A0A087XGI8_POEFO Loading...

Vestigial like family member 3

AlphaFold DB , UniProt , Accession A0A087XGI8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 406 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
1M35.3Very low37.7Very low230 Ų230168 Ų168100%1.13387%0.867SS**  092.10-59.9174.692.600106
2Q37.2Very low37.3Very low167 Ų167167.6 Ų167.678%0.7887%0.866SS**  96.882.6101.1-156.4159.98.900109.2
3T42.2Very low36.9Very low134 Ų134158.7 Ų158.782%0.82284%0.841SS**  56.812399.164.90000114.5
4G33.9Very low37.2Very low77 Ų77158.6 Ų158.679%0.79484%0.838SS**  trans17950.9167.300000114.5H6G4-H6 PolarHBondContact O-N 3.04Å
5R39.9Very low37.2Very low255 Ų255163.2 Ų163.296%0.96284%0.842SS**  trans-77.1108.2165.2-94.6-176.6153.7-168.6-6.3108.1
6H40.3Very low37.3Very low191 Ų191157.6 Ų157.688%0.88484%0.836SS**  trans-83118172.3-134.463.9000108.7G4G4-H6 PolarHBondContact O-N 3.04Å
7G38.6Very low37.6Very low68 Ų68154.4 Ų154.470%0.70184%0.837SS**  trans-73.8128.2174.800000110.6C9G7-C9 PolarHBondContact O-N 3.38Å
8H37.1Very low37.5Very low188 Ų188151.4 Ų151.487%0.8784%0.837SS**  trans-80.3101.8172.9-134.2-109.4000108.3M10H8-M10 PolarHBondContact O-N 3.23Å
9C37.2Very low37.8Very low117 Ų117148.8 Ų148.879%0.79184%0.838SS**  trans-77.7108170.5-166.60000108.1G7 R11G7-C9 PolarHBondContact O-N 3.38Å; C9-R11 PolarHBondContact O-N 3.43Å; C9-R11 VanDerWaalsContact O-N 3.07Å
10M34.7Very low37.8Very low183 Ų183145.1 Ų145.190%0.90183%0.833SS**  trans-69.8102.1167.4-81.6-172.2177.700108.6H8H8-M10 PolarHBondContact O-N 3.23Å
11R38Very low38.1Very low238 Ų238143.4 Ų143.490%0.89883%0.83SS**  trans-86.8109.3170-167.5173.1-171.8153.50.9107.6C9 G13C9-R11 PolarHBondContact O-N 3.43Å; C9-R11 VanDerWaalsContact O-N 3.07Å; R11-G13 PolarHBondContact O-N 3.27Å
12L33.6Very low38.4Very low163 Ų163140.5 Ų140.585%0.85381%0.814SS**  trans-6597.9171.9-167.472.3000108.4
13G32.2Very low39Very low52 Ų52140 Ų14054%0.53682%0.817SS.*  trans-83.5108172.900000109.8R11 Y15R11-G13 PolarHBondContact O-N 3.27Å; G13-Y15 PolarHBondContact O-N 3.44Å
14I40.1Very low39.2Very low158 Ų158140.7 Ų140.781%0.8182%0.821SS**  trans-74.2103.6166.2-57.4-171.5000106.8G16I14-G16 PolarHBondContact O-N 3.33Å
15Y37.1Very low39.7Very low227 Ų227140.9 Ų140.989%0.8982%0.815SS**  trans-72.6106.7171.2-82.2-90.7000109.2G13 A17G13-Y15 PolarHBondContact O-N 3.44Å; Y15-A17 PolarHBondContact O-N 3.37Å
16G40Very low39.8Very low73 Ų73138.8 Ų138.875%0.75381%0.807SS**  trans-74.6109.1162.900000109.4I14 A18I14-G16 PolarHBondContact O-N 3.33Å; G16-A18 PolarHBondContact O-N 3.22Å
17A41.1Very low40.1Very low103 Ų103137.5 Ų137.585%0.85181%0.806SS**  trans-72.6112.8172.800000109.6Y15Y15-A17 PolarHBondContact O-N 3.37Å
18A37Very low40.6Very low101 Ų101142.3 Ų142.384%0.83581%0.808SS**  trans-69.8142.9168.900000110.4G16G16-A18 PolarHBondContact O-N 3.22Å
19A43.3Very low41.2Very low103 Ų103136.9 Ų136.985%0.85179%0.791SS**  trans-65.8140.3-171.200000114.2
20G37.2Very low41.8Very low73 Ų73136.9 Ų136.975%0.75378%0.779SS**  trans-138.2132.1152.200000107.4
21S43.2Very low42.7Very low110 Ų110130.1 Ų130.177%0.76976%0.757SS**  trans-6126.4169.9-131.40000114.9
22E43Very low43.5Very low169 Ų169124.9 Ų124.979%0.7974%0.742SS**  -176142.767.744.9-153.176.700110.4T24E22-T24 PolarHBondContact O-N 3.03Å; E22-T24 VanDerWaalsContact O-N 3.08Å
23D48.7Very low44.5Very low156 Ų156122.5 Ų122.583%0.83473%0.73SS**SBendtrans-66.996.4-169-69.3-55.9000113.5
24T47.4Very low45.7Very low149 Ų149126.4 Ų126.491%0.91473%0.732SS**SBendtrans-172.516.5153.414.20000116.5E22E22-T24 PolarHBondContact O-N 3.03Å; E22-T24 VanDerWaalsContact O-N 3.08Å
25A44.3Very low46.7Very low81 Ų81121.7 Ų121.767%0.66971%0.713SS**  trans-125.19.4-17700000115.7
26R42.8Very low47.7Very low212 Ų212113 Ų11380%0.869%0.689SS**Hα-helixtrans-83.9-14-170.5-81.4-173150.4-146-6.2116.6
27L46.4Very low48.8Very low163 Ų163114.7 Ų114.785%0.85368%0.68SS**Hα-helixtrans-83.2-20.2-179.4-85151.7000114.1
28K49.2Very low49.8Very low169 Ų169116.7 Ų116.774%0.73567%0.67SS**Hα-helixtrans-88.3-36.2-176.4-159.4163.9-177.7174.70113.6Q30 E32K28-Q30 PolarHBondContact O-N 3.32Å; K28-E32 WeakPolarHBondContact O-CG 3.46Å; K28-E32 PolarHBondContact O-N 3.02Å
29S48.1Very low51Low75 Ų75116.7 Ų116.752%0.52466%0.655SS.*Hα-helixtrans-73.7-26.9179.284.70000113.6L33S29-L33 PolarHBondContact O-N 3.31Å
30Q51.3Low52Low116 Ų116117.8 Ų117.854%0.54265%0.646SS.*Hα-helixtrans-70.9-40.2177.5-157.6177.7-1.700110.9K28 L33 F34K28-Q30 PolarHBondContact O-N 3.32Å; Q30-L33 PolarHBondContact O-N 3.15Å; Q30-F34 HydrophobicContact CG-CD2 4.03Å; Q30-F34 HydrophobicContact CG-CE2 3.84Å; Q30-F34 WeakPolarHBondContact O-CD2 3.47Å; Q30-F34 PolarHBondContact O-N 3.44Å; Q30-F34 VanDerWaalsContact O-N 3.08Å
31G53.3Low53.3Low42 Ų42117.3 Ų117.343%0.43363%0.631SS.*Hα-helixtrans-64.7-37.9175.800000113.9F34 S35G31-F34 PolarHBondContact O-N 3.26Å; G31-S35 WeakPolarHBondContact O-CB 3.43Å; G31-S35 PolarHBondContact O-N 3.46Å
32E53.4Low54.2Low127 Ų127115 Ų11559%0.59361%0.614SS**Hα-helixtrans-68.3-39.9177.2-69-67146.700112.2K28 S35 A36K28-E32 WeakPolarHBondContact O-CG 3.46Å; K28-E32 PolarHBondContact O-N 3.02Å; E32-S35 PolarHBondContact O-N 3.43Å; E32-A36 WeakPolarHBondContact O-CB 3.37Å; E32-A36 PolarHBondContact O-N 3.13Å
33L56.1Low55.4Low113 Ų113112 Ų11259%0.59260%0.603SS**Hα-helixtrans-67-40.5175.1-83.1166.6000112.3S29 Q30 A36 L37S29-L33 PolarHBondContact O-N 3.31Å; Q30-L33 PolarHBondContact O-N 3.15Å; L33-A36 PolarHBondContact O-N 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.18Å; L33-L37 WeakPolarHBondContact O-CD1 3.44Å; L33-L37 PolarHBondContact O-N 3.41Å
34F57.7Low56.3Low134 Ų134111.2 Ų111.259%0.58859%0.593SS**Hα-helixtrans-65.6-39.6174.1-85.6-72.1000111.8Q30 G31 F38Q30-F34 HydrophobicContact CG-CD2 4.03Å; Q30-F34 HydrophobicContact CG-CE2 3.84Å; Q30-F34 WeakPolarHBondContact O-CD2 3.47Å; Q30-F34 PolarHBondContact O-N 3.44Å; Q30-F34 VanDerWaalsContact O-N 3.08Å; G31-F34 PolarHBondContact O-N 3.26Å; F34-F38 WeakPolarHBondContact O-CB 3.38Å; F34-F38 PolarHBondContact O-N 3.27Å
35S59.3Low57.2Low59 Ų59109.7 Ų109.741%0.41358%0.579SS.*Hα-helixtrans-63.3-46.3175.4-169.10000111.6G31 E32 F38 L39G31-S35 WeakPolarHBondContact O-CB 3.43Å; G31-S35 PolarHBondContact O-N 3.46Å; E32-S35 PolarHBondContact O-N 3.43Å; S35-F38 PolarHBondContact O-N 3.19Å; S35-L39 WeakPolarHBondContact O-CB 3.32Å; S35-L39 VanDerWaalsContact O-CG 3.29Å; S35-L39 WeakPolarHBondContact O-CG 3.47Å; S35-L39 PolarHBondContact O-N 3.27Å
36A58.3Low58.5Low45 Ų45113.9 Ų113.937%0.37258%0.578SS.*Hα-helixtrans-64.5-42.3177.700000112.6E32 L33 F38 L39 L40E32-A36 WeakPolarHBondContact O-CB 3.37Å; E32-A36 PolarHBondContact O-N 3.13Å; L33-A36 PolarHBondContact O-N 3.27Å; A36-F38 VanDerWaalsContact C-N 3.31Å; A36-F38 PolarHBondContact O-N 3.08Å; A36-L39 PolarHBondContact O-N 3.33Å; A36-L40 VanDerWaalsContact O-CD1 3.24Å; A36-L40 WeakPolarHBondContact O-CD1 3.43Å; A36-L40 PolarHBondContact O-N 3.35Å
37L63.6Low59.8Low109 Ų109108.6 Ų108.657%0.57157%0.565SS**Hα-helixtrans-64.4-35.5174-88.6153.2000112.4L33 S41L33-L37 WeakPolarHBondContact O-CB 3.18Å; L33-L37 WeakPolarHBondContact O-CD1 3.44Å; L33-L37 PolarHBondContact O-N 3.41Å; L37-S41 VanDerWaalsContact O-CB 3.31Å; L37-S41 WeakPolarHBondContact O-CB 3.48Å; L37-S41 PolarHBondContact O-N 3.08Å; L37-S41 PolarHBondContact O-OG 2.93Å
38F61.7Low60.8Low145 Ų145103.6 Ų103.664%0.63654%0.544SS*.Hα-helixtrans-71.3-40.9177.5-158.3-94.7000111.6F34 S35 A36 S41 C42F34-F38 WeakPolarHBondContact O-CB 3.38Å; F34-F38 PolarHBondContact O-N 3.27Å; S35-F38 PolarHBondContact O-N 3.19Å; A36-F38 VanDerWaalsContact C-N 3.31Å; A36-F38 PolarHBondContact O-N 3.08Å; F38-S41 PolarHBondContact O-N 3.38Å; F38-C42 WeakPolarHBondContact O-CB 3.27Å; F38-C42 PolarHBondContact O-N 2.88Å
39L63.1Low61.7Low100 Ų100102.2 Ų102.252%0.52454%0.538SS..Hα-helixtrans-64.2-48.2174.2-69.6172.9000111.3S35 A36 S41 C42 D43S35-L39 WeakPolarHBondContact O-CB 3.32Å; S35-L39 VanDerWaalsContact O-CG 3.29Å; S35-L39 WeakPolarHBondContact O-CG 3.47Å; S35-L39 PolarHBondContact O-N 3.27Å; A36-L39 PolarHBondContact O-N 3.33Å; L39-S41 VanDerWaalsContact C-N 3.27Å; L39-S41 PolarHBondContact O-N 3.29Å; L39-C42 PolarHBondContact O-N 3.3Å; L39-C42 VanDerWaalsContact O-N 3.15Å; L39-D43 WeakPolarHBondContact O-CB 3.38Å; L39-D43 VanDerWaalsContact O-CG 3.3Å; L39-D43 PolarHBondContact O-N 3.26Å
40L64.2Low62.7Low127 Ų127101.7 Ų101.767%0.66553%0.531SS*.Hα-helixtrans-59.1-37.4174.5-97.1101.7000112.7A36 F44A36-L40 VanDerWaalsContact O-CD1 3.24Å; A36-L40 WeakPolarHBondContact O-CD1 3.43Å; A36-L40 PolarHBondContact O-N 3.35Å; L40-F44 VanDerWaalsContact O-CB 3.3Å; L40-F44 WeakPolarHBondContact O-CB 3.4Å; L40-F44 PolarHBondContact O-N 3.47Å
41S63.9Low63.7Low63 Ų63101 Ų10144%0.44153%0.53SS..Hα-helixtrans-70.7-39.3177.5-62.90000112L37 F38 L39 L45L37-S41 VanDerWaalsContact O-CB 3.31Å; L37-S41 WeakPolarHBondContact O-CB 3.48Å; L37-S41 PolarHBondContact O-N 3.08Å; L37-S41 PolarHBondContact O-OG 2.93Å; F38-S41 PolarHBondContact O-N 3.38Å; L39-S41 VanDerWaalsContact C-N 3.27Å; L39-S41 PolarHBondContact O-N 3.29Å; S41-L45 WeakPolarHBondContact O-CB 3.19Å; S41-L45 WeakPolarHBondContact O-CD1 3.35Å; S41-L45 VanDerWaalsContact O-CG 3.31Å; S41-L45 WeakPolarHBondContact O-CG 3.27Å; S41-L45 PolarHBondContact O-N 3.35Å
42C62.3Low64.3Low60 Ų60100.4 Ų100.441%0.40553%0.525SS..Hα-helixtrans-65-43.7174.4-88.80000111.7F38 L39 L45 Y46F38-C42 WeakPolarHBondContact O-CB 3.27Å; F38-C42 PolarHBondContact O-N 2.88Å; L39-C42 PolarHBondContact O-N 3.3Å; L39-C42 VanDerWaalsContact O-N 3.15Å; C42-L45 PolarHBondContact O-N 3.48Å; C42-Y46 VanDerWaalsContact O-CB 3.29Å; C42-Y46 WeakPolarHBondContact O-CB 3.31Å; C42-Y46 PolarHBondContact O-N 3.28Å
