A0A096MD21_POEFO Loading...

Janus kinase and microtubule interacting protein 3

AlphaFold DB , UniProt , Accession A0A096MD21, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 494 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
1M30.9Very low39.9Very low243 Ų243156 Ų156100%1.19782%0.823SS**  0153.20-76.6169.4136.100108.2
2A31.6Very low40Very low86 Ų86154.1 Ų154.171%0.71181%0.814SS**  trans57.1110.7176.400000115.8
3T39.3Very low40.3Very low129 Ų129153.6 Ų153.679%0.79181%0.811SS**  62.9135.870.670.30000113.4
4M29.3Very low40.5Very low168 Ų168152.9 Ų152.983%0.82881%0.808SS**  cis-144154.128.4-70.8178.7-79.500115.8
5R35.1Very low40.4Very low240 Ų240156.3 Ų156.391%0.90681%0.805SS**  trans39.9127.9146.4-70.7-177.1170.5165.5-2.6122.3
6R57.9Low40.4Very low235 Ų235151.9 Ų151.989%0.88779%0.793SS**  trans-64.9145.4150.5-66.9173.9171.4157.7-5.2111.2
7P43.1Very low40.7Very low125 Ų125153.1 Ų153.181%0.81279%0.793SS**  trans-81.3146.215233.6-30.2000110.5
8S48.4Very low40.9Very low116 Ų116150.3 Ų150.381%0.81179%0.789SS**  trans-148.494.7175.558.80000110.3
9S40.6Very low40.7Very low81 Ų81147.6 Ų147.657%0.56678%0.784SS**  trans-159.1133.6174.846.40000110.8N11S9-N11 VanDerWaalsContact C-N 3.26Å; S9-N11 PolarHBondContact O-N 2.73Å; S9-N11 VanDerWaalsContact O-N 3.15Å
10L42.1Very low41.3Very low172 Ų172145.7 Ų145.790%0.90178%0.782SS**THydrogen-bonded Turntrans-9153.2-175-153.8159.6000110.5
11N40.3Very low41.7Very low121 Ų121147.8 Ų147.865%0.64778%0.781SS**THydrogen-bonded Turntrans-126.8-12.1-168.9-81.811.8000115.5S9 L13 D14S9-N11 VanDerWaalsContact C-N 3.26Å; S9-N11 PolarHBondContact O-N 2.73Å; S9-N11 VanDerWaalsContact O-N 3.15Å; N11-L13 VanDerWaalsContact C-N 3.26Å; N11-L13 PolarHBondContact O-N 2.71Å; N11-D14 PolarHBondContact O-N 3Å
12D41.8Very low42.6Very low133 Ų133143 Ų14371%0.71176%0.755SS**THydrogen-bonded Turntrans-77.1-3.7-169.1-69-47.5000115.2
13L43.6Very low43.3Very low148 Ų148141.3 Ų141.378%0.77575%0.746SS**THydrogen-bonded Turntrans-82.3-28.6172.3-76.8169.2000113.3N11 R15 S16N11-L13 VanDerWaalsContact C-N 3.26Å; N11-L13 PolarHBondContact O-N 2.71Å; L13-R15 PolarHBondContact O-N 3.08Å; L13-S16 WeakPolarHBondContact O-CB 3.49Å; L13-S16 PolarHBondContact O-N 2.84Å; L13-S16 PolarHBondContact O-OG 2.66Å
14D42.4Very low43.7Very low143 Ų143142.6 Ų142.677%0.76574%0.738SS**THydrogen-bonded Turntrans-76.3-6.2-172.6-138.319000112.8N11N11-D14 PolarHBondContact O-N 3Å
15R39.7Very low45Very low205 Ų205139.1 Ų139.177%0.77472%0.719SS**THydrogen-bonded Turntrans-91.3-9.4178.4-140.7171.2-168.91713114.2L13 H17L13-R15 PolarHBondContact O-N 3.08Å; R15-H17 PolarHBondContact O-N 3.26Å
16S40.1Very low46Very low86 Ų86133.3 Ų133.360%0.60170%0.702SS**THydrogen-bonded Turntrans-63.4-28.4175.6-41.40000112.7L13L13-S16 WeakPolarHBondContact O-CB 3.49Å; L13-S16 PolarHBondContact O-N 2.84Å; L13-S16 PolarHBondContact O-OG 2.66Å
17H46.2Very low46.5Very low171 Ų171126.9 Ų126.979%0.79269%0.685SS**THydrogen-bonded Turntrans-101.17.6-170.9-70-66.6000115.1R15R15-H17 PolarHBondContact O-N 3.26Å
18S44.8Very low47.9Very low104 Ų104125.4 Ų125.473%0.72767%0.668SS**  trans-147.274.8176.3-160.20000113.9
19S36.9Very low49Very low99 Ų99128 Ų12869%0.69266%0.66SS**  trans-149.667.9161.6-161.10000112.2Y21S19-Y21 PolarHBondContact O-N 3.4Å
20S52.4Low50.7Low108 Ų108129.2 Ų129.276%0.75566%0.657SS**SBendtrans36.7-1.1145.7-156.70000124
21Y49Very low52.4Low190 Ų190125.4 Ų125.475%0.74564%0.635SS**SBendtrans-146.95.7-165.7-115.7-86000115.4S19S19-Y21 PolarHBondContact O-N 3.4Å
22H50.2Low54.5Low142 Ų142125.4 Ų125.466%0.65763%0.631SS**SBendtrans-131.3-8.3-178-99.425.3000116.8Y24 H25H22-Y24 VanDerWaalsContact C-N 3.27Å; H22-Y24 PolarHBondContact O-N 3.43Å; H22-H25 AromaticContact CE1-CD2 3.73Å; H22-H25 AromaticContact ND1-CD2 3.94Å; H22-H25 PolarHBondContact O-N 3.14Å
23G45.7Very low56.6Low51 Ų51125.7 Ų125.753%0.52663%0.626SS.*SBendtrans-60.7-41.3166.300000111.5H25 Q26 D27G23-H25 PolarHBondContact O-N 3.38Å; G23-H25 VanDerWaalsContact O-N 3.14Å; G23-Q26 PolarHBondContact O-N 3.22Å; G23-D27 PolarHBondContact O-N 2.91Å
24Y48.1Very low58.9Low156 Ų156123.1 Ų123.161%0.61261%0.613SS**Hα-helixtrans-49-41.1174.7-63.9-71.9000113.3H22 Q26 D27 E28H22-Y24 VanDerWaalsContact C-N 3.27Å; H22-Y24 PolarHBondContact O-N 3.43Å; Y24-Q26 PolarHBondContact O-N 2.81Å; Y24-D27 PolarHBondContact O-N 3.09Å; Y24-E28 WeakPolarHBondContact O-CA 3.38Å; Y24-E28 WeakPolarHBondContact O-CB 3.32Å; Y24-E28 WeakPolarHBondContact O-CG 3.48Å; Y24-E28 PolarHBondContact O-N 3.16Å
25H56.4Low61.1Low96 Ų96123.4 Ų123.444%0.44460%0.604SS.*Hα-helixtrans-74.1-2.9-177.8-86-16.7000115.5H22 G23 E28 R29H22-H25 AromaticContact CE1-CD2 3.73Å; H22-H25 AromaticContact ND1-CD2 3.94Å; H22-H25 PolarHBondContact O-N 3.14Å; G23-H25 PolarHBondContact O-N 3.38Å; G23-H25 VanDerWaalsContact O-N 3.14Å; H25-E28 IonicContact CE1-OE2 3.63Å; H25-E28 IonicContact CG-OE2 2.7Å; H25-E28 IonicContact ND1-OE2 3.17Å; H25-E28 PolarHBondContact ND1-OE2 3.28Å; H25-R29 VanDerWaalsContact O-CZ 3.28Å; H25-R29 PolarHBondContact O-NE 3.4Å; H25-R29 PolarHBondContact O-NH2 2.89Å
26Q56.9Low63.5Low118 Ų118119.5 Ų119.555%0.55160%0.597SS**Hα-helixtrans-101.9-48.3165.6-177.8153.1-15.100110.6G23 Y24 E28 R29 E30G23-Q26 PolarHBondContact O-N 3.22Å; Y24-Q26 PolarHBondContact O-N 2.81Å; Q26-E28 PolarHBondContact O-N 3.42Å; Q26-R29 PolarHBondContact O-N 3.05Å; Q26-E30 WeakPolarHBondContact CG-OE1 3.47Å; Q26-E30 PolarHBondContact NE2-OE1 2.83Å; Q26-E30 PolarHBondContact O-N 2.79Å
27D67.3Low65.9Low99 Ų99119.4 Ų119.453%0.52959%0.587SS.*Hα-helixtrans-55-37.6173.9-61.4-10.5000111.9G23 Y24 M31G23-D27 PolarHBondContact O-N 2.91Å; Y24-D27 PolarHBondContact O-N 3.09Å; D27-M31 WeakPolarHBondContact O-CB 3.33Å; D27-M31 PolarHBondContact O-N 3.15Å
28E72.9Confident68.1Low94 Ų94115.5 Ų115.544%0.43958%0.575SS.*Hα-helixtrans-63.5-40174.4-80.5170.6160.800112.4Y24 H25 Q26 M31 E32Y24-E28 WeakPolarHBondContact O-CA 3.38Å; Y24-E28 WeakPolarHBondContact O-CB 3.32Å; Y24-E28 WeakPolarHBondContact O-CG 3.48Å; Y24-E28 PolarHBondContact O-N 3.16Å; H25-E28 IonicContact CE1-OE2 3.63Å; H25-E28 IonicContact CG-OE2 2.7Å; H25-E28 IonicContact ND1-OE2 3.17Å; H25-E28 PolarHBondContact ND1-OE2 3.28Å; Q26-E28 PolarHBondContact O-N 3.42Å; E28-M31 CarbonylContact O-C 3.57Å; E28-M31 PolarHBondContact O-N 2.73Å; E28-E32 WeakPolarHBondContact O-CB 3.24Å; E28-E32 PolarHBondContact O-N 3.3Å
29R72.6Confident70.3Confident171 Ų171115.4 Ų115.465%0.64557%0.57SS**Hα-helixtrans-74.7-36.5-179.5-85.8-179.3-77.4-173.8-4.3112H25 Q26 E32 F33H25-R29 VanDerWaalsContact O-CZ 3.28Å; H25-R29 PolarHBondContact O-NE 3.4Å; H25-R29 PolarHBondContact O-NH2 2.89Å; Q26-R29 PolarHBondContact O-N 3.05Å; R29-E32 PolarHBondContact O-N 2.99Å; R29-F33 WeakPolarHBondContact O-CB 3.21Å; R29-F33 PolarHBondContact O-N 3Å
30E75.9Confident72.7Confident107 Ų107116.9 Ų116.950%0.557%0.566SS.*Hα-helixtrans-68.7-38.6172.2-66.1178.6-154.200110.6Q26 L34Q26-E30 WeakPolarHBondContact CG-OE1 3.47Å; Q26-E30 PolarHBondContact NE2-OE1 2.83Å; Q26-E30 PolarHBondContact O-N 2.79Å; E30-L34 WeakPolarHBondContact O-CB 3.26Å; E30-L34 VanDerWaalsContact O-CG 3.29Å; E30-L34 WeakPolarHBondContact O-CG 3.19Å; E30-L34 PolarHBondContact O-N 2.95Å
31M77.2Confident74.3Confident92 Ų92116.6 Ų116.645%0.45355%0.553SS.*Hα-helixtrans-70-32.6173.4-168.3-177.1-51.100113.2D27 E28 R35D27-M31 WeakPolarHBondContact O-CB 3.33Å; D27-M31 PolarHBondContact O-N 3.15Å; E28-M31 CarbonylContact O-C 3.57Å; E28-M31 PolarHBondContact O-N 2.73Å; M31-R35 WeakPolarHBondContact O-CB 3.27Å; M31-R35 WeakPolarHBondContact O-CD 3.47Å; M31-R35 WeakPolarHBondContact O-CG 3.47Å; M31-R35 PolarHBondContact O-N 2.85Å; M31-R35 PolarHBondContact SD-NH2 2.84Å
32E83.7Confident76.1Confident120 Ų120111.8 Ų111.856%0.56154%0.537SS*.Hα-helixtrans-72.2-40.6175.8-174.3161.9-116.500111.3E28 R29 R35 L36E28-E32 WeakPolarHBondContact O-CB 3.24Å; E28-E32 PolarHBondContact O-N 3.3Å; R29-E32 PolarHBondContact O-N 2.99Å; E32-R35 PolarHBondContact O-N 3.42Å; E32-L36 PolarHBondContact O-N 2.8Å
33F86.4Confident77.8Confident139 Ų139110.2 Ų110.261%0.6153%0.53SS*.Hα-helixtrans-58.9-48.2168.9179.1-96.1000111.8R29 R35 L36 Q37R29-F33 WeakPolarHBondContact O-CB 3.21Å; R29-F33 PolarHBondContact O-N 3Å; F33-R35 PolarHBondContact O-N 3.33Å; F33-L36 WeakPolarHBondContact O-CB 3.49Å; F33-L36 PolarHBondContact O-N 2.83Å; F33-Q37 PolarHBondContact O-N 2.77Å
34L91.6Very high79.7Confident95 Ų95112.2 Ų112.250%0.49753%0.527SS..Hα-helixtrans-64-36.8176.6-72.7168.6000112.6E30 Q37 V38E30-L34 WeakPolarHBondContact O-CB 3.26Å; E30-L34 VanDerWaalsContact O-CG 3.29Å; E30-L34 WeakPolarHBondContact O-CG 3.19Å; E30-L34 PolarHBondContact O-N 2.95Å; L34-Q37 PolarHBondContact O-N 2.66Å; L34-V38 WeakPolarHBondContact O-CG2 3.47Å; L34-V38 PolarHBondContact O-N 3.21Å
35R89.5Confident81.5Confident149 Ų149108.9 Ų108.956%0.56252%0.52SS*.Hα-helixtrans-63.2-42.5172.2-77.7166-176.1169.23.4111.6M31 E32 F33 Q37 V38 V39M31-R35 WeakPolarHBondContact O-CB 3.27Å; M31-R35 WeakPolarHBondContact O-CD 3.47Å; M31-R35 WeakPolarHBondContact O-CG 3.47Å; M31-R35 PolarHBondContact O-N 2.85Å; M31-R35 PolarHBondContact SD-NH2 2.84Å; E32-R35 PolarHBondContact O-N 3.42Å; F33-R35 PolarHBondContact O-N 3.33Å; R35-Q37 VanDerWaalsContact C-N 3.35Å; R35-V38 PolarHBondContact O-N 2.98Å; R35-V39 WeakPolarHBondContact O-CG2 3.31Å; R35-V39 PolarHBondContact O-N 3.26Å
36L90.3Very high83Confident123 Ų123107.5 Ų107.564%0.64452%0.515SS*.Hα-helixtrans-60-46.5175.9-130.474000111E32 F33 V38 V39 E40E32-L36 PolarHBondContact O-N 2.8Å; F33-L36 WeakPolarHBondContact O-CB 3.49Å; F33-L36 PolarHBondContact O-N 2.83Å; L36-V38 VanDerWaalsContact C-N 3.35Å; L36-V38 PolarHBondContact O-N 2.77Å; L36-V39 PolarHBondContact O-N 3.02Å; L36-E40 WeakPolarHBondContact O-CB 3.49Å; L36-E40 PolarHBondContact O-N 2.91Å
37Q89Confident84.4Confident83 Ų83105.3 Ų105.339%0.38851%0.507SS..Hα-helixtrans-63.2-37.9177.9-169.3174.940.700112.6F33 L34 R35 Q41F33-Q37 PolarHBondContact O-N 2.77Å; L34-Q37 PolarHBondContact O-N 2.66Å; R35-Q37 VanDerWaalsContact C-N 3.35Å; Q37-Q41 WeakPolarHBondContact O-CB 3.47Å; Q37-Q41 VanDerWaalsContact O-CG 3.3Å; Q37-Q41 WeakPolarHBondContact O-CG 3.4Å; Q37-Q41 PolarHBondContact O-N 2.79Å
38V92.6Very high84.9Confident90 Ų90105.6 Ų105.655%0.54551%0.509SS..Hα-helixtrans-68.4-37.5174.1168.80000111.7L34 R35 L36 Q42L34-V38 WeakPolarHBondContact O-CG2 3.47Å; L34-V38 PolarHBondContact O-N 3.21Å; R35-V38 PolarHBondContact O-N 2.98Å; L36-V38 VanDerWaalsContact C-N 3.35Å; L36-V38 PolarHBondContact O-N 2.77Å; V38-Q42 WeakPolarHBondContact O-CB 3.22Å; V38-Q42 PolarHBondContact O-N 3.27Å
39V91.2Very high85.2Confident102 Ų102103.7 Ų103.762%0.61851%0.506SS*.Hα-helixtrans-67.6-40.1174.91690000111.5R35 L36 Q42 H43R35-V39 WeakPolarHBondContact O-CG2 3.31Å; R35-V39 PolarHBondContact O-N 3.26Å; L36-V39 PolarHBondContact O-N 3.02Å; V39-Q42 PolarHBondContact O-N 2.87Å; V39-H43 PolarHBondContact O-N 3.32Å
40E88.8Confident85.8Confident129 Ų129100.4 Ų100.460%0.60350%0.496SS*.Hα-helixtrans-64.2-45.3174.6-174.8174.7-149.500111.5L36 Q42 H43 I44L36-E40 WeakPolarHBondContact O-CB 3.49Å; L36-E40 PolarHBondContact O-N 2.91Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.22Å; E40-H43 PolarHBondContact O-N 2.77Å; E40-I44 HydrophobicContact CG-CD1 4.44Å; E40-I44 WeakPolarHBondContact O-CG1 3.3Å; E40-I44 PolarHBondContact O-N 2.78Å
41Q85.8Confident85.8Confident102 Ų10297.9 Ų97.948%0.47749%0.493SS..Hα-helixtrans-62-38.8172.9-74.2178.15.100112.3Q37 I44 I45Q37-Q41 WeakPolarHBondContact O-CB 3.47Å; Q37-Q41 VanDerWaalsContact O-CG 3.3Å; Q37-Q41 WeakPolarHBondContact O-CG 3.4Å; Q37-Q41 PolarHBondContact O-N 2.79Å; Q41-I44 PolarHBondContact O-N 3.17Å; Q41-I45 WeakPolarHBondContact O-CB 3.36Å; Q41-I45 WeakPolarHBondContact O-CD1 3.49Å; Q41-I45 VanDerWaalsContact O-CG1 3.25Å; Q41-I45 WeakPolarHBondContact O-CG1 3.45Å; Q41-I45 PolarHBondContact O-N 2.86Å
42Q86Confident85.5Confident89 Ų8999.6 Ų99.642%0.41650%0.504SS..Hα-helixtrans-65.2-39.1174.7-170.963.157.900111.6V38 V39 E40 I44 I45 D46V38-Q42 WeakPolarHBondContact O-CB 3.22Å; V38-Q42 PolarHBondContact O-N 3.27Å; V39-Q42 PolarHBondContact O-N 2.87Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.22Å; Q42-I44 VanDerWaalsContact C-N 3.34Å; Q42-I44 PolarHBondContact O-N 3.14Å; Q42-I45 PolarHBondContact O-N 3.48Å; Q42-D46 PolarHBondContact NE2-OD1 2.81Å; Q42-D46 WeakPolarHBondContact O-CB 3.39Å; Q42-D46 PolarHBondContact O-N 2.88Å
43H85.9Confident85.1Confident110 Ų11099.9 Ų99.951%0.50951%0.505SS..Hα-helixtrans-62.4-41.9175.3-161.4-60.2000111.7V39 E40 D46 D47V39-H43 PolarHBondContact O-N 3.32Å; E40-H43 PolarHBondContact O-N 2.77Å; H43-D46 PolarHBondContact O-N 2.9Å; H43-D47 IonicContact CE1-OD1 3.52Å; H43-D47 IonicContact CE1-OD2 2.72Å; H43-D47 PolarHBondContact CE1-OD2 3.15Å; H43-D47 IonicContact ND1-OD1 2.65Å; H43-D47 IonicContact ND1-OD2 3.42Å; H43-D47 PolarHBondContact ND1-OD2 3.49Å; H43-D47 WeakPolarHBondContact O-CB 3.35Å; H43-D47 VanDerWaalsContact O-CG 3.28Å; H43-D47 PolarHBondContact O-N 2.9Å
44I85.4Confident84.5Confident92 Ų9297.2 Ų97.247%0.47250%0.5SS..Hα-helixtrans-63.5-43.1174.8-65.6164000110.9E40 Q41 Q42 D47 L48E40-I44 HydrophobicContact CG-CD1 4.44Å; E40-I44 WeakPolarHBondContact O-CG1 3.3Å; E40-I44 PolarHBondContact O-N 2.78Å; Q41-I44 PolarHBondContact O-N 3.17Å; Q42-I44 VanDerWaalsContact C-N 3.34Å; Q42-I44 PolarHBondContact O-N 3.14Å; I44-D47 PolarHBondContact O-N 3.11Å; I44-L48 HydrophobicContact CG2-CD1 3.95Å; I44-L48 WeakPolarHBondContact O-CB 3.48Å; I44-L48 VanDerWaalsContact O-CG 3.25Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 2.82Å
45I86Confident83.5Confident87 Ų8795.4 Ų95.445%0.44650%0.499SS..Hα-helixtrans-63.7-42.3175.8-71.4164000111Q41 Q42 S49Q41-I45 WeakPolarHBondContact O-CB 3.36Å; Q41-I45 WeakPolarHBondContact O-CD1 3.49Å; Q41-I45 VanDerWaalsContact O-CG1 3.25Å; Q41-I45 WeakPolarHBondContact O-CG1 3.45Å; Q41-I45 PolarHBondContact O-N 2.86Å; Q42-I45 PolarHBondContact O-N 3.48Å; I45-S49 VanDerWaalsContact O-CB 3.24Å; I45-S49 WeakPolarHBondContact O-CB 3.25Å; I45-S49 PolarHBondContact O-N 2.83Å; I45-S49 PolarHBondContact O-OG 2.76Å
46D88.6Confident82.5Confident67 Ų6789.6 Ų89.636%0.35849%0.486SS..Hα-helixtrans-66.4-40.7178.9-73.6-1.9000111.2Q42 H43 S49 K50Q42-D46 PolarHBondContact NE2-OD1 2.81Å; Q42-D46 WeakPolarHBondContact O-CB 3.39Å; Q42-D46 PolarHBondContact O-N 2.88Å; H43-D46 PolarHBondContact O-N 2.9Å; D46-S49 PolarHBondContact O-N 2.72Å; D46-K50 WeakPolarHBondContact O-CB 3.22Å; D46-K50 WeakPolarHBondContact O-CD 3.42Å; D46-K50 VanDerWaalsContact O-CE 3.29Å; D46-K50 WeakPolarHBondContact O-CE 3.47Å; D46-K50 WeakPolarHBondContact O-CG 3.43Å; D46-K50 PolarHBondContact O-N 3.41Å
47D85.9Confident81.4Confident71 Ų7191.5 Ų91.538%0.3849%0.485SS..Hα-helixtrans-70.4-40.5177.5-69.6-22.8000112.3H43 I44 S49 K50 A51H43-D47 IonicContact CE1-OD1 3.52Å; H43-D47 IonicContact CE1-OD2 2.72Å; H43-D47 PolarHBondContact CE1-OD2 3.15Å; H43-D47 IonicContact ND1-OD1 2.65Å; H43-D47 IonicContact ND1-OD2 3.42Å; H43-D47 PolarHBondContact ND1-OD2 3.49Å; H43-D47 WeakPolarHBondContact O-CB 3.35Å; H43-D47 VanDerWaalsContact O-CG 3.28Å; H43-D47 PolarHBondContact O-N 2.9Å; I44-D47 PolarHBondContact O-N 3.11Å; D47-S49 VanDerWaalsContact C-N 3.28Å; D47-S49 PolarHBondContact O-N 3.46Å; D47-K50 PolarHBondContact O-N 2.85Å; D47-K50 IonicContact OD1-NZ 3.53Å; D47-K50 PolarHBondContact OD1-NZ 3.41Å; D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 3.42Å
48L76.7Confident80.3Confident106 Ų10691.2 Ų91.256%0.55549%0.489SS*.Hα-helixtrans-63.6-35.6170.7-71171.8000111.7I44 A51 L52I44-L48 HydrophobicContact CG2-CD1 3.95Å; I44-L48 WeakPolarHBondContact O-CB 3.48Å; I44-L48 VanDerWaalsContact O-CG 3.25Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 2.82Å; L48-A51 PolarHBondContact O-N 2.87Å; L48-L52 WeakPolarHBondContact O-CB 3.35Å; L48-L52 WeakPolarHBondContact O-CG 3.41Å; L48-L52 PolarHBondContact O-N 3.04Å
49S81.1Confident79.2Confident54 Ų5492.8 Ų92.838%0.37849%0.488SS..Hα-helixtrans-68.7-45.6175.7-60.30000111.5I45 D46 D47 A51 L52 E53I45-S49 VanDerWaalsContact O-CB 3.24Å; I45-S49 WeakPolarHBondContact O-CB 3.25Å; I45-S49 PolarHBondContact O-N 2.83Å; I45-S49 PolarHBondContact O-OG 2.76Å; D46-S49 PolarHBondContact O-N 2.72Å; D47-S49 VanDerWaalsContact C-N 3.28Å; D47-S49 PolarHBondContact O-N 3.46Å; S49-A51 VanDerWaalsContact C-N 3.29Å; S49-A51 PolarHBondContact O-N 2.7Å; S49-L52 PolarHBondContact O-N 2.62Å; S49-E53 WeakPolarHBondContact O-CG 3.48Å; S49-E53 PolarHBondContact O-N 2.99Å
50K83.7Confident78.1Confident101 Ų10192.3 Ų92.344%0.43948%0.483SS..Hα-helixtrans-58.8-40.3171.9-68.6160.3-144157.70111.5D46 D47 T54D46-K50 WeakPolarHBondContact O-CB 3.22Å; D46-K50 WeakPolarHBondContact O-CD 3.42Å; D46-K50 VanDerWaalsContact O-CE 3.29Å; D46-K50 WeakPolarHBondContact O-CE 3.47Å; D46-K50 WeakPolarHBondContact O-CG 3.43Å; D46-K50 PolarHBondContact O-N 3.41Å; D47-K50 PolarHBondContact O-N 2.85Å; D47-K50 IonicContact OD1-NZ 3.53Å; D47-K50 PolarHBondContact OD1-NZ 3.41Å; K50-T54 VanDerWaalsContact O-CB 3.26Å; K50-T54 WeakPolarHBondContact O-CB 3.47Å; K50-T54 PolarHBondContact O-N 2.95Å; K50-T54 PolarHBondContact O-OG1 3.31Å
51A75.5Confident77Confident54 Ų5490.6 Ų90.645%0.44648%0.481SS..Hα-helixtrans-66.3-41.5176.600000111.9D47 L48 S49 T54 A55D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 3.42Å; L48-A51 PolarHBondContact O-N 2.87Å; S49-A51 VanDerWaalsContact C-N 3.29Å; S49-A51 PolarHBondContact O-N 2.7Å; A51-T54 PolarHBondContact O-N 3.12Å; A51-A55 VanDerWaalsContact O-CB 3.31Å; A51-A55 WeakPolarHBondContact O-CB 3.04Å; A51-A55 PolarHBondContact O-N 2.94Å
52L72Confident76.1Confident129 Ų12990.8 Ų90.868%0.67548%0.484SS*.Hα-helixtrans-67.9-40.9175-78.2164.9000112.6L48 S49 A55 G56L48-L52 WeakPolarHBondContact O-CB 3.35Å; L48-L52 WeakPolarHBondContact O-CG 3.41Å; L48-L52 PolarHBondContact O-N 3.04Å; S49-L52 PolarHBondContact O-N 2.62Å; L52-A55 PolarHBondContact O-N 3.44Å; L52-G56 PolarHBondContact O-N 2.83Å
53E74.9Confident75.3Confident126 Ų12691 Ų9159%0.58949%0.485SS*.Hα-helixtrans-61.3-47171.4-76.2-170.6174.500110.8S49 A55 G56 Y57S49-E53 WeakPolarHBondContact O-CG 3.48Å; S49-E53 PolarHBondContact O-N 2.99Å; E53-A55 PolarHBondContact O-N 2.97Å; E53-G56 CarbonylContact O-C 3.6Å; E53-G56 WeakPolarHBondContact O-CA 3.2Å; E53-G56 PolarHBondContact O-N 3Å; E53-G56 VanDerWaalsContact O-N 3.08Å; E53-Y57 WeakPolarHBondContact O-CD2 3.38Å; E53-Y57 PolarHBondContact O-N 2.61Å
54T74.1Confident74.4Confident83 Ų8394.7 Ų94.751%0.50949%0.494SS..Hα-helixtrans-62.6-42.2178.5-56.50000111.3K50 A51 G56 Y57 V58K50-T54 VanDerWaalsContact O-CB 3.26Å; K50-T54 WeakPolarHBondContact O-CB 3.47Å; K50-T54 PolarHBondContact O-N 2.95Å; K50-T54 PolarHBondContact O-OG1 3.31Å; A51-T54 PolarHBondContact O-N 3.12Å; T54-G56 VanDerWaalsContact C-N 3.31Å; T54-G56 PolarHBondContact O-N 3.07Å; T54-Y57 PolarHBondContact O-N 2.95Å; T54-V58 WeakPolarHBondContact O-CB 3.34Å; T54-V58 WeakPolarHBondContact O-CG2 3.18Å; T54-V58 PolarHBondContact O-N 3.48Å
55A70.1Confident73.4Confident57 Ų5793.2 Ų93.247%0.47149%0.488SS..Hα-helixtrans-63.4-36.6172.500000112.1A51 L52 E53 V58 K59A51-A55 VanDerWaalsContact O-CB 3.31Å; A51-A55 WeakPolarHBondContact O-CB 3.04Å; A51-A55 PolarHBondContact O-N 2.94Å; L52-A55 PolarHBondContact O-N 3.44Å; E53-A55 PolarHBondContact O-N 2.97Å; A55-V58 PolarHBondContact O-N 2.87Å; A55-K59 WeakPolarHBondContact O-CB 3.33Å; A55-K59 PolarHBondContact O-N 3.15Å
56G69.4Low72.5Confident27 Ų2794.1 Ų94.128%0.27849%0.492SS..Hα-helixtrans-64-43.7171.600000112.8L52 E53 T54 K59 N60L52-G56 PolarHBondContact O-N 2.83Å; E53-G56 CarbonylContact O-C 3.6Å; E53-G56 WeakPolarHBondContact O-CA 3.2Å; E53-G56 PolarHBondContact O-N 3Å; E53-G56 VanDerWaalsContact O-N 3.08Å; T54-G56 VanDerWaalsContact C-N 3.31Å; T54-G56 PolarHBondContact O-N 3.07Å; G56-K59 PolarHBondContact O-N 3.03Å; G56-N60 WeakPolarHBondContact O-CB 3.45Å; G56-N60 PolarHBondContact O-N 3.41Å; G56-N60 PolarHBondContact O-ND2 3.26Å; G56-N60 VanDerWaalsContact O-ND2 3.14Å
57Y67.5Low71.1Confident162 Ų16296.9 Ų96.964%0.63551%0.507SS*.Hα-helixtrans-63.6-45.1173-81.5-69.6000111.7E53 T54 K59 N60 V61E53-Y57 WeakPolarHBondContact O-CD2 3.38Å; E53-Y57 PolarHBondContact O-N 2.61Å; T54-Y57 PolarHBondContact O-N 2.95Å; Y57-K59 PolarHBondContact O-N 3.24Å; Y57-N60 PolarHBondContact O-N 2.94Å; Y57-V61 WeakPolarHBondContact O-CB 3.48Å; Y57-V61 VanDerWaalsContact O-CG2 3.25Å; Y57-V61 WeakPolarHBondContact O-CG2 3.45Å; Y57-V61 PolarHBondContact O-N 3.4Å
58V66.1Low69.6Low78 Ų7897.1 Ų97.147%0.47351%0.507SS..Hα-helixtrans-60-45.4175.3167.90000110.8T54 A55 V61 I62T54-V58 WeakPolarHBondContact O-CB 3.34Å; T54-V58 WeakPolarHBondContact O-CG2 3.18Å; T54-V58 PolarHBondContact O-N 3.48Å; A55-V58 PolarHBondContact O-N 2.87Å; V58-V61 PolarHBondContact O-N 2.86Å; V58-I62 HydrophobicContact CG1-CD1 3.73Å; V58-I62 HydrophobicContact CG1-CG1 4.47Å; V58-I62 WeakPolarHBondContact O-CB 3.47Å; V58-I62 VanDerWaalsContact O-CG1 3.26Å; V58-I62 WeakPolarHBondContact O-CG1 3.5Å; V58-I62 PolarHBondContact O-N 3.4Å
59K69.4Low68.6Low122 Ų12299.6 Ų99.653%0.5351%0.51SS..Hα-helixtrans-59.2-49.7174-179.6-177.4168.9-176.40111.8A55 G56 Y57 V61 I62 E63A55-K59 WeakPolarHBondContact O-CB 3.33Å; A55-K59 PolarHBondContact O-N 3.15Å; G56-K59 PolarHBondContact O-N 3.03Å; Y57-K59 PolarHBondContact O-N 3.24Å; K59-V61 VanDerWaalsContact C-N 3.28Å; K59-V61 PolarHBondContact O-N 2.76Å; K59-I62 PolarHBondContact O-N 2.94Å; K59-E63 WeakPolarHBondContact CE-OE1 3.29Å; K59-E63 IonicContact NZ-OE1 2.68Å; K59-E63 PolarHBondContact O-N 2.89Å
60N67.4Low66.9Low93 Ų93106.6 Ų106.650%0.49753%0.529SS..Hα-helixtrans-63.8-33179-70.6-27.1000112.3G56 Y57 R64G56-N60 WeakPolarHBondContact O-CB 3.45Å; G56-N60 PolarHBondContact O-N 3.41Å; G56-N60 PolarHBondContact O-ND2 3.26Å; G56-N60 VanDerWaalsContact O-ND2 3.14Å; Y57-N60 PolarHBondContact O-N 2.94Å; N60-R64 WeakPolarHBondContact O-CB 3.42Å; N60-R64 PolarHBondContact O-N 3.3Å
61V66.4Low65Low92 Ų92112.3 Ų112.356%0.55855%0.548SS*.Hα-helixtrans-69.2-44.4172.7166.20000110.7Y57 V58 K59 R64 D65Y57-V61 WeakPolarHBondContact O-CB 3.48Å; Y57-V61 VanDerWaalsContact O-CG2 3.25Å; Y57-V61 WeakPolarHBondContact O-CG2 3.45Å; Y57-V61 PolarHBondContact O-N 3.4Å; V58-V61 PolarHBondContact O-N 2.86Å; K59-V61 VanDerWaalsContact C-N 3.28Å; K59-V61 PolarHBondContact O-N 2.76Å; V61-R64 PolarHBondContact O-N 2.94Å; V61-D65 VanDerWaalsContact O-CB 3.24Å; V61-D65 WeakPolarHBondContact O-CB 3.35Å; V61-D65 PolarHBondContact O-N 3.37Å
62I67Low63.5Low107 Ų107119.2 Ų119.255%0.54956%0.562SS.*Hα-helixtrans-62.1-47176.4-70.3164.4000111V58 K59 R64 D65 L66V58-I62 HydrophobicContact CG1-CD1 3.73Å; V58-I62 HydrophobicContact CG1-CG1 4.47Å; V58-I62 WeakPolarHBondContact O-CB 3.47Å; V58-I62 VanDerWaalsContact O-CG1 3.26Å; V58-I62 WeakPolarHBondContact O-CG1 3.5Å; V58-I62 PolarHBondContact O-N 3.4Å; K59-I62 PolarHBondContact O-N 2.94Å; I62-R64 VanDerWaalsContact C-N 3.35Å; I62-R64 PolarHBondContact O-N 2.79Å; I62-D65 PolarHBondContact O-N 3.48Å; I62-L66 VanDerWaalsContact O-CB 3.28Å; I62-L66 WeakPolarHBondContact O-CB 3.22Å; I62-L66 PolarHBondContact O-N 2.87Å
63E68.9Low62Low94 Ų94122 Ų12244%0.43957%0.572SS.*Hα-helixtrans-63.2-40.3177-71.9-179.7-177.400111.7K59 L67K59-E63 WeakPolarHBondContact CE-OE1 3.29Å; K59-E63 IonicContact NZ-OE1 2.68Å; K59-E63 PolarHBondContact O-N 2.89Å; E63-L67 VanDerWaalsContact O-CG 3.31Å; E63-L67 WeakPolarHBondContact O-CG 3.19Å; E63-L67 PolarHBondContact O-N 3.35Å
64R65.8Low59.9Low187 Ų187124.1 Ų124.171%0.70658%0.582SS**Hα-helixtrans-68.7-38176-172.6177.6-171.2174.63.3112.7N60 V61 I62 L67 L68N60-R64 WeakPolarHBondContact O-CB 3.42Å; N60-R64 PolarHBondContact O-N 3.3Å; V61-R64 PolarHBondContact O-N 2.94Å; I62-R64 VanDerWaalsContact C-N 3.35Å; I62-R64 PolarHBondContact O-N 2.79Å; R64-L67 PolarHBondContact O-N 3.12Å; R64-L68 HydrophobicContact CG-CD1 4.34Å; R64-L68 VanDerWaalsContact O-CG 3.27Å; R64-L68 WeakPolarHBondContact O-CG 3.44Å; R64-L68 PolarHBondContact O-N 3.31Å
65D64.3Low58.6Low61 Ų61125.6 Ų125.633%0.32659%0.593SS.*Hα-helixtrans-73.6-35.7178.7-164.457.6000111.2V61 I62 L67 L68 R69V61-D65 VanDerWaalsContact O-CB 3.24Å; V61-D65 WeakPolarHBondContact O-CB 3.35Å; V61-D65 PolarHBondContact O-N 3.37Å; I62-D65 PolarHBondContact O-N 3.48Å; D65-L67 VanDerWaalsContact C-N 3.35Å; D65-L67 PolarHBondContact O-N 3.02Å; D65-L68 CarbonylContact O-C 3.6Å; D65-L68 PolarHBondContact O-N 2.88Å; D65-L68 VanDerWaalsContact O-N 3.13Å; D65-R69 WeakPolarHBondContact O-CB 3.46Å; D65-R69 VanDerWaalsContact O-CG 3.27Å; D65-R69 WeakPolarHBondContact O-CG 3.5Å; D65-R69 PolarHBondContact O-N 3.09Å; D65-R69 IonicContact OD2-CZ 3.07Å; D65-R69 IonicContact OD2-NE 3.35Å; D65-R69 PolarHBondContact OD2-NE 3.36Å; D65-R69 IonicContact OD2-NH2 2.68Å; D65-R69 PolarHBondContact OD2-NH2 2.97Å
66L68.3Low56.8Low105 Ų105129.9 Ų129.955%0.5561%0.613SS.*Hα-helixtrans-59.5-44.1169.1-171.568.3000111.5I62 L68 R69 Y70I62-L66 VanDerWaalsContact O-CB 3.28Å; I62-L66 WeakPolarHBondContact O-CB 3.22Å; I62-L66 PolarHBondContact O-N 2.87Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 3.39Å; L66-R69 PolarHBondContact O-N 3.43Å; L66-Y70 PolarHBondContact O-N 3.24Å
67L57.9Low55Low125 Ų125139.2 Ų139.265%0.65464%0.64SS**Hα-helixtrans-65.8-31.1173.3-73.8167.1000113.1E63 R64 D65 R71E63-L67 VanDerWaalsContact O-CG 3.31Å; E63-L67 WeakPolarHBondContact O-CG 3.19Å; E63-L67 PolarHBondContact O-N 3.35Å; R64-L67 PolarHBondContact O-N 3.12Å; D65-L67 VanDerWaalsContact C-N 3.35Å; D65-L67 PolarHBondContact O-N 3.02Å; L67-R71 PolarHBondContact O-N 2.97Å
68L55.3Low53.6Low76 Ų76142.5 Ų142.540%0.39865%0.651SS.*Hα-helixtrans-75.6-37174.5-74167.4000112.2R64 D65 L66 R71 R72R64-L68 HydrophobicContact CG-CD1 4.34Å; R64-L68 VanDerWaalsContact O-CG 3.27Å; R64-L68 WeakPolarHBondContact O-CG 3.44Å; R64-L68 PolarHBondContact O-N 3.31Å; D65-L68 CarbonylContact O-C 3.6Å; D65-L68 PolarHBondContact O-N 2.88Å; D65-L68 VanDerWaalsContact O-N 3.13Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 3.39Å; L68-R71 CarbonylContact O-C 3.58Å; L68-R71 PolarHBondContact O-N 3.25Å; L68-R71 VanDerWaalsContact O-N 3.1Å; L68-R72 WeakPolarHBondContact O-CG 3.46Å; L68-R72 PolarHBondContact O-N 2.99Å
69R55.8Low51.9Low159 Ų159150 Ų15060%0.667%0.671SS**Hα-helixtrans-61.4-46.2172-71.1169.3-165.3-119.41.3110.6D65 L66 R71 R72D65-R69 WeakPolarHBondContact O-CB 3.46Å; D65-R69 VanDerWaalsContact O-CG 3.27Å; D65-R69 WeakPolarHBondContact O-CG 3.5Å; D65-R69 PolarHBondContact O-N 3.09Å; D65-R69 IonicContact OD2-CZ 3.07Å; D65-R69 IonicContact OD2-NE 3.35Å; D65-R69 PolarHBondContact OD2-NE 3.36Å; D65-R69 IonicContact OD2-NH2 2.68Å; D65-R69 PolarHBondContact OD2-NH2 2.97Å; L66-R69 PolarHBondContact O-N 3.43Å; R69-R71 PolarHBondContact O-N 3.3Å; R69-R71 VanDerWaalsContact O-N 3.08Å; R69-R72 PolarHBondContact O-N 3.32Å; R69-R72 VanDerWaalsContact O-N 3.09Å
70Y46Very low50.4Low201 Ų201155.1 Ų155.179%0.78869%0.687SS**THydrogen-bonded Turntrans-57.4-21.9172.2-109-81.4000114.4L66L66-Y70 PolarHBondContact O-N 3.24Å
71R43.2Very low48.5Very low221 Ų221157.5 Ų157.583%0.83471%0.705SS**THydrogen-bonded Turntrans-101.62.7-179.4-161.9170.9177.8176.40.7113.9L67 L68 R69L67-R71 PolarHBondContact O-N 2.97Å; L68-R71 CarbonylContact O-C 3.58Å; L68-R71 PolarHBondContact O-N 3.25Å; L68-R71 VanDerWaalsContact O-N 3.1Å; R69-R71 PolarHBondContact O-N 3.3Å; R69-R71 VanDerWaalsContact O-N 3.08Å
72R44.8Very low46.9Very low199 Ų199162.3 Ų162.375%0.75172%0.719SS**  trans-113.415.4-175.2-79.3-172.9179.4-145.15.5115.4L68 R69 E74L68-R72 WeakPolarHBondContact O-CG 3.46Å; L68-R72 PolarHBondContact O-N 2.99Å; R69-R72 PolarHBondContact O-N 3.32Å; R69-R72 VanDerWaalsContact O-N 3.09Å; R72-E74 VanDerWaalsContact C-N 3.31Å; R72-E74 PolarHBondContact O-N 2.88Å
73Q40.2Very low45.2Very low186 Ų186169.1 Ų169.187%0.86974%0.737SS**  trans-74.179.4168-70.6-171.3-6.900111.8
74E30.6Very low43.5Very low172 Ų172168.9 Ų168.980%0.80475%0.752SS**  trans-159.1128161.9-108.4-68.3139.300108.5R72R72-E74 VanDerWaalsContact C-N 3.31Å; R72-E74 PolarHBondContact O-N 2.88Å
75P45.4Very low41.6Very low113 Ų113165.4 Ų165.473%0.73476%0.755SS**  trans-103.5128.1-158.836.5-33.5000116.1
76V32.8Very low39.9Very low148 Ų148173.6 Ų173.690%0.89778%0.781SS**  trans-127126.9170.7-174.70000112.6
77R32.9Very low38.3Very low222 Ų222174.4 Ų174.484%0.83879%0.79SS**  trans-85.5166.6-167.9-61.9162152.9159.5-9.8115
78R36.7Very low37Very low231 Ų231176.4 Ų176.487%0.87280%0.8SS**  trans86.5148.6159.9-51.7169.2-178.5162.10.3115
79R30.5Very low35.9Very low237 Ų237181.4 Ų181.489%0.89482%0.821SS**  cis-156.2156.2-6-133.4-174.8179.4-166.6-0.5110.3
80R37.8Very low34.9Very low228 Ų228180.1 Ų180.186%0.8683%0.831SS**  trans-73.9151.1169.5-67177.1174.1162.4-3.7113.1
81T28.9Very low34Very low143 Ų143179.9 Ų179.988%0.87783%0.834SS**  trans-146.9129.7147.139.90000111.6
82F31.2Very low33.2Very low194 Ų194177.8 Ų177.885%0.85183%0.828SS**  trans-78.7158.5170.4-100.9-108.8000112.3
83R32.8Very low32.6Very low250 Ų250171.2 Ų171.294%0.94382%0.822SS**  trans-159.5155.1142.4-109.2168.6-164.7-134.60.5110.9
84A31.7Very low32.4Very low89 Ų89170.9 Ų170.974%0.73681%0.814SS**  trans-148.9157.4-178.500000110.6
85C27.2Very low32.5Very low114 Ų114170.3 Ų170.377%0.7782%0.816SS**  trans144.6149.7172-85.10000108.7
86R28.8Very low32.3Very low232 Ų232172 Ų17288%0.87581%0.814SS**  cis-160.3167.7-6.9-123.7173.6-173.5-157.1-0.1111.1
87V33.7Very low32.9Very low122 Ų122173 Ų17374%0.73981%0.809SS**  trans-75.8152.8171175.50000111.8
88I31.8Very low33Very low168 Ų168165.5 Ų165.586%0.86280%0.795SS**  trans-135.8149.1159.4-63-175.8000108.7
89E31.5Very low32.8Very low180 Ų180160.3 Ų160.384%0.84179%0.794SS**  trans-105-170.7-171.8-65.8174.1110.700114
90T35.6Very low33.1Very low132 Ų132157.5 Ų157.581%0.8179%0.793SS**  trans-102.3160.1-167.6510000115.1
91F25.7Very low33.4Very low197 Ų197154 Ų15486%0.86479%0.792SS**  trans170.2162.7154.4-107.8-143.4000108.8
92Y27.8Very low33.7Very low177 Ų177153 Ų15369%0.69479%0.791SS**  cis-171154.3-24167.9-95000108.2Y94Y92-Y94 HydrophobicContact CE2-CD2 4.35Å; Y92-Y94 WeakPolarHBondContact OH-CD2 3.33Å
93G31.6Very low34.7Very low61 Ų61151.9 Ų151.963%0.62979%0.794SS**  trans177.4154.4173.900000114.1
94Y34.9Very low34.8Very low179 Ų179143.7 Ų143.770%0.70279%0.787SS**  trans-157.6142.5-168.7-132.2-82.9000110.2Y92Y92-Y94 HydrophobicContact CE2-CD2 4.35Å; Y92-Y94 WeakPolarHBondContact OH-CD2 3.33Å
95D33.8Very low35.4Very low160 Ų160145.3 Ų145.386%0.85679%0.793SS**  trans-170.3166.2153.2-138.2-16.3000113.9
96E41.6Very low36Very low148 Ų148145.1 Ų145.169%0.69279%0.793SS**  trans-143.2175.6-172.3-52178-176.900110.3
97E43.6Very low36.4Very low168 Ų168141.2 Ų141.279%0.78579%0.789SS**  cis-166.6172.81.8-139.7-68.688.900110.1
98A35.7Very low36.6Very low66 Ų66140.5 Ų140.555%0.54579%0.789SS.*  trans97.8151.7138.900000125
99S32Very low36.8Very low121 Ų121142.1 Ų142.185%0.84679%0.79SS**  trans91.3155155.1770000121.7
100M38.1Very low37Very low178 Ų178140.8 Ų140.888%0.87778%0.783SS**  cis-168.5165.5-47-138.1179.875.300111.9
101D42.6Very low37.2Very low155 Ų155140.7 Ų140.783%0.82978%0.783SS**  trans-98.2174.4-166.7-43.2-87.9000118.8
102S35.4Very low38.1Very low123 Ų123137.1 Ų137.186%0.8677%0.773SS**  trans-166.9163.2165.5-161.50000116.3
103D53.8Low38.7Very low170 Ų170139.3 Ų139.391%0.90978%0.78SS**  trans-140.7172.3-162.8-99.4-39.5000116.8
104G33.9Very low39.2Very low78 Ų78142.6 Ų142.680%0.80479%0.788SS**  trans160142.7157.200000120.7
105S43.6Very low40.1Very low123 Ų123140.4 Ų140.486%0.8680%0.796SS**  trans-170.1156.7174.4-170.40000117.3
106S40.6Very low40.5Very low110 Ų110139.8 Ų139.877%0.76979%0.792SS**  trans176.2177169.8-83.40000114.5
107L38Very low40.5Very low150 Ų150139 Ų13979%0.78580%0.798SS**  -173.2167-52.5-147.475.9000113
108S36.1Very low40.5Very low107 Ų107139.3 Ų139.375%0.74880%0.799SS**  trans80.9162154.784.40000122
109F37.6Very low41.3Very low201 Ų201138.9 Ų138.988%0.88279%0.791SS**  cis-160.6-171.6-41.2-118.7-72.4000112.1
110H35.3Very low42.1Very low152 Ų152138.1 Ų138.170%0.70478%0.778SS**  trans-141.7155.7-166.816087.2000113.9
111T39.8Very low42.8Very low131 Ų131137.9 Ų137.980%0.80477%0.774SS**  trans-158.9165.3161.9100000114.6
112D44.8Very low43.3Very low121 Ų121134 Ų13465%0.64776%0.756SS**  trans-144159.9-172.8160.759.3000111.5
113R40.3Very low44.2Very low223 Ų223131 Ų13184%0.84273%0.734SS**  trans168.9144.9140.4-96.5167.1-175.2125.53116.4
114T42.3Very low44.4Very low130 Ų130126.2 Ų126.280%0.79871%0.711SS**  trans-116.4161.2156.928.70000111.6
115P52.9Low45.8Very low134 Ų134129.8 Ų129.887%0.8770%0.7SS**  trans-130.4175.4147.638.1-25.7000112.9
116D41.7Very low46.9Very low146 Ų146129.9 Ų129.978%0.78169%0.687SS**  trans-132.5141.6-159.5175.925.3000112
117T42.2Very low48.4Very low133 Ų133127.4 Ų127.482%0.81666%0.663SS**  trans-164130.9168.5-47.40000111.4
118E44.3Very low50.1Low174 Ų174122.9 Ų122.981%0.81365%0.648SS**PPolyproline II helixtrans-64.4143.6176.2-67.6-76.3166.200113.4
119P52.5Low52.2Low56 Ų56122.9 Ų122.936%0.36464%0.636SS.*PPolyproline II helixtrans-98.1145.5-174.86.115.3000115.2C123 V124P119-C123 HydrophobicContact CB-CB 4.11Å; P119-V124 HydrophobicContact CB-CG2 3.85Å; P119-V124 HydrophobicContact CG-CG2 4.04Å
120D47.8Very low54.4Low106 Ų106118.2 Ų118.257%0.56762%0.62SS**PPolyproline II helixtrans-56141.9165.4-179.4-48.8000111.4T122 C123 V124D120-T122 PolarHBondContact O-N 3.44Å; D120-T122 VanDerWaalsContact O-N 3.09Å; D120-T122 WeakPolarHBondContact OD1-CB 3.15Å; D120-T122 PolarHBondContact OD1-N 2.91Å; D120-T122 PolarHBondContact OD1-OG1 2.97Å; D120-C123 HydrophobicContact CB-CB 4.02Å; D120-C123 CarbonylContact O-C 3.56Å; D120-C123 VanDerWaalsContact O-CA 3.27Å; D120-C123 WeakPolarHBondContact O-CA 3.3Å; D120-C123 WeakPolarHBondContact O-CB 3.36Å; D120-C123 PolarHBondContact O-N 2.98Å; D120-V124 WeakPolarHBondContact O-CG2 3.47Å; D120-V124 PolarHBondContact O-N 3.28Å
121E53.7Low56.7Low173 Ų173118 Ų11881%0.80861%0.613SS**Hα-helixtrans-58.9-24.9-178.9-68.7-167152.800114.3R125E121-R125 PolarHBondContact O-N 2.97Å
122T53.2Low59Low73 Ų73119.5 Ų119.545%0.44861%0.605SS.*Hα-helixtrans-73-40169.757.60000111.9D120 R125 E126D120-T122 PolarHBondContact O-N 3.44Å; D120-T122 VanDerWaalsContact O-N 3.09Å; D120-T122 WeakPolarHBondContact OD1-CB 3.15Å; D120-T122 PolarHBondContact OD1-N 2.91Å; D120-T122 PolarHBondContact OD1-OG1 2.97Å; T122-R125 PolarHBondContact O-N 3.45Å; T122-E126 PolarHBondContact O-N 3.48Å
123C54.5Low61.1Low60 Ų60120 Ų12041%0.40560%0.598SS.*Hα-helixtrans-62.2-45.4170.7-170.80000111.1P119 D120 R125 E126 E127P119-C123 HydrophobicContact CB-CB 4.11Å; D120-C123 HydrophobicContact CB-CB 4.02Å; D120-C123 CarbonylContact O-C 3.56Å; D120-C123 VanDerWaalsContact O-CA 3.27Å; D120-C123 WeakPolarHBondContact O-CA 3.3Å; D120-C123 WeakPolarHBondContact O-CB 3.36Å; D120-C123 PolarHBondContact O-N 2.98Å; C123-R125 PolarHBondContact O-N 2.86Å; C123-R125 VanDerWaalsContact O-N 3.15Å; C123-E126 PolarHBondContact O-N 3.06Å; C123-E126 VanDerWaalsContact O-N 3.08Å; C123-E127 WeakPolarHBondContact O-CB 3.49Å; C123-E127 PolarHBondContact O-N 2.96Å
124V57.4Low63.4Low69 Ų69115.1 Ų115.142%0.41858%0.584SS.*Hα-helixtrans-55.1-36.4178.3176.70000112P119 D120 A128P119-V124 HydrophobicContact CB-CG2 3.85Å; P119-V124 HydrophobicContact CG-CG2 4.04Å; D120-V124 WeakPolarHBondContact O-CG2 3.47Å; D120-V124 PolarHBondContact O-N 3.28Å; V124-A128 VanDerWaalsContact O-CB 3.26Å; V124-A128 WeakPolarHBondContact O-CB 3.39Å; V124-A128 PolarHBondContact O-N 3.22Å
125R62.9Low65.7Low153 Ų153114.5 Ų114.558%0.57758%0.576SS**Hα-helixtrans-72-44.7176.6-176.1177.960.7-124.6-9.3112.5E121 T122 C123 E127 A128 E129E121-R125 PolarHBondContact O-N 2.97Å; T122-R125 PolarHBondContact O-N 3.45Å; C123-R125 PolarHBondContact O-N 2.86Å; C123-R125 VanDerWaalsContact O-N 3.15Å; R125-E127 VanDerWaalsContact C-N 3.33Å; R125-A128 PolarHBondContact O-N 3.41Å; R125-E129 PolarHBondContact O-N 2.97Å
126E67.7Low67.5Low126 Ų126110.4 Ų110.459%0.58955%0.548SS*.Hα-helixtrans-68.3-35.6177.4-68.3-178.4-176.100111.3T122 C123 E129 L130T122-E126 PolarHBondContact O-N 3.48Å; C123-E126 PolarHBondContact O-N 3.06Å; C123-E126 VanDerWaalsContact O-N 3.08Å; E126-E129 CarbonylContact O-C 3.5Å; E126-E129 WeakPolarHBondContact O-CB 3.47Å; E126-E129 PolarHBondContact O-N 3.35Å; E126-L130 WeakPolarHBondContact O-CB 3.43Å; E126-L130 VanDerWaalsContact O-CG 3.32Å; E126-L130 WeakPolarHBondContact O-CG 3.22Å; E126-L130 PolarHBondContact O-N 3.44Å
127E70.6Confident69.9Low57 Ų57109.4 Ų109.427%0.26654%0.539SS..Hα-helixtrans-67-41.4173-162-166.2-17800111.7C123 R125 E129 L130 R131C123-E127 WeakPolarHBondContact O-CB 3.49Å; C123-E127 PolarHBondContact O-N 2.96Å; R125-E127 VanDerWaalsContact C-N 3.33Å; E127-E129 VanDerWaalsContact C-N 3.29Å; E127-E129 PolarHBondContact O-N 3.23Å; E127-L130 PolarHBondContact O-N 3.21Å; E127-R131 HydrophobicContact CG-CG 4.4Å; E127-R131 VanDerWaalsContact O-CB 3.31Å; E127-R131 WeakPolarHBondContact O-CB 3.46Å; E127-R131 VanDerWaalsContact O-CG 3.24Å; E127-R131 WeakPolarHBondContact O-CG 3.2Å; E127-R131 PolarHBondContact O-N 3.43Å; E127-R131 IonicContact OE1-CZ 3.21Å; E127-R131 IonicContact OE1-NE 3.02Å; E127-R131 PolarHBondContact OE1-NE 3Å; E127-R131 IonicContact OE1-NH2 2.66Å; E127-R131 PolarHBondContact OE1-NH2 3.05Å; E127-R131 IonicContact OE2-CZ 3.73Å; E127-R131 IonicContact OE2-NE 3.88Å; E127-R131 IonicContact OE2-NH2 3.26Å; E127-R131 PolarHBondContact OE2-NH2 3.3Å
128A74.3Confident72.2Confident56 Ų56109.1 Ų109.146%0.46353%0.528SS..Hα-helixtrans-61-39171.600000111.7V124 R125 Y132V124-A128 VanDerWaalsContact O-CB 3.26Å; V124-A128 WeakPolarHBondContact O-CB 3.39Å; V124-A128 PolarHBondContact O-N 3.22Å; R125-A128 PolarHBondContact O-N 3.41Å; A128-Y132 WeakPolarHBondContact O-CB 3.42Å; A128-Y132 PolarHBondContact O-N 3.43Å
129E80.8Confident74.6Confident106 Ų106107.4 Ų107.450%0.49552%0.515SS..Hα-helixtrans-69.4-32.4174.5-110.8-160.6-123.500113.4R125 E126 E127 R133R125-E129 PolarHBondContact O-N 2.97Å; E126-E129 CarbonylContact O-C 3.5Å; E126-E129 WeakPolarHBondContact O-CB 3.47Å; E126-E129 PolarHBondContact O-N 3.35Å; E127-E129 VanDerWaalsContact C-N 3.29Å; E127-E129 PolarHBondContact O-N 3.23Å; E129-R133 WeakPolarHBondContact O-CG 3.26Å; E129-R133 PolarHBondContact O-N 2.76Å; E129-R133 VanDerWaalsContact O-N 3.16Å; E129-R133 PolarHBondContact O-NH1 3.25Å; E129-R133 IonicContact OE2-CZ 3.19Å; E129-R133 IonicContact OE2-NH1 2.71Å; E129-R133 PolarHBondContact OE2-NH1 3.17Å; E129-R133 IonicContact OE2-NH2 2.73Å; E129-R133 PolarHBondContact OE2-NH2 3.44Å
130L82.6Confident76.6Confident103 Ų103109.5 Ų109.554%0.53952%0.52SS..Hα-helixtrans-72.6-46.9172.9-76165.7000111.4E126 E127 Y132 R133 Q134E126-L130 WeakPolarHBondContact O-CB 3.43Å; E126-L130 VanDerWaalsContact O-CG 3.32Å; E126-L130 WeakPolarHBondContact O-CG 3.22Å; E126-L130 PolarHBondContact O-N 3.44Å; E127-L130 PolarHBondContact O-N 3.21Å; L130-Y132 VanDerWaalsContact C-N 3.28Å; L130-Y132 PolarHBondContact O-N 3.47Å; L130-R133 PolarHBondContact O-N 2.94Å; L130-R133 VanDerWaalsContact O-N 3.14Å; L130-Q134 WeakPolarHBondContact O-CG 3.33Å; L130-Q134 PolarHBondContact O-N 3.48Å
131R84.5Confident78.7Confident147 Ų147106.1 Ų106.156%0.55551%0.507SS*.Hα-helixtrans-59.4-37.8174.2-71.2173.2-176.4-165.75.8111.1E127 L135E127-R131 HydrophobicContact CG-CG 4.4Å; E127-R131 VanDerWaalsContact O-CB 3.31Å; E127-R131 WeakPolarHBondContact O-CB 3.46Å; E127-R131 VanDerWaalsContact O-CG 3.24Å; E127-R131 WeakPolarHBondContact O-CG 3.2Å; E127-R131 PolarHBondContact O-N 3.43Å; E127-R131 IonicContact OE1-CZ 3.21Å; E127-R131 IonicContact OE1-NE 3.02Å; E127-R131 PolarHBondContact OE1-NE 3Å; E127-R131 IonicContact OE1-NH2 2.66Å; E127-R131 PolarHBondContact OE1-NH2 3.05Å; E127-R131 IonicContact OE2-CZ 3.73Å; E127-R131 IonicContact OE2-NE 3.88Å; E127-R131 IonicContact OE2-NH2 3.26Å; E127-R131 PolarHBondContact OE2-NH2 3.3Å; R131-L135 WeakPolarHBondContact O-CB 3.29Å; R131-L135 PolarHBondContact O-N 3.27Å
132Y87.5Confident80.6Confident164 Ų164102.4 Ų102.464%0.64349%0.492SS*.Hα-helixtrans-66.8-41.7173.7-177.3-101000112.8A128 L130 T136A128-Y132 WeakPolarHBondContact O-CB 3.42Å; A128-Y132 PolarHBondContact O-N 3.43Å; L130-Y132 VanDerWaalsContact C-N 3.28Å; L130-Y132 PolarHBondContact O-N 3.47Å; Y132-T136 WeakPolarHBondContact O-CB 3.09Å; Y132-T136 PolarHBondContact O-N 3.45Å; Y132-T136 PolarHBondContact O-OG1 3.3Å
133R89.7Confident82.4Confident132 Ų132103.7 Ų103.750%0.49849%0.493SS..Hα-helixtrans-64.5-43.8174.2-75.4179.3-175.683.8-4.8111.8E129 L130 T136 Q137E129-R133 WeakPolarHBondContact O-CG 3.26Å; E129-R133 PolarHBondContact O-N 2.76Å; E129-R133 VanDerWaalsContact O-N 3.16Å; E129-R133 PolarHBondContact O-NH1 3.25Å; E129-R133 IonicContact OE2-CZ 3.19Å; E129-R133 IonicContact OE2-NH1 2.71Å; E129-R133 PolarHBondContact OE2-NH1 3.17Å; E129-R133 IonicContact OE2-NH2 2.73Å; E129-R133 PolarHBondContact OE2-NH2 3.44Å; L130-R133 PolarHBondContact O-N 2.94Å; L130-R133 VanDerWaalsContact O-N 3.14Å; R133-T136 PolarHBondContact O-N 3.02Å; R133-Q137 WeakPolarHBondContact O-CG 3.47Å; R133-Q137 PolarHBondContact O-N 3.05Å
134Q88.2Confident84.1Confident119 Ų119107.9 Ų107.956%0.55650%0.5SS*.Hα-helixtrans-61-51174.3-75.9176.8-2900111.4L130 T136 Q137 E138L130-Q134 WeakPolarHBondContact O-CG 3.33Å; L130-Q134 PolarHBondContact O-N 3.48Å; Q134-T136 PolarHBondContact O-N 3.15Å; Q134-Q137 CarbonylContact O-C 3.59Å; Q134-Q137 WeakPolarHBondContact O-CA 3.5Å; Q134-Q137 WeakPolarHBondContact O-CB 3.28Å; Q134-Q137 PolarHBondContact O-N 3.36Å; Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 3.24Å
135L91Very high85.6Confident118 Ų118106.7 Ų106.762%0.61850%0.498SS*.Hα-helixtrans-58.1-34.6177.5-176.663000112.2R131 Y139R131-L135 WeakPolarHBondContact O-CB 3.29Å; R131-L135 PolarHBondContact O-N 3.27Å; L135-Y139 WeakPolarHBondContact O-CB 3.45Å; L135-Y139 PolarHBondContact O-N 3Å
136T90.3Very high86.6Confident47 Ų47107 Ų10729%0.28850%0.5SS..Hα-helixtrans-70.1-40.5174.1-55.80000112.1Y132 R133 Q134 Q140Y132-T136 WeakPolarHBondContact O-CB 3.09Å; Y132-T136 PolarHBondContact O-N 3.45Å; Y132-T136 PolarHBondContact O-OG1 3.3Å; R133-T136 PolarHBondContact O-N 3.02Å; Q134-T136 PolarHBondContact O-N 3.15Å; T136-Q140 WeakPolarHBondContact O-CB 3.26Å; T136-Q140 VanDerWaalsContact O-CG 3.31Å; T136-Q140 WeakPolarHBondContact O-CG 3.38Å; T136-Q140 PolarHBondContact O-N 2.66Å
137Q92.8Very high87.4Confident125 Ų125103.4 Ų103.458%0.58449%0.492SS*.Hα-helixtrans-66.2-43.2174.6-75.8-178.7-21.600112.1R133 Q134 Q140 A141R133-Q137 WeakPolarHBondContact O-CG 3.47Å; R133-Q137 PolarHBondContact O-N 3.05Å; Q134-Q137 CarbonylContact O-C 3.59Å; Q134-Q137 WeakPolarHBondContact O-CA 3.5Å; Q134-Q137 WeakPolarHBondContact O-CB 3.28Å; Q134-Q137 PolarHBondContact O-N 3.36Å; Q137-Q140 CarbonylContact O-C 3.59Å; Q137-Q140 PolarHBondContact O-N 3.38Å; Q137-A141 WeakPolarHBondContact O-CB 3.36Å; Q137-A141 PolarHBondContact O-N 3.27Å
138E90.8Very high88Confident128 Ų128105.7 Ų105.760%0.59851%0.505SS*.Hα-helixtrans-63.9-42.9174.5-71.8-55.1143.200111.4Q134 Q140 A141 L142Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 3.24Å; E138-Q140 VanDerWaalsContact C-N 3.33Å; E138-Q140 PolarHBondContact O-N 2.93Å; E138-A141 PolarHBondContact O-N 3.05Å; E138-A141 VanDerWaalsContact O-N 3.15Å; E138-L142 VanDerWaalsContact O-CB 3.25Å; E138-L142 WeakPolarHBondContact O-CB 3.45Å; E138-L142 PolarHBondContact O-N 3.48Å
139Y93.6Very high88.2Confident138 Ų138107.7 Ų107.754%0.54151%0.508SS..Hα-helixtrans-60.7-41.9173.6-177-105.6000111.9L135 L142 Q143L135-Y139 WeakPolarHBondContact O-CB 3.45Å; L135-Y139 PolarHBondContact O-N 3Å; Y139-L142 PolarHBondContact O-N 3.2Å; Y139-Q143 HydrophobicContact CD1-CG 4.46Å; Y139-Q143 VanDerWaalsContact CE1-CD 3.46Å; Y139-Q143 HydrophobicContact CE1-CG 4.14Å; Y139-Q143 WeakPolarHBondContact O-CB 3.35Å; Y139-Q143 WeakPolarHBondContact O-CG 3.29Å; Y139-Q143 PolarHBondContact O-N 2.9Å; Y139-Q143 PolarHBondContact OH-NE2 3.45Å; Y139-Q143 VanDerWaalsContact OH-NE2 3.17Å
140Q95.1Very high87.8Confident99 Ų99105.6 Ų105.646%0.46351%0.509SS..Hα-helixtrans-70.1-30.3174.1-72.51775.700113.2T136 Q137 E138 R144T136-Q140 WeakPolarHBondContact O-CB 3.26Å; T136-Q140 VanDerWaalsContact O-CG 3.31Å; T136-Q140 WeakPolarHBondContact O-CG 3.38Å; T136-Q140 PolarHBondContact O-N 2.66Å; Q137-Q140 CarbonylContact O-C 3.59Å; Q137-Q140 PolarHBondContact O-N 3.38Å; E138-Q140 VanDerWaalsContact C-N 3.33Å; E138-Q140 PolarHBondContact O-N 2.93Å; Q140-R144 WeakPolarHBondContact O-CB 3.41Å; Q140-R144 WeakPolarHBondContact O-CG 3.44Å; Q140-R144 PolarHBondContact O-N 2.95Å; Q140-R144 VanDerWaalsContact O-N 3.14Å; Q140-R144 PolarHBondContact O-NE 2.98Å
141A92.2Very high87.3Confident35 Ų35107.7 Ų107.729%0.28952%0.516SS..Hα-helixtrans-70.9-43.9173.800000110.7Q137 E138 R144 A145Q137-A141 WeakPolarHBondContact O-CB 3.36Å; Q137-A141 PolarHBondContact O-N 3.27Å; E138-A141 PolarHBondContact O-N 3.05Å; E138-A141 VanDerWaalsContact O-N 3.15Å; A141-R144 CarbonylContact O-C 3.59Å; A141-R144 PolarHBondContact O-N 3.46Å; A141-A145 WeakPolarHBondContact O-CB 3.41Å; A141-A145 PolarHBondContact O-N 2.92Å
142L92.4Very high86.5Confident95 Ų95105.9 Ų105.950%0.49752%0.521SS..Hα-helixtrans-64.4-42175.2-173.961.4000111.7E138 Y139 R144 A145 Y146E138-L142 VanDerWaalsContact O-CB 3.25Å; E138-L142 WeakPolarHBondContact O-CB 3.45Å; E138-L142 PolarHBondContact O-N 3.48Å; Y139-L142 PolarHBondContact O-N 3.2Å; L142-R144 VanDerWaalsContact C-N 3.35Å; L142-R144 PolarHBondContact O-N 2.87Å; L142-A145 PolarHBondContact O-N 2.99Å; L142-Y146 HydrophobicContact CD1-CD2 3.9Å; L142-Y146 HydrophobicContact CD1-CE2 3.73Å; L142-Y146 HydrophobicContact CD2-CE2 4.48Å; L142-Y146 HydrophobicContact CG-CD2 3.92Å; L142-Y146 HydrophobicContact CG-CE2 3.95Å; L142-Y146 WeakPolarHBondContact O-CB 3.46Å; L142-Y146 WeakPolarHBondContact O-CD2 3.33Å; L142-Y146 PolarHBondContact O-N 3.26Å
143Q91.8Very high85.1Confident100 Ų100101.4 Ų101.447%0.46751%0.513SS..Hα-helixtrans-60.1-42.2171.5-79.7-174.3-28.900112.1Y139 A147Y139-Q143 HydrophobicContact CD1-CG 4.46Å; Y139-Q143 VanDerWaalsContact CE1-CD 3.46Å; Y139-Q143 HydrophobicContact CE1-CG 4.14Å; Y139-Q143 WeakPolarHBondContact O-CB 3.35Å; Y139-Q143 WeakPolarHBondContact O-CG 3.29Å; Y139-Q143 PolarHBondContact O-N 2.9Å; Y139-Q143 PolarHBondContact OH-NE2 3.45Å; Y139-Q143 VanDerWaalsContact OH-NE2 3.17Å; Q143-A147 WeakPolarHBondContact O-CB 3.47Å; Q143-A147 PolarHBondContact O-N 2.9Å
144R90.9Very high83.3Confident149 Ų14997.7 Ų97.756%0.56252%0.516SS*.Hα-helixtrans-67.4-38.3174.5-77.2173.8-71.5149.1-2.2112.4Q140 A141 L142 A147 L148Q140-R144 WeakPolarHBondContact O-CB 3.41Å; Q140-R144 WeakPolarHBondContact O-CG 3.44Å; Q140-R144 PolarHBondContact O-N 2.95Å; Q140-R144 VanDerWaalsContact O-N 3.14Å; Q140-R144 PolarHBondContact O-NE 2.98Å; A141-R144 CarbonylContact O-C 3.59Å; A141-R144 PolarHBondContact O-N 3.46Å; L142-R144 VanDerWaalsContact C-N 3.35Å; L142-R144 PolarHBondContact O-N 2.87Å; R144-A147 PolarHBondContact O-N 3.49Å; R144-L148 WeakPolarHBondContact O-CB 3.48Å; R144-L148 VanDerWaalsContact O-CG 3.3Å; R144-L148 WeakPolarHBondContact O-CG 3.46Å; R144-L148 PolarHBondContact O-N 2.78Å
145A87.4Confident82Confident44 Ų4495.1 Ų95.136%0.36452%0.522SS..Hα-helixtrans-66-42.2175.500000111.7A141 L142 L148 L149A141-A145 WeakPolarHBondContact O-CB 3.41Å; A141-A145 PolarHBondContact O-N 2.92Å; L142-A145 PolarHBondContact O-N 2.99Å; A145-L148 PolarHBondContact O-N 2.9Å; A145-L149 WeakPolarHBondContact O-CB 3.49Å; A145-L149 WeakPolarHBondContact O-CG 3.42Å; A145-L149 PolarHBondContact O-N 2.83Å
146Y84Confident80.3Confident158 Ų15895.5 Ų95.562%0.6252%0.524SS*.Hα-helixtrans-65-36.8171.9-90.6-69.3000112.5L142 A150L142-Y146 HydrophobicContact CD1-CD2 3.9Å; L142-Y146 HydrophobicContact CD1-CE2 3.73Å; L142-Y146 HydrophobicContact CD2-CE2 4.48Å; L142-Y146 HydrophobicContact CG-CD2 3.92Å; L142-Y146 HydrophobicContact CG-CE2 3.95Å; L142-Y146 WeakPolarHBondContact O-CB 3.46Å; L142-Y146 WeakPolarHBondContact O-CD2 3.33Å; L142-Y146 PolarHBondContact O-N 3.26Å; Y146-A150 WeakPolarHBondContact O-CB 3.05Å; Y146-A150 PolarHBondContact O-N 3.34Å
147A85.2Confident78.8Confident51 Ų51101.7 Ų101.742%0.42154%0.543SS..Hα-helixtrans-64.9-46.7173.600000111.6Q143 R144 L149 A150 E151Q143-A147 WeakPolarHBondContact O-CB 3.47Å; Q143-A147 PolarHBondContact O-N 2.9Å; R144-A147 PolarHBondContact O-N 3.49Å; A147-L149 PolarHBondContact O-N 3.11Å; A147-A150 CarbonylContact O-C 3.5Å; A147-A150 WeakPolarHBondContact O-CA 3.3Å; A147-A150 WeakPolarHBondContact O-CB 3.47Å; A147-A150 PolarHBondContact O-N 2.96Å; A147-A150 VanDerWaalsContact O-N 3.11Å; A147-E151 WeakPolarHBondContact O-CG 3.45Å; A147-E151 PolarHBondContact O-N 2.98Å
148L83.5Confident77.6Confident105 Ų10598.2 Ų98.255%0.5553%0.529SS..Hα-helixtrans-65.8-35.8177.1-71168.1000112.5R144 A145 E151 T152R144-L148 WeakPolarHBondContact O-CB 3.48Å; R144-L148 VanDerWaalsContact O-CG 3.3Å; R144-L148 WeakPolarHBondContact O-CG 3.46Å; R144-L148 PolarHBondContact O-N 2.78Å; A145-L148 PolarHBondContact O-N 2.9Å; L148-E151 PolarHBondContact O-N 3.13Å; L148-T152 WeakPolarHBondContact O-CB 3.31Å; L148-T152 WeakPolarHBondContact O-CG2 3.17Å; L148-T152 PolarHBondContact O-N 3.43Å; L148-T152 PolarHBondContact O-OG1 3.48Å
149L78.3Confident76.8Confident98 Ų9894.7 Ų94.751%0.51352%0.522SS..Hα-helixtrans-69.1-34.9170.9-76.4168.3000111.7A145 A147 T152 C153A145-L149 WeakPolarHBondContact O-CB 3.49Å; A145-L149 WeakPolarHBondContact O-CG 3.42Å; A145-L149 PolarHBondContact O-N 2.83Å; A147-L149 PolarHBondContact O-N 3.11Å; L149-T152 WeakPolarHBondContact CA-OG1 3.26Å; L149-C153 WeakPolarHBondContact O-CB 3.42Å; L149-C153 PolarHBondContact O-N 2.62Å
150A71.7Confident76.1Confident63 Ų6394.1 Ų94.152%0.52152%0.524SS..Hα-helixtrans-71-29.717300000112.5Y146 A147 G154Y146-A150 WeakPolarHBondContact O-CB 3.05Å; Y146-A150 PolarHBondContact O-N 3.34Å; A147-A150 CarbonylContact O-C 3.5Å; A147-A150 WeakPolarHBondContact O-CA 3.3Å; A147-A150 WeakPolarHBondContact O-CB 3.47Å; A147-A150 PolarHBondContact O-N 2.96Å; A147-A150 VanDerWaalsContact O-N 3.11Å; A150-G154 WeakPolarHBondContact O-CA 3.4Å; A150-G154 PolarHBondContact O-N 2.85Å
151E73.4Confident75.6Confident147 Ų14795 Ų9569%0.68753%0.526SS*.Hα-helixtrans-77.5-40.2173.3-72.8-179.8145.500112.1A147 L148A147-E151 WeakPolarHBondContact O-CG 3.45Å; A147-E151 PolarHBondContact O-N 2.98Å; L148-E151 PolarHBondContact O-N 3.13Å
152T66.4Low75.1Confident109 Ų10998.5 Ų98.567%0.66954%0.537SS*.Hα-helixtrans-78-36-179.950.30000113.7L148 L149L148-T152 WeakPolarHBondContact O-CB 3.31Å; L148-T152 WeakPolarHBondContact O-CG2 3.17Å; L148-T152 PolarHBondContact O-N 3.43Å; L148-T152 PolarHBondContact O-OG1 3.48Å; L149-T152 WeakPolarHBondContact CA-OG1 3.26Å
153C59.1Low75Confident70 Ų7098.6 Ų98.647%0.47354%0.536SS..Hα-helixtrans-93.1-17.2174.2-59.20000113.4L149 G155L149-C153 WeakPolarHBondContact O-CB 3.42Å; L149-C153 PolarHBondContact O-N 2.62Å; C153-G155 VanDerWaalsContact C-N 3.28Å; C153-G155 PolarHBondContact O-N 2.82Å
154G52.2Low74.9Confident53 Ų5398.2 Ų98.255%0.54653%0.533SS..  trans-85.310.7179.800000115A150 N156A150-G154 WeakPolarHBondContact O-CA 3.4Å; A150-G154 PolarHBondContact O-N 2.85Å; G154-N156 PolarHBondContact O-N 2.75Å
155G59.2Low74.9Confident66 Ų6693.9 Ų93.968%0.6852%0.524SS*.SBendtrans-6756.7168.600000113.2C153C153-G155 VanDerWaalsContact C-N 3.28Å; C153-G155 PolarHBondContact O-N 2.82Å
156N55.4Low74.9Confident126 Ų126100.2 Ų100.267%0.67454%0.538SS*.  trans46.674.1-176.3-168.118.3000112.9G154 D158G154-N156 PolarHBondContact O-N 2.75Å; N156-D158 PolarHBondContact O-N 3.48Å
157Y58.5Low75.4Confident176 Ų17697.7 Ų97.769%0.6953%0.532SS*.  trans-66.769.4-179.8-154.9-81000111.9A159Y157-A159 PolarHBondContact O-N 2.91Å
158D68.4Low75.8Confident52 Ų52101 Ų10128%0.27854%0.539SS..  trans-7592.5178.9-176-24.7000108.5N156 E160 K161 E162N156-D158 PolarHBondContact O-N 3.48Å; D158-E160 PolarHBondContact O-N 3.19Å; D158-E160 VanDerWaalsContact O-N 3.12Å; D158-E160 WeakPolarHBondContact OD1-CA 3.23Å; D158-E160 VanDerWaalsContact OD1-CB 3.29Å; D158-E160 WeakPolarHBondContact OD1-CB 3.49Å; D158-E160 PolarHBondContact OD1-N 3.31Å; D158-K161 HydrophobicContact CB-CB 4.09Å; D158-K161 HydrophobicContact CB-CD 4.2Å; D158-K161 HydrophobicContact CB-CG 4.1Å; D158-K161 WeakPolarHBondContact O-CA 3.38Å; D158-K161 WeakPolarHBondContact O-CB 3.5Å; D158-K161 PolarHBondContact O-N 3.36Å; D158-K161 PolarHBondContact OD1-N 2.97Å; D158-K161 WeakPolarHBondContact OD2-CG 3.45Å; D158-K161 IonicContact OD2-NZ 2.62Å; D158-K161 PolarHBondContact OD2-NZ 2.92Å; D158-E162 PolarHBondContact O-N 3.37Å
159A74.6Confident76.3Confident54 Ų54100.4 Ų100.445%0.44654%0.535SS..Hα-helixtrans-57-25.2178.500000112.6Y157 I163Y157-A159 PolarHBondContact O-N 2.91Å; A159-I163 VanDerWaalsContact O-CB 3.3Å; A159-I163 WeakPolarHBondContact O-CB 3.35Å; A159-I163 WeakPolarHBondContact O-CD1 3.45Å; A159-I163 WeakPolarHBondContact O-CG1 3.28Å; A159-I163 PolarHBondContact O-N 2.66Å
160E78.1Confident77.1Confident126 Ų126100.4 Ų100.459%0.58954%0.536SS*.Hα-helixtrans-75.3-33.7176.3-150.7-167.3128.100111.6D158 K164D158-E160 PolarHBondContact O-N 3.19Å; D158-E160 VanDerWaalsContact O-N 3.12Å; D158-E160 WeakPolarHBondContact OD1-CA 3.23Å; D158-E160 VanDerWaalsContact OD1-CB 3.29Å; D158-E160 WeakPolarHBondContact OD1-CB 3.49Å; D158-E160 PolarHBondContact OD1-N 3.31Å; E160-K164 VanDerWaalsContact O-CD 3.22Å; E160-K164 WeakPolarHBondContact O-CD 3.45Å; E160-K164 WeakPolarHBondContact O-CE 3.35Å; E160-K164 WeakPolarHBondContact O-CG 3.21Å; E160-K164 PolarHBondContact O-N 3.06Å; E160-K164 WeakPolarHBondContact OE1-CE 3.35Å; E160-K164 IonicContact OE1-NZ 2.61Å; E160-K164 PolarHBondContact OE1-NZ 2.72Å
161K84.4Confident78.2Confident118 Ų118102.1 Ų102.151%0.51354%0.536SS..Hα-helixtrans-67.8-46.9166.7-74.1-173.7-169.281.60111.6D158 I163 K164 T165D158-K161 HydrophobicContact CB-CB 4.09Å; D158-K161 HydrophobicContact CB-CD 4.2Å; D158-K161 HydrophobicContact CB-CG 4.1Å; D158-K161 WeakPolarHBondContact O-CA 3.38Å; D158-K161 WeakPolarHBondContact O-CB 3.5Å; D158-K161 PolarHBondContact O-N 3.36Å; D158-K161 PolarHBondContact OD1-N 2.97Å; D158-K161 WeakPolarHBondContact OD2-CG 3.45Å; D158-K161 IonicContact OD2-NZ 2.62Å; D158-K161 PolarHBondContact OD2-NZ 2.92Å; K161-I163 VanDerWaalsContact C-N 3.33Å; K161-I163 PolarHBondContact O-N 3.31Å; K161-K164 CarbonylContact O-C 3.57Å; K161-K164 WeakPolarHBondContact O-CA 3.47Å; K161-K164 WeakPolarHBondContact O-CB 3.47Å; K161-K164 PolarHBondContact O-N 2.99Å; K161-T165 PolarHBondContact O-N 2.65Å; K161-T165 PolarHBondContact O-OG1 3.29Å; K161-T165 VanDerWaalsContact O-OG1 3.07Å
162E82.8Confident79.2Confident109 Ų10999.4 Ų99.451%0.50952%0.523SS..Hα-helixtrans-65.6-37.1-175.8-171.459.3-166.200112.1D158 T165 R166D158-E162 PolarHBondContact O-N 3.37Å; E162-T165 PolarHBondContact O-N 3.34Å; E162-R166 WeakPolarHBondContact O-CB 3.45Å; E162-R166 PolarHBondContact O-N 3.36Å
163I89.4Confident80.5Confident96 Ų9698.5 Ų98.549%0.49251%0.513SS..Hα-helixtrans-60.7-45.1169-72.2165.8000110.7A159 K161 R166 E167A159-I163 VanDerWaalsContact O-CB 3.3Å; A159-I163 WeakPolarHBondContact O-CB 3.35Å; A159-I163 WeakPolarHBondContact O-CD1 3.45Å; A159-I163 WeakPolarHBondContact O-CG1 3.28Å; A159-I163 PolarHBondContact O-N 2.66Å; K161-I163 VanDerWaalsContact C-N 3.33Å; K161-I163 PolarHBondContact O-N 3.31Å; I163-R166 PolarHBondContact O-N 3.32Å; I163-E167 HydrophobicContact CG2-CG 4.3Å; I163-E167 WeakPolarHBondContact O-CB 3.38Å; I163-E167 WeakPolarHBondContact O-CG 3.47Å; I163-E167 PolarHBondContact O-N 2.89Å
164K90.8Very high82.2Confident92 Ų9298 Ų9840%0.451%0.511SS..Hα-helixtrans-64.8-39.5177.6-72.3163.8-1671650113E160 K161 R166 E167 Q168E160-K164 VanDerWaalsContact O-CD 3.22Å; E160-K164 WeakPolarHBondContact O-CD 3.45Å; E160-K164 WeakPolarHBondContact O-CE 3.35Å; E160-K164 WeakPolarHBondContact O-CG 3.21Å; E160-K164 PolarHBondContact O-N 3.06Å; E160-K164 WeakPolarHBondContact OE1-CE 3.35Å; E160-K164 IonicContact OE1-NZ 2.61Å; E160-K164 PolarHBondContact OE1-NZ 2.72Å; K161-K164 CarbonylContact O-C 3.57Å; K161-K164 WeakPolarHBondContact O-CA 3.47Å; K161-K164 WeakPolarHBondContact O-CB 3.47Å; K161-K164 PolarHBondContact O-N 2.99Å; K164-R166 VanDerWaalsContact C-N 3.34Å; K164-E167 PolarHBondContact O-N 3.15Å; K164-Q168 WeakPolarHBondContact O-CB 3.3Å; K164-Q168 WeakPolarHBondContact O-CG 2.76Å; K164-Q168 PolarHBondContact O-N 3.12Å
165T89.1Confident84.3Confident59 Ų59104.2 Ų104.236%0.36252%0.518SS..Hα-helixtrans-61.2-45.4173.2-51.30000110.3K161 E162 Q168 L169K161-T165 PolarHBondContact O-N 2.65Å; K161-T165 PolarHBondContact O-OG1 3.29Å; K161-T165 VanDerWaalsContact O-OG1 3.07Å; E162-T165 PolarHBondContact O-N 3.34Å; T165-Q168 PolarHBondContact O-N 3.42Å; T165-L169 HydrophobicContact CG2-CD1 4.27Å; T165-L169 WeakPolarHBondContact O-CG 3.27Å; T165-L169 PolarHBondContact O-N 2.91Å
166R89.3Confident85.9Confident177 Ų177108.8 Ų108.867%0.66852%0.516SS*.Hα-helixtrans-64.4-41177-175.3175.6-179142.11.2112.7E162 I163 K164 L169 L170E162-R166 WeakPolarHBondContact O-CB 3.45Å; E162-R166 PolarHBondContact O-N 3.36Å; I163-R166 PolarHBondContact O-N 3.32Å; K164-R166 VanDerWaalsContact C-N 3.34Å; R166-L169 PolarHBondContact O-N 3.32Å; R166-L170 HydrophobicContact CG-CD1 4.26Å; R166-L170 WeakPolarHBondContact O-CB 3.26Å; R166-L170 VanDerWaalsContact O-CG 3.26Å; R166-L170 WeakPolarHBondContact O-CG 3.49Å; R166-L170 PolarHBondContact O-N 3.18Å
167E93.2Very high87.8Confident104 Ų104108.9 Ų108.949%0.48651%0.512SS..Hα-helixtrans-64.5-41.6173.9-75.6175.217000111.5I163 K164 L170 N171I163-E167 HydrophobicContact CG2-CG 4.3Å; I163-E167 WeakPolarHBondContact O-CB 3.38Å; I163-E167 WeakPolarHBondContact O-CG 3.47Å; I163-E167 PolarHBondContact O-N 2.89Å; K164-E167 PolarHBondContact O-N 3.15Å; E167-L170 PolarHBondContact O-N 3.43Å; E167-N171 WeakPolarHBondContact O-CB 3.49Å; E167-N171 PolarHBondContact O-N 2.7Å; E167-N171 PolarHBondContact O-ND2 3.09Å
168Q94Very high89.5Confident121 Ų121103.9 Ų103.957%0.56550%0.502SS*.Hα-helixtrans-60.5-49.3174.6-74.91667.100111.1K164 T165 L170 N171 E172K164-Q168 WeakPolarHBondContact O-CB 3.3Å; K164-Q168 WeakPolarHBondContact O-CG 2.76Å; K164-Q168 PolarHBondContact O-N 3.12Å; T165-Q168 PolarHBondContact O-N 3.42Å; Q168-L170 VanDerWaalsContact C-N 3.35Å; Q168-L170 PolarHBondContact O-N 3.41Å; Q168-N171 WeakPolarHBondContact O-CB 3.41Å; Q168-N171 PolarHBondContact O-N 3.39Å; Q168-N171 VanDerWaalsContact O-N 3.15Å; Q168-E172 WeakPolarHBondContact O-CG 3.4Å; Q168-E172 PolarHBondContact O-N 2.89Å
169L94.3Very high90.7Very high92 Ų92108 Ų10848%0.48251%0.514SS..Hα-helixtrans-61.5-38.9176.7-69.7170.1000112.6T165 R166 E172 I173T165-L169 HydrophobicContact CG2-CD1 4.27Å; T165-L169 WeakPolarHBondContact O-CG 3.27Å; T165-L169 PolarHBondContact O-N 2.91Å; R166-L169 PolarHBondContact O-N 3.32Å; L169-E172 PolarHBondContact O-N 3.38Å; L169-I173 WeakPolarHBondContact O-CB 3.24Å; L169-I173 WeakPolarHBondContact O-CD1 3.48Å; L169-I173 WeakPolarHBondContact O-CG1 3.49Å; L169-I173 PolarHBondContact O-N 3.42Å
170L94.6Very high91.5Very high99 Ų99108.9 Ų108.952%0.51851%0.514SS..Hα-helixtrans-65.4-39.3174.2-74.4168.9000112.3R166 E167 Q168 S174R166-L170 HydrophobicContact CG-CD1 4.26Å; R166-L170 WeakPolarHBondContact O-CB 3.26Å; R166-L170 VanDerWaalsContact O-CG 3.26Å; R166-L170 WeakPolarHBondContact O-CG 3.49Å; R166-L170 PolarHBondContact O-N 3.18Å; E167-L170 PolarHBondContact O-N 3.43Å; Q168-L170 VanDerWaalsContact C-N 3.35Å; Q168-L170 PolarHBondContact O-N 3.41Å; L170-S174 WeakPolarHBondContact O-CB 3.48Å; L170-S174 PolarHBondContact O-N 3Å
171N94.8Very high92.2Very high98 Ų98105.5 Ų105.552%0.52451%0.507SS..Hα-helixtrans-67.1-36.8174.2-79.5-71000112.1E167 Q168 R175E167-N171 WeakPolarHBondContact O-CB 3.49Å; E167-N171 PolarHBondContact O-N 2.7Å; E167-N171 PolarHBondContact O-ND2 3.09Å; Q168-N171 WeakPolarHBondContact O-CB 3.41Å; Q168-N171 PolarHBondContact O-N 3.39Å; Q168-N171 VanDerWaalsContact O-N 3.15Å; N171-R175 VanDerWaalsContact O-CG 3.29Å; N171-R175 WeakPolarHBondContact O-CG 3.39Å; N171-R175 PolarHBondContact O-N 3.01Å
172E95.7Very high92.6Very high91 Ų91104.3 Ų104.343%0.42551%0.507SS..Hα-helixtrans-67.9-46.6174.4-73.9178.6-177.600111.7Q168 L169 S174 R175 Y176Q168-E172 WeakPolarHBondContact O-CG 3.4Å; Q168-E172 PolarHBondContact O-N 2.89Å; L169-E172 PolarHBondContact O-N 3.38Å; E172-S174 VanDerWaalsContact C-N 3.29Å; E172-S174 PolarHBondContact O-N 2.91Å; E172-R175 WeakPolarHBondContact O-CB 3.38Å; E172-R175 PolarHBondContact O-N 3.32Å; E172-R175 VanDerWaalsContact O-N 3.12Å; E172-Y176 HydrophobicContact CB-CD2 4.47Å; E172-Y176 HydrophobicContact CB-CE2 4.3Å; E172-Y176 WeakPolarHBondContact O-CD2 3.35Å; E172-Y176 PolarHBondContact O-N 2.91Å
173I92.4Very high92.9Very high89 Ų89103.3 Ų103.346%0.45650%0.504SS..Hα-helixtrans-54.9-46.1173.1-71.9163.7000110.6L169 R175 Y176 Q177L169-I173 WeakPolarHBondContact O-CB 3.24Å; L169-I173 WeakPolarHBondContact O-CD1 3.48Å; L169-I173 WeakPolarHBondContact O-CG1 3.49Å; L169-I173 PolarHBondContact O-N 3.42Å; I173-R175 PolarHBondContact O-N 3.08Å; I173-Y176 PolarHBondContact O-N 3.45Å; I173-Q177 HydrophobicContact CG2-CG 4.43Å; I173-Q177 WeakPolarHBondContact O-CB 3.23Å; I173-Q177 VanDerWaalsContact O-CG 3.28Å; I173-Q177 WeakPolarHBondContact O-CG 3.44Å; I173-Q177 PolarHBondContact O-N 3.16Å
174S95.3Very high92.8Very high60 Ų60104.9 Ų104.942%0.4251%0.51SS..Hα-helixtrans-60.9-43.5176.7178.70000112.4L170 E172 Q177 S178L170-S174 WeakPolarHBondContact O-CB 3.48Å; L170-S174 PolarHBondContact O-N 3Å; E172-S174 VanDerWaalsContact C-N 3.29Å; E172-S174 PolarHBondContact O-N 2.91Å; S174-Q177 PolarHBondContact O-N 2.95Å; S174-S178 PolarHBondContact O-N 3.5Å; S174-S178 PolarHBondContact O-OG 3.24Å
175R96.1Very high92.7Very high184 Ų184103.3 Ų103.369%0.69451%0.51SS*.Hα-helixtrans-62.9-41.9175.4-73.3169.5-179.2-167.71.1112.5N171 E172 I173 R179N171-R175 VanDerWaalsContact O-CG 3.29Å; N171-R175 WeakPolarHBondContact O-CG 3.39Å; N171-R175 PolarHBondContact O-N 3.01Å; E172-R175 WeakPolarHBondContact O-CB 3.38Å; E172-R175 PolarHBondContact O-N 3.32Å; E172-R175 VanDerWaalsContact O-N 3.12Å; I173-R175 PolarHBondContact O-N 3.08Å; R175-R179 WeakPolarHBondContact O-CB 3.47Å; R175-R179 PolarHBondContact O-N 3.43Å
176Y93.8Very high92.6Very high162 Ų162103.1 Ų103.164%0.63552%0.515SS*.Hα-helixtrans-67.3-38176.2-72.1-60.4000111.8E172 I173 R179 V180E172-Y176 HydrophobicContact CB-CD2 4.47Å; E172-Y176 HydrophobicContact CB-CE2 4.3Å; E172-Y176 WeakPolarHBondContact O-CD2 3.35Å; E172-Y176 PolarHBondContact O-N 2.91Å; I173-Y176 PolarHBondContact O-N 3.45Å; Y176-R179 PolarHBondContact O-N 3.32Å; Y176-V180 WeakPolarHBondContact O-CG2 3.33Å; Y176-V180 PolarHBondContact O-N 2.86Å
177Q93.6Very high92.2Very high128 Ų128100.7 Ų100.760%0.59851%0.514SS*.Hα-helixtrans-61.4-47.4173.7-75169.9-15.800112.2I173 S174 R179 V180 A181I173-Q177 HydrophobicContact CG2-CG 4.43Å; I173-Q177 WeakPolarHBondContact O-CB 3.23Å; I173-Q177 VanDerWaalsContact O-CG 3.28Å; I173-Q177 WeakPolarHBondContact O-CG 3.44Å; I173-Q177 PolarHBondContact O-N 3.16Å; S174-Q177 PolarHBondContact O-N 2.95Å; Q177-R179 VanDerWaalsContact C-N 3.31Å; Q177-R179 PolarHBondContact O-N 3.28Å; Q177-V180 PolarHBondContact O-N 3.41Å; Q177-A181 PolarHBondContact O-N 2.89Å; Q177-A181 VanDerWaalsContact O-N 3.09Å
178S94.3Very high91.6Very high70 Ų70103 Ų10349%0.4952%0.523SS..Hα-helixtrans-58.5-44172.6-60.60000111.6S174 V180 A181 D182S174-S178 PolarHBondContact O-N 3.5Å; S174-S178 PolarHBondContact O-OG 3.24Å; S178-V180 VanDerWaalsContact C-N 3.33Å; S178-V180 PolarHBondContact O-N 2.87Å; S178-A181 PolarHBondContact O-N 2.93Å; S178-D182 PolarHBondContact O-N 3.17Å
179R94.8Very high90.9Very high138 Ų138103.1 Ų103.152%0.52152%0.523SS..Hα-helixtrans-66.2-32.4-179.4-175.154.7-179.1161.32.3113.3R175 Y176 Q177 L183R175-R179 WeakPolarHBondContact O-CB 3.47Å; R175-R179 PolarHBondContact O-N 3.43Å; Y176-R179 PolarHBondContact O-N 3.32Å; Q177-R179 VanDerWaalsContact C-N 3.31Å; Q177-R179 PolarHBondContact O-N 3.28Å; R179-L183 HydrophobicContact CG-CD1 4.32Å; R179-L183 WeakPolarHBondContact O-CD1 3.5Å; R179-L183 VanDerWaalsContact O-CG 3.26Å; R179-L183 WeakPolarHBondContact O-CG 3.48Å; R179-L183 PolarHBondContact O-N 2.87Å
180V91.5Very high90.4Very high74 Ų74104.5 Ų104.545%0.44853%0.527SS..Hα-helixtrans-66.8-48.7172.2167.90000110.1Y176 Q177 S178 D182 L183 E184Y176-V180 WeakPolarHBondContact O-CG2 3.33Å; Y176-V180 PolarHBondContact O-N 2.86Å; Q177-V180 PolarHBondContact O-N 3.41Å; S178-V180 VanDerWaalsContact C-N 3.33Å; S178-V180 PolarHBondContact O-N 2.87Å; V180-D182 VanDerWaalsContact C-N 3.33Å; V180-D182 PolarHBondContact O-N 2.73Å; V180-L183 PolarHBondContact O-N 2.97Å; V180-E184 HydrophobicContact CG1-CG 4.19Å; V180-E184 WeakPolarHBondContact CG1-OE1 3.25Å; V180-E184 WeakPolarHBondContact O-CG 3.45Å; V180-E184 PolarHBondContact O-N 3.35Å
181A91.3Very high89.6Confident54 Ų54101.5 Ų101.545%0.44652%0.52SS..Hα-helixtrans-60.3-38.9178.500000113.1Q177 S178 L183 S185Q177-A181 PolarHBondContact O-N 2.89Å; Q177-A181 VanDerWaalsContact O-N 3.09Å; S178-A181 PolarHBondContact O-N 2.93Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 2.82Å; A181-S185 VanDerWaalsContact O-CB 3.29Å; A181-S185 WeakPolarHBondContact O-CB 3.28Å; A181-S185 PolarHBondContact O-N 2.89Å
182D93.9Very high88.7Confident94 Ų94101.9 Ų101.950%0.50352%0.521SS..Hα-helixtrans-59.1-44.1172.7-70.2-24.1000112S178 V180 A186S178-D182 PolarHBondContact O-N 3.17Å; V180-D182 VanDerWaalsContact C-N 3.33Å; V180-D182 PolarHBondContact O-N 2.73Å; D182-A186 WeakPolarHBondContact O-CB 3.2Å; D182-A186 PolarHBondContact O-N 2.66Å
183L88.6Confident88Confident87 Ų87102.4 Ų102.446%0.45553%0.527SS..Hα-helixtrans-71.9-42.9-178.3-72.8169.5000111.7R179 V180 A181 S185 A186 L187R179-L183 HydrophobicContact CG-CD1 4.32Å; R179-L183 WeakPolarHBondContact O-CD1 3.5Å; R179-L183 VanDerWaalsContact O-CG 3.26Å; R179-L183 WeakPolarHBondContact O-CG 3.48Å; R179-L183 PolarHBondContact O-N 2.87Å; V180-L183 PolarHBondContact O-N 2.97Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 2.82Å; L183-S185 VanDerWaalsContact C-N 3.31Å; L183-S185 PolarHBondContact O-N 3.32Å; L183-A186 PolarHBondContact O-N 2.87Å; L183-L187 WeakPolarHBondContact O-CB 3.36Å; L183-L187 PolarHBondContact O-N 3.08Å
184E88.7Confident87.6Confident130 Ų130103.7 Ų103.761%0.60753%0.533SS*.Hα-helixtrans-58.9-42.8173-71.6175.7168.500111.4V180 K188V180-E184 HydrophobicContact CG1-CG 4.19Å; V180-E184 WeakPolarHBondContact CG1-OE1 3.25Å; V180-E184 WeakPolarHBondContact O-CG 3.45Å; V180-E184 PolarHBondContact O-N 3.35Å; E184-K188 WeakPolarHBondContact O-CB 3.36Å; E184-K188 PolarHBondContact O-N 3.23Å
185S88.7Confident87.3Confident59 Ų59106.7 Ų106.741%0.41354%0.538SS..Hα-helixtrans-61.8-48.9174.5-173.90000111.6A181 L183 L187 K188 H189A181-S185 VanDerWaalsContact O-CB 3.29Å; A181-S185 WeakPolarHBondContact O-CB 3.28Å; A181-S185 PolarHBondContact O-N 2.89Å; L183-S185 VanDerWaalsContact C-N 3.31Å; L183-S185 PolarHBondContact O-N 3.32Å; S185-L187 PolarHBondContact O-N 3.43Å; S185-K188 PolarHBondContact O-N 2.79Å; S185-H189 PolarHBondContact O-N 3.19Å; S185-H189 PolarHBondContact O-ND1 3.47Å
186A86.4Confident86.9Confident55 Ų55104.7 Ų104.746%0.45553%0.531SS..Hα-helixtrans-60.3-44178.600000112.3D182 L183 K188 H189 Q190D182-A186 WeakPolarHBondContact O-CB 3.2Å; D182-A186 PolarHBondContact O-N 2.66Å; L183-A186 PolarHBondContact O-N 2.87Å; A186-K188 VanDerWaalsContact C-N 3.34Å; A186-K188 PolarHBondContact O-N 3.07Å; A186-H189 PolarHBondContact O-N 3.26Å; A186-Q190 PolarHBondContact O-N 3.38Å
187L79.4Confident86.7Confident125 Ų125100.6 Ų100.665%0.65452%0.522SS*.Hα-helixtrans-66.5-36.4-179.8-147.3156.3000111.3L183 S185 Q190 G191L183-L187 WeakPolarHBondContact O-CB 3.36Å; L183-L187 PolarHBondContact O-N 3.08Å; S185-L187 PolarHBondContact O-N 3.43Å; L187-Q190 PolarHBondContact O-N 2.77Å; L187-G191 PolarHBondContact O-N 3.16Å
188K80.9Confident86.7Confident153 Ų153100.7 Ų100.767%0.66552%0.523SS*.Hα-helixtrans-63.8-41.1171.9-174.8179.5179.3-177.90112.8E184 S185 A186 G191 L192E184-K188 WeakPolarHBondContact O-CB 3.36Å; E184-K188 PolarHBondContact O-N 3.23Å; S185-K188 PolarHBondContact O-N 2.79Å; A186-K188 VanDerWaalsContact C-N 3.34Å; A186-K188 PolarHBondContact O-N 3.07Å; K188-G191 PolarHBondContact O-N 2.94Å; K188-L192 PolarHBondContact O-N 3.36Å
189H80.9Confident86.6Confident123 Ų123103.4 Ų103.457%0.56953%0.528SS*.Hα-helixtrans-67.5-42176-72.186.9000111.6S185 A186 G191 L192 D193S185-H189 PolarHBondContact O-N 3.19Å; S185-H189 PolarHBondContact O-ND1 3.47Å; A186-H189 PolarHBondContact O-N 3.26Å; H189-G191 VanDerWaalsContact C-N 3.28Å; H189-G191 PolarHBondContact O-N 3.36Å; H189-L192 WeakPolarHBondContact O-CB 3.36Å; H189-L192 PolarHBondContact O-N 3.21Å; H189-D193 PolarHBondContact O-N 2.98Å; H189-D193 VanDerWaalsContact O-N 3.15Å
190Q82.3Confident86.4Confident121 Ų121100.9 Ų100.957%0.56552%0.52SS*.Hα-helixtrans-61-36.3175.1-169.4176.910.300112.4A186 L187 L192 D193 M194A186-Q190 PolarHBondContact O-N 3.38Å; L187-Q190 PolarHBondContact O-N 2.77Å; Q190-L192 VanDerWaalsContact C-N 3.29Å; Q190-L192 PolarHBondContact O-N 3.27Å; Q190-D193 PolarHBondContact O-N 3.43Å; Q190-M194 PolarHBondContact O-N 2.79Å
191G77.9Confident86.3Confident36 Ų36102.4 Ų102.437%0.37152%0.523SS..Hα-helixtrans-70.1-18173.900000115.2L187 K188 H189L187-G191 PolarHBondContact O-N 3.16Å; K188-G191 PolarHBondContact O-N 2.94Å; H189-G191 VanDerWaalsContact C-N 3.28Å; H189-G191 PolarHBondContact O-N 3.36Å
192L76.8Confident86.5Confident106 Ų106102.3 Ų102.356%0.55552%0.522SS*.Hα-helixtrans-83.3-39.6171.2-68.2170.3000111.4K188 H189 Q190 M194 K195 W196K188-L192 PolarHBondContact O-N 3.36Å; H189-L192 WeakPolarHBondContact O-CB 3.36Å; H189-L192 PolarHBondContact O-N 3.21Å; Q190-L192 VanDerWaalsContact C-N 3.29Å; Q190-L192 PolarHBondContact O-N 3.27Å; L192-M194 PolarHBondContact O-N 2.98Å; L192-K195 PolarHBondContact O-N 2.91Å; L192-W196 PolarHBondContact O-N 3.33Å
193D80.9Confident86.5Confident103 Ų103103.6 Ų103.655%0.55153%0.528SS*.Hα-helixtrans-61.3-43.2178.4-163.930.9000111.5H189 Q190 K195 W196 V197H189-D193 PolarHBondContact O-N 2.98Å; H189-D193 VanDerWaalsContact O-N 3.15Å; Q190-D193 PolarHBondContact O-N 3.43Å; D193-K195 PolarHBondContact O-N 3Å; D193-W196 PolarHBondContact O-N 2.96Å; D193-V197 WeakPolarHBondContact O-CG2 3.42Å; D193-V197 PolarHBondContact O-N 3.06Å
194M83Confident86.6Confident115 Ų115106.5 Ų106.557%0.56753%0.534SS*.Hα-helixtrans-58.1-46.4173.3-73.2-67-177.300112.8Q190 L192 W196 V197 E198Q190-M194 PolarHBondContact O-N 2.79Å; L192-M194 PolarHBondContact O-N 2.98Å; M194-W196 VanDerWaalsContact C-N 3.34Å; M194-W196 PolarHBondContact O-N 3.18Å; M194-V197 WeakPolarHBondContact O-CB 3.4Å; M194-V197 PolarHBondContact O-N 3.47Å; M194-E198 WeakPolarHBondContact O-CG 3.38Å; M194-E198 PolarHBondContact O-N 3.47Å
195K89.5Confident86.9Confident123 Ų123105.9 Ų105.954%0.53553%0.531SS..Hα-helixtrans-63.8-38.6177.9-73.7-173.3174.4-1640112.6L192 D193 V197 E198 E199L192-K195 PolarHBondContact O-N 2.91Å; D193-K195 PolarHBondContact O-N 3Å; K195-V197 VanDerWaalsContact C-N 3.3Å; K195-V197 PolarHBondContact O-N 3.15Å; K195-E198 PolarHBondContact O-N 3.44Å; K195-E199 WeakPolarHBondContact O-CB 3.39Å; K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.37Å
196W88.7Confident87.2Confident143 Ų143109.8 Ų109.854%0.54254%0.537SS..Hα-helixtrans-63.9-37.3175.3-177.579.4000111.8L192 D193 M194 K200L192-W196 PolarHBondContact O-N 3.33Å; D193-W196 PolarHBondContact O-N 2.96Å; M194-W196 VanDerWaalsContact C-N 3.34Å; M194-W196 PolarHBondContact O-N 3.18Å; W196-K200 HydrophobicContact CE3-CD 4.31Å; W196-K200 HydrophobicContact CH2-CD 3.73Å; W196-K200 HydrophobicContact CZ2-CD 4.04Å; W196-K200 HydrophobicContact CZ3-CD 3.85Å; W196-K200 WeakPolarHBondContact O-CB 3.5Å; W196-K200 PolarHBondContact O-N 2.93Å
197V89.6Confident87.4Confident75 Ų75111.6 Ų111.646%0.45554%0.539SS..Hα-helixtrans-65.8-42.3172.6172.90000111.7D193 M194 K195 Q201D193-V197 WeakPolarHBondContact O-CG2 3.42Å; D193-V197 PolarHBondContact O-N 3.06Å; M194-V197 WeakPolarHBondContact O-CB 3.4Å; M194-V197 PolarHBondContact O-N 3.47Å; K195-V197 VanDerWaalsContact C-N 3.3Å; K195-V197 PolarHBondContact O-N 3.15Å; V197-Q201 VanDerWaalsContact O-CB 3.31Å; V197-Q201 WeakPolarHBondContact O-CB 3.45Å; V197-Q201 PolarHBondContact O-N 3.19Å
198E92.3Very high88.1Confident130 Ų130110.7 Ų110.761%0.60753%0.531SS*.Hα-helixtrans-61.8-51.3175.7-70.8170.1169.900112.1M194 K195 K200 Q201 A202M194-E198 WeakPolarHBondContact O-CG 3.38Å; M194-E198 PolarHBondContact O-N 3.47Å; K195-E198 PolarHBondContact O-N 3.44Å; E198-K200 PolarHBondContact O-N 2.93Å; E198-Q201 PolarHBondContact O-N 2.97Å; E198-A202 PolarHBondContact O-N 3.02Å
199E93.3Very high88.8Confident127 Ų127108.3 Ų108.359%0.59352%0.523SS*.Hα-helixtrans-60.6-43.6177.6-73.3175.8-170.500111.5K195 Q201 A202 L203K195-E199 WeakPolarHBondContact O-CB 3.39Å; K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.37Å; E199-Q201 PolarHBondContact O-N 3.36Å; E199-A202 PolarHBondContact O-N 3.15Å; E199-L203 WeakPolarHBondContact O-CB 3.32Å; E199-L203 VanDerWaalsContact O-CG 3.3Å; E199-L203 WeakPolarHBondContact O-CG 3.35Å; E199-L203 PolarHBondContact O-N 2.9Å
200K90.1Very high89.4Confident85 Ų85106.6 Ų106.637%0.3752%0.517SS..Hα-helixtrans-61.4-41.6174.9177.5176.7176.4-179.40112.2W196 E198 L203 Y204W196-K200 HydrophobicContact CE3-CD 4.31Å; W196-K200 HydrophobicContact CH2-CD 3.73Å; W196-K200 HydrophobicContact CZ2-CD 4.04Å; W196-K200 HydrophobicContact CZ3-CD 3.85Å; W196-K200 WeakPolarHBondContact O-CB 3.5Å; W196-K200 PolarHBondContact O-N 2.93Å; E198-K200 PolarHBondContact O-N 2.93Å; K200-L203 PolarHBondContact O-N 3.37Å; K200-Y204 HydrophobicContact CD-CE2 4.44Å; K200-Y204 HydrophobicContact CG-CD2 4.03Å; K200-Y204 HydrophobicContact CG-CE2 3.79Å; K200-Y204 WeakPolarHBondContact O-CD2 3.47Å; K200-Y204 PolarHBondContact O-N 3.46Å
201Q89.1Confident90Very high107 Ų107104.2 Ų104.250%0.551%0.511SS..Hα-helixtrans-68.4-40.5178.6-171.26320.300111.7V197 E198 E199 L203 Y204 Q205V197-Q201 VanDerWaalsContact O-CB 3.31Å; V197-Q201 WeakPolarHBondContact O-CB 3.45Å; V197-Q201 PolarHBondContact O-N 3.19Å; E198-Q201 PolarHBondContact O-N 2.97Å; E199-Q201 PolarHBondContact O-N 3.36Å; Q201-L203 VanDerWaalsContact C-N 3.35Å; Q201-Y204 PolarHBondContact O-N 3.36Å; Q201-Q205 WeakPolarHBondContact O-CG 3.35Å; Q201-Q205 PolarHBondContact O-N 2.96Å
202A94.9Very high90.8Very high51 Ų51108 Ų10842%0.42152%0.518SS..Hα-helixtrans-63-39.817300000111.9E198 E199 Q205 R206E198-A202 PolarHBondContact O-N 3.02Å; E199-A202 PolarHBondContact O-N 3.15Å; A202-Q205 PolarHBondContact O-N 3.06Å; A202-R206 WeakPolarHBondContact O-CB 3.36Å; A202-R206 PolarHBondContact O-N 2.87Å
203L95Very high91.8Very high122 Ų122109 Ų10964%0.63952%0.518SS*.Hα-helixtrans-64.2-38173.7-74.3169.8000112.5E199 K200 Q201 R206 N207E199-L203 WeakPolarHBondContact O-CB 3.32Å; E199-L203 VanDerWaalsContact O-CG 3.3Å; E199-L203 WeakPolarHBondContact O-CG 3.35Å; E199-L203 PolarHBondContact O-N 2.9Å; K200-L203 PolarHBondContact O-N 3.37Å; Q201-L203 VanDerWaalsContact C-N 3.35Å; L203-R206 PolarHBondContact O-N 3.23Å; L203-N207 VanDerWaalsContact O-CB 3.27Å; L203-N207 WeakPolarHBondContact O-CB 3.48Å; L203-N207 PolarHBondContact O-N 3.43Å
204Y90.7Very high92.4Very high147 Ų147107.9 Ų107.958%0.57652%0.515SS*.Hα-helixtrans-64.3-43.8173.1-85.4-65.4000112.6K200 Q201 N207 Q208K200-Y204 HydrophobicContact CD-CE2 4.44Å; K200-Y204 HydrophobicContact CG-CD2 4.03Å; K200-Y204 HydrophobicContact CG-CE2 3.79Å; K200-Y204 WeakPolarHBondContact O-CD2 3.47Å; K200-Y204 PolarHBondContact O-N 3.46Å; Q201-Y204 PolarHBondContact O-N 3.36Å; Y204-N207 PolarHBondContact O-N 2.89Å; Y204-Q208 PolarHBondContact O-N 3.37Å
205Q94.1Very high92.9Very high117 Ų117106.6 Ų106.655%0.54751%0.514SS..Hα-helixtrans-59.9-48.6174.7-71170.8-1600111Q201 A202 N207 Q208 E209Q201-Q205 WeakPolarHBondContact O-CG 3.35Å; Q201-Q205 PolarHBondContact O-N 2.96Å; A202-Q205 PolarHBondContact O-N 3.06Å; Q205-N207 VanDerWaalsContact C-N 3.28Å; Q205-N207 PolarHBondContact O-N 3.41Å; Q205-Q208 WeakPolarHBondContact O-CB 3.47Å; Q205-Q208 PolarHBondContact O-N 2.9Å; Q205-E209 WeakPolarHBondContact O-CG 3.18Å; Q205-E209 PolarHBondContact O-N 2.72Å
206R94.8Very high93.3Very high141 Ų141106.2 Ų106.253%0.53251%0.514SS..Hα-helixtrans-60.5-35.6177.8-164.174.9-173109.24.5112.9A202 L203 E209 L210A202-R206 WeakPolarHBondContact O-CB 3.36Å; A202-R206 PolarHBondContact O-N 2.87Å; L203-R206 PolarHBondContact O-N 3.23Å; R206-E209 WeakPolarHBondContact CD-OE2 3.09Å; R206-E209 IonicContact CZ-OE2 3.6Å; R206-E209 IonicContact NE-OE2 3.79Å; R206-E209 IonicContact NH1-OE2 2.67Å; R206-E209 PolarHBondContact NH1-OE2 2.75Å; R206-L210 VanDerWaalsContact O-CG 3.28Å; R206-L210 WeakPolarHBondContact O-CG 3.1Å; R206-L210 PolarHBondContact O-N 3.42Å
207N90.8Very high93.5Very high94 Ų94104.4 Ų104.450%0.50351%0.513SS..Hα-helixtrans-71.2-42.4176.9-162.8-22.7000111.1L203 Y204 Q205 E209 L210 V211L203-N207 VanDerWaalsContact O-CB 3.27Å; L203-N207 WeakPolarHBondContact O-CB 3.48Å; L203-N207 PolarHBondContact O-N 3.43Å; Y204-N207 PolarHBondContact O-N 2.89Å; Q205-N207 VanDerWaalsContact C-N 3.28Å; Q205-N207 PolarHBondContact O-N 3.41Å; N207-E209 PolarHBondContact O-N 3.14Å; N207-L210 WeakPolarHBondContact O-CB 3.48Å; N207-L210 PolarHBondContact O-N 3.18Å; N207-L210 VanDerWaalsContact O-N 3.07Å; N207-V211 WeakPolarHBondContact O-CG2 3.47Å; N207-V211 PolarHBondContact O-N 3.12Å
208Q93.9Very high93.7Very high105 Ų105106.2 Ų106.249%0.49152%0.516SS..Hα-helixtrans-57.8-46.3174.5-176.262.730.300112.1Y204 Q205 L210 V211 E212Y204-Q208 PolarHBondContact O-N 3.37Å; Q205-Q208 WeakPolarHBondContact O-CB 3.47Å; Q205-Q208 PolarHBondContact O-N 2.9Å; Q208-L210 VanDerWaalsContact C-N 3.26Å; Q208-L210 PolarHBondContact O-N 3.49Å; Q208-V211 PolarHBondContact O-N 3.39Å; Q208-E212 WeakPolarHBondContact CG-OE1 3.41Å; Q208-E212 PolarHBondContact NE2-OE1 2.97Å; Q208-E212 WeakPolarHBondContact O-CG 3.42Å; Q208-E212 PolarHBondContact O-N 3.4Å
209E95.8Very high93.8Very high104 Ų104102 Ų10249%0.48651%0.507SS..Hα-helixtrans-57.4-37.7174-67.7172.516200112.8Q205 R206 N207 K213Q205-E209 WeakPolarHBondContact O-CG 3.18Å; Q205-E209 PolarHBondContact O-N 2.72Å; R206-E209 WeakPolarHBondContact CD-OE2 3.09Å; R206-E209 IonicContact CZ-OE2 3.6Å; R206-E209 IonicContact NE-OE2 3.79Å; R206-E209 IonicContact NH1-OE2 2.67Å; R206-E209 PolarHBondContact NH1-OE2 2.75Å; N207-E209 PolarHBondContact O-N 3.14Å; E209-K213 WeakPolarHBondContact O-CB 3.41Å; E209-K213 PolarHBondContact O-N 3.34Å; E209-K213 VanDerWaalsContact O-N 3.08Å
210L94.3Very high94Very high87 Ų8799 Ų9946%0.45549%0.493SS..Hα-helixtrans-73.2-39.2178.4-71.7169.2000111.9R206 N207 Q208 K213 V214R206-L210 VanDerWaalsContact O-CG 3.28Å; R206-L210 WeakPolarHBondContact O-CG 3.1Å; R206-L210 PolarHBondContact O-N 3.42Å; N207-L210 WeakPolarHBondContact O-CB 3.48Å; N207-L210 PolarHBondContact O-N 3.18Å; N207-L210 VanDerWaalsContact O-N 3.07Å; Q208-L210 VanDerWaalsContact C-N 3.26Å; Q208-L210 PolarHBondContact O-N 3.49Å; L210-K213 PolarHBondContact O-N 3.32Å; L210-V214 WeakPolarHBondContact O-CG2 3.28Å; L210-V214 PolarHBondContact O-N 3.46Å
211V94.3Very high94Very high71 Ų7197.6 Ų97.643%0.4350%0.498SS..Hα-helixtrans-62.5-47.3174.4170.60000110.8N207 Q208 K213 V214 V215N207-V211 WeakPolarHBondContact O-CG2 3.47Å; N207-V211 PolarHBondContact O-N 3.12Å; Q208-V211 PolarHBondContact O-N 3.39Å; V211-K213 VanDerWaalsContact C-N 3.3Å; V211-K213 PolarHBondContact O-N 3Å; V211-V214 PolarHBondContact O-N 3.16Å; V211-V214 VanDerWaalsContact O-N 3.16Å; V211-V215 WeakPolarHBondContact O-CG2 3.35Å; V211-V215 PolarHBondContact O-N 2.74Å
212E95.9Very high94.4Very high114 Ų11498 Ų9853%0.53350%0.503SS..Hα-helixtrans-61.1-40.1176.8-72.4172.7-163.400111.7Q208 V215 Q216Q208-E212 WeakPolarHBondContact CG-OE1 3.41Å; Q208-E212 PolarHBondContact NE2-OE1 2.97Å; Q208-E212 WeakPolarHBondContact O-CG 3.42Å; Q208-E212 PolarHBondContact O-N 3.4Å; E212-V215 PolarHBondContact O-N 3.02Å; E212-Q216 PolarHBondContact O-N 3.46Å
213K96.3Very high94.5Very high127 Ų127102 Ų10255%0.55251%0.507SS*.Hα-helixtrans-66.7-36.6174.4-172.9170.3-177.5174.60113.1E209 L210 V211 Q216 M217E209-K213 WeakPolarHBondContact O-CB 3.41Å; E209-K213 PolarHBondContact O-N 3.34Å; E209-K213 VanDerWaalsContact O-N 3.08Å; L210-K213 PolarHBondContact O-N 3.32Å; V211-K213 VanDerWaalsContact C-N 3.3Å; V211-K213 PolarHBondContact O-N 3Å; K213-Q216 PolarHBondContact O-N 3.22Å; K213-M217 VanDerWaalsContact O-CG 3.28Å; K213-M217 WeakPolarHBondContact O-CG 3.12Å; K213-M217 PolarHBondContact O-N 2.91Å
214V93Very high94.6Very high80 Ų80100.5 Ų100.549%0.48550%0.499SS..Hα-helixtrans-62.8-47.7173.7166.70000110.2L210 V211 Q216 M217 E218L210-V214 WeakPolarHBondContact O-CG2 3.28Å; L210-V214 PolarHBondContact O-N 3.46Å; V211-V214 PolarHBondContact O-N 3.16Å; V211-V214 VanDerWaalsContact O-N 3.16Å; V214-Q216 VanDerWaalsContact C-N 3.29Å; V214-Q216 PolarHBondContact O-N 3.26Å; V214-M217 PolarHBondContact O-N 2.77Å; V214-E218 HydrophobicContact CG1-CG 4.3Å; V214-E218 WeakPolarHBondContact O-CG 3.46Å; V214-E218 PolarHBondContact O-N 3.01Å
215V95.3Very high94.9Very high89 Ų8997.8 Ų97.854%0.53950%0.495SS..Hα-helixtrans-60.5-37.5177.7173.80000112V211 E212 G219V211-V215 WeakPolarHBondContact O-CG2 3.35Å; V211-V215 PolarHBondContact O-N 2.74Å; E212-V215 PolarHBondContact O-N 3.02Å; V215-G219 PolarHBondContact O-N 2.96Å; V215-G219 VanDerWaalsContact O-N 3.12Å
216Q96.9Very high95.1Very high115 Ų11597.1 Ų97.154%0.53750%0.495SS..Hα-helixtrans-61.7-50.4171.2-176.9-171.9-20.700111.6E212 K213 V214 E218 G219 E220E212-Q216 PolarHBondContact O-N 3.46Å; K213-Q216 PolarHBondContact O-N 3.22Å; V214-Q216 VanDerWaalsContact C-N 3.29Å; V214-Q216 PolarHBondContact O-N 3.26Å; Q216-E218 VanDerWaalsContact C-N 3.3Å; Q216-E218 PolarHBondContact O-N 3.02Å; Q216-G219 PolarHBondContact O-N 3.37Å; Q216-G219 VanDerWaalsContact O-N 3.16Å; Q216-E220 PolarHBondContact NE2-OE1 2.81Å; Q216-E220 PolarHBondContact O-N 3.06Å
217M92.4Very high95.2Very high104 Ų10494 Ų9451%0.51249%0.489SS..Hα-helixtrans-62.5-35.6-179.1-70.3-62.1-50.400112.4K213 V214 E220 A221K213-M217 VanDerWaalsContact O-CG 3.28Å; K213-M217 WeakPolarHBondContact O-CG 3.12Å; K213-M217 PolarHBondContact O-N 2.91Å; V214-M217 PolarHBondContact O-N 2.77Å; M217-E220 PolarHBondContact O-N 3.04Å; M217-A221 VanDerWaalsContact O-CB 3.3Å; M217-A221 WeakPolarHBondContact O-CB 3.39Å; M217-A221 PolarHBondContact O-N 3.42Å
218E93.8Very high95.5Very high113 Ų11393.4 Ų93.453%0.52849%0.485SS..Hα-helixtrans-64.3-43.9173.2-72.5176.3161.600111.5V214 Q216 E220 A221 L222V214-E218 HydrophobicContact CG1-CG 4.3Å; V214-E218 WeakPolarHBondContact O-CG 3.46Å; V214-E218 PolarHBondContact O-N 3.01Å; Q216-E218 VanDerWaalsContact C-N 3.3Å; Q216-E218 PolarHBondContact O-N 3.02Å; E218-E220 PolarHBondContact O-N 3.33Å; E218-A221 PolarHBondContact O-N 3Å; E218-L222 WeakPolarHBondContact O-CG 3.48Å; E218-L222 PolarHBondContact O-N 2.88Å
219G95.8Very high95.7Very high41 Ų4191.5 Ų91.542%0.42348%0.476SS..Hα-helixtrans-63-38.6174.500000113.5V215 Q216 R223V215-G219 PolarHBondContact O-N 2.96Å; V215-G219 VanDerWaalsContact O-N 3.12Å; Q216-G219 PolarHBondContact O-N 3.37Å; Q216-G219 VanDerWaalsContact O-N 3.16Å; G219-R223 PolarHBondContact O-N 2.99Å
220E96.4Very high95.8Very high64 Ų6491.6 Ų91.630%0.29948%0.48SS..Hα-helixtrans-69.6-38.5174.3-71.5-176.3-15000112.4Q216 M217 E218 R223 L224Q216-E220 PolarHBondContact NE2-OE1 2.81Å; Q216-E220 PolarHBondContact O-N 3.06Å; M217-E220 PolarHBondContact O-N 3.04Å; E218-E220 PolarHBondContact O-N 3.33Å; E220-R223 PolarHBondContact O-N 3.19Å; E220-L224 WeakPolarHBondContact O-CG 3.48Å; E220-L224 PolarHBondContact O-N 3.33Å
221A90.6Very high95.9Very high56 Ų5692 Ų9246%0.46348%0.481SS..Hα-helixtrans-65.7-39.1175.500000112.5M217 E218 L224 N225M217-A221 VanDerWaalsContact O-CB 3.3Å; M217-A221 WeakPolarHBondContact O-CB 3.39Å; M217-A221 PolarHBondContact O-N 3.42Å; E218-A221 PolarHBondContact O-N 3Å; A221-L224 PolarHBondContact O-N 3.04Å; A221-N225 WeakPolarHBondContact O-CB 3.48Å; A221-N225 PolarHBondContact O-N 2.99Å
222L96.8Very high96Very high115 Ų11594.7 Ų94.760%0.60248%0.484SS*.Hα-helixtrans-60.9-48.8172.9-74.5169.8000111.3E218 L224 N225 D226E218-L222 WeakPolarHBondContact O-CG 3.48Å; E218-L222 PolarHBondContact O-N 2.88Å; L222-L224 PolarHBondContact O-N 2.69Å; L222-N225 WeakPolarHBondContact O-CB 3.4Å; L222-N225 PolarHBondContact O-N 2.99Å; L222-N225 VanDerWaalsContact O-N 3.15Å; L222-D226 PolarHBondContact O-N 2.94Å
223R97.9Very high96.1Very high136 Ų13693.4 Ų93.451%0.51348%0.48SS..Hα-helixtrans-58.4-46.1176.9-171.5-17069.8-135.3-9.2111.9G219 E220 N225 D226 D227G219-R223 PolarHBondContact O-N 2.99Å; E220-R223 PolarHBondContact O-N 3.19Å; R223-N225 VanDerWaalsContact C-N 3.28Å; R223-N225 PolarHBondContact O-N 2.87Å; R223-D226 PolarHBondContact O-N 2.89Å; R223-D227 VanDerWaalsContact O-CG 3.31Å; R223-D227 PolarHBondContact O-N 3.47Å
224L97.1Very high96.2Very high91 Ų9192.8 Ų92.848%0.47648%0.48SS..Hα-helixtrans-64.8-31.6178.4-72171.1000112.7E220 A221 L222 I228E220-L224 WeakPolