ų140.882%0.81875%0.751SS**  trans-69.489.3174.6-162172.1-173.200107.7V9 V13V9-M11 PolarHBondContact O-N 2.82Å; V9-M11 VanDerWaalsContact O-N 3.16Å; M11-V13 HydrophobicContact CG-CG2 4.04Å; M11-V13 PolarHBondContact O-N 2.73Å
12K59.3Low55.3Low160 Ų160135.2 Ų135.270%0.69672%0.724SS**  trans-75.580.9176.5-152.1168.9-174163.40107.6E10 H14E10-K12 PolarHBondContact O-N 2.81Å; K12-H14 HydrophobicContact CG-CB 4.42Å; K12-H14 PolarHBondContact O-N 2.9Å
13V57.1Low56.5Low115 Ų115130.5 Ų130.570%0.69771%0.706SS**  trans-73.964.7163.3-168.70000107.4M11M11-V13 HydrophobicContact CG-CG2 4.04Å; M11-V13 PolarHBondContact O-N 2.73Å
14H56.7Low58Low139 Ų139125.4 Ų125.464%0.64468%0.684SS**  trans-91.5142.3154.6-99.470.2000106.2K12K12-H14 HydrophobicContact CG-CB 4.42Å; K12-H14 PolarHBondContact O-N 2.9Å
15I58.6Low59.7Low155 Ų155126.1 Ų126.180%0.79567%0.668SS**SBendtrans95.964177.1-45.8147.7000112.6
16H58.8Low60.7Low133 Ų133124.7 Ų124.762%0.61666%0.655SS**SBend-17114.7127.2-124.7-83.2000115.4K18 F19H16-K18 PolarHBondContact O-N 2.05Å; H16-F19 PolarHBondContact O-N 3.45Å
17T53.4Low61.7Low136 Ų136122.8 Ų122.883%0.83464%0.639SS**SBendtrans-74-9.8171.342.90000113.6F19T17-F19 PolarHBondContact O-N 3.05Å; T17-F19 VanDerWaalsContact O-N 3.14Å
18K57.7Low62.8Low189 Ų189124.2 Ų124.282%0.82263%0.63SS**  trans-8461160.6-62.7-175.9-178.6177.60108.6H16 C20H16-K18 PolarHBondContact O-N 2.05Å; K18-C20 PolarHBondContact O-N 2.92Å
19F58.8Low63.4Low143 Ų143123 Ų12363%0.62763%0.625SS**  trans-50.9111.2141.9-90.6-87.1000103.8H16 T17 L21 L24H16-F19 PolarHBondContact O-N 3.45Å; T17-F19 PolarHBondContact O-N 3.05Å; T17-F19 VanDerWaalsContact O-N 3.14Å; F19-L21 VanDerWaalsContact C-N 3.27Å; F19-L21 PolarHBondContact O-N 2.93Å; F19-L24 HydrophobicContact CB-CD1 4.39Å
20C61.4Low63.7Low50 Ų50123.2 Ų123.234%0.33862%0.616SS.*  trans-50.899.3-172.9166.80000106.4K18 I22 C23 L24K18-C20 PolarHBondContact O-N 2.92Å; C20-I22 PolarHBondContact O-N 3.36Å; C20-C23 HydrophobicContact CB-CB 3.49Å; C20-C23 VanDerWaalsContact CB-CB 3.49Å; C20-C23 WeakPolarHBondContact CB-SG 3.14Å; C20-C23 CarbonylContact O-C 3.56Å; C20-C23 VanDerWaalsContact O-CA 3.29Å; C20-C23 WeakPolarHBondContact O-CA 3.29Å; C20-C23 VanDerWaalsContact O-CB 3.26Å; C20-C23 WeakPolarHBondContact O-CB 3.25Å; C20-C23 PolarHBondContact O-N 3.41Å; C20-C23 WeakPolarHBondContact SG-CB 2.93Å; C20-C23 PolarHBondContact SG-N 3.14Å; C20-C23 CovalentContact SG-SG 2.05Å; C20-C23 PolarHBondContact SG-SG 3.25Å; C20-L24 PolarHBondContact O-N 3.36Å
21L70.5Confident63.9Low126 Ų126123.2 Ų123.266%0.6662%0.616SS**Hα-helixtrans-58.9-34.8-179.3-72.7173.5000108F19 C23 L24 L25F19-L21 VanDerWaalsContact C-N 3.27Å; F19-L21 PolarHBondContact O-N 2.93Å; L21-C23 VanDerWaalsContact C-N 3.27Å; L21-C23 PolarHBondContact O-N 3.22Å; L21-L24 HydrophobicContact CD2-CD1 4.38Å; L21-L24 PolarHBondContact O-N 3.08Å; L21-L25 VanDerWaalsContact O-CB 3.29Å; L21-L25 WeakPolarHBondContact O-CB 3.1Å; L21-L25 WeakPolarHBondContact O-CG 3.24Å; L21-L25 PolarHBondContact O-N 2.92Å
22I68.6Low63.6Low124 Ų124119.8 Ų119.864%0.63661%0.607SS**Hα-helixtrans-53.4-44.4168.4-61.9165.2000111.1C20 L25 T26C20-I22 PolarHBondContact O-N 3.36Å; I22-L25 PolarHBondContact O-N 2.74Å; I22-T26 HydrophobicContact CG2-CG2 4.45Å; I22-T26 WeakPolarHBondContact O-CB 3.3Å; I22-T26 VanDerWaalsContact O-CG2 3.25Å; I22-T26 WeakPolarHBondContact O-CG2 3.26Å; I22-T26 PolarHBondContact O-N 2.78Å; I22-T26 PolarHBondContact O-OG1 3.32Å; I22-T26 VanDerWaalsContact O-OG1 3.08Å
23C68Low63.3Low68 Ų68118.6 Ų118.646%0.45961%0.609SS.*Hα-helixtrans-72.2-35.8-179.1-56.30000112.4C20 L21 T26 F27C20-C23 HydrophobicContact CB-CB 3.49Å; C20-C23 VanDerWaalsContact CB-CB 3.49Å; C20-C23 WeakPolarHBondContact CB-SG 3.14Å; C20-C23 CarbonylContact O-C 3.56Å; C20-C23 VanDerWaalsContact O-CA 3.29Å; C20-C23 WeakPolarHBondContact O-CA 3.29Å; C20-C23 VanDerWaalsContact O-CB 3.26Å; C20-C23 WeakPolarHBondContact O-CB 3.25Å; C20-C23 PolarHBondContact O-N 3.41Å; C20-C23 WeakPolarHBondContact SG-CB 2.93Å; C20-C23 PolarHBondContact SG-N 3.14Å; C20-C23 CovalentContact SG-SG 2.05Å; C20-C23 PolarHBondContact SG-SG 3.25Å; L21-C23 VanDerWaalsContact C-N 3.27Å; L21-C23 PolarHBondContact O-N 3.22Å; C23-T26 VanDerWaalsContact CA-OG1 3.24Å; C23-T26 WeakPolarHBondContact CA-OG1 3.15Å; C23-T26 PolarHBondContact O-OG1 3.49Å; C23-F27 VanDerWaalsContact O-CB 3.3Å; C23-F27 WeakPolarHBondContact O-CB 3.46Å; C23-F27 PolarHBondContact O-N 2.78Å
24L76.3Confident63Low87 Ų87118.9 Ų118.946%0.45560%0.602SS.*Hα-helixtrans-68-42.8172-69.9173.4000111.2F19 C20 L21 F27 I28F19-L24 HydrophobicContact CB-CD1 4.39Å; C20-L24 PolarHBondContact O-N 3.36Å; L21-L24 HydrophobicContact CD2-CD1 4.38Å; L21-L24 PolarHBondContact O-N 3.08Å; L24-F27 PolarHBondContact O-N 3.17Å; L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.5Å; L24-I28 PolarHBondContact O-N 2.85Å
25L75.8Confident62.9Low95 Ų95117.2 Ų117.250%0.49761%0.605SS.*Hα-helixtrans-63.4-48.6175.6-69.9169.9000110.1L21 I22 F27 I28 F29L21-L25 VanDerWaalsContact O-CB 3.29Å; L21-L25 WeakPolarHBondContact O-CB 3.1Å; L21-L25 WeakPolarHBondContact O-CG 3.24Å; L21-L25 PolarHBondContact O-N 2.92Å; I22-L25 PolarHBondContact O-N 2.74Å; L25-F27 VanDerWaalsContact C-N 3.29Å; L25-F27 PolarHBondContact O-N 2.69Å; L25-I28 PolarHBondContact O-N 2.95Å; L25-I28 VanDerWaalsContact O-N 3.17Å; L25-F29 HydrophobicContact CB-CD2 4.39Å; L25-F29 HydrophobicContact CB-CE2 4.48Å; L25-F29 WeakPolarHBondContact O-CB 3.29Å; L25-F29 WeakPolarHBondContact O-CD2 3.38Å; L25-F29 PolarHBondContact O-N 2.82Å