43D67.5Low64.9Low106 Ų106101.2 Ų101.257%0.56753%0.526SS*.Hα-helixtrans-65.1-40.1177.4-68.9-33.9000111.2L39 Y46 L47L39-D43 WeakPolarHBondContact O-CB 3.38Å; L39-D43 VanDerWaalsContact O-CG 3.3Å; L39-D43 PolarHBondContact O-N 3.26Å; D43-Y46 PolarHBondContact O-N 3.17Å; D43-L47 WeakPolarHBondContact O-CB 3.45Å; D43-L47 PolarHBondContact O-N 3.48Å
44F67.6Low65.3Low141 Ų141101.8 Ų101.862%0.61853%0.53SS*.Hα-helixtrans-67.6-38.6175.9-171.1-95.3000112.9L40 S48L40-F44 VanDerWaalsContact O-CB 3.3Å; L40-F44 WeakPolarHBondContact O-CB 3.4Å; L40-F44 PolarHBondContact O-N 3.47Å; F44-S48 VanDerWaalsContact O-CB 3.29Å; F44-S48 WeakPolarHBondContact O-CB 3.24Å; F44-S48 PolarHBondContact O-N 3.04Å; F44-S48 PolarHBondContact O-OG 3.06Å
45L66.5Low65.6Low117 Ų11797.1 Ų97.161%0.61352%0.516SS*.Hα-helixtrans-69-39.8175-79.8165.6000111.7S41 C42 K49S41-L45 WeakPolarHBondContact O-CB 3.19Å; S41-L45 WeakPolarHBondContact O-CD1 3.35Å; S41-L45 VanDerWaalsContact O-CG 3.31Å; S41-L45 WeakPolarHBondContact O-CG 3.27Å; S41-L45 PolarHBondContact O-N 3.35Å; C42-L45 PolarHBondContact O-N 3.48Å; L45-K49 WeakPolarHBondContact O-CB 3.34Å; L45-K49 PolarHBondContact O-N 3.19Å
46Y72Confident65.8Low169 Ų169100.1 Ų100.166%0.66353%0.525SS*.Hα-helixtrans-65.6-46175.4-173.3-99.7000110.6C42 D43 S48 K49 V50C42-Y46 VanDerWaalsContact O-CB 3.29Å; C42-Y46 WeakPolarHBondContact O-CB 3.31Å; C42-Y46 PolarHBondContact O-N 3.28Å; D43-Y46 PolarHBondContact O-N 3.17Å; Y46-S48 PolarHBondContact O-N 2.76Å; Y46-K49 PolarHBondContact O-N 3.05Å; Y46-K49 VanDerWaalsContact O-N 3.15Å; Y46-V50 HydrophobicContact CD1-CG2 3.97Å; Y46-V50 HydrophobicContact CE1-CG2 3.66Å; Y46-V50 HydrophobicContact CE2-CG2 4.42Å; Y46-V50 HydrophobicContact CG-CG2 4.47Å; Y46-V50 WeakPolarHBondContact O-CB 3.4Å; Y46-V50 VanDerWaalsContact O-CG2 3.27Å; Y46-V50 WeakPolarHBondContact O-CG2 3.27Å; Y46-V50 PolarHBondContact O-N 3.33Å
47L69.6Low65.9Low100 Ų100101.4 Ų101.452%0.52453%0.531SS..Hα-helixtrans-62.6-43.6176.5-16964.6000111.6D43 K49 V50 I51D43-L47 WeakPolarHBondContact O-CB 3.45Å; D43-L47 PolarHBondContact O-N 3.48Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 2.94Å; L47-V50 PolarHBondContact O-N 3.1Å; L47-I51 HydrophobicContact CD1-CD1 4.35Å; L47-I51 HydrophobicContact CG-CD1 3.88Å; L47-I51 WeakPolarHBondContact O-CB 3.1Å; L47-I51 WeakPolarHBondContact O-CD1 3.1Å; L47-I51 WeakPolarHBondContact O-CG1 3.09Å; L47-I51 PolarHBondContact O-N 3.02Å
48S67.8Low65.5Low58 Ų5898.9 Ų98.941%0.40652%0.522SS..Hα-helixtrans-61.7-36.9174.1-710000112.4F44 Y46 G52F44-S48 VanDerWaalsContact O-CB 3.29Å; F44-S48 WeakPolarHBondContact O-CB 3.24Å; F44-S48 PolarHBondContact O-N 3.04Å; F44-S48 PolarHBondContact O-OG 3.06Å; Y46-S48 PolarHBondContact O-N 2.76Å; S48-G52 PolarHBondContact O-N 3.29Å
49K67.9Low65.3Low140 Ų14096.8 Ų96.861%0.60952%0.517SS*.Hα-helixtrans-73.8-40.8179.4-163.3158180166.70111.5L45 Y46 L47 G52 F53L45-K49 WeakPolarHBondContact O-CB 3.34Å; L45-K49 PolarHBondContact O-N 3.19Å; Y46-K49 PolarHBondContact O-N 3.05Å; Y46-K49 VanDerWaalsContact O-N 3.15Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 2.94Å; K49-G52 PolarHBondContact O-N 2.68Å; K49-F53 HydrophobicContact CG-CD2 3.97Å; K49-F53 HydrophobicContact CG-CE2 3.81Å; K49-F53 WeakPolarHBondContact O-CD2 3.39Å; K49-F53 PolarHBondContact O-N 3.49Å
50V70.5Confident65Low64 Ų6497.4 Ų97.439%0.38852%0.521SS..Hα-helixtrans-63.6-44.7173.4171.30000110.8Y46 L47 G52 F53 L54Y46-V50 HydrophobicContact CD1-CG2 3.97Å; Y46-V50 HydrophobicContact CE1-CG2 3.66Å; Y46-V50 HydrophobicContact CE2-CG2 4.42Å; Y46-V50 HydrophobicContact CG-CG2 4.47Å; Y46-V50 WeakPolarHBondContact O-CB 3.4Å; Y46-V50 VanDerWaalsContact O-CG2 3.27Å; Y46-V50 WeakPolarHBondContact O-CG2 3.27Å; Y46-V50 PolarHBondContact O-N 3.33Å; L47-V50 PolarHBondContact O-N 3.1Å; V50-G52 VanDerWaalsContact C-N 3.32Å; V50-G52 PolarHBondContact O-N 3.12Å; V50-F53 PolarHBondContact O-N 2.65Å; V50-L54 WeakPolarHBondContact O-CB 3.27Å; V50-L54 PolarHBondContact O-N 2.7Å
51I70.8Confident64.8Low101 Ų10195.5 Ų95.552%0.51851%0.514SS..Hα-helixtrans-62.1-41.7174-68.4165.2000110.5L47 L54 A55L47-I51 HydrophobicContact CD1-CD1 4.35Å; L47-I51 HydrophobicContact CG-CD1 3.88Å; L47-I51 WeakPolarHBondContact O-CB 3.1Å; L47-I51 WeakPolarHBondContact O-CD1 3.1Å; L47-I51 WeakPolarHBondContact O-CG1 3.09Å; L47-I51 PolarHBondContact O-N 3.02Å; I51-L54 PolarHBondContact O-N 3.18Å; I51-A55 WeakPolarHBondContact O-CB 3.36Å; I51-A55 PolarHBondContact O-N 3.32Å
52G66.2Low64.5Low31 Ų3198 Ų9832%0.3252%0.52SS..Hα-helixtrans-62.4-43.5175.200000113.1S48 K49 V50 A55 M56S48-G52 PolarHBondContact O-N 3.29Å; K49-G52 PolarHBondContact O-N 2.68Å; V50-G52 VanDerWaalsContact C-N 3.32Å; V50-G52 PolarHBondContact O-N 3.12Å; G52-A55 PolarHBondContact O-N 2.96Å; G52-M56 WeakPolarHBondContact O-CB 3.15Å; G52-M56 VanDerWaalsContact O-CG 3.24Å; G52-M56 WeakPolarHBondContact O-CG 3.4Å; G52-M56 PolarHBondContact O-N 3.43Å
53F66Low64.2Low143 Ų143102.4 Ų102.463%0.62753%0.529SS*.Hα-helixtrans-67-39.1176.2-87.7-70.7000112.3K49 V50 S57K49-F53 HydrophobicContact CG-CD2 3.97Å; K49-F53 HydrophobicContact CG-CE2 3.81Å; K49-F53 WeakPolarHBondContact O-CD2 3.39Å; K49-F53 PolarHBondContact O-N 3.49Å; V50-F53 PolarHBondContact O-N 2.65Å; F53-S57 VanDerWaalsContact O-CB 3.27Å; F53-S57 WeakPolarHBondContact O-CB 3.29Å; F53-S57 PolarHBondContact O-N 3.07Å
54L64.2Low63.6Low126 Ų126104.4 Ų104.466%0.6654%0.535SS*.Hα-helixtrans-67.6-39.6175.7-161.471.1000111.2V50 I51 S57 C58V50-L54 WeakPolarHBondContact O-CB 3.27Å; V50-L54 PolarHBondContact O-N 2.7Å; I51-L54 PolarHBondContact O-N 3.18Å; L54-S57 PolarHBondContact O-N 3.08Å; L54-C58 WeakPolarHBondContact O-CB 3.27Å; L54-C58 PolarHBondContact O-N 2.91Å; L54-C58 PolarHBondContact O-SG 3.29Å; L54-C58 VanDerWaalsContact O-SG 3.34Å
55A64.1Low63Low36 Ų36105.8 Ų105.830%0.29854%0.543SS..Hα-helixtrans-65.9-40.4176.100000112.6I51 G52 C58 L59I51-A55 WeakPolarHBondContact O-CB 3.36Å; I51-A55 PolarHBondContact O-N 3.32Å; G52-A55 PolarHBondContact O-N 2.96Å; A55-C58 VanDerWaalsContact CA-SG 3.55Å; A55-C58 PolarHBondContact O-SG 3.46Å; A55-L59 WeakPolarHBondContact O-CB 3.15Å; A55-L59 PolarHBondContact O-N 3.42Å
56M63.3Low62.3Low121 Ų121104.6 Ų104.660%0.59655%0.545SS*.Hα-helixtrans-72.3-36.9176.7-67.4-62.894.100112.1G52 L59 D60G52-M56 WeakPolarHBondContact O-CB 3.15Å; G52-M56 VanDerWaalsContact O-CG 3.24Å; G52-M56 WeakPolarHBondContact O-CG 3.4Å; G52-M56 PolarHBondContact O-N 3.43Å; M56-L59 HydrophobicContact CE-CD1 4.46Å; M56-D60 PolarHBondContact O-N 3.5Å; M56-D60 VanDerWaalsContact O-N 3.15Å
57S61Low61.2Low72 Ų72103.7 Ų103.750%0.50354%0.541SS..Hα-helixtrans-67.4-41.9174.6-176.40000112.2F53 L54 D60 V61F53-S57 VanDerWaalsContact O-CB 3.27Å; F53-S57 WeakPolarHBondContact O-CB 3.29Å; F53-S57 PolarHBondContact O-N 3.07Å; L54-S57 PolarHBondContact O-N 3.08Å; S57-D60 PolarHBondContact O-N 2.99Å; S57-V61 WeakPolarHBondContact O-CG2 3.32Å; S57-V61 PolarHBondContact O-N 3.03Å; S57-V61 VanDerWaalsContact O-N 3.09Å
58C54.9Low60.1Low57 Ų57100.9 Ų100.939%0.38554%0.537SS..Hα-helixtrans-72.5-31.617874.40000112.8L54 A55 D60 M62L54-C58 WeakPolarHBondContact O-CB 3.27Å; L54-C58 PolarHBondContact O-N 2.91Å; L54-C58 PolarHBondContact O-SG 3.29Å; L54-C58 VanDerWaalsContact O-SG 3.34Å; A55-C58 VanDerWaalsContact CA-SG 3.55Å; A55-C58 PolarHBondContact O-SG 3.46Å; C58-D60 VanDerWaalsContact C-N 3.33Å; C58-M62 VanDerWaalsContact O-CB 3.31Å; C58-M62 WeakPolarHBondContact O-CB 3.45Å; C58-M62 VanDerWaalsContact O-CG 3.27Å; C58-M62 WeakPolarHBondContact O-CG 3.44Å; C58-M62 PolarHBondContact O-N 3.01Å
59L58.4Low59.1Low101 Ų101102.2 Ų102.253%0.52955%0.551SS.*Hα-helixtrans-62.8-43.8172.1-125.8105.3000110.6A55 M56 M62 Y63A55-L59 WeakPolarHBondContact O-CB 3.15Å; A55-L59 PolarHBondContact O-N 3.42Å; M56-L59 HydrophobicContact CE-CD1 4.46Å; L59-M62 PolarHBondContact O-N 3.3Å; L59-Y63 WeakPolarHBondContact O-CB 3.37Å; L59-Y63 PolarHBondContact O-N 2.95Å
60D56.2Low58.3Low112 Ų112103.2 Ų103.260%0.59956%0.557SS**Hα-helixtrans-65.5-43.8-177.8-152.428.8000111.1M56 S57 C58 H64M56-D60 PolarHBondContact O-N 3.5Å; M56-D60 VanDerWaalsContact O-N 3.15Å; S57-D60 PolarHBondContact O-N 2.99Å; C58-D60 VanDerWaalsContact C-N 3.33Å; D60-H64 WeakPolarHBondContact O-CB 3.42Å; D60-H64 PolarHBondContact O-N 3.47Å
61V60.8Low57.3Low87 Ų87110.7 Ų110.753%0.52758%0.58SS.*Hα-helixtrans-65.3-44.8175.6174.10000112.2S57 Q65S57-V61 WeakPolarHBondContact O-CG2 3.32Å; S57-V61 PolarHBondContact O-N 3.03Å; S57-V61 VanDerWaalsContact O-N 3.09Å; V61-Q65 VanDerWaalsContact O-CB 3.32Å; V61-Q65 WeakPolarHBondContact O-CB 3.19Å; V61-Q65 PolarHBondContact O-N 3.39Å
62M57.2Low56.2Low116 Ų116111.8 Ų111.857%0.57159%0.586SS**Hα-helixtrans-71.1-35.1179.9-71.2-166.1-58.700112.8C58 L59 S66C58-M62 VanDerWaalsContact O-CB 3.31Å; C58-M62 WeakPolarHBondContact O-CB 3.45Å; C58-M62 VanDerWaalsContact O-CG 3.27Å; C58-M62 WeakPolarHBondContact O-CG 3.44Å; C58-M62 PolarHBondContact O-N 3.01Å; L59-M62 PolarHBondContact O-N 3.3Å; M62-S66 WeakPolarHBondContact O-CB 3.46Å; M62-S66 PolarHBondContact O-N 2.84Å; M62-S66 VanDerWaalsContact O-N 3.08Å
63Y56.1Low55.3Low153 Ų153115.2 Ų115.260%0.660%0.603SS**Hα-helixtrans-70-39.6178-160.7-96.9000111L59 Y67L59-Y63 WeakPolarHBondContact O-CB 3.37Å; L59-Y63 PolarHBondContact O-N 2.95Å; Y63-Y67 HydrophobicContact CD2-CD2 4.39Å; Y63-Y67 WeakPolarHBondContact O-CB 3.24Å; Y63-Y67 PolarHBondContact O-N 2.9Å; Y63-Y67 VanDerWaalsContact O-N 3.12Å
64H55.1Low54.6Low148 Ų148112.8 Ų112.869%0.68561%0.609SS**Hα-helixtrans-68.7-39.2176-123-115.3000112.8D60 G68D60-H64 WeakPolarHBondContact O-CB 3.42Å; D60-H64 PolarHBondContact O-N 3.47Å; H64-G68 WeakPolarHBondContact O-CA 3.15Å; H64-G68 PolarHBondContact O-N 3.39Å
65Q55Low54Low169 Ų169111.1 Ų111.179%0.7961%0.614SS**Hα-helixtrans-82.4-27.5-173.7-157.8162.449.300113.6V61V61-Q65 VanDerWaalsContact O-CB 3.32Å; V61-Q65 WeakPolarHBondContact O-CB 3.19Å; V61-Q65 PolarHBondContact O-N 3.39Å
66S51.1Low53.3Low92 Ų92111.1 Ų111.164%0.64361%0.614SS**Hα-helixtrans-101.8-24.9-179.7-67.60000115.2M62M62-S66 WeakPolarHBondContact O-CB 3.46Å; M62-S66 PolarHBondContact O-N 2.84Å; M62-S66 VanDerWaalsContact O-N 3.08Å
67Y49.8Very low52.6Low151 Ų151113.8 Ų113.859%0.59262%0.619SS**Hα-helixtrans-114.1-7.6-178.6-74.3-86.8000114.4Y63 A69 H70Y63-Y67 HydrophobicContact CD2-CD2 4.39Å; Y63-Y67 WeakPolarHBondContact O-CB 3.24Å; Y63-Y67 PolarHBondContact O-N 2.9Å; Y63-Y67 VanDerWaalsContact O-N 3.12Å; Y67-A69 PolarHBondContact O-N 3.41Å; Y67-H70 PolarHBondContact O-N 3.47Å
68G46.6Very low52.1Low41 Ų41116.7 Ų116.742%0.42362%0.622SS.*THydrogen-bonded Turntrans-64.6-9.8-176.200000116.4H64H64-G68 WeakPolarHBondContact O-CA 3.15Å; H64-G68 PolarHBondContact O-N 3.39Å
69A45.4Very low52Low86 Ų86117 Ų11771%0.71163%0.629SS**THydrogen-bonded Turntrans-95.1-12.7176.800000114.3Y67Y67-A69 PolarHBondContact O-N 3.41Å
70H50.8Low51.7Low160 Ų160116.9 Ų116.974%0.74163%0.632SS**THydrogen-bonded Turntrans-116.3-4.3-169.2-69.5-66.8000115.6Y67Y67-H70 PolarHBondContact O-N 3.47Å
71Y51.1Low51.6Low222 Ų222120.3 Ų120.387%0.87164%0.638SS**  trans-138.764.4175.5-108.6-93.6000111.2
72L47.9Very low51.2Low123 Ų123123.9 Ų123.964%0.64464%0.643SS**  trans-92.1130.1160.6-75.8-179.9000109.8A76L72-A76 HydrophobicContact CB-CB 4.18Å; L72-A76 HydrophobicContact CD1-CB 3.79Å; L72-A76 HydrophobicContact CG-CB 4.5Å
73P46.5Very low51.2Low103 Ų103123.7 Ų123.767%0.66965%0.645SS**  trans-53.2143.5166.7-23.833.3000110.4A75 A76P73-A75 PolarHBondContact O-N 3.39Å; P73-A76 PolarHBondContact O-N 3.34Å
74A50.3Low51.3Low92 Ų92121.9 Ų121.976%0.7664%0.642SS**THydrogen-bonded Turntrans-543-171.700000117.2Y77A74-Y77 WeakPolarHBondContact O-CD1 3.33Å
75A52.9Low51.5Low91 Ų91120 Ų12075%0.75263%0.633SS**THydrogen-bonded Turntrans-81.7-19.8175.300000114.2P73P73-A75 PolarHBondContact O-N 3.39Å
76A48.3Very low51.7Low37 Ų37118 Ų11831%0.30662%0.624SS.*THydrogen-bonded Turntrans-84-15.4-171.700000115.3L72 P73 K78 A79 T80L72-A76 HydrophobicContact CB-CB 4.18Å; L72-A76 HydrophobicContact CD1-CB 3.79Å; L72-A76 HydrophobicContact CG-CB 4.5Å; P73-A76 PolarHBondContact O-N 3.34Å; A76-K78 PolarHBondContact O-N 3Å; A76-A79 PolarHBondContact O-N 3.42Å; A76-T80 PolarHBondContact O-OG1 3.45Å
77Y49.6Very low52.2Low176 Ų176118.9 Ų118.969%0.6962%0.618SS**Hα-helixtrans-66.7-22.3-175.291.6-88.2000113.6A74A74-Y77 WeakPolarHBondContact O-CD1 3.33Å
78K49.3Very low52.8Low133 Ų133116.4 Ų116.458%0.57861%0.611SS**Hα-helixtrans-78.6-24.9-178.6-121.4-167.1-178.9-162.20113.4A76 Y82A76-K78 PolarHBondContact O-N 3Å; K78-Y82 WeakPolarHBondContact O-CD2 3.37Å
79A53Low53.4Low63 Ų63119.9 Ų119.952%0.52162%0.616SS.*Hα-helixtrans-80.9-30.8-17400000113.2A76 N83A76-A79 PolarHBondContact O-N 3.42Å; A79-N83 PolarHBondContact O-N 2.99Å; A79-N83 PolarHBondContact O-ND2 3.27Å; A79-N83 VanDerWaalsContact O-ND2 3.17Å
80T53.1Low54.1Low99 Ų99121.8 Ų121.861%0.60761%0.611SS**Hα-helixtrans-75.5-32.1-178.63.50000112.8A76 N83 H84A76-T80 PolarHBondContact O-OG1 3.45Å; T80-N83 PolarHBondContact O-N 3.25Å; T80-H84 PolarHBondContact O-N 3.38Å
81Y52.9Low54.5Low185 Ų185122.7 Ų122.773%0.72561%0.608SS**Hα-helixtrans-66.7-38.7179.4-163.1-94.5000112.7
82Y54.1Low54.9Low161 Ų161119.5 Ų119.563%0.63160%0.598SS**Hα-helixtrans-74.4-35.3177.7-78.1-82.2000113.1K78 H85 Q86K78-Y82 WeakPolarHBondContact O-CD2 3.37Å; Y82-H85 PolarHBondContact O-N 3.03Å; Y82-Q86 PolarHBondContact O-N 3.15Å
83N55.6Low55.3Low112 Ų112119.1 Ų119.160%0.59960%0.596SS**Hα-helixtrans-67.9-40.5-179.6-95-81.8000112.9A79 T80 H85 Q86 Q87A79-N83 PolarHBondContact O-N 2.99Å; A79-N83 PolarHBondContact O-ND2 3.27Å; A79-N83 VanDerWaalsContact O-ND2 3.17Å; T80-N83 PolarHBondContact O-N 3.25Å; N83-H85 VanDerWaalsContact C-N 3.28Å; N83-H85 PolarHBondContact O-N 2.82Å; N83-Q86 PolarHBondContact O-N 3.35Å; N83-Q87 PolarHBondContact O-N 3.16Å; N83-Q87 VanDerWaalsContact O-N 3.08Å
84H58.3Low55.7Low116 Ų116117.5 Ų117.554%0.53759%0.587SS.*Hα-helixtrans-64.5-34.1179.8-166.7-91.7000112.2T80 Q88T80-H84 PolarHBondContact O-N 3.38Å; H84-Q88 PolarHBondContact CE1-NE2 2.8Å; H84-Q88 PolarHBondContact O-N 2.89Å
85H60Low55.9Low109 Ų109116.3 Ų116.351%0.50558%0.577SS.*Hα-helixtrans-75.1-36.7179.9-149-17.5000112.9Y82 N83 Q89Y82-H85 PolarHBondContact O-N 3.03Å; N83-H85 VanDerWaalsContact C-N 3.28Å; N83-H85 PolarHBondContact O-N 2.82Å; H85-Q89 PolarHBondContact O-N 3.31Å
86Q59.1Low55.8Low126 Ų126119.5 Ų119.559%0.58957%0.571SS**Hα-helixtrans-63.5-43.9173.2-89.1-99.9-2100111.9Y82 N83 Q88 Q89 Q90Y82-Q86 PolarHBondContact O-N 3.15Å; N83-Q86 PolarHBondContact O-N 3.35Å; Q86-Q88 VanDerWaalsContact C-N 3.34Å; Q86-Q88 PolarHBondContact O-N 3.09Å; Q86-Q89 PolarHBondContact O-N 2.84Å; Q86-Q89 VanDerWaalsContact O-N 3.13Å; Q86-Q90 PolarHBondContact O-N 3.38Å; Q86-Q90 VanDerWaalsContact O-N 3.08Å
87Q62.7Low55.8Low111 Ų111125.2 Ų125.252%0.51959%0.589SS.*Hα-helixtrans-67.2-33.8-179.5-160.1174.722.200112.5N83 R91N83-Q87 PolarHBondContact O-N 3.16Å; N83-Q87 VanDerWaalsContact O-N 3.08Å; Q87-R91 PolarHBondContact O-N 3.34Å
88Q60.7Low55.9Low98 Ų98124.1 Ų124.146%0.45859%0.592SS.*Hα-helixtrans-68.6-31172.6-75.7-165.1-9.400113.3H84 Q86 K92H84-Q88 PolarHBondContact CE1-NE2 2.8Å; H84-Q88 PolarHBondContact O-N 2.89Å; Q86-Q88 VanDerWaalsContact C-N 3.34Å; Q86-Q88 PolarHBondContact O-N 3.09Å; Q88-K92 WeakPolarHBondContact O-CG 3.06Å; Q88-K92 PolarHBondContact O-N 3.47Å
89Q60.2Low56Low114 Ų114124.7 Ų124.753%0.53360%0.597SS.*Hα-helixtrans-73.5-39.7175.6-70.2-168.13.900111.9H85 Q86 R91 K92 L93H85-Q89 PolarHBondContact O-N 3.31Å; Q86-Q89 PolarHBondContact O-N 2.84Å; Q86-Q89 VanDerWaalsContact O-N 3.13Å; Q89-R91 PolarHBondContact O-N 2.71Å; Q89-K92 PolarHBondContact O-N 2.83Å; Q89-L93 WeakPolarHBondContact O-CG 3.47Å; Q89-L93 PolarHBondContact O-N 2.96Å; Q89-L93 VanDerWaalsContact O-N 3.15Å
90Q59.8Low55.6Low126 Ų126127.3 Ų127.359%0.58960%0.598SS**Hα-helixtrans-63.5-38.9175.3-78.5179.9-13.400112.9Q86 K92 L93 S94Q86-Q90 PolarHBondContact O-N 3.38Å; Q86-Q90 VanDerWaalsContact O-N 3.08Å; Q90-K92 VanDerWaalsContact C-N 3.33Å; Q90-K92 PolarHBondContact O-N 3.2Å; Q90-L93 PolarHBondContact O-N 2.94Å; Q90-S94 PolarHBondContact O-N 3.44Å; Q90-S94 PolarHBondContact O-OG 3.41Å
91R59.8Low55.1Low179 Ų179128.2 Ų128.268%0.67561%0.607SS**Hα-helixtrans-65-33.4175.3-75-170.8-178.7-170.22.1113.5Q87 Q89 S94 A95Q87-R91 PolarHBondContact O-N 3.34Å; Q89-R91 PolarHBondContact O-N 2.71Å; R91-S94 WeakPolarHBondContact CA-OG 3.14Å; R91-S94 PolarHBondContact O-OG 3.08Å; R91-A95 PolarHBondContact O-N 3.03Å
92K59.2Low54.9Low156 Ų156124.9 Ų124.968%0.67861%0.606SS**Hα-helixtrans-70.9-36.1176.3-75.1178.7177.9-176.90111.9Q88 Q89 Q90 Y96Q88-K92 WeakPolarHBondContact O-CG 3.06Å; Q88-K92 PolarHBondContact O-N 3.47Å; Q89-K92 PolarHBondContact O-N 2.83Å; Q90-K92 VanDerWaalsContact C-N 3.33Å; Q90-K92 PolarHBondContact O-N 3.2Å; K92-Y96 PolarHBondContact O-N 2.82Å
93L55.8Low54.4Low115 Ų115125.4 Ų125.460%0.60261%0.614SS**Hα-helixtrans-72.9-35.2177.3-66.1162.9000112.3Q89 Q90 K97Q89-L93 WeakPolarHBondContact O-CG 3.47Å; Q89-L93 PolarHBondContact O-N 2.96Å; Q89-L93 VanDerWaalsContact O-N 3.15Å; Q90-L93 PolarHBondContact O-N 2.94Å; L93-K97 PolarHBondContact O-N 3.41Å
94S54.3Low53.9Low69 Ų69128.2 Ų128.248%0.48362%0.624SS.*Hα-helixtrans-72.1-30.6177.361.40000113.4Q90 R91 M98Q90-S94 PolarHBondContact O-N 3.44Å; Q90-S94 PolarHBondContact O-OG 3.41Å; R91-S94 WeakPolarHBondContact CA-OG 3.14Å; R91-S94 PolarHBondContact O-OG 3.08Å; S94-M98 WeakPolarHBondContact O-CG 3.42Å; S94-M98 PolarHBondContact O-N 2.96Å
95A56.2Low53.1Low66 Ų66132 Ų13255%0.54564%0.642SS.*Hα-helixtrans-70.4-37175.100000112.3R91R91-A95 PolarHBondContact O-N 3.03Å
96Y51Low52Low158 Ų158135.1 Ų135.162%0.6266%0.657SS**Hα-helixtrans-66.6-40.6174.7161.2-95.8000112.2K92 M98 Q99K92-Y96 PolarHBondContact O-N 2.82Å; Y96-M98 VanDerWaalsContact C-N 3.29Å; Y96-M98 PolarHBondContact O-N 2.76Å; Y96-Q99 PolarHBondContact O-N 3.49Å
97K48Very low51Low157 Ų157134.1 Ų134.168%0.68366%0.661SS**Hα-helixtrans-71.2-21.5-177.2-164.9164.6-177.31650114L93L93-K97 PolarHBondContact O-N 3.41Å
98M50.5Low50.1Low153 Ų153133.9 Ų133.975%0.75467%0.669SS**Hα-helixtrans-87.2-13.5175.8-67.2-69.5-71.500113.2S94 Y96S94-M98 WeakPolarHBondContact O-CG 3.42Å; S94-M98 PolarHBondContact O-N 2.96Å; Y96-M98 VanDerWaalsContact C-N 3.29Å; Y96-M98 PolarHBondContact O-N 2.76Å
99Q51.9Low49.1Very low145 Ų145138.5 Ų138.568%0.67869%0.691SS**Hα-helixtrans-81.5-24.7178.5-168.77531.600112.2Y96 T102Y96-Q99 PolarHBondContact O-N 3.49Å; Q99-T102 PolarHBondContact O-OG1 3.48Å; Q99-T102 VanDerWaalsContact O-OG1 3.04Å
100E44.3Very low47.7Very low118 Ų118136.8 Ų136.855%0.55170%0.704SS**G310 helixtrans-77.6-17.9-176-160.5173.1168.600113.2T102E100-T102 VanDerWaalsContact C-N 3.29Å; E100-T102 PolarHBondContact O-N 2.95Å
101C42.8Very low46.7Very low118 Ų118134.2 Ų134.280%0.79771%0.711SS**G310 helixtrans-81.81.5177.3-75.30000114.9
102T48Very low45.6Very low115 Ų115134.8 Ų134.871%0.70672%0.724SS**G310 helixtrans-103.7-3.4179.316.20000114.6Q99 E100Q99-T102 PolarHBondContact O-OG1 3.48Å; Q99-T102 VanDerWaalsContact O-OG1 3.04Å; E100-T102 VanDerWaalsContact C-N 3.29Å; E100-T102 PolarHBondContact O-N 2.95Å
103E44Very low44.8Very low172 Ų172138.6 Ų138.680%0.80473%0.734SS**SBendtrans-113.640.7-178.1-158.6-175.5111.600112.5
104Q45.3Very low44Very low172 Ų172136.6 Ų136.680%0.80474%0.741SS**SBendtrans-13919.6177.4-133.3113.671.900115.9
105Q42.6Very low43.3Very low195 Ų195141.6 Ų141.691%0.91176%0.759SS**  trans-132.387.1165.6-84.3-178.9-3.700110.8
106E35.4Very low43Very low175 Ų175146.4 Ų146.482%0.81877%0.774SS**  trans-109125.2158.6-124.9-110.8127.200107.2
107P38.2Very low42.6Very low104 Ų104147 Ų14768%0.67578%0.783SS**  trans-97144.8151.432.1-24.6000109.8
108P44.3Very low41.9Very low107 Ų107145.9 Ų145.970%0.69578%0.784SS**  trans-86.1149.5-168.734.9-33.6000112.1
109Q39.2Very low41.3Very low194 Ų194145 Ų14591%0.90778%0.783SS**  trans125.5131.2143.9-71.9-169.9-1200115.7
110G31.2Very low40.5Very low79 Ų79149.2 Ų149.281%0.81479%0.792SS**  trans114.589.2143.900000114
111G38.4Very low39.7Very low71 Ų71146.8 Ų146.873%0.73280%0.8SS**  trans-67.6160.6177.600000114.6
112M37.3Very low39.4Very low192 Ų192147.7 Ų147.795%0.94680%0.801SS**  -166.9149.3128.4-13169.4176.400110.3
113R41.3Very low38.8Very low235 Ų235150 Ų15089%0.88780%0.804SS**  trans-46.9151.6179.5-76167155.2-94.4-0.1115.4
114G39.1Very low38.1Very low73 Ų73150.1 Ų150.175%0.75380%0.804SS**  trans-67.8173.4169.400000115.3
115M41.3Very low37.4Very low175 Ų175147.3 Ų147.386%0.86280%0.804SS**  trans-161.5131.3158.7-136.1152.8159.400110.9
116L48.1Very low37.7Very low166 Ų166143.7 Ų143.787%0.86980%0.797SS**  trans-61.7146.8158.6-68.8143.8000110.2
117Q43.3Very low37.6Very low170 Ų170140 Ų14079%0.79480%0.797SS**  trans-165.4103.4155.6-106163.967.100107.1
118N33.1Very low37.3Very low134 Ų134140.1 Ų140.172%0.71781%0.807SS**  75.490.765.7-166.162000115
119N38.4Very low37Very low135 Ų135139.6 Ų139.672%0.72281%0.811SS**  61.3146.8112.6-143.86.6000122.3
120R34Very low36.6Very low233 Ų233136.4 Ų136.488%0.87981%0.805SS**  trans92.5134.7166.8-58.2-179.5-179.7-153-0.3116.3
121G29.1Very low37Very low68 Ų68138.6 Ų138.670%0.70180%0.802SS**  cis169.9148.8-0.300000111.8
122V36.2Very low36.7Very low137 Ų137143 Ų14383%0.8380%0.804SS**  trans52.6113.8143-165.80000120.7
123Q34.1Very low36.5Very low162 Ų162138.6 Ų138.676%0.75779%0.792SS**  177.6111.2122.2-102.3176.628.600110.5
124Q30.5Very low36Very low175 Ų175132.9 Ų132.982%0.81879%0.788SS**  82.2116.8103.5-77178.56.300115.9
125S30.4Very low36.1Very low113 Ų113135.1 Ų135.179%0.7979%0.789SS**  trans-84.2165.7160.3-143.60000108.9
126P48.3Very low35.8Very low119 Ų119138 Ų13877%0.77379%0.791SS**  cis-150.9163.643.737.8-13.8000120
127A33Very low35.1Very low99 Ų99135 Ų13582%0.81878%0.783SS**  trans41.7122.9143.100000123.8
128A33.8Very low34.6Very low106 Ų106132.5 Ų132.588%0.87679%0.785SS**  -163.5138.1129.200000111.2
129A36.2Very low35Very low95 Ų95130.7 Ų130.779%0.78579%0.788SS**  trans-78.5157.2-174.300000114
130T31.8Very low35.2Very low127 Ų127133.4 Ų133.478%0.77980%0.797SS**  trans174.4115.6137.2-73.50000110.5
131V39.7Very low35.3Very low126 Ų126128.1 Ų128.176%0.76480%0.795SS**  trans41.5138.1132.2-175.10000118.1
132E32.7Very low36Very low163 Ų163132.5 Ų132.576%0.76280%0.797SS**  cis-177.8149.4-6.4173.7161.2164.600106.7
133S33Very low36.6Very low100 Ų100133.4 Ų133.470%0.69980%0.797SS**  trans46.6120.515376.40000123.9
134S31Very low36.8Very low115 Ų115135.1 Ų135.180%0.80480%0.802SS**  116.1124118.4-143.60000117.8
135P41.2Very low37.4Very low119 Ų119133 Ų13377%0.77380%0.796SS**  trans-91.2139.4-176.435.3-31.5000114
136R34.7Very low38Very low236 Ų236131.9 Ų131.989%0.89179%0.788SS**  trans-16.5149.3135.5-68.7-179.6-164158.44113.5
137S32.7Very low38Very low103 Ų103132.3 Ų132.372%0.7279%0.789SS**  cis173.5157.921.234.80000108
138S32Very low38.5Very low118 Ų118134.6 Ų134.683%0.82578%0.782SS**  trans57109.1146.2-95.70000119.6
139A41.6Very low39.2Very low95 Ų95134.5 Ų134.579%0.78577%0.773SS**  trans-59.316214500000111.4
140E42.5Very low40.6Very low193 Ų193134.7 Ų134.790%0.90278%0.775SS**  trans10398.7171.1-156.2178.310500115.5
141S36.7Very low41.9Very low122 Ų122137.1 Ų137.185%0.85378%0.777SS**  trans-154.1122.6138.8-175.80000109
142E43.6Very low43.3Very low159 Ų159135.8 Ų135.874%0.74378%0.78SS**  trans-66.6162.5175.4-65.2-15099.300114.3
143L50.3Low45.5Very low156 Ų156136 Ų13682%0.81778%0.781SS**  trans53.9104.5145.9-88.2151.8000118.5
144K36.7Very low47.3Very low198 Ų198142.5 Ų142.586%0.86179%0.791SS**  trans-136.1114.4146.5-166.6157.7179.41750111S146K144-S146 PolarHBondContact O-N 3.15Å
145D43.9Very low49.8Very low132 Ų132141.1 Ų141.171%0.70677%0.774SS**  trans-31.8117.5156.4173.828.9000111.4T147D145-T147 PolarHBondContact OD1-OG1 3.28Å
146S42.4Very low51.8Low88 Ų88139.6 Ų139.662%0.61577%0.767SS**  trans-137.771.6175.2166.50000107.3K144 Q148K144-S146 PolarHBondContact O-N 3.15Å; S146-Q148 PolarHBondContact O-N 3.27Å
147T48.4Very low54.1Low128 Ų128134.4 Ų134.479%0.78577%0.766SS**  trans-68.257.9154.5-52.40000109.1D145D145-T147 PolarHBondContact OD1-OG1 3.28Å
148Q43.5Very low56.7Low147 Ų147140.5 Ų140.569%0.68777%0.774SS**  trans-100122.6164.3-79.1-73.2-20.800105.6S146 A150S146-Q148 PolarHBondContact O-N 3.27Å; Q148-A150 PolarHBondContact O-N 3.15Å
149P48.6Very low59.2Low105 Ų105137.8 Ų137.868%0.68275%0.754SS**  trans-55119.2168.323.2-29.2000106.3E151P149-E151 PolarHBondContact O-N 2.97Å
150A65.4Low61.3Low99 Ų99138.6 Ų138.682%0.81875%0.749SS**  trans-49.5114.5-178.400000108Q148 A152Q148-A150 PolarHBondContact O-N 3.15Å; A150-A152 PolarHBondContact O-N 3.28Å; A150-A152 VanDerWaalsContact O-N 3.1Å
151E58.6Low63.5Low178 Ų178135.4 Ų135.483%0.83274%0.737SS**  trans-58122.3178.1-81.7-163.4138.500107.4P149 E153P149-E151 PolarHBondContact O-N 2.97Å; E151-E153 PolarHBondContact O-N 2.83Å
152A69.9Low65.9Low98 Ų98136.1 Ų136.181%0.8173%0.725SS**  trans-70.598.1177.100000107.9A150 Y154A150-A152 PolarHBondContact O-N 3.28Å; A150-A152 VanDerWaalsContact O-N 3.1Å; A152-Y154 PolarHBondContact O-N 3.4Å
153E78.8Confident67.9Low168 Ų168134.5 Ų134.579%0.78573%0.726SS**  trans-66.4124.5175.4-69.9-176.5179.800110.1E151 L155E151-E153 PolarHBondContact O-N 2.83Å; E153-L155 PolarHBondContact O-N 3.4Å
154Y71.8Confident69.6Low236 Ų236135.7 Ų135.793%0.92572%0.722SS**  trans-79107.9176.8-135.9-94.2000109.2A152A152-Y154 PolarHBondContact O-N 3.4Å
155L82.4Confident72.1Confident85 Ų85131.9 Ų131.945%0.44571%0.705SS.*  trans-75.5153.3174.9-60.3176.5000110.7E153 C159 L161E153-L155 PolarHBondContact O-N 3.4Å; L155-C159 HydrophobicContact CB-CB 3.96Å; L155-C159 WeakPolarHBondContact CB-SG 3.17Å; L155-C159 HydrophobicContact CD1-CB 4.25Å; L155-L161 HydrophobicContact CD1-CD1 4.35Å
156S83Confident74.3Confident88 Ų88134.3 Ų134.362%0.61571%0.712SS**  trans-56.3150176.4-175.70000111.4R158 C159S156-R158 PolarHBondContact O-N 2.91Å; S156-C159 PolarHBondContact O-N 3.39Å; S156-C159 PolarHBondContact O-SG 2.95Å
157S83.3Confident76.5Confident126 Ų126132.5 Ų132.588%0.88171%0.707SS**THydrogen-bonded Turntrans-59.1-1.2-17856.30000116
158R88.1Confident78.7Confident231 Ų231131.1 Ų131.187%0.87270%0.695SS**THydrogen-bonded Turntrans-116.915.9179.9-58.4-179.366.51141.1113.6S156S156-R158 PolarHBondContact O-N 2.91Å
159C84.3Confident80.9Confident62 Ų62129.6 Ų129.642%0.41969%0.69SS.*  trans-89.7150.8175.465.80000112L155 S156L155-C159 HydrophobicContact CB-CB 3.96Å; L155-C159 WeakPolarHBondContact CB-SG 3.17Å; L155-C159 HydrophobicContact CD1-CB 4.25Å; S156-C159 PolarHBondContact O-N 3.39Å; S156-C159 PolarHBondContact O-SG 2.95Å
160V86.1Confident83.1Confident111 Ų111126 Ų12667%0.67367%0.673SS**  trans-113.4122163.5-179.10000106.6F162V160-F162 HydrophobicContact CB-CE2 4.18Å; V160-F162 HydrophobicContact CG1-CD2 4.19Å; V160-F162 HydrophobicContact CG1-CE1 4.28Å; V160-F162 HydrophobicContact CG1-CE2 3.61Å; V160-F162 HydrophobicContact CG1-CZ 3.67Å
161L88.3Confident84.4Confident126 Ų126126.4 Ų126.466%0.6666%0.661SS**  trans-94.2123.2175.7-177.762000109.2L155L155-L161 HydrophobicContact CD1-CD1 4.35Å
162F85.8Confident86.1Confident137 Ų137121.6 Ų121.660%0.60164%0.644SS**  trans-103.4107.8170.8-66.5-82.7000109V160 Y164V160-F162 HydrophobicContact CB-CE2 4.18Å; V160-F162 HydrophobicContact CG1-CD2 4.19Å; V160-F162 HydrophobicContact CG1-CE1 4.28Å; V160-F162 HydrophobicContact CG1-CE2 3.61Å; V160-F162 HydrophobicContact CG1-CZ 3.67Å; F162-Y164 HydrophobicContact CB-CD2 4.31Å; F162-Y164 HydrophobicContact CB-CE2 3.5Å; F162-Y164 HydrophobicContact CG-CE2 4.46Å
163T86.8Confident87.2Confident125 Ų125119.8 Ų119.877%0.76762%0.622SS**PPolyproline II helixtrans-95.9116.9170.9-49.70000108.2
164Y86.1Confident87.9Confident182 Ų182116.6 Ų116.671%0.71461%0.611SS**PPolyproline II helixtrans-99.5124.9175.8-62.2-81.2000109F162F162-Y164 HydrophobicContact CB-CD2 4.31Å; F162-Y164 HydrophobicContact CB-CE2 3.5Å; F162-Y164 HydrophobicContact CG-CE2 4.46Å
165F89.5Confident89.1Confident117 Ų117110 Ų11051%0.51359%0.588SS.*PPolyproline II helixtrans-80.8132.9169.5173.5-104.3000109.1G167 I169 V172F165-G167 WeakPolarHBondContact CE1-O 3.21Å; F165-I169 HydrophobicContact CD1-CG1 4.16Å; F165-I169 HydrophobicContact CE1-CG1 3.69Å; F165-V172 HydrophobicContact CE2-CG2 4.1Å; F165-V172 HydrophobicContact CZ-CB 4.39Å; F165-V172 HydrophobicContact CZ-CG2 3.74Å
166Q88.3Confident89.6Confident184 Ų184112.1 Ų112.186%0.8660%0.596SS**  trans-119.9107.8176.2-168.967.648.700108.6
167G90.5Very high90.1Very high49 Ų49113.6 Ų113.651%0.50559%0.591SS.*SBendtrans156.8173.2-179.400000112.1F165F165-G167 WeakPolarHBondContact CE1-O 3.21Å
168D92.9Very high90.6Very high100 Ų100111.2 Ų111.254%0.53558%0.575SS.*  trans-82.3129.7163.1-166.4-14.1000108.7G170 D171 V172D168-G170 PolarHBondContact O-N 3.31Å; D168-G170 PolarHBondContact OD1-N 2.89Å; D168-D171 HydrophobicContact CB-CB 4.27Å; D168-V172 PolarHBondContact O-N 3.39Å
169I91.4Very high90.8Very high114 Ų114107.5 Ų107.559%0.58556%0.561SS**Hα-helixtrans-66.4-35.7176.9-58169.3000109.2F165 V172 V173F165-I169 HydrophobicContact CD1-CG1 4.16Å; F165-I169 HydrophobicContact CE1-CG1 3.69Å; I169-V172 PolarHBondContact O-N 2.91Å; I169-V173 HydrophobicContact CG2-CG2 4.04Å; I169-V173 VanDerWaalsContact O-CB 3.29Å; I169-V173 WeakPolarHBondContact O-CB 3.27Å; I169-V173 WeakPolarHBondContact O-CG2 3.45Å; I169-V173 PolarHBondContact O-N 2.86Å
170G93.6Very high91.1Very high31 Ų31107.4 Ų107.432%0.3256%0.564SS.*Hα-helixtrans-57.9-50.817800000111.7D168 V172 V173 D174D168-G170 PolarHBondContact O-N 3.31Å; D168-G170 PolarHBondContact OD1-N 2.89Å; G170-V172 PolarHBondContact O-N 3.28Å; G170-V173 PolarHBondContact O-N 3.47Å; G170-D174 WeakPolarHBondContact O-CB 2.97Å; G170-D174 PolarHBondContact O-N 2.96Å
171D93.3Very high91.2Very high107 Ų107108.9 Ų108.957%0.57257%0.568SS**Hα-helixtrans-63.5-42.6179.9-67.6-20.8000112.6D168 V173 D174 E175D168-D171 HydrophobicContact CB-CB 4.27Å; D171-V173 VanDerWaalsContact C-N 3.32Å; D171-V173 PolarHBondContact O-N 3.07Å; D171-D174 PolarHBondContact O-N 2.78Å; D171-E175 VanDerWaalsContact O-CB 3.24Å; D171-E175 WeakPolarHBondContact O-CB 3.3Å; D171-E175 PolarHBondContact O-N 2.83Å
172V93.7Very high90.9Very high76 Ų76107 Ų10746%0.46157%0.565SS.*Hα-helixtrans-65.8-39.1179171.80000111.3F165 D168 I169 G170 H176F165-V172 HydrophobicContact CE2-CG2 4.1Å; F165-V172 HydrophobicContact CZ-CB 4.39Å; F165-V172 HydrophobicContact CZ-CG2 3.74Å; D168-V172 PolarHBondContact O-N 3.39Å; I169-V172 PolarHBondContact O-N 2.91Å; G170-V172 PolarHBondContact O-N 3.28Å; V172-H176 VanDerWaalsContact O-CB 3.27Å; V172-H176 WeakPolarHBondContact O-CB 3.29Å; V172-H176 PolarHBondContact O-N 2.93Å
173V93.9Very high90.4Very high60 Ų60107.3 Ų107.336%0.36457%0.568SS.*Hα-helixtrans-65.6-52.2174.7169.70000109.6I169 G170 D171 E175 H176 F177I169-V173 HydrophobicContact CG2-CG2 4.04Å; I169-V173 VanDerWaalsContact O-CB 3.29Å; I169-V173 WeakPolarHBondContact O-CB 3.27Å; I169-V173 WeakPolarHBondContact O-CG2 3.45Å; I169-V173 PolarHBondContact O-N 2.86Å; G170-V173 PolarHBondContact O-N 3.47Å; D171-V173 VanDerWaalsContact C-N 3.32Å; D171-V173 PolarHBondContact O-N 3.07Å; V173-E175 VanDerWaalsContact C-N 3.3Å; V173-E175 PolarHBondContact O-N 2.87Å; V173-H176 CarbonylContact O-C 3.6Å; V173-H176 WeakPolarHBondContact O-CA 3.49Å; V173-H176 WeakPolarHBondContact O-CB 3.35Å; V173-H176 PolarHBondContact O-N 3.15Å; V173-F177 HydrophobicContact CG1-CD2 3.53Å; V173-F177 HydrophobicContact CG1-CE2 3.58Å; V173-F177 VanDerWaalsContact O-CD2 3.27Å; V173-F177 WeakPolarHBondContact O-CD2 3.48Å; V173-F177 PolarHBondContact O-N 3.48Å
174D93.9Very high89.6Confident102 Ų102106.8 Ų106.855%0.54557%0.567SS.*Hα-helixtrans-60.5-38.7-178.8-77-6.9000112.1G170 D171 S178G170-D174 WeakPolarHBondContact O-CB 2.97Å; G170-D174 PolarHBondContact O-N 2.96Å; D171-D174 PolarHBondContact O-N 2.78Å; D174-S178 WeakPolarHBondContact O-CB 3.2Å; D174-S178 PolarHBondContact O-N 2.85Å; D174-S178 PolarHBondContact O-OG 3.38Å
175E95.3Very high88.3Confident97 Ų97102.7 Ų102.745%0.45357%0.565SS.*Hα-helixtrans-64.4-43.7172.2-175.5-179.4131.900111.5D171 V173 S178 R179D171-E175 VanDerWaalsContact O-CB 3.24Å; D171-E175 WeakPolarHBondContact O-CB 3.3Å; D171-E175 PolarHBondContact O-N 2.83Å; V173-E175 VanDerWaalsContact C-N 3.3Å; V173-E175 PolarHBondContact O-N 2.87Å; E175-S178 PolarHBondContact O-N 3.38Å; E175-R179 WeakPolarHBondContact O-CB 3.31Å; E175-R179 WeakPolarHBondContact O-CG 3.38Å; E175-R179 PolarHBondContact O-N 3.4Å; E175-R179 IonicContact OE1-CZ 2.87Å; E175-R179 IonicContact OE1-NE 3.87Å; E175-R179 IonicContact OE1-NH1 2.7Å; E175-R179 PolarHBondContact OE1-NH1 2.81Å; E175-R179 IonicContact OE1-NH2 2.65Å; E175-R179 PolarHBondContact OE1-NH2 2.84Å
176H94.1Very high86.7Confident129 Ų129102.8 Ų102.860%0.59758%0.58SS**Hα-helixtrans-61.4-47.1177.1-178.783.7000111.8V172 V173 R179 A180V172-H176 VanDerWaalsContact O-CB 3.27Å; V172-H176 WeakPolarHBondContact O-CB 3.29Å; V172-H176 PolarHBondContact O-N 2.93Å; V173-H176 CarbonylContact O-C 3.6Å; V173-H176 WeakPolarHBondContact O-CA 3.49Å; V173-H176 WeakPolarHBondContact O-CB 3.35Å; V173-H176 PolarHBondContact O-N 3.15Å; H176-R179 PolarHBondContact O-N 3.09Å; H176-A180 WeakPolarHBondContact O-CB 3.29Å; H176-A180 PolarHBondContact O-N 2.97Å
177F93.4Very high84.8Confident119 Ų119102.3 Ų102.352%0.52258%0.576SS.*Hα-helixtrans-66.2-44.2177.4-85.9-88.5000111.7V173 R179 A180 L181V173-F177 HydrophobicContact CG1-CD2 3.53Å; V173-F177 HydrophobicContact CG1-CE2 3.58Å; V173-F177 VanDerWaalsContact O-CD2 3.27Å; V173-F177 WeakPolarHBondContact O-CD2 3.48Å; V173-F177 PolarHBondContact O-N 3.48Å; F177-R179 VanDerWaalsContact C-N 3.3Å; F177-R179 PolarHBondContact O-N 2.88Å; F177-A180 PolarHBondContact O-N 2.99Å; F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 VanDerWaalsContact O-CG 3.32Å; F177-L181 WeakPolarHBondContact O-CG 3.35Å; F177-L181 PolarHBondContact O-N 2.84Å
178S92.8Very high82.5Confident76 Ų76104.2 Ų104.253%0.53158%0.581SS.*Hα-helixtrans-58.6-44176-640000111D174 E175 L181 S182D174-S178 WeakPolarHBondContact O-CB 3.2Å; D174-S178 PolarHBondContact O-N 2.85Å; D174-S178 PolarHBondContact O-OG 3.38Å; E175-S178 PolarHBondContact O-N 3.38Å; S178-L181 PolarHBondContact O-N 2.96Å; S178-S182 WeakPolarHBondContact O-CB 3.29Å; S178-S182 PolarHBondContact O-N 2.99Å; S178-S182 PolarHBondContact O-OG 3.36Å
179R92.6Very high80.5Confident153 Ų153105.1 Ų105.158%0.57759%0.59SS**Hα-helixtrans-62.7-46175-78.4179.7175.1146.510.1112.4E175 H176 F177 L181 S182 Q183E175-R179 WeakPolarHBondContact O-CB 3.31Å; E175-R179 WeakPolarHBondContact O-CG 3.38Å; E175-R179 PolarHBondContact O-N 3.4Å; E175-R179 IonicContact OE1-CZ 2.87Å; E175-R179 IonicContact OE1-NE 3.87Å; E175-R179 IonicContact OE1-NH1 2.7Å; E175-R179 PolarHBondContact OE1-NH1 2.81Å; E175-R179 IonicContact OE1-NH2 2.65Å; E175-R179 PolarHBondContact OE1-NH2 2.84Å; H176-R179 PolarHBondContact O-N 3.09Å; F177-R179 VanDerWaalsContact C-N 3.3Å; F177-R179 PolarHBondContact O-N 2.88Å; R179-L181 VanDerWaalsContact C-N 3.29Å; R179-L181 PolarHBondContact O-N 3.36Å; R179-S182 WeakPolarHBondContact CA-OG 3.31Å; R179-S182 PolarHBondContact O-N 3.13Å; R179-S182 PolarHBondContact O-OG 3.32Å; R179-Q183 VanDerWaalsContact O-CG 3.27Å; R179-Q183 WeakPolarHBondContact O-CG 3.39Å; R179-Q183 PolarHBondContact O-N 3.37Å
180A90.9Very high78.1Confident60 Ų60106 Ų10650%0.49659%0.592SS.*Hα-helixtrans-61.6-37.9-179.700000112.3H176 F177H176-A180 WeakPolarHBondContact O-CB 3.29Å; H176-A180 PolarHBondContact O-N 2.97Å; F177-A180 PolarHBondContact O-N 2.99Å
181L88Confident75.6Confident143 Ų143108.9 Ų108.975%0.74961%0.607SS**Hα-helixtrans-86.4-26.6-179.1-62.9176.3000113.5F177 S178 R179 Q183F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 VanDerWaalsContact O-CG 3.32Å; F177-L181 WeakPolarHBondContact O-CG 3.35Å; F177-L181 PolarHBondContact O-N 2.84Å; S178-L181 PolarHBondContact O-N 2.96Å; R179-L181 VanDerWaalsContact C-N 3.29Å; R179-L181 PolarHBondContact O-N 3.36Å; L181-Q183 PolarHBondContact O-N 3Å
182S81.4Confident72.9Confident85 Ų85110.8 Ų110.859%0.59461%0.61SS**Hα-helixtrans-75.9-8.4175.170.10000113.5S178 R179 P184S178-S182 WeakPolarHBondContact O-CB 3.29Å; S178-S182 PolarHBondContact O-N 2.99Å; S178-S182 PolarHBondContact O-OG 3.36Å; R179-S182 WeakPolarHBondContact CA-OG 3.31Å; R179-S182 PolarHBondContact O-N 3.13Å; R179-S182 PolarHBondContact O-OG 3.32Å; S182-P184 WeakPolarHBondContact O-CD 3.49Å; S182-P184 VanDerWaalsContact O-N 3.12Å
183Q76.5Confident70.4Confident144 Ų144112.7 Ų112.767%0.67362%0.624SS**SBendtrans-64.9109.9172.7-70.2-100.1-17.400107.5R179 L181 S185R179-Q183 VanDerWaalsContact O-CG 3.27Å; R179-Q183 WeakPolarHBondContact O-CG 3.39Å; R179-Q183 PolarHBondContact O-N 3.37Å; L181-Q183 PolarHBondContact O-N 3Å; Q183-S185 PolarHBondContact O-N 3.43Å
184P68.8Low68.1Low114 Ų114117 Ų11774%0.7464%0.644SS**  trans-58.4117.4170.625.7-31.4000105.8S182 S186S182-P184 WeakPolarHBondContact O-CD 3.49Å; S182-P184 VanDerWaalsContact O-N 3.12Å; P184-S186 PolarHBondContact O-N 2.99Å
185S60.1Low65.3Low97 Ų97122.7 Ų122.768%0.67866%0.657SS**  trans-51.1102.5177.7178.20000108.5Q183 F187Q183-S185 PolarHBondContact O-N 3.43Å; S185-F187 PolarHBondContact O-N 2.85Å; S185-F187 VanDerWaalsContact O-N 3.08Å; S185-F187 WeakPolarHBondContact OG-CB 3.47Å; S185-F187 PolarHBondContact OG-N 2.84Å
186S55.3Low62.6Low119 Ų119123.6 Ų123.683%0.83267%0.669SS**  trans-76.823.1169.4-171.50000110.5P184 S188P184-S186 PolarHBondContact O-N 2.99Å; S186-S188 PolarHBondContact O-N 2.83Å
187F49.3Very low59.8Low174 Ų174122.8 Ų122.876%0.76367%0.674SS**  trans-73.881.5150.6-100.8-93.2000107.3S185 V189S185-F187 PolarHBondContact O-N 2.85Å; S185-F187 VanDerWaalsContact O-N 3.08Å; S185-F187 WeakPolarHBondContact OG-CB 3.47Å; S185-F187 PolarHBondContact OG-N 2.84Å; F187-V189 VanDerWaalsContact C-N 3.27Å; F187-V189 PolarHBondContact O-N 2.75Å
188S41.5Very low57.1Low88 Ų88125.6 Ų125.662%0.61569%0.689SS**  trans-50.3107.3142.5179.50000105.8S186 E190S186-S188 PolarHBondContact O-N 2.83Å; S188-E190 PolarHBondContact O-N 3.2Å
189V50Low54.7Low119 Ų119127.9 Ų127.972%0.72170%0.699SS**  trans-64.583.5164.6174.20000105.6F187 S191F187-V189 VanDerWaalsContact C-N 3.27Å; F187-V189 PolarHBondContact O-N 2.75Å; V189-S191 PolarHBondContact O-N 3.4Å
190E41.1Very low51.7Low132 Ų132126.3 Ų126.362%0.61771%0.707SS**  trans-70.865.1160-175.574.8-150.600106.6S188 K192S188-E190 PolarHBondContact O-N 3.2Å; E190-K192 HydrophobicContact CG-CD 4.09Å; E190-K192 HydrophobicContact CG-CG 3.89Å; E190-K192 PolarHBondContact O-N 3.46Å; E190-K192 WeakPolarHBondContact OE1-CE 3.45Å; E190-K192 WeakPolarHBondContact OE1-CG 3.33Å
191S42.1Very low49.1Very low92 Ų92129.1 Ų129.164%0.64372%0.721SS**  trans-69.186.5155.3166.70000105.8V189 P193V189-S191 PolarHBondContact O-N 3.4Å; S191-P193 WeakPolarHBondContact O-CD 3.21Å
192K36.3Very low46.4Very low147 Ų147128.5 Ų128.564%0.63972%0.724SS**  trans-65.4114.1159.8-76.3162.3-178.9173.50108.4E190 I194E190-K192 HydrophobicContact CG-CD 4.09Å; E190-K192 HydrophobicContact CG-CG 3.89Å; E190-K192 PolarHBondContact O-N 3.46Å; E190-K192 WeakPolarHBondContact OE1-CE 3.45Å; E190-K192 WeakPolarHBondContact OE1-CG 3.33Å; K192-I194 PolarHBondContact O-N 3.1Å
193P40.5Very low44.4Very low117 Ų117129 Ų12976%0.7673%0.733SS**  trans-70.7110.9136.530.2-28.6000107S191 R195S191-P193 WeakPolarHBondContact O-CD 3.21Å; P193-R195 PolarHBondContact O-N 3.35Å; P193-R195 VanDerWaalsContact O-N 3.09Å
194I46.5Very low42.3Very low151 Ų151128.7 Ų128.777%0.77474%0.741SS**  trans-54.1114.3162.2-72.4165.1000107.5K192K192-I194 PolarHBondContact O-N 3.1Å
195R35.6Very low40.9Very low220 Ų220129.8 Ų129.883%0.8374%0.741SS**  174.8121.5119.5-90.3-153.7-81.3-134.43.1113.9P193P193-R195 PolarHBondContact O-N 3.35Å; P193-R195 VanDerWaalsContact O-N 3.09Å
196V37.4Very low40Very low116 Ų116131.8 Ų131.870%0.70374%0.744SS**  trans85.6106.8132.8-178.10000118.6
197T36.4Very low39.2Very low112 Ų112133.7 Ų133.769%0.68774%0.744SS**  trans68.6118.3143.5-47.50000115.5
198Q36.6Very low38.4Very low179 Ų179137.5 Ų137.584%0.83675%0.753SS**  -170.1148.157.1-150.7169.5-72.200110.6
199V41.5Very low38Very low124 Ų124140.8 Ų140.875%0.75276%0.756SS**  trans-31.1134.1165.9178.80000115
200T30.7Very low37.3Very low120 Ų120141.5 Ų141.574%0.73676%0.756SS**  177.8125.2116.5-670000111.2
201C36Very low36.8Very low118 Ų118139.1 Ų139.180%0.79777%0.767SS**  trans-66.7135.2167.1-43.50000109.9
202T30.2Very low36.2Very low131 Ų131138 Ų13880%0.80477%0.77SS**  trans-166.9119.8142.118.60000109.5
203A39.8Very low36.1Very low95 Ų95136.9 Ų136.979%0.78578%0.78SS**  trans-68.2135.8157.700000108.8
204T32.7Very low35.9Very low138 Ų138138.9 Ų138.985%0.84778%0.779SS**  trans-158.6127.2146.743.60000111.6
205N38.4Very low36Very low137 Ų137137 Ų13773%0.73378%0.777SS**  trans-36.3143156.2-102.6-39.9000114.7
206N41.4Very low35.9Very low139 Ų139133.5 Ų133.574%0.74378%0.775SS**  trans55.5146.9137.8-53.1-19.9000121.5
207L38.9Very low35.6Very low159 Ų159131.4 Ų131.483%0.83278%0.776SS**  trans79.195.7140.9-169.566.8000117.2
208W32.5Very low35.7Very low254 Ų254135.4 Ų135.496%0.96279%0.788SS**  -155.7150.1127.463.9-16.9000110.8
209K33.6Very low35.5Very low157 Ų157130.8 Ų130.868%0.68379%0.787SS**  trans-118.9159-159.8-158.9179.2155.3-71.90106.3
210D34.7Very low35.1Very low133 Ų133131 Ų13171%0.71179%0.789SS**  trans88.5124159.4-53.9-42.8000118.6
211G30.2Very low35.4Very low82 Ų82130.5 Ų130.585%0.84579%0.791SS**  110.898.2124.700000118.5
212G31.2Very low35.6Very low68 Ų68130 Ų13070%0.70179%0.788SS**  93.8111.2124.600000119.7
213S32.9Very low35.9Very low124 Ų124135.8 Ų135.887%0.86780%0.796SS**  trans66.6122.6135.137.80000121.1
214H37.2Very low35.5Very low159 Ų159137 Ų13774%0.73680%0.798SS**  trans-53156.4160.3-132.5-105.8000112.1D216H214-D216 PolarHBondContact ND1-N 3.33Å
215P47.7Very low35.4Very low113 Ų113135.7 Ų135.773%0.73480%0.795SS**  -142.7174.390.136.2-18.8000115.9
216D33.7Very low35.5Very low146 Ų146133.8 Ų133.878%0.78179%0.79SS**  trans-42.9149.5-174.9-57.4-70.1000118.5H214H214-D216 PolarHBondContact ND1-N 3.33Å
217G32.3Very low35.2Very low71 Ų71136.7 Ų136.773%0.73280%0.797SS**  trans161.770.9160.200000117.5
218Q38.4Very low35.6Very low197 Ų197133.5 Ų133.592%0.92179%0.785SS**  trans37.5111.6148-83.3166.8-40.600121.1
219G32.2Very low36Very low81 Ų81127.2 Ų127.284%0.83578%0.777SS**  trans-154.4103.4148.300000109
220T33.4Very low36.1Very low129 Ų129127.8 Ų127.879%0.79178%0.782SS**  trans-70.4140-175.148.10000112
221S36.3Very low36Very low110 Ų110127.3 Ų127.377%0.76978%0.784SS**  148.9150.4111.154.30000107.8
222S40.3Very low36.2Very low106 Ų106128.4 Ų128.474%0.74178%0.779SS**  cis-171.691.8-10.7-85.30000106.4
223W35.5Very low36.4Very low254 Ų254130.3 Ų130.396%0.96278%0.781SS**  trans-173.493.7144.7-135.2-58.3000110.6
224S32.9Very low36.2Very low119 Ų119130.4 Ų130.483%0.83278%0.78SS**  trans-150.9107.9159.948.60000107.5
225S30.1Very low36.3Very low112 Ų112130.7 Ų130.778%0.78379%0.786SS**  trans-89.1154173.7-174.30000110.1
226P41.2Very low36Very low97 Ų97131.3 Ų131.363%0.6379%0.79SS**  trans-99.2141.6-153.9-5.527.7000117.4
227F35.1Very low36.3Very low200 Ų200129.5 Ų129.588%0.87779%0.789SS**  trans67.4158150.2-60.7-68.9000122.5
228P45.9Very low36.4Very low91 Ų91133.1 Ų133.159%0.59180%0.797SS**  cis-127.6169.6-41.237.6-22.5000112.9
229P41.9Very low36.2Very low123 Ų123128.7 Ų128.780%0.79979%0.788SS**  trans-86.9128.1171.433.3-27.3000110.5
230Q34.1Very low36.5Very low169 Ų169129.5 Ų129.579%0.7979%0.786SS**  trans-118.4137172.3-70.5-74.3-32.200110.3
231V34Very low36.4Very low123 Ų123129.5 Ų129.575%0.74579%0.791SS**  trans-93.5151.9-175.9-74.10000111.3
232S33Very low36.5Very low105 Ų105130 Ų13073%0.73479%0.79SS**  trans80.3124.2150.9-55.20000121.9
233S35.8Very low36Very low107 Ų107133.2 Ų133.275%0.74879%0.793SS**  trans54.3124.4130.7-49.20000121.5
234C28.8Very low36.8Very low126 Ų126125.1 Ų125.185%0.85177%0.773SS**  156.6135.1118.7-73.10000112.2
235L39.7Very low36.6Very low166 Ų166126.7 Ų126.787%0.86977%0.767SS**  trans-63.9162.9163.5-61.5168.3000110.7
236P41.2Very low36.8Very low125 Ų125130.6 Ų130.681%0.81277%0.77SS**  -148155.788.434.8-15.6000116.9
237S39.6Very low36.5Very low108 Ų108130.7 Ų130.776%0.75577%0.773SS**  trans-62.2149.5159.9-64.50000113.3
238V34.8Very low36.3Very low148 Ų148126.4 Ų126.490%0.89777%0.768SS**  trans-143.9133.1139.6173.90000110.3
239S34.3Very low35.6Very low104 Ų104127.6 Ų127.673%0.72778%0.778SS**  trans-81.3156.7-177.9-54.60000114.8
240A38.9Very low35.6Very low97 Ų97127.4 Ų127.480%0.80278%0.778SS**  trans57.9128.8138.400000121.4
241S30.7Very low35.4Very low129 Ų129125.6 Ų125.690%0.90278%0.777SS**  trans-148.9133.4134.8-166.70000111.3
242V38.6Very low35.6Very low122 Ų122125 Ų12574%0.73978%0.779SS**  trans-91.2143.3-174.7169.80000108.9
243H30.4Very low35.6Very low172 Ų172129.2 Ų129.280%0.79678%0.784SS**  trans-139.3130.1150.3-157.2-84.7000112
244P51.5Low35.6Very low84 Ų84129.4 Ų129.455%0.54579%0.786SS.*  trans-97-179.8179.139.1-32.7000112.6
245E29Very low35.7Very low153 Ų153130.7 Ų130.772%0.71578%0.779SS**  trans80.6120.5179.7-55.2-172.5147.800114.4
246F35.4Very low36.3Very low193 Ų193127.7 Ų127.785%0.84677%0.769SS**  cis-146.2159.644.2-88.2-91.6000113.9
247S33.1Very low36.3Very low100 Ų100128.3 Ų128.370%0.69977%0.766SS**  trans-99.8149.1-170.1178.60000113.2
248S32Very low36Very low109 Ų109127 Ų12776%0.76277%0.769SS**  trans59.4116.8145.1-55.90000122.7
249S30.5Very low36.2Very low116 Ų116124.5 Ų124.581%0.81176%0.764SS**  154.8143.4103.4-1690000113
250P43.5Very low36.5Very low120 Ų120126.8 Ų126.878%0.77977%0.768SS**PPolyproline II helixtrans-94.3136.3179.935.7-29000112.5
251V29.9Very low36.4Very low130 Ų130134.4 Ų134.479%0.78878%0.776SS**PPolyproline II helixtrans-99.8126.5166.7153.50000109.8F253V251-F253 HydrophobicContact CG1-CD2 3.63Å; V251-F253 HydrophobicContact CG1-CE2 3.81Å
252S37Very low36.8Very low112 Ų112133 Ų13378%0.78377%0.772SS**PPolyproline II helixtrans-92.3132.6175.3-173.90000109.5
253F33.4Very low36.5Very low192 Ų192131.7 Ų131.784%0.84277%0.768SS**  trans-145.2144.9159.2-87-76000111.9V251V251-F253 HydrophobicContact CG1-CD2 3.63Å; V251-F253 HydrophobicContact CG1-CE2 3.81Å
254S36.3Very low36.7Very low112 Ų112132.3 Ų132.378%0.78377%0.771SS**  trans-86.6156.2-16239.90000116.1
255H30.7Very low36.1Very low153 Ų153135.1 Ų135.171%0.70879%0.786SS**  trans-53.4168.3162.6-14449.3000112.1D257H255-D257 IonicContact CD2-OD1 3.8Å; H255-D257 IonicContact CE1-OD1 3.75Å; H255-D257 IonicContact NE2-OD1 2.91Å; H255-D257 PolarHBondContact NE2-OD1 2.9Å
256P52.6Low36.3Very low102 Ų102135.8 Ų135.866%0.66279%0.794SS**  cis-149.7172.927.742.5-19.7000120.2
257D40.6Very low36.2Very low139 Ų139131.6 Ų131.674%0.74379%0.788SS**  trans27.5133.9147.7-50.3-25.3000122.5H255H255-D257 IonicContact CD2-OD1 3.8Å; H255-D257 IonicContact CE1-OD1 3.75Å; H255-D257 IonicContact NE2-OD1 2.91Å; H255-D257 PolarHBondContact NE2-OD1 2.9Å
258G31.9Very low36.1Very low79 Ų79136.4 Ų136.481%0.81480%0.8SS**  trans160.2114.1158.500000116.4
259A39.9Very low36.1Very low97 Ų97135.6 Ų135.680%0.80280%0.8SS**  trans-62.4133.9178.800000114.6
260L40.7Very low36.1Very low152 Ų152135.9 Ų135.980%0.79680%0.802SS**  trans-161.7113.1155.2-72-178.3000109.3
261W37.4Very low35.7Very low256 Ų256137.1 Ų137.197%0.9780%0.8SS**  trans-160.384.9132.4-77.2115000107.9
262A39.3Very low35.9Very low99 Ų99136.3 Ų136.382%0.81880%0.798SS**  trans-81.2119.7151.800000107.1
263S30.8Very low35.7Very low95 Ų95136.4 Ų136.466%0.66480%0.798SS**  trans-157.9139.5153.7-158.30000110.1
264H36.1Very low36Very low185 Ų185132.8 Ų132.886%0.85679%0.794SS**  trans96.879.5179-55-72.5000117.1
265V37.6Very low35.8Very low143 Ų143131.5 Ų131.587%0.86779%0.791SS**  trans-113.3114.1153.2-96.70000109.5
266L33.9Very low36.2Very low168 Ų168129.2 Ų129.288%0.8879%0.792SS**  trans171.9125.6145.1-123.967.2000105.8
267S33.3Very low35.2Very low104 Ų104132.8 Ų132.873%0.72780%0.804SS**  cis-150.9128.916.8-65.70000110.7
268Q31.4Very low34.9Very low201 Ų201130.8 Ų130.894%0.93980%0.801SS**  trans7.9110.5140.8-157.3171.650.700119.5
269A31.1Very low34.9Very low93 Ų93134.1 Ų134.177%0.76980%0.801SS**  trans-149.4133.2138.600000108.8
270S30.6Very low34.6Very low121 Ų121134.7 Ų134.785%0.84680%0.798SS**PPolyproline II helixtrans-53.4132.3-170.1-169.90000114.8
271I34.7Very low34.4Very low146 Ų146139.1 Ų139.175%0.74981%0.805SS**PPolyproline II helixtrans-101.3124.1168.9-52.2170.6000107.9
272P35.5Very low34.4Very low114 Ų114132.5 Ų132.574%0.7479%0.793SS**PPolyproline II helixtrans-79.8132.3154.730.3-26.8000109.8
273S32.4Very low34Very low113 Ų113138.3 Ų138.379%0.7980%0.795SS**PPolyproline II helixtrans-50.9131.8179.8-158.30000112.7A275S273-A275 PolarHBondContact O-N 3.47Å
274P38.4Very low34.2Very low117 Ų117139.1 Ų139.176%0.7680%0.801SS**  trans-80.8114.5174.529.6-29.6000110.6
275A33.8Very low34.5Very low85 Ų85138.2 Ų138.270%0.70280%0.801SS**  trans-59.9143.2164.600000111.1S273 L277S273-A275 PolarHBondContact O-N 3.47Å; A275-L277 PolarHBondContact O-N 2.95Å
276S38.2Very low34.1Very low104 Ų104136.7 Ų136.773%0.72780%0.797SS**  trans-9.7114164.3580000117
277L31.4Very low34.5Very low177 Ų177134.6 Ų134.693%0.92779%0.793SS**  trans-112.6103.7149.1-76174.2000108.4A275A275-L277 PolarHBondContact O-N 2.95Å
278S34.9Very low34.8Very low98 Ų98138.7 Ų138.769%0.68580%0.801SS**  trans-65.6129.4162.5-57.30000109.1
279D31.4Very low34.7Very low149 Ų149133.1 Ų133.180%0.79779%0.79SS**  trans172.280.8131.7-84.9-29.4000108.7
280S34.4Very low35Very low108 Ų108135.3 Ų135.376%0.75579%0.793SS**  trans-118.3109158.3-72.10000106.2T282S280-T282 PolarHBondContact O-N 3.21Å
281W35.6Very low35.2Very low245 Ų245135.6 Ų135.693%0.92880%0.796SS**  trans-54.1101.9179-75.977.2000110.1
282T37.8Very low35Very low118 Ų118132.1 Ų132.172%0.72480%0.795SS**  trans-101.1107.6170.844.80000107.7S280 S284S280-T282 PolarHBondContact O-N 3.21Å; T282-S284 PolarHBondContact O-N 3.23Å
283Y30.2Very low35Very low221 Ų221137.3 Ų137.387%0.86780%0.802SS**  trans-58.4104.5162.7-94.6-94000107.8L285Y283-L285 PolarHBondContact O-N 2.79Å; Y283-L285 VanDerWaalsContact O-N 3.15Å
284S34.8Very low35.6Very low112 Ų112137.7 Ų137.778%0.78380%0.801SS**  trans-75.299.4172-69.80000108.8T282 S286T282-S284 PolarHBondContact O-N 3.23Å; S284-S286 PolarHBondContact O-N 3Å
285L41.9Very low35.7Very low166 Ų166137.9 Ų137.987%0.86980%0.796SS**  trans-72.7106161.1-72168000107.4Y283 P287Y283-L285 PolarHBondContact O-N 2.79Å; Y283-L285 VanDerWaalsContact O-N 3.15Å; L285-P287 WeakPolarHBondContact O-CD 3.33Å
286S31Very low36.1Very low110 Ų110140.3 Ų140.377%0.76980%0.802SS**  trans-64.6123174.6-162.10000110.2S284 Q288S284-S286 PolarHBondContact O-N 3Å; S286-Q288 PolarHBondContact O-N 3.28Å
287P40.7Very low36.5Very low124 Ų124143.9 Ų143.981%0.80581%0.807SS**  trans-84.6105.2166.229.6-25.4000109.2L285L285-P287 WeakPolarHBondContact O-CD 3.33Å
288Q39.7Very low37Very low190 Ų190142.5 Ų142.589%0.88880%0.8SS**  trans-91.9108.4168.7-172178.79.700110.2S286S286-Q288 PolarHBondContact O-N 3.28Å
289A30.6Very low37.4Very low85 Ų85142.6 Ų142.670%0.70280%0.797SS**  trans177119.2145.300000106.3
290T36.9Very low37.8Very low138 Ų138145.7 Ų145.785%0.84780%0.799SS**  -168.1158.159.849.70000109.7
291S34.4Very low38.3Very low128 Ų128149.4 Ų149.490%0.89580%0.804SS**  trans110.6113161.8-160.90000116.5
292G30.3Very low38.2Very low72 Ų72142.5 Ų142.574%0.74279%0.793SS**  trans108.285.5145.500000118
293Y35.2Very low38.8Very low224 Ų224145.9 Ų145.988%0.87880%0.8SS**  trans-71.8144.2146.6-101.9-90.2000108.6
294P46.6Very low39.8Very low120 Ų120141.4 Ų141.478%0.77980%0.798SS**  -138.9137.576.731.3-11.6000114
295N40.4Very low40.3Very low122 Ų122147.9 Ų147.965%0.65281%0.805SS**  64.5109.4103.8-158.8-15.9000115.1
296V42.4Very low40.1Very low135 Ų135145.5 Ų145.582%0.81880%0.802SS**  -169.3125.1114.2-86.90000110.7
297H46Very low40.7Very low179 Ų179148.1 Ų148.183%0.82980%0.802SS**  trans-65.8132.1163.5-79.9-84000110.5
298D41.9Very low41.2Very low148 Ų148147.3 Ų147.379%0.79180%0.797SS**  trans-138.899.1147.8-106.7-47.6000107.3
299V43.1Very low41.3Very low101 Ų101145.7 Ų145.761%0.61279%0.789SS**  86.5101101168.90000111.3H301V299-H301 PolarHBondContact O-N 3.35Å
300Y40.1Very low42Very low214 Ų214148.7 Ų148.784%0.83979%0.792SS**  trans-26117.9154.3-85.8-101.7000112.8
301H44.2Very low42.2Very low185 Ų185150.6 Ų150.686%0.85679%0.791SS**  trans-126.5109.8150.7-85.4-2000110.9V299V299-H301 PolarHBondContact O-N 3.35Å
302S34.5Very low42.5Very low100 Ų100151 Ų15170%0.69979%0.788SS**  trans-67.8145.1-179.1-43.40000112.2
303H50.5Low43Very low190 Ų190157.3 Ų157.388%0.8879%0.79SS**  trans-52.5153.4164.9-58.5-61.9000113.1
304P49.8Very low43.2Very low127 Ų127153.3 Ų153.383%0.82578%0.778SS**  trans-121.8128.4138.426.9-12.8000112.3
305R46.3Very low42.9Very low247 Ų247155.8 Ų155.893%0.93278%0.779SS**  trans-65.3140.5162.5-85.9178166.3146.3-4.1110.2
306S37.7Very low42.9Very low116 Ų116158.5 Ų158.581%0.81179%0.788SS**  trans-150.498.1148.860.20000110.8
307H43.9Very low42.6Very low166 Ų166158 Ų15877%0.76979%0.79SS**  trans-87.8140.6155.7-94.1-72.4000108.5
308P51.2Low42.6Very low107 Ų107157.7 Ų157.770%0.69579%0.791SS**  trans-117.9120.2145.731.4-18.8000110
309H40.3Very low42.6Very low156 Ų156158.6 Ų158.672%0.72280%0.795SS**  trans-80.4125.1159-75.2-76.7000108.4
310I46.5Very low42.3Very low148 Ų148162.2 Ų162.276%0.75981%0.805SS**  trans-127.6117.3161.2-63.1177.7000107.5
311H40.6Very low42.2Very low177 Ų177157.6 Ų157.682%0.81980%0.804SS**  trans-88.1123.9165-74.4-76.4000109
312T41.4Very low41.8Very low137 Ų137159.3 Ų159.384%0.8480%0.804SS**  trans-141.6133.2154.9-11.20000109.4
313R41.4Very low41.7Very low205 Ų205158.1 Ų158.177%0.77480%0.796SS**  trans-98.5142.2-165.5-153.8-160.1-80.1-143.67.1109.8
314H38.8Very low41.2Very low139 Ų139154.7 Ų154.764%0.64479%0.791SS**  trans76135.6167.6-49.5-68.2000115.8
315H40.8Very low40.7Very low172 Ų172156.6 Ų156.680%0.79679%0.789SS**  cis-152.8163.434.2-77-95.4000111.9
316H38.9Very low40.2Very low179 Ų179149.9 Ų149.983%0.82978%0.779SS**  trans-58141176.4-57.2-93.6000114.5
317S37.4Very low40.6Very low125 Ų125149.2 Ų149.287%0.87477%0.772SS**  trans-163.6137.4131.9-89.50000112.9
318M46.2Very low40.8Very low173 Ų173146.4 Ų146.485%0.85278%0.778SS**  trans-48.8140.7176.2-63.3-86.4-166.500112.6
319L40.2Very low40.8Very low166 Ų166148.1 Ų148.187%0.86978%0.78SS**  176.1108.7127.8-89.3167.1000108.7S321L319-S321 PolarHBondContact O-N 3.15Å
320H37.2Very low41.1Very low177 Ų177143.5 Ų143.582%0.81976%0.761SS**  trans-71.3105.6172.8-79.8-80.5000110.2Y322H320-Y322 PolarHBondContact O-N 2.88Å
321S37.3Very low41.6Very low117 Ų117141.6 Ų141.682%0.81876%0.758SS**  trans-80.6102.7161.4-580000108.8L319 S323L319-S321 PolarHBondContact O-N 3.15Å; S321-S323 PolarHBondContact O-N 2.95Å
322Y36.6Very low42.4Very low221 Ų221142.3 Ų142.387%0.86775%0.754SS**  trans-61.7116.4164.8-88-95.1000109H320H320-Y322 PolarHBondContact O-N 2.88Å
323S33.1Very low42.9Very low76 Ų76142 Ų14253%0.53174%0.741SS.*  trans-89.7120.7164.1-175.10000109S321 H325S321-S323 PolarHBondContact O-N 2.95Å; S323-H325 PolarHBondContact O-N 3.49Å; S323-H325 PolarHBondContact OG-CD2 2.89Å; S323-H325 PolarHBondContact OG-CE1 2.94Å; S323-H325 PolarHBondContact OG-NE2 3.42Å
324P40.2Very low43.4Very low118 Ų118137.6 Ų137.677%0.76673%0.733SS**  trans-90.585.5175.134.9-27.1000108.7
325H37.7Very low44.2Very low167 Ų167135.6 Ų135.677%0.77374%0.74SS**  trans-106.582161.5-57.4-42.7000107.8S323S323-H325 PolarHBondContact O-N 3.49Å; S323-H325 PolarHBondContact OG-CD2 2.89Å; S323-H325 PolarHBondContact OG-CE1 2.94Å; S323-H325 PolarHBondContact OG-NE2 3.42Å
326S37Very low44.9Very low105 Ų105134.5 Ų134.573%0.73474%0.739SS**  trans-88.5118.5166.1-172.80000107.8A328S326-A328 PolarHBondContact O-N 2.87Å
327P45.1Very low45.8Very low103 Ų103132.2 Ų132.267%0.66973%0.732SS**  trans-67.6126.6167.827.7-28.7000107.7L329P327-L329 PolarHBondContact O-N 3.47Å
328A49.4Very low46.5Very low106 Ų106133.9 Ų133.988%0.87673%0.731SS**  trans-51.6102.8179.700000110.9S326S326-A328 PolarHBondContact O-N 2.87Å
329L50.5Low46.5Very low144 Ų144131.7 Ų131.775%0.75473%0.729SS**  trans-77.7130.2169.7-68.7171.9000108.4P327P327-L329 PolarHBondContact O-N 3.47Å
330D46.8Very low46.6Very low59 Ų59127.1 Ų127.132%0.31672%0.722SS.*  trans-50.7128.8174.5175.7-4.6000110.5R332 F333D330-R332 PolarHBondContact O-N 3.23Å; D330-R332 WeakPolarHBondContact OD1-CG 3.17Å; D330-R332 PolarHBondContact OD1-N 2.91Å; D330-R332 IonicContact OD1-NE 3.4Å; D330-R332 PolarHBondContact OD1-NE 3.48Å; D330-R332 IonicContact OD2-CZ 3.23Å; D330-R332 VanDerWaalsContact OD2-CZ 3.23Å; D330-R332 IonicContact OD2-NE 2.84Å; D330-R332 PolarHBondContact OD2-NE 3.31Å; D330-R332 IonicContact OD2-NH2 2.75Å; D330-R332 PolarHBondContact OD2-NH2 3.4Å; D330-F333 HydrophobicContact CB-CD2 3.99Å; D330-F333 HydrophobicContact CB-CE2 4.13Å; D330-F333 PolarHBondContact O-N 3.08Å; D330-F333 VanDerWaalsContact O-N 3.1Å
331P57.6Low46.8Very low108 Ų108125.1 Ų125.170%0.70172%0.722SS**G310 helixtrans-57.6-13.2-176.620.6-32.3000114.4F333 N334P331-F333 PolarHBondContact O-N 3.48Å; P331-N334 PolarHBondContact O-N 3.21Å
332R57.8Low47.1Very low192 Ų192131 Ų13173%0.72573%0.726SS**G310 helixtrans-69.4-14.3175.8-62.7-174.4-58.51484.3114.7D330D330-R332 PolarHBondContact O-N 3.23Å; D330-R332 WeakPolarHBondContact OD1-CG 3.17Å; D330-R332 PolarHBondContact OD1-N 2.91Å; D330-R332 IonicContact OD1-NE 3.4Å; D330-R332 PolarHBondContact OD1-NE 3.48Å; D330-R332 IonicContact OD2-CZ 3.23Å; D330-R332 VanDerWaalsContact OD2-CZ 3.23Å; D330-R332 IonicContact OD2-NE 2.84Å; D330-R332 PolarHBondContact OD2-NE 3.31Å; D330-R332 IonicContact OD2-NH2 2.75Å; D330-R332 PolarHBondContact OD2-NH2 3.4Å
333F50.8Low46.8Very low129 Ų129125.4 Ų125.457%0.56672%0.72SS**G310 helixtrans-102.44.6179.2-60.2-78000114.1D330 P331 A335D330-F333 HydrophobicContact CB-CD2 3.99Å; D330-F333 HydrophobicContact CB-CE2 4.13Å; D330-F333 PolarHBondContact O-N 3.08Å; D330-F333 VanDerWaalsContact O-N 3.1Å; P331-F333 PolarHBondContact O-N 3.48Å; F333-A335 VanDerWaalsContact C-N 3.28Å; F333-A335 PolarHBondContact O-N 3.45Å
334N51.8Low46.9Very low114 Ų114130.8 Ų130.861%0.6174%0.737SS**G310 helixtrans-77.8-8.4-176.5-133.2-21.3000114.1P331 L336P331-N334 PolarHBondContact O-N 3.21Å; N334-L336 VanDerWaalsContact C-N 3.3Å; N334-L336 PolarHBondContact O-N 3.37Å
335A55.4Low46.6Very low96 Ų96130.5 Ų130.579%0.79374%0.737SS**G310 helixtrans-81.5-4.3178.800000114.1F333F333-A335 VanDerWaalsContact C-N 3.28Å; F333-A335 PolarHBondContact O-N 3.45Å
336L57Low46.4Very low149 Ų149132.1 Ų132.178%0.7875%0.745SS**G310 helixtrans-106.91.5-179-62.7176.8000113.6N334N334-L336 VanDerWaalsContact C-N 3.3Å; N334-L336 PolarHBondContact O-N 3.37Å
337L56.3Low46.2Very low131 Ų131131.6 Ų131.669%0.68675%0.747SS**SBendtrans-94.5106.2171.9-65.8173.7000108.9
338L52.7Low45.5Very low161 Ų161131.2 Ų131.284%0.84375%0.753SS**  trans-55.9140.8172.1-73.1150.8000110.1G340L338-G340 PolarHBondContact O-N 2.91Å
339P46.5Very low44.6Very low126 Ų126132.2 Ų132.282%0.81875%0.749SS**  trans-57.4109.5177.9-22.932.6000110.9V341P339-V341 PolarHBondContact O-N 3.39Å
340G42.4Very low43.6Very low70 Ų70131 Ų13172%0.72275%0.752SS**  trans-59.8128.4177.700000111.4L338 R342L338-G340 PolarHBondContact O-N 2.91Å; G340-R342 PolarHBondContact O-N 3.37Å
341V40.4Very low43.1Very low136 Ų136134.5 Ų134.582%0.82478%0.778SS**  trans-49102.5165.7171.90000109P339 S343P339-V341 PolarHBondContact O-N 3.39Å; V341-S343 PolarHBondContact O-N 2.91Å
342R43.2Very low41.8Very low239 Ų239132.5 Ų132.590%0.90278%0.777SS**  trans-82.9103.5167.2-170.6173.5-175.6144.8-0.2107.9G340 Q344G340-R342 PolarHBondContact O-N 3.37Å; R342-Q344 PolarHBondContact O-N 3.08Å; R342-Q344 VanDerWaalsContact O-N 3.13Å
343S30.8Very low40.6Very low105 Ų105129.3 Ų129.373%0.73478%0.784SS**  trans-55.9111171.1-48.20000110.2V341 S345V341-S343 PolarHBondContact O-N 2.91Å; S343-S345 PolarHBondContact O-N 3.5Å
344Q35.6Very low39.6Very low189 Ų189128.4 Ų128.488%0.88379%0.794SS**  trans-79.3101.2173.5-176.7171400108.8R342R342-Q344 PolarHBondContact O-N 3.08Å; R342-Q344 VanDerWaalsContact O-N 3.13Å
345S32.8Very low39.2Very low111 Ų111128.1 Ų128.178%0.77680%0.798SS**  trans-151.584.9166.7-77.60000109.7S343S343-S345 PolarHBondContact O-N 3.5Å
346Q34.8Very low37.9Very low201 Ų201131.7 Ų131.794%0.93980%0.798SS**  trans-162.7132.4145.3-112.6170.115.100109.8
347A32.3Very low36.7Very low94 Ų94128.8 Ų128.878%0.77779%0.791SS**  trans-94.1163.2-17100000112.4
348A31Very low35.5Very low95 Ų95130.5 Ų130.579%0.78580%0.8SS**  trans68.3130.7165.400000114.8
349T30.6Very low34.4Very low128 Ų128126.7 Ų126.779%0.78580%0.8SS**  cis-160137.440.640.40000110.6
350S29.5Very low33.5Very low118 Ų118124.4 Ų124.483%0.82580%0.799SS**  trans-172139.5131.6-820000112.3
351P35.8Very low33Very low132 Ų132131.1 Ų131.186%0.85781%0.808SS**  trans-93.2155.5-16838-33.5000112.2
352G30.5Very low32.7Very low67 Ų67128.7 Ų128.769%0.69180%0.803SS**  trans159.997161.400000116
353S31.6Very low31.9Very low125 Ų125126.1 Ų126.187%0.87480%0.801SS**  trans60.7107.6148.951.60000120.9
354S29.7Very low32.2Very low110 Ų110127.9 Ų127.977%0.76980%0.801SS**  trans-69169.6138-155.20000109
355P44.7Very low32Very low108 Ų108125.5 Ų125.570%0.70179%0.794SS**  cis-151.3173.621.446.8-26.3000118.9
356H27.7Very low32Very low170 Ų170127.3 Ų127.379%0.78780%0.795SS**  trans81.4140135.3-146.7-85.4000123.1
357S32.7Very low31.8Very low89 Ų89121.2 Ų121.262%0.62279%0.785SS**  trans81.9107152.928.30000122.4
358D30.9Very low31.7Very low167 Ų167121.7 Ų121.789%0.89378%0.783SS**  36.1123.5115.8-93.2-36000121.2
359G29.3Very low31.7Very low81 Ų81124.6 Ų124.684%0.83579%0.785SS**  90.6126.712100000118.4
360G28.3Very low31.8Very low77 Ų77124 Ų12479%0.79479%0.787SS**  trans12487.5147.900000117.5
361K31.2Very low32.4Very low212 Ų212123.4 Ų123.492%0.92278%0.78SS**  trans13.2122130.8-158.1-173.8-168.3-125.70118
362A32.9Very low32.3Very low85 Ų85124.5 Ų124.570%0.70278%0.777SS**  151.6150.7117.700000114
363E28.3Very low32.3Very low185 Ų185126.6 Ų126.686%0.86478%0.781SS**  trans89.388.8145-133.7162.5132.600120.3
364L36.3Very low32.3Very low141 Ų141125.7 Ų125.774%0.73878%0.781SS**  1.6120.7123.2-161135.4000117.1
365D31.2Very low32.3Very low139 Ų139125 Ų12574%0.74378%0.782SS**  -168.9156.7109-137.8-51.8000111.9
366L32.8Very low31.7Very low150 Ų150125.6 Ų125.679%0.78579%0.789SS**  trans-77.7157.7-165.2-67.595.5000114.4
367G29.5Very low31.9Very low72 Ų72123.6 Ų123.674%0.74279%0.788SS**  trans-170.878.9164.400000112.3
368S30.4Very low31.6Very low104 Ų104124.5 Ų124.573%0.72780%0.795SS**  trans-11129.4160.254.60000115.9
369N30.8Very low31.5Very low156 Ų156127.4 Ų127.483%0.83479%0.793SS**  -156.4124.883.1-75.2-20.5000111.4
370S33.6Very low31.8Very low117 Ų117129.2 Ų129.282%0.81879%0.788SS**  trans-114.4153.2160-98.20000106.4
371P43.1Very low32.3Very low105 Ų105130.9 Ų130.968%0.68279%0.785SS**  -147.9149.762.922.93.1000118.9
372I33.7Very low32.6Very low155 Ų155126.6 Ų126.680%0.79578%0.779SS**  71.6131.1127.4-61168000117.2
373S30.5Very low32.6Very low110 Ų110127.3 Ų127.377%0.76979%0.785SS**  cis-171.2166.9-3.5-109.40000110.1
374A30.9Very low33Very low106 Ų106127 Ų12788%0.87679%0.788SS**  trans105.882.2150.100000116.5
375A30.2Very low33Very low95 Ų95129.4 Ų129.479%0.78580%0.795SS**  trans-110.3145.2152.100000110.1
376S32Very low33Very low122 Ų122126.1 Ų126.185%0.85380%0.795SS**PPolyproline II helixtrans-49.7141.1178.849.20000116
377V32.2Very low32.9Very low127 Ų127124.5 Ų124.577%0.7780%0.796SS**PPolyproline II helixtrans-101.5121.7170.3177.20000110.1
378S26.3Very low33.4Very low108 Ų108127.9 Ų127.976%0.75580%0.796SS**PPolyproline II helixtrans-88129.1165.5178.20000109.2
379W27.7Very low33.6Very low228 Ų228131.5 Ų131.586%0.86480%0.802SS**PPolyproline II helixtrans-88.8130.1177.5-97.477.3000111.4
380T35Very low33.9Very low120 Ų120129.1 Ų129.174%0.73679%0.793SS**  trans-139.4135.8160.5-70000107.9
381P39Very low34.1Very low112 Ų112134.5 Ų134.573%0.72780%0.797SS**  trans-92.9147.8-175.235-31.1000112.1
382P37.8Very low33.8Very low121 Ų121135.6 Ų135.679%0.78680%0.797SS**  trans-114.2144.9158.933.5-21.6000112.8
383A34.3Very low34Very low101 Ų101133.8 Ų133.884%0.83580%0.798SS**  trans-65.6142.2169.300000111.2
384L36.1Very low34.6Very low177 Ų177132.6 Ų132.693%0.92780%0.795SS**  trans-121.7125.9168.7-85.3169.8000111.2
385H35.5Very low35.2Very low192 Ų192136 Ų13689%0.88980%0.796SS**  trans-106.7129.7173.3-148-93.3000106.6
386G32.5Very low35.8Very low71 Ų71137.9 Ų137.973%0.73279%0.793SS**  trans78.9129.5141.700000121.9
387S30.7Very low36.1Very low116 Ų116139.8 Ų139.881%0.81179%0.789SS**  trans100.998.7135.3-152.10000119.9
388L38.3Very low36.3Very low143 Ų143140 Ų14075%0.74979%0.79SS**  20124.7120.2-16580.1000116.9
389E36Very low37Very low180 Ų180143 Ų14384%0.84179%0.79SS**  -165.3142.8129-88.1-98.2121.900110.1
390T37.7Very low37.4Very low105 Ų105139.6 Ų139.664%0.64479%0.785SS**  trans-83.3142.6-169.9-49.30000110.7
391Y37.6Very low37.7Very low230 Ų230142.4 Ų142.490%0.90279%0.788SS**  trans-142.9121.1152-115.2-84.3000111.9
392D35.5Very low37.8Very low129 Ų129142.5 Ų142.569%0.6979%0.786SS**  trans-89.5143.6173176.329.1000109.4
393S39.5Very low37.9Very low117 Ų117142.3 Ų142.382%0.81879%0.788SS**  trans-172105.2147.5-85.90000110.6
394A43Very low38.8Very low85 Ų85144.8 Ų144.870%0.70279%0.785SS**  trans-62.3148.5164.200000112.8
395I42.5Very low39.1Very low177 Ų177146 Ų14691%0.90878%0.778SS**  trans-145.1118.4134.9-144.8118.5000109.7
396D43Very low39.7Very low135 Ų135148.8 Ų148.872%0.72279%0.788SS**  trans-84.2149.5172.9177.141000110
397Q38.8Very low40Very low162 Ų162152.7 Ų152.776%0.75779%0.79SS**  trans148112.7139.8-82.9-179.652.600110.5
398T35.3Very low40.5Very low131 Ų131154.6 Ų154.680%0.80479%0.789SS**  179.9118.4106.9300000112.9
399K40.4Very low40.6Very low171 Ų171155.2 Ų155.274%0.74379%0.792SS**  trans8392.9130.9-157.8169.9-175.3-72.30120.3
400M36.6Very low40.9Very low156 Ų156153.8 Ų153.877%0.76879%0.789SS**  64.5109.8121.1-61.1175-164.200120.5
401K40.9Very low41.1Very low180 Ų180156.8 Ų156.878%0.78380%0.798SS**  94.4111.8108-159162.7175.2175.60118.7
402T41.8Very low41.3Very low113 Ų113151.9 Ų151.969%0.69379%0.791SS**  trans65.1124142.558.60000120
403S40.3Very low41.8Very low118 Ų118153.6 Ų153.683%0.82580%0.798SS**  -174.514091.8-83.70000112.4
404I51.9Low41.9Very low153 Ų153156.4 Ų156.479%0.78580%0.796SS**  trans-96.7161.6169.3-63.1173000107.7
405W44.1Very low41.9Very low202 Ų202162.3 Ų162.377%0.76580%0.804SS**  trans106.4128.6163.5-76.666.4000113.1
406F46.4Very low41.8Very low250 Ų250161 Ų161100%1.09680%0.795SS**  cis-126.1017.9-93.8-97.1000112.8

Retrieved 406 of 406 residues in 60.1 ms (Link to these results)