26T70.3Confident62.7Low78 Ų78117 Ų11748%0.47960%0.6SS.*Hα-helixtrans-60.8-38.8175.954.40000111.5I22 C23 F29 H30I22-T26 HydrophobicContact CG2-CG2 4.45Å; I22-T26 WeakPolarHBondContact O-CB 3.3Å; I22-T26 VanDerWaalsContact O-CG2 3.25Å; I22-T26 WeakPolarHBondContact O-CG2 3.26Å; I22-T26 PolarHBondContact O-N 2.78Å; I22-T26 PolarHBondContact O-OG1 3.32Å; I22-T26 VanDerWaalsContact O-OG1 3.08Å; C23-T26 VanDerWaalsContact CA-OG1 3.24Å; C23-T26 WeakPolarHBondContact CA-OG1 3.15Å; C23-T26 PolarHBondContact O-OG1 3.49Å; T26-F29 PolarHBondContact O-N 3.45Å; T26-H30 WeakPolarHBondContact O-CB 3.32Å; T26-H30 PolarHBondContact O-N 3.35Å
27F72Confident62.3Low126 Ų126118.4 Ų118.455%0.55361%0.607SS**Hα-helixtrans-62.3-46175.2-178.1-96.7000111.3C23 L24 L25 H30 H31C23-F27 VanDerWaalsContact O-CB 3.3Å; C23-F27 WeakPolarHBondContact O-CB 3.46Å; C23-F27 PolarHBondContact O-N 2.78Å; L24-F27 PolarHBondContact O-N 3.17Å; L25-F27 VanDerWaalsContact C-N 3.29Å; L25-F27 PolarHBondContact O-N 2.69Å; F27-H30 PolarHBondContact O-N 2.8Å; F27-H31 AromaticContact CE1-CD2 3.65Å; F27-H31 AromaticContact CE2-CD2 3.38Å; F27-H31 WeakPolarHBondContact CE2-CD2 3.45Å; F27-H31 AromaticContact CE2-NE2 3.77Å; F27-H31 AromaticContact CZ-CD2 3.15Å; F27-H31 WeakPolarHBondContact CZ-CD2 3.06Å; F27-H31 AromaticContact CZ-NE2 3.45Å; F27-H31 WeakPolarHBondContact CZ-NE2 3.11Å; F27-H31 WeakPolarHBondContact O-CB 3.26Å; F27-H31 PolarHBondContact O-N 2.95Å
28I73.1Confident62.2Low98 Ų98118 Ų11850%0.50360%0.6SS.*Hα-helixtrans-63.6-45.7177.8-66.9165.7000111.3L24 L25 H30 H31 C32L24-I28 VanDerWaalsContact O-CG1 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.5Å; L24-I28 PolarHBondContact O-N 2.85Å; L25-I28 PolarHBondContact O-N 2.95Å; L25-I28 VanDerWaalsContact O-N 3.17Å; I28-H30 VanDerWaalsContact C-N 3.32Å; I28-H30 PolarHBondContact O-N 3.48Å; I28-H31 PolarHBondContact O-N 3.29Å; I28-C32 WeakPolarHBondContact O-CB 3Å; I28-C32 PolarHBondContact O-N 3.15Å; I28-C32 VanDerWaalsContact O-N 3.07Å; I28-C32 PolarHBondContact O-SG 3.11Å
29F65.9Low62.2Low139 Ų139116.9 Ų116.961%0.6160%0.597SS**Hα-helixtrans-65.3-35.4177.1-79.9-71.5000112.1L25 T26 N33L25-F29 HydrophobicContact CB-CD2 4.39Å; L25-F29 HydrophobicContact CB-CE2 4.48Å; L25-F29 WeakPolarHBondContact O-CB 3.29Å; L25-F29 WeakPolarHBondContact O-CD2 3.38Å; L25-F29 PolarHBondContact O-N 2.82Å; T26-F29 PolarHBondContact O-N 3.45Å; F29-N33 WeakPolarHBondContact O-CB 3.38Å; F29-N33 VanDerWaalsContact O-CG 3.29Å; F29-N33 PolarHBondContact O-N 3.35Å; F29-N33 VanDerWaalsContact O-N 3.13Å; F29-N33 PolarHBondContact O-ND2 3.28Å
30H64.3Low61.7Low141 Ų141117.3 Ų117.365%0.65361%0.606SS**Hα-helixtrans-79.2-32.9179.4-153.4-65.7000112.6T26 F27 I28 H34T26-H30 WeakPolarHBondContact O-CB 3.32Å; T26-H30 PolarHBondContact O-N 3.35Å; F27-H30 PolarHBondContact O-N 2.8Å; I28-H30 VanDerWaalsContact C-N 3.32Å; I28-H30 PolarHBondContact O-N 3.48Å; H30-H34 PolarHBondContact O-N 3.33Å
31H57.7Low61.1Low120 Ų120122.4 Ų122.456%0.55662%0.624SS**Hα-helixtrans-75-26.4175.3-117.6-80.7000113.1F27 I28F27-H31 AromaticContact CE1-CD2 3.65Å; F27-H31 AromaticContact CE2-CD2 3.38Å; F27-H31 WeakPolarHBondContact CE2-CD2 3.45Å; F27-H31 AromaticContact CE2-NE2 3.77Å; F27-H31 AromaticContact CZ-CD2 3.15Å; F27-H31 WeakPolarHBondContact CZ-CD2 3.06Å; F27-H31 AromaticContact CZ-NE2 3.45Å; F27-H31 WeakPolarHBondContact CZ-NE2 3.11Å; F27-H31 WeakPolarHBondContact O-CB 3.26Å; F27-H31 PolarHBondContact O-N 2.95Å; I28-H31 PolarHBondContact O-N 3.29Å
32C52.2Low59.6Low93 Ų93119 Ų11963%0.62862%0.62SS**Hα-helixtrans-87.1-23.9174.4-69.30000113.3I28 H34I28-C32 WeakPolarHBondContact O-CB 3Å; I28-C32 PolarHBondContact O-N 3.15Å; I28-C32 VanDerWaalsContact O-N 3.07Å; I28-C32 PolarHBondContact O-SG 3.11Å; C32-H34 VanDerWaalsContact C-N 3.3Å
33N52.8Low58.9Low135 Ų135119.4 Ų119.472%0.72263%0.63SS**Hα-helixtrans-79.3-12.1171.6-79-18.9000113.3F29 C35F29-N33 WeakPolarHBondContact O-CB 3.38Å; F29-N33 VanDerWaalsContact O-CG 3.29Å; F29-N33 PolarHBondContact O-N 3.35Å; F29-N33 VanDerWaalsContact O-N 3.13Å; F29-N33 PolarHBondContact O-ND2 3.28Å; N33-C35 VanDerWaalsContact C-N 3.29Å; N33-C35 PolarHBondContact O-N 2.92Å
34H49.7Very low57.7Low122 Ų122125.3 Ų125.357%0.56565%0.651SS**THydrogen-bonded Turntrans-96.332.5177.3-15162.8000112.8H30 C32H30-H34 PolarHBondContact O-N 3.33Å; C32-H34 VanDerWaalsContact C-N 3.3Å
35C55.4Low56.4Low103 Ų103129.9 Ų129.970%0.69667%0.67SS**SBendtrans-106.858.6162.2-73.90000108.8N33N33-C35 VanDerWaalsContact C-N 3.29Å; N33-C35 PolarHBondContact O-N 2.92Å
36H54.4Low55.2Low150 Ų150131.6 Ų131.669%0.69468%0.679SS**  trans-173.586.6155.3-116-89.4000106.8D38H36-D38 IonicContact ND1-OD1 3.81Å; H36-D38 PolarHBondContact ND1-OD1 2.66Å; H36-D38 PolarHBondContact O-N 2.69Å; H36-D38 VanDerWaalsContact O-N 3.13Å
37E49.4Very low53.9Low164 Ų164135 Ų13577%0.76669%0.689SS**  trans-71.796.9153.2-122171157.200104.6H39E37-H39 PolarHBondContact O-N 3.28Å; E37-H39 VanDerWaalsContact O-N 3.13Å
38D52.7Low52.3Low126 Ų126139.2 Ų139.267%0.67470%0.702SS**  trans-53.9119169-71-42.3000107.6H36 D40H36-D38 IonicContact ND1-OD1 3.81Å; H36-D38 PolarHBondContact ND1-OD1 2.66Å; H36-D38 PolarHBondContact O-N 2.69Å; H36-D38 VanDerWaalsContact O-N 3.13Å; D38-D40 PolarHBondContact O-N 2.99Å
39H57.2Low51.3Low167 Ų167143.3 Ų143.377%0.77372%0.718SS**  trans-63.287.5166.7-84.3-65.6000108E37 H41E37-H39 PolarHBondContact O-N 3.28Å; E37-H39 VanDerWaalsContact O-N 3.13Å; H39-H41 VanDerWaalsContact C-N 3.32Å; H39-H41 AromaticContact ND1-NE2 3.94Å; H39-H41 PolarHBondContact O-N 3.09Å
40D47.3Very low50.2Low151 Ų151145.1 Ų145.181%0.80773%0.728SS**  trans-69.591.4167.7-167.319000108.1D38D38-D40 PolarHBondContact O-N 2.99Å
41H50.3Low49.1Very low157 Ų157149.2 Ų149.273%0.72774%0.738SS**  trans-103.8101163.9-69.1-48.1000108H39H39-H41 VanDerWaalsContact C-N 3.32Å; H39-H41 AromaticContact ND1-NE2 3.94Å; H39-H41 PolarHBondContact O-N 3.09Å
42G39.1Very low48.2Very low54 Ų54146.6 Ų146.656%0.55774%0.743SS**  trans-58.9170.5167.600000113.1E44G42-E44 PolarHBondContact O-N 3.31Å
43P52.5Low47.9Very low133 Ų133150.7 Ų150.786%0.86476%0.756SS**  trans-86.3104.3-159.433.7-31.2000110.9
44E42.7Very low47.6Very low192 Ų192150.6 Ų150.690%0.89776%0.76SS**  trans-118.3100.4154.6-76.6-105.714400107.5G42G42-E44 PolarHBondContact O-N 3.31Å
45E49.3Very low47.6Very low184 Ų184152.6 Ų152.686%0.8677%0.77SS**  trans-31.6132.4154.6-117.517915600110.8
46L51.2Low47.4Very low131 Ų131151.5 Ų151.569%0.68676%0.763SS**  161.4124.3113.5-164.977.4000110.9
47H42.4Very low47.3Very low149 Ų149151.4 Ų151.469%0.6976%0.763SS**  trans97.3107.5156.4-65.6-34.3000121.6
48R38Very low47.6Very low215 Ų215148.6 Ų148.681%0.81176%0.761SS**  93.595.5127.1-74.9176.381.7103.7-2.9117
49H52.7Low47.8Very low183 Ų183145.6 Ų145.685%0.84775%0.751SS**  32.594.8126.2-69-71.5000116.5
50H43.8Very low48Very low178 Ų178144.4 Ų144.482%0.82474%0.743SS**  trans-145.9101.3139.2-133.9-107.4000111.1
51R40.7Very low48.9Very low226 Ų226144.2 Ų144.285%0.85374%0.735SS**  trans54.1107.4130.1-171.4175.5163.2141-3.6117.7
52G38.9Very low50.4Low65 Ų65140.4 Ų140.467%0.6773%0.726SS**  trans78.790.6134.800000114.8T54G52-T54 VanDerWaalsContact C-N 3.26Å; G52-T54 PolarHBondContact O-N 3.13Å
53M46.3Very low52.7Low180 Ų180141.8 Ų141.889%0.88772%0.724SS**  trans-57.486.9161-165.48976.800109.6
54T45.9Very low54.6Low133 Ų133140 Ų14082%0.81670%0.704SS**  trans-84.2102.9148.831.20000106.3G52 S56G52-T54 VanDerWaalsContact C-N 3.26Å; G52-T54 PolarHBondContact O-N 3.13Å; T54-S56 PolarHBondContact O-N 3.15Å
55E48.6Very low57Low164 Ų164134.3 Ų134.377%0.76668%0.679SS**  trans-47.3128169.1-72.8172128.100111.2E57E55-E57 PolarHBondContact O-N 3.46Å
56S52.3Low59Low79 Ų79128.2 Ų128.255%0.55266%0.661SS**SBendtrans44.449.8136.2-167.80000118.5T54 S59T54-S56 PolarHBondContact O-N 3.15Å; S56-S59 PolarHBondContact OG-OG 3.26Å
57E51.8Low61Low148 Ų148126.9 Ų126.969%0.69265%0.651SS**SBendtrans-90.7-21.4161.9-70.3-103.1119.300111.7E55 S59 K60 F61E55-E57 PolarHBondContact O-N 3.46Å; E57-S59 VanDerWaalsContact C-N 3.33Å; E57-S59 PolarHBondContact O-N 3.46Å; E57-K60 PolarHBondContact O-N 3.29Å; E57-F61 PolarHBondContact O-N 3.01Å
58S55.3Low63.5Low105 Ų105123.7 Ų123.773%0.73464%0.639SS**Hα-helixtrans-66.4-29.4-177.3-177.20000113.8
59S58.7Low66.2Low64 Ų64118.7 Ų118.745%0.44863%0.625SS.*Hα-helixtrans-80.3-34-178.464.50000112.6S56 E57 S62 V63S56-S59 PolarHBondContact OG-OG 3.26Å; E57-S59 VanDerWaalsContact C-N 3.33Å; E57-S59 PolarHBondContact O-N 3.46Å; S59-S62 PolarHBondContact O-N 3.36Å; S59-V63 PolarHBondContact O-N 3.07Å
60K60.3Low68.2Low142 Ų142117.1 Ų117.162%0.61762%0.616SS**Hα-helixtrans-69.5-35.9178.3-66.9-179.9-176.5169.60112.2E57 S62 V63 Q64E57-K60 PolarHBondContact O-N 3.29Å; K60-S62 VanDerWaalsContact C-N 3.33Å; K60-S62 PolarHBondContact O-N 3.36Å; K60-V63 PolarHBondContact O-N 3.1Å; K60-Q64 PolarHBondContact O-N 2.77Å
61F65.8Low70.6Confident146 Ų146114.6 Ų114.664%0.6460%0.602SS**Hα-helixtrans-59.4-45.2176.2-169.1-104.7000111.2E57 V63 Q64 D65E57-F61 PolarHBondContact O-N 3.01Å; F61-V63 PolarHBondContact O-N 3.5Å; F61-Q64 PolarHBondContact O-N 2.94Å; F61-D65 WeakPolarHBondContact CD1-OD2 3.49Å; F61-D65 WeakPolarHBondContact CE1-OD2 3.32Å; F61-D65 WeakPolarHBondContact CZ-OD2 3.37Å; F61-D65 WeakPolarHBondContact O-CB 3.45Å; F61-D65 PolarHBondContact O-N 2.75Å
62S81.7Confident73.2Confident77 Ų77109.6 Ų109.654%0.53858%0.584SS.*Hα-helixtrans-61.7-42.2176.7157.80000113.6S59 K60 A66S59-S62 PolarHBondContact O-N 3.36Å; K60-S62 VanDerWaalsContact C-N 3.33Å; K60-S62 PolarHBondContact O-N 3.36Å; S62-A66 WeakPolarHBondContact O-CB 3.49Å; S62-A66 PolarHBondContact O-N 3.23Å; S62-A66 VanDerWaalsContact O-N 3.13Å
63V88.1Confident75.9Confident84 Ų84112.8 Ų112.851%0.50958%0.577SS.*Hα-helixtrans-68.9-45.4-179.7175.60000110.8S59 K60 F61 D65 A66 E67S59-V63 PolarHBondContact O-N 3.07Å; K60-V63 PolarHBondContact O-N 3.1Å; F61-V63 PolarHBondContact O-N 3.5Å; V63-D65 VanDerWaalsContact C-N 3.33Å; V63-D65 PolarHBondContact O-N 3.19Å; V63-A66 PolarHBondContact O-N 3.11Å; V63-E67 WeakPolarHBondContact O-CG 3.35Å; V63-E67 PolarHBondContact O-N 3Å
64Q92.1Very high78.2Confident96 Ų96107.8 Ų107.845%0.44955%0.553SS.*Hα-helixtrans-64.1-39.5-179.4-171.16276.500111.9K60 F61 E67 N68K60-Q64 PolarHBondContact O-N 2.77Å; F61-Q64 PolarHBondContact O-N 2.94Å; Q64-E67 PolarHBondContact NE2-OE2 3.13Å; Q64-E67 PolarHBondContact O-N 3.43Å; Q64-N68 PolarHBondContact NE2-OD1 3.45Å; Q64-N68 WeakPolarHBondContact O-CB 3.46Å; Q64-N68 PolarHBondContact O-N 3.13Å; Q64-N68 PolarHBondContact O-ND2 3.33Å; Q64-N68 VanDerWaalsContact O-ND2 3.17Å
65D92.5Very high80.5Confident71 Ų71105.9 Ų105.938%0.3854%0.535SS..Hα-helixtrans-64.5-43.3176.6-73.5-16.1000111.6F61 V63 E67 N68 E69F61-D65 WeakPolarHBondContact CD1-OD2 3.49Å; F61-D65 WeakPolarHBondContact CE1-OD2 3.32Å; F61-D65 WeakPolarHBondContact CZ-OD2 3.37Å; F61-D65 WeakPolarHBondContact O-CB 3.45Å; F61-D65 PolarHBondContact O-N 2.75Å; V63-D65 VanDerWaalsContact C-N 3.33Å; V63-D65 PolarHBondContact O-N 3.19Å; D65-E67 VanDerWaalsContact C-N 3.34Å; D65-E67 PolarHBondContact O-N 2.77Å; D65-N68 PolarHBondContact O-N 3.5Å; D65-E69 WeakPolarHBondContact O-CB 3.49Å; D65-E69 PolarHBondContact O-N 3.12Å
66A91.9Very high82.7Confident57 Ų57102.7 Ų102.747%0.47152%0.518SS..Hα-helixtrans-63-39.617500000112.3S62 V63 E69 K70S62-A66 WeakPolarHBondContact O-CB 3.49Å; S62-A66 PolarHBondContact O-N 3.23Å; S62-A66 VanDerWaalsContact O-N 3.13Å; V63-A66 PolarHBondContact O-N 3.11Å; A66-E69 PolarHBondContact O-N 2.84Å; A66-K70 WeakPolarHBondContact O-CB 3.39Å; A66-K70 PolarHBondContact O-N 3.28Å
67E93.4Very high84.7Confident103 Ų103102 Ų10248%0.48151%0.508SS..Hα-helixtrans-64-41.9174.3-74.8-172.1160.700112.3V63 Q64 D65 K70 K71V63-E67 WeakPolarHBondContact O-CG 3.35Å; V63-E67 PolarHBondContact O-N 3Å; Q64-E67 PolarHBondContact NE2-OE2 3.13Å; Q64-E67 PolarHBondContact O-N 3.43Å; D65-E67 VanDerWaalsContact C-N 3.34Å; D65-E67 PolarHBondContact O-N 2.77Å; E67-K70 PolarHBondContact O-N 3.41Å; E67-K71 WeakPolarHBondContact O-CB 3.42Å; E67-K71 PolarHBondContact O-N 2.76Å
68N94.9Very high86.8Confident82 Ų8298 Ų9844%0.43949%0.489SS..Hα-helixtrans-64.3-43.4177.9-70.9-23.6000111.3Q64 D65 K71 Y72Q64-N68 PolarHBondContact NE2-OD1 3.45Å; Q64-N68 WeakPolarHBondContact O-CB 3.46Å; Q64-N68 PolarHBondContact O-N 3.13Å; Q64-N68 PolarHBondContact O-ND2 3.33Å; Q64-N68 VanDerWaalsContact O-ND2 3.17Å; D65-N68 PolarHBondContact O-N 3.5Å; N68-K71 PolarHBondContact O-N 2.94Å; N68-Y72 WeakPolarHBondContact O-CB 3.39Å; N68-Y72 PolarHBondContact O-N 3.49Å
69E94Very high88.7Confident110 Ų11098.6 Ų98.651%0.51448%0.484SS..Hα-helixtrans-63-46.4175.6-176.5174.7-163.400111.2D65 A66 K71 Y72 Y73D65-E69 WeakPolarHBondContact O-CB 3.49Å; D65-E69 PolarHBondContact O-N 3.12Å; A66-E69 PolarHBondContact O-N 2.84Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.4Å; E69-Y72 WeakPolarHBondContact O-CB 3.44Å; E69-Y72 PolarHBondContact O-N 3.28Å; E69-Y73 HydrophobicContact CG-CD2 3.79Å; E69-Y73 HydrophobicContact CG-CE2 3.4Å; E69-Y73 VanDerWaalsContact CG-CE2 3.4Å; E69-Y73 WeakPolarHBondContact O-CD2 3.48Å; E69-Y73 PolarHBondContact O-N 2.98Å; E69-Y73 VanDerWaalsContact O-N 3.08Å
70K94.7Very high90.4Very high149 Ų149104.2 Ų104.265%0.64850%0.495SS*.Hα-helixtrans-56.5-48.2174.9-170.4-175.6102.1-174.70111A66 E67 Y72 Y73 I74A66-K70 WeakPolarHBondContact O-CB 3.39Å; A66-K70 PolarHBondContact O-N 3.28Å; E67-K70 PolarHBondContact O-N 3.41Å; K70-Y72 VanDerWaalsContact C-N 3.35Å; K70-Y72 PolarHBondContact O-N 3.45Å; K70-Y73 PolarHBondContact O-N 3.46Å; K70-I74 WeakPolarHBondContact O-CG1 3.47Å; K70-I74 PolarHBondContact O-N 2.92Å; K70-I74 VanDerWaalsContact O-N 3.07Å
71K94.9Very high92.1Very high125 Ų12599.2 Ų99.254%0.54347%0.473SS..Hα-helixtrans-59.1-46.8178.8-179.2179171.9-177.20111.2E67 N68 E69 Y73 I74 E75E67-K71 WeakPolarHBondContact O-CB 3.42Å; E67-K71 PolarHBondContact O-N 2.76Å; N68-K71 PolarHBondContact O-N 2.94Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.4Å; K71-Y73 VanDerWaalsContact C-N 3.34Å; K71-Y73 PolarHBondContact O-N 3.37Å; K71-I74 PolarHBondContact O-N 3.38Å; K71-E75 WeakPolarHBondContact CE-OE1 3.44Å; K71-E75 HydrophobicContact CG-CG 4.45Å; K71-E75 IonicContact NZ-OE1 3.98Å; K71-E75 WeakPolarHBondContact O-CG 3.16Å; K71-E75 PolarHBondContact O-N 3.24Å
72Y95.7Very high93.5Very high122 Ų12293 Ų9348%0.47845%0.45SS..Hα-helixtrans-54.8-47.5178173-93.8000112.2N68 E69 K70 E75 K76N68-Y72 WeakPolarHBondContact O-CB 3.39Å; N68-Y72 PolarHBondContact O-N 3.49Å; E69-Y72 WeakPolarHBondContact O-CB 3.44Å; E69-Y72 PolarHBondContact O-N 3.28Å; K70-Y72 VanDerWaalsContact C-N 3.35Å; K70-Y72 PolarHBondContact O-N 3.45Å; Y72-E75 PolarHBondContact O-N 2.85Å; Y72-K76 HydrophobicContact CD1-CG 4.46Å; Y72-K76 HydrophobicContact CE1-CG 4.03Å; Y72-K76 HydrophobicContact CE2-CG 4.48Å; Y72-K76 WeakPolarHBondContact O-CG 3.42Å; Y72-K76 PolarHBondContact O-N 3.11Å; Y72-K76 WeakPolarHBondContact OH-CE 2.96Å
73Y95.4Very high94.1Very high132 Ų13296.5 Ų96.552%0.51846%0.458SS..Hα-helixtrans-69.5-36.1-179.6-72.5-62.3000113.2E69 K70 K71 K76 L77E69-Y73 HydrophobicContact CG-CD2 3.79Å; E69-Y73 HydrophobicContact CG-CE2 3.4Å; E69-Y73 VanDerWaalsContact CG-CE2 3.4Å; E69-Y73 WeakPolarHBondContact O-CD2 3.48Å; E69-Y73 PolarHBondContact O-N 2.98Å; E69-Y73 VanDerWaalsContact O-N 3.08Å; K70-Y73 PolarHBondContact O-N 3.46Å; K71-Y73 VanDerWaalsContact C-N 3.34Å; K71-Y73 PolarHBondContact O-N 3.37Å; Y73-K76 PolarHBondContact O-N 2.77Å; Y73-L77 WeakPolarHBondContact O-CG 3.44Å; Y73-L77 PolarHBondContact O-N 3.13Å
74I93.9Very high94.2Very high75 Ų75100.2 Ų100.239%0.38548%0.475SS..Hα-helixtrans-63.8-43.9173.6-67.1-62.2000111K70 K71 K76 L77 F78K70-I74 WeakPolarHBondContact O-CG1 3.47Å; K70-I74 PolarHBondContact O-N 2.92Å; K70-I74 VanDerWaalsContact O-N 3.07Å; K71-I74 PolarHBondContact O-N 3.38Å; I74-K76 VanDerWaalsContact C-N 3.31Å; I74-K76 PolarHBondContact O-N 3.45Å; I74-L77 HydrophobicContact CD1-CD1 4.32Å; I74-L77 WeakPolarHBondContact O-CB 3.35Å; I74-L77 PolarHBondContact O-N 3.36Å; I74-L77 VanDerWaalsContact O-N 3.12Å; I74-F78 HydrophobicContact CG2-CD2 4.27Å; I74-F78 HydrophobicContact CG2-CE1 4.26Å; I74-F78 HydrophobicContact CG2-CE2 3.88Å; I74-F78 HydrophobicContact CG2-CZ 3.87Å; I74-F78 PolarHBondContact O-N 3.28Å
75E94.7Very high94Very high92 Ų9298.1 Ų98.143%0.4348%0.479SS..Hα-helixtrans-59.7-42.8175.3-73.6176.617200111.1K71 Y72 L77 F78 D79K71-E75 WeakPolarHBondContact CE-OE1 3.44Å; K71-E75 HydrophobicContact CG-CG 4.45Å; K71-E75 IonicContact NZ-OE1 3.98Å; K71-E75 WeakPolarHBondContact O-CG 3.16Å; K71-E75 PolarHBondContact O-N 3.24Å; Y72-E75 PolarHBondContact O-N 2.85Å; E75-L77 VanDerWaalsContact C-N 3.28Å; E75-L77 PolarHBondContact O-N 2.94Å; E75-F78 CarbonylContact O-C 3.56Å; E75-F78 PolarHBondContact O-N 2.87Å; E75-F78 VanDerWaalsContact O-N 3.1Å; E75-D79 VanDerWaalsContact O-CG 3.3Å; E75-D79 PolarHBondContact O-N 3.02Å
76K94.7Very high94Very high97 Ų97104.2 Ų104.242%0.42250%0.496SS..Hα-helixtrans-62-32.8174.8-71-61.1175-1560114.1Y72 Y73 I74 D79 R80Y72-K76 HydrophobicContact CD1-CG 4.46Å; Y72-K76 HydrophobicContact CE1-CG 4.03Å; Y72-K76 HydrophobicContact CE2-CG 4.48Å; Y72-K76 WeakPolarHBondContact O-CG 3.42Å; Y72-K76 PolarHBondContact O-N 3.11Å; Y72-K76 WeakPolarHBondContact OH-CE 2.96Å; Y73-K76 PolarHBondContact O-N 2.77Å; I74-K76 VanDerWaalsContact C-N 3.31Å; I74-K76 PolarHBondContact O-N 3.45Å; K76-D79 IonicContact NZ-OD2 3.94Å; K76-R80 WeakPolarHBondContact O-CB 3.22Å; K76-R80 PolarHBondContact O-N 3.1Å
77L94.5Very high94Very high64 Ų64104.1 Ų104.134%0.33549%0.488SS..Hα-helixtrans-68.6-42.8173.1-72.2168.8000111Y73 I74 E75 R80 Y81 L95Y73-L77 WeakPolarHBondContact O-CG 3.44Å; Y73-L77 PolarHBondContact O-N 3.13Å; I74-L77 HydrophobicContact CD1-CD1 4.32Å; I74-L77 WeakPolarHBondContact O-CB 3.35Å; I74-L77 PolarHBondContact O-N 3.36Å; I74-L77 VanDerWaalsContact O-N 3.12Å; E75-L77 VanDerWaalsContact C-N 3.28Å; E75-L77 PolarHBondContact O-N 2.94Å; L77-R80 PolarHBondContact O-N 3.46Å; L77-Y81 HydrophobicContact CD2-CD2 4.2Å; L77-Y81 HydrophobicContact CD2-CE2 4.2Å; L77-Y81 WeakPolarHBondContact O-CB 3.18Å; L77-Y81 PolarHBondContact O-N 3.25Å; L77-L95 HydrophobicContact CD2-CD1 3.76Å; L77-L95 HydrophobicContact CD2-CD2 4.49Å
78F95.4Very high94Very high65 Ų65102 Ų10229%0.28549%0.485SS..Hα-helixtrans-70.3-35.4178.9-67.7-3.8000112.5I74 E75 R80 G82 G85 L87I74-F78 HydrophobicContact CG2-CD2 4.27Å; I74-F78 HydrophobicContact CG2-CE1 4.26Å; I74-F78 HydrophobicContact CG2-CE2 3.88Å; I74-F78 HydrophobicContact CG2-CZ 3.87Å; I74-F78 PolarHBondContact O-N 3.28Å; E75-F78 CarbonylContact O-C 3.56Å; E75-F78 PolarHBondContact O-N 2.87Å; E75-F78 VanDerWaalsContact O-N 3.1Å; F78-R80 PolarHBondContact O-N 2.9Å; F78-G82 CarbonylContact O-C 3.6Å; F78-G82 WeakPolarHBondContact O-CA 3.44Å; F78-G82 PolarHBondContact O-N 2.92Å; F78-G82 VanDerWaalsContact O-O 3.12Å; F78-G85 WeakPolarHBondContact CD2-O 3.38Å; F78-G85 WeakPolarHBondContact CE2-O 3.35Å; F78-L87 HydrophobicContact CD1-CB 4.39Å; F78-L87 HydrophobicContact CE1-CB 4.09Å
79D94.9Very high93.8Very high118 Ų118103.5 Ų103.563%0.63149%0.487SS*.Hα-helixtrans-61.5-35.2172.3-73.1-14.3000112E75 K76E75-D79 VanDerWaalsContact O-CG 3.3Å; E75-D79 PolarHBondContact O-N 3.02Å; K76-D79 IonicContact NZ-OD2 3.94Å
80R95.8Very high93.7Very high182 Ų182105 Ų10569%0.68749%0.492SS*.Hα-helixtrans-89.8-37.6-173.7-176.1178-70.1-145.22113.5K76 L77 F78K76-R80 WeakPolarHBondContact O-CB 3.22Å; K76-R80 PolarHBondContact O-N 3.1Å; L77-R80 PolarHBondContact O-N 3.46Å; F78-R80 PolarHBondContact O-N 2.9Å
81Y95.9Very high93.7Very high37 Ų3798 Ų9815%0.14546%0.462CS..Hα-helixtrans-122.9-13.7-170.4-60-73.4000113.4L77 G91 K94 L95 N98L77-Y81 HydrophobicContact CD2-CD2 4.2Å; L77-Y81 HydrophobicContact CD2-CE2 4.2Å; L77-Y81 WeakPolarHBondContact O-CB 3.18Å; L77-Y81 PolarHBondContact O-N 3.25Å; Y81-G91 WeakPolarHBondContact O-CA 3.42Å; Y81-K94 HydrophobicContact CD1-CB 4.29Å; Y81-K94 HydrophobicContact CD1-CD 4.29Å; Y81-K94 HydrophobicContact CD1-CG 4.05Å; Y81-K94 HydrophobicContact CE1-CG 4.21Å; Y81-L95 HydrophobicContact CD1-CB 4.04Å; Y81-L95 HydrophobicContact CD2-CB 4.08Å; Y81-L95 HydrophobicContact CD2-CD1 3.63Å; Y81-L95 HydrophobicContact CD2-CG 4.34Å; Y81-L95 HydrophobicContact CE1-CB 4.44Å; Y81-L95 HydrophobicContact CE2-CB 4.44Å; Y81-L95 HydrophobicContact CE2-CD1 3.44Å; Y81-L95 VanDerWaalsContact CE2-CD1 3.44Å; Y81-L95 HydrophobicContact CG-CB 3.86Å; Y81-L95 HydrophobicContact CG-CD1 4.29Å; Y81-N98 WeakPolarHBondContact CE1-ND2 3.39Å
82G95.1Very high93.5Very high15 Ų1595.4 Ų95.416%0.15545%0.454CS..  trans-110.1-176.7-178.300000113.3F78 R86F78-G82 CarbonylContact O-C 3.6Å; F78-G82 WeakPolarHBondContact O-CA 3.44Å; F78-G82 PolarHBondContact O-N 2.92Å; F78-G82 VanDerWaalsContact O-O 3.12Å; G82-R86 CarbonylContact C-O 3.2Å; G82-R86 WeakPolarHBondContact CA-O 3.43Å
83E92.7Very high93.4Very high151 Ų15192.6 Ų92.671%0.70645%0.445SS*.BIsolated β-bridgetrans-144.9144.5173.3-67.4179.4-178.500108.1G85 R86E83-G85 PolarHBondContact O-N 3.4Å; E83-R86 PolarHBondContact N-O 2.89Å; E83-R86 PolarHBondContact O-N 3.49Å; E83-R86 VanDerWaalsContact O-O 3.04Å
84N90.4Very high93.2Very high162 Ų16291.4 Ų91.487%0.86644%0.443SS*.THydrogen-bonded Turntrans54.836178.8-54-45.7000114.1R86N84-R86 PolarHBondContact O-N 3.36Å
85G89.4Confident93.2Very high52 Ų5288.9 Ų88.954%0.53643%0.43SS..THydrogen-bonded Turntrans66.618.5-17900000114F78 E83F78-G85 WeakPolarHBondContact CD2-O 3.38Å; F78-G85 WeakPolarHBondContact CE2-O 3.35Å; E83-G85 PolarHBondContact O-N 3.4Å
86R91.8Very high93.1Very high198 Ų19886.8 Ų86.875%0.74742%0.421SS*.BIsolated β-bridgetrans-129.6150.7177.9-69.3-176.1165.4-129.1-3110.6G82 E83 N84G82-R86 CarbonylContact C-O 3.2Å; G82-R86 WeakPolarHBondContact CA-O 3.43Å; E83-R86 PolarHBondContact N-O 2.89Å; E83-R86 PolarHBondContact O-N 3.49Å; E83-R86 VanDerWaalsContact O-O 3.04Å; N84-R86 PolarHBondContact O-N 3.36Å
87L92.3Very high92.9Very high56 Ų5685.8 Ų85.829%0.29342%0.423SS..  trans-96.5115.1173.5-162.666.2000109.1F78 L92 L95F78-L87 HydrophobicContact CD1-CB 4.39Å; F78-L87 HydrophobicContact CE1-CB 4.09Å; L87-L92 HydrophobicContact CD2-CB 3.74Å; L87-L92 HydrophobicContact CD2-CD1 3.7Å; L87-L92 HydrophobicContact CD2-CG 4.29Å; L87-L92 HydrophobicContact CG-CB 3.97Å; L87-L95 HydrophobicContact CD2-CD2 4.16Å
88S92.3Very high92.8Very high59 Ų5987.6 Ų87.641%0.41343%0.433SS..  trans-73.5165.617267.80000110.3F90 G91 L92S88-F90 VanDerWaalsContact C-N 3.28Å; S88-F90 PolarHBondContact O-N 3.38Å; S88-G91 PolarHBondContact O-N 3.35Å; S88-G91 VanDerWaalsContact O-N 3.11Å; S88-G91 PolarHBondContact OG-N 3.08Å; S88-L92 WeakPolarHBondContact O-CB 3.12Å; S88-L92 PolarHBondContact O-N 3.22Å
89F91.1Very high92.5Very high112 Ų11289.9 Ų89.949%0.49145%0.448SS..Hα-helixtrans-54.8-47.1173.3176.2-97.4000111.5G91 L92 E93 V106F89-G91 VanDerWaalsContact C-N 3.32Å; F89-G91 PolarHBondContact O-N 3.48Å; F89-L92 PolarHBondContact O-N 3.07Å; F89-E93 WeakPolarHBondContact O-CB 3.41Å; F89-E93 PolarHBondContact O-N 3.38Å; F89-V106 HydrophobicContact CD2-CG2 4.4Å; F89-V106 HydrophobicContact CE2-CG2 3.37Å; F89-V106 HydrophobicContact CZ-CG2 3.54Å
90F92.1Very high92.2Very high142 Ų14287.4 Ų87.462%0.62345%0.45SS*.Hα-helixtrans-61.2-40.1176.2178.9-103.9000112.5S88 E93 K94S88-F90 VanDerWaalsContact C-N 3.28Å; S88-F90 PolarHBondContact O-N 3.38Å; F90-E93 PolarHBondContact O-N 2.91Å; F90-K94 WeakPolarHBondContact O-CB 3.47Å; F90-K94 PolarHBondContact O-N 3.31Å
91G94.1Very high91.7Very high2 Ų284.5 Ų84.52%0.02145%0.448CS..Hα-helixtrans-62.2-46.2175.500000112.8Y81 S88 F89 E93 K94 L95Y81-G91 WeakPolarHBondContact O-CA 3.42Å; S88-G91 PolarHBondContact O-N 3.35Å; S88-G91 VanDerWaalsContact O-N 3.11Å; S88-G91 PolarHBondContact OG-N 3.08Å; F89-G91 VanDerWaalsContact C-N 3.32Å; F89-G91 PolarHBondContact O-N 3.48Å; G91-E93 VanDerWaalsContact C-N 3.31Å; G91-E93 PolarHBondContact O-N 3.23Å; G91-K94 PolarHBondContact O-N 3.12Å; G91-L95 WeakPolarHBondContact O-CB 3.44Å; G91-L95 PolarHBondContact O-N 3.42Å
92L91.6Very high90.8Very high70 Ų7084.8 Ų84.837%0.36646%0.462SS..Hα-helixtrans-61.8-41.4174.6177.561.7000111.1L87 S88 F89 L95 L96L87-L92 HydrophobicContact CD2-CB 3.74Å; L87-L92 HydrophobicContact CD2-CD1 3.7Å; L87-L92 HydrophobicContact CD2-CG 4.29Å; L87-L92 HydrophobicContact CG-CB 3.97Å; S88-L92 WeakPolarHBondContact O-CB 3.12Å; S88-L92 PolarHBondContact O-N 3.22Å; F89-L92 PolarHBondContact O-N 3.07Å; L92-L95 WeakPolarHBondContact O-CB 3.16Å; L92-L95 PolarHBondContact O-N 3.37Å; L92-L96 HydrophobicContact CD1-CD1 3.69Å; L92-L96 HydrophobicContact CD1-CG 3.96Å; L92-L96 HydrophobicContact CG-CD1 3.91Å; L92-L96 HydrophobicContact CG-CG 4.49Å; L92-L96 WeakPolarHBondContact O-CG 3.07Å; L92-L96 PolarHBondContact O-N 3Å
93E92.3Very high90Very high64 Ų6491.3 Ų91.330%0.29949%0.489SS..Hα-helixtrans-61.2-47.6177.7-178.4-177-159.400112.4F89 F90 G91 L95 L96 T97 I104F89-E93 WeakPolarHBondContact O-CB 3.41Å; F89-E93 PolarHBondContact O-N 3.38Å; F90-E93 PolarHBondContact O-N 2.91Å; G91-E93 VanDerWaalsContact C-N 3.31Å; G91-E93 PolarHBondContact O-N 3.23Å; E93-L95 VanDerWaalsContact C-N 3.34Å; E93-L95 PolarHBondContact O-N 3.34Å; E93-L96 PolarHBondContact O-N 2.8Å; E93-T97 WeakPolarHBondContact O-CB 3.38Å; E93-T97 PolarHBondContact O-N 3.1Å; E93-T97 PolarHBondContact O-OG1 3.37Å; E93-I104 VanDerWaalsContact CA-CD1 3.4Å; E93-I104 HydrophobicContact CB-CD1 3.98Å; E93-I104 HydrophobicContact CG-CD1 3.99Å
94K93.1Very high89Confident106 Ų10686.2 Ų86.246%0.46147%0.466SS..Hα-helixtrans-62.6-40.7175.6-170.8177.8-179.1-175.30112Y81 F90 G91 N98Y81-K94 HydrophobicContact CD1-CB 4.29Å; Y81-K94 HydrophobicContact CD1-CD 4.29Å; Y81-K94 HydrophobicContact CD1-CG 4.05Å; Y81-K94 HydrophobicContact CE1-CG 4.21Å; F90-K94 WeakPolarHBondContact O-CB 3.47Å; F90-K94 PolarHBondContact O-N 3.31Å; G91-K94 PolarHBondContact O-N 3.12Å; K94-N98 WeakPolarHBondContact O-CB 3.43Å; K94-N98 VanDerWaalsContact O-CG 3.31Å; K94-N98 PolarHBondContact O-N 2.84Å; K94-N98 VanDerWaalsContact O-N 3.11Å; K94-N98 PolarHBondContact O-ND2 3.05Å
95L93.1Very high88.3Confident23 Ų2385.2 Ų85.212%0.1245%0.454CS..Hα-helixtrans-59.5-54.9176.8169.361.1000111L77 Y81 L87 G91 L92 E93 T97 N98 L99L77-L95 HydrophobicContact CD2-CD1 3.76Å; L77-L95 HydrophobicContact CD2-CD2 4.49Å; Y81-L95 HydrophobicContact CD1-CB 4.04Å; Y81-L95 HydrophobicContact CD2-CB 4.08Å; Y81-L95 HydrophobicContact CD2-CD1 3.63Å; Y81-L95 HydrophobicContact CD2-CG 4.34Å; Y81-L95 HydrophobicContact CE1-CB 4.44Å; Y81-L95 HydrophobicContact CE2-CB 4.44Å; Y81-L95 HydrophobicContact CE2-CD1 3.44Å; Y81-L95 VanDerWaalsContact CE2-CD1 3.44Å; Y81-L95 HydrophobicContact CG-CB 3.86Å; Y81-L95 HydrophobicContact CG-CD1 4.29Å; L87-L95 HydrophobicContact CD2-CD2 4.16Å; G91-L95 WeakPolarHBondContact O-CB 3.44Å; G91-L95 PolarHBondContact O-N 3.42Å; L92-L95 WeakPolarHBondContact O-CB 3.16Å; L92-L95 PolarHBondContact O-N 3.37Å; E93-L95 VanDerWaalsContact C-N 3.34Å; E93-L95 PolarHBondContact O-N 3.34Å; L95-T97 VanDerWaalsContact C-N 3.35Å; L95-T97 PolarHBondContact O-N 3Å; L95-N98 PolarHBondContact O-N 2.95Å; L95-L99 HydrophobicContact CD1-CD1 3.79Å; L95-L99 HydrophobicContact CG-CD1 3.98Å; L95-L99 PolarHBondContact O-N 3.36Å; L95-L99 VanDerWaalsContact O-N 3.1Å
96L91.4Very high87.5Confident47 Ų4788.3 Ų88.325%0.24646%0.462CS..Hα-helixtrans-68.2-34.6-175.2-65.5174.2000112.1L92 E93 N98 L99 G100 L101 I104L92-L96 HydrophobicContact CD1-CD1 3.69Å; L92-L96 HydrophobicContact CD1-CG 3.96Å; L92-L96 HydrophobicContact CG-CD1 3.91Å; L92-L96 HydrophobicContact CG-CG 4.49Å; L92-L96 WeakPolarHBondContact O-CG 3.07Å; L92-L96 PolarHBondContact O-N 3Å; E93-L96 PolarHBondContact O-N 2.8Å; L96-N98 PolarHBondContact O-N 3.26Å; L96-L99 HydrophobicContact CD2-CD1 4.31Å; L96-L99 WeakPolarHBondContact O-CB 3.44Å; L96-L99 PolarHBondContact O-N 3.27Å; L96-G100 PolarHBondContact O-N 3.48Å; L96-L101 HydrophobicContact CB-CB 4.47Å; L96-L101 HydrophobicContact CB-CD1 4.39Å; L96-L101 HydrophobicContact CD2-CD1 3.48Å; L96-L101 VanDerWaalsContact CD2-CD1 3.48Å; L96-L101 WeakPolarHBondContact O-CB 3.41Å; L96-L101 PolarHBondContact O-N 3.48Å; L96-L101 VanDerWaalsContact O-N 3.11Å; L96-I104 HydrophobicContact CB-CD1 3.65Å; L96-I104 HydrophobicContact CB-CG1 4.37Å; L96-I104 HydrophobicContact CD1-CD1 3.61Å; L96-I104 HydrophobicContact CD1-CG1 4.33Å; L96-I104 HydrophobicContact CG-CD1 4.19Å
97T91.3Very high86.7Confident76 Ų7684.1 Ų84.147%0.46646%0.458SS..Hα-helixtrans-61.6-43.6172.2-580000111.3E93 L95 L99 G100E93-T97 WeakPolarHBondContact O-CB 3.38Å; E93-T97 PolarHBondContact O-N 3.1Å; E93-T97 PolarHBondContact O-OG1 3.37Å; L95-T97 VanDerWaalsContact C-N 3.35Å; L95-T97 PolarHBondContact O-N 3Å; T97-L99 VanDerWaalsContact C-N 3.26Å; T97-L99 PolarHBondContact O-N 3.46Å; T97-G100 PolarHBondContact O-N 3.44Å
98N91.8Very high85.9Confident102 Ų10289.1 Ų89.155%0.54548%0.48SS..Hα-helixtrans-71-19.6178.4-73.5-50.6000113.7Y81 K94 L95 L96 G100Y81-N98 WeakPolarHBondContact CE1-ND2 3.39Å; K94-N98 WeakPolarHBondContact O-CB 3.43Å; K94-N98 VanDerWaalsContact O-CG 3.31Å; K94-N98 PolarHBondContact O-N 2.84Å; K94-N98 VanDerWaalsContact O-N 3.11Å; K94-N98 PolarHBondContact O-ND2 3.05Å; L95-N98 PolarHBondContact O-N 2.95Å; L96-N98 PolarHBondContact O-N 3.26Å; N98-G100 VanDerWaalsContact C-N 3.25Å
99L90.4Very high85Confident113 Ų11392.5 Ų92.559%0.59249%0.492SS*.THydrogen-bonded Turntrans-79.1-7.3169.6-80.8151.6000112.9L95 L96 T97 L101L95-L99 HydrophobicContact CD1-CD1 3.79Å; L95-L99 HydrophobicContact CG-CD1 3.98Å; L95-L99 PolarHBondContact O-N 3.36Å; L95-L99 VanDerWaalsContact O-N 3.1Å; L96-L99 HydrophobicContact CD2-CD1 4.31Å; L96-L99 WeakPolarHBondContact O-CB 3.44Å; L96-L99 PolarHBondContact O-N 3.27Å; T97-L99 VanDerWaalsContact C-N 3.26Å; T97-L99 PolarHBondContact O-N 3.46Å; L99-L101 HydrophobicContact CB-CD1 3.96Å; L99-L101 HydrophobicContact CB-CG 4.07Å; L99-L101 HydrophobicContact CD1-CD1 4.37Å
100G88Confident83.8Confident66 Ų6692.9 Ų92.968%0.6850%0.499SS*.THydrogen-bonded Turntrans7819.9-177.500000113.9L96 T97 N98 G102L96-G100 PolarHBondContact O-N 3.48Å; T97-G100 PolarHBondContact O-N 3.44Å; N98-G100 VanDerWaalsContact C-N 3.25Å; G100-G102 PolarHBondContact O-N 3.32Å
101L86.4Confident82.6Confident122 Ų12294.1 Ų94.164%0.63951%0.507SS*.  trans-81.47-178.4-66.2167.8000113.9L96 L99L96-L101 HydrophobicContact CB-CB 4.47Å; L96-L101 HydrophobicContact CB-CD1 4.39Å; L96-L101 HydrophobicContact CD2-CD1 3.48Å; L96-L101 VanDerWaalsContact CD2-CD1 3.48Å; L96-L101 WeakPolarHBondContact O-CB 3.41Å; L96-L101 PolarHBondContact O-N 3.48Å; L96-L101 VanDerWaalsContact O-N 3.11Å; L99-L101 HydrophobicContact CB-CD1 3.96Å; L99-L101 HydrophobicContact CB-CG 4.07Å; L99-L101 HydrophobicContact CD1-CD1 4.37Å
102G76.8Confident81.1Confident43 Ų43101.3 Ų101.344%0.44354%0.54SS..  trans80.3-169.3174.700000114.4G100G100-G102 PolarHBondContact O-N 3.32Å
103E76.7Confident79.7Confident151 Ų151105.6 Ų105.671%0.70656%0.563SS**  trans-70.3131.1179.8-173.4-170-171.900110.6K105E103-K105 WeakPolarHBondContact OE1-CE 3.35Å; E103-K105 IonicContact OE1-NZ 3.15Å; E103-K105 WeakPolarHBondContact OE2-CE 2.94Å; E103-K105 IonicContact OE2-NZ 2.73Å; E103-K105 PolarHBondContact OE2-NZ 3.36Å; E103-K105 VanDerWaalsContact OE2-NZ 3.15Å
104I73.1Confident78.2Confident45 Ų45108.3 Ų108.323%0.23158%0.579CS.*  trans-93.9126.2178.6-59.4166000108.8E93 L96E93-I104 VanDerWaalsContact CA-CD1 3.4Å; E93-I104 HydrophobicContact CB-CD1 3.98Å; E93-I104 HydrophobicContact CG-CD1 3.99Å; L96-I104 HydrophobicContact CB-CD1 3.65Å; L96-I104 HydrophobicContact CB-CG1 4.37Å; L96-I104 HydrophobicContact CD1-CD1 3.61Å; L96-I104 HydrophobicContact CD1-CG1 4.33Å; L96-I104 HydrophobicContact CG-CD1 4.19Å
105K75.1Confident76.5Confident140 Ų140106 Ų10661%0.60959%0.586SS**  trans-115.1125.4173.9-66.3-175.7-177.7174.70109.2E103 V107E103-K105 WeakPolarHBondContact OE1-CE 3.35Å; E103-K105 IonicContact OE1-NZ 3.15Å; E103-K105 WeakPolarHBondContact OE2-CE 2.94Å; E103-K105 IonicContact OE2-NZ 2.73Å; E103-K105 PolarHBondContact OE2-NZ 3.36Å; E103-K105 VanDerWaalsContact OE2-NZ 3.15Å; K105-V107 HydrophobicContact CB-CG2 4.33Å; K105-V107 PolarHBondContact O-N 3.05Å
106V72.2Confident74.7Confident117 Ų117111.1 Ų111.171%0.70961%0.609SS**  trans-75.5110.6166.7-176.50000106.5F89F89-V106 HydrophobicContact CD2-CG2 4.4Å; F89-V106 HydrophobicContact CE2-CG2 3.37Å; F89-V106 HydrophobicContact CZ-CG2 3.54Å
107V76.2Confident73Confident110 Ų110116.2 Ų116.267%0.66764%0.636SS**  trans-107.3120.6173.8-176.60000107K105 I109K105-V107 HydrophobicContact CB-CG2 4.33Å; K105-V107 PolarHBondContact O-N 3.05Å; V107-I109 PolarHBondContact O-N 3.47Å; V107-I109 VanDerWaalsContact O-N 3.15Å
108E74.3Confident71.4Confident162 Ų162120.1 Ų120.176%0.75765%0.649SS**  trans-66.5110.9170.9-173.9172.5-160.800108N110E108-N110 PolarHBondContact O-N 3.43Å
109I73.7Confident69.7Low130 Ų130122.1 Ų122.167%0.66766%0.664SS**  trans-85.696.8174.4-51.4176.9000106.1V107 H111V107-I109 PolarHBondContact O-N 3.47Å; V107-I109 VanDerWaalsContact O-N 3.15Å; I109-H111 PolarHBondContact O-N 3.34Å
110N66.1Low68.1Low120 Ų120120.3 Ų120.364%0.64266%0.661SS**  trans-63.7104.5167.4-78.3-37.5000107.9E108 E112E108-N110 PolarHBondContact O-N 3.43Å; N110-E112 PolarHBondContact O-N 3.3Å; N110-E112 VanDerWaalsContact O-N 3.09Å
111H67.4Low66.6Low168 Ų168123.9 Ų123.978%0.77866%0.66SS**  trans-74.991.3159.7-723.4000106.1I109 D113I109-H111 PolarHBondContact O-N 3.34Å; H111-D113 PolarHBondContact O-N 3.47Å
112E63.2Low65.1Low152 Ų152126.5 Ų126.571%0.7167%0.674SS**  trans-52.8128.1156.6-60.4179.8-156.100105.8N110 L114N110-E112 PolarHBondContact O-N 3.3Å; N110-E112 VanDerWaalsContact O-N 3.09Å; E112-L114 HydrophobicContact CB-CD1 4.25Å; E112-L114 PolarHBondContact O-N 3.4Å
113D61.5Low63.7Low161 Ų161131.4 Ų131.486%0.86169%0.69SS**  trans-66.460.9179.5-170.730.5000110H111 G115H111-D113 PolarHBondContact O-N 3.47Å; D113-G115 PolarHBondContact O-N 3.17Å
114L59.5Low62.6Low120 Ų120130.3 Ų130.363%0.62869%0.688SS**  trans-70.684.4164.3-86.3144.8000104.4E112 H116E112-L114 HydrophobicContact CB-CD1 4.25Å; E112-L114 PolarHBondContact O-N 3.4Å; L114-H116 VanDerWaalsContact C-N 3.25Å; L114-H116 PolarHBondContact O-N 3.04Å
115G57.7Low61.5Low59 Ų59136.7 Ų136.761%0.60872%0.721SS**  trans-50.488.4-179.500000111.3D113D113-G115 PolarHBondContact O-N 3.17Å
116H56.6Low60.5Low129 Ų129133.4 Ų133.460%0.59772%0.72SS**  trans-13594.6177.1-66.5-33.9000107.5L114 H118L114-H116 VanDerWaalsContact C-N 3.25Å; L114-H116 PolarHBondContact O-N 3.04Å; H116-H118 PolarHBondContact O-CD2 2.91Å; H116-H118 PolarHBondContact O-N 2.93Å
117D55Low59.7Low154 Ų154133.9 Ų133.982%0.82472%0.723SS**  trans-7.166.4144.8-161.524.2000116.5
118H58.4Low58.5Low158 Ų158136 Ų13673%0.73173%0.726SS**  trans-123.637.4171.4-64-43.2000111.1H116 S120H116-H118 PolarHBondContact O-CD2 2.91Å; H116-H118 PolarHBondContact O-N 2.93Å; H118-S120 PolarHBondContact O-N 3.24Å; H118-S120 VanDerWaalsContact O-N 3.12Å
119V55.8Low57.3Low144 Ų144137.1 Ų137.187%0.87373%0.731SS**  trans-83.143.2168.4-166.70000111.1
120S55.7Low56.3Low76 Ų76133.5 Ų133.553%0.53173%0.726SS.*  trans-144.5104.4162.552.30000105.5H118H118-S120 PolarHBondContact O-N 3.24Å; H118-S120 VanDerWaalsContact O-N 3.12Å
121H58.1Low55.6Low141 Ų141136.5 Ų136.565%0.65373%0.733SS**SBend-171.33895.3-81.7-66.2000112.4D123 I124H121-D123 VanDerWaalsContact C-N 3.29Å; H121-I124 HydrophobicContact CB-CD1 4.44Å
122L54.6Low54.6Low176 Ų176134.7 Ų134.792%0.92173%0.725SS**THydrogen-bonded Turntrans-93.624.4167.6-82172.6000113.5
123D47.9Very low53.6Low146 Ų146136.6 Ų136.678%0.78173%0.731SS**THydrogen-bonded Turntrans-107.21.8169-93.8-15.4000113.8H121 L125H121-D123 VanDerWaalsContact C-N 3.29Å; D123-L125 PolarHBondContact O-N 3.02Å; D123-L125 VanDerWaalsContact O-N 3.1Å
124I52Low52.9Low129 Ų129135.6 Ų135.666%0.66272%0.721SS**THydrogen-bonded Turntrans-8942.2177.3-42.3177.2000111.2H121H121-I124 HydrophobicContact CB-CD1 4.44Å
125L51.4Low52.3Low178 Ų178135.3 Ų135.393%0.93273%0.729SS**THydrogen-bonded Turntrans-133.525.5162.1-70.6179.6000111.4D123D123-L125 PolarHBondContact O-N 3.02Å; D123-L125 VanDerWaalsContact O-N 3.1Å
126A52.4Low51.8Low72 Ų72140.3 Ų140.360%0.59574%0.736SS**SBendtrans-127.2108.1172.700000111
127V57.2Low51.4Low127 Ų127139.2 Ų139.277%0.7774%0.739SS**  trans53.199149.9-173.50000116.8E129V127-E129 HydrophobicContact CG1-CB 4.13Å
128Q49.9Very low51.1Low155 Ų155140.3 Ų140.372%0.72474%0.738SS**  trans-119.365.7147.2-150.4175.261.700109.7G130 H132Q128-G130 PolarHBondContact O-N 3.2Å; Q128-H132 PolarHBondContact OE1-CE1 2.84Å; Q128-H132 PolarHBondContact OE1-NE2 3.39Å
129E48.4Very low50.7Low184 Ų184140.6 Ų140.686%0.8674%0.74SS**  trans-72.2109.1159.5-174.4173.5-16100107.7V127V127-E129 HydrophobicContact CG1-CB 4.13Å
130G53.6Low50.4Low54 Ų54141.4 Ų141.456%0.55773%0.734SS**SBendtrans103.2118.3160.500000117.1Q128Q128-G130 PolarHBondContact O-N 3.2Å
131K52.3Low50Low183 Ų183146.4 Ų146.480%0.79675%0.746SS**  trans86.279.4151.9-52.2173.4-173.11760116.8F133K131-F133 HydrophobicContact CB-CD2 4.29Å; K131-F133 HydrophobicContact CB-CE2 4.4Å; K131-F133 HydrophobicContact CG-CE2 4.37Å
132H46Very low49.6Very low131 Ų131148.2 Ų148.261%0.60676%0.755SS**  trans-93.7103.1147.2-71.5-78.8000108.7Q128Q128-H132 PolarHBondContact OE1-CE1 2.84Å; Q128-H132 PolarHBondContact OE1-NE2 3.39Å
133F42.6Very low48.9Very low191 Ų191147.7 Ų147.784%0.83875%0.753SS**  trans-93.3114.3163.4-82.2-91.7000107.7K131K131-F133 HydrophobicContact CB-CD2 4.29Å; K131-F133 HydrophobicContact CB-CE2 4.4Å; K131-F133 HydrophobicContact CG-CE2 4.37Å
134H46.3Very low48.5Very low141 Ų141152.9 Ų152.965%0.65377%0.772SS**  trans-96103.7169-65.9-72.6000109.2H136H134-H136 PolarHBondContact O-N 3.01Å
135S46.8Very low48.3Very low113 Ų113154.1 Ų154.179%0.7978%0.778SS**  trans-80.6101.6159.9179.10000107.7
136H47.5Very low48.1Very low164 Ų164152.8 Ų152.876%0.75977%0.77SS**  trans-87.5102.3165.6-72.2-73.4000108.4H134H134-H136 PolarHBondContact O-N 3.01Å
137T47.5Very low47.9Very low107 Ų107157.3 Ų157.366%0.65678%0.779SS**  trans-138.492.4155.3-59.30000108.4
138H49.1Very low47.3Very low177 Ų177159.1 Ų159.182%0.81978%0.78SS**  trans-131.191.3150.2-90.3-75000107.2H140H138-H140 PolarHBondContact O-N 3.4Å
139Q49.8Very low47.2Very low164 Ų164159.4 Ų159.477%0.76678%0.783SS**  trans-69.7107.4157.5-74.5-176.2-1800107.1
140H50Low47.1Very low160 Ų160157.7 Ų157.774%0.74178%0.778SS**  trans-89.1113.2158.4-96.3-78.6000107.6H138H138-H140 PolarHBondContact O-N 3.4Å
141F46Very low46.6Very low181 Ų181165.1 Ų165.179%0.79479%0.794SS**  trans-105.4140.9157-89.2-83.1000109.4
142H50.8Low46.2Very low180 Ų180163.8 Ų163.883%0.83379%0.794SS**  trans-73.2157.9-164.2-75.2-91.5000115.2
143N39.9Very low46.2Very low165 Ų165166.5 Ų166.588%0.88281%0.809SS**  trans-41.2140.8165.3-86.3-4.7000114.5
144H38.3Very low46.5Very low255 Ų255164.3 Ų164.3100%1.18181%0.807SS**  -161.30104.8-149.2-58.1000111.5

Retrieved 144 of 144 residues in 193.1 ms (Link to these results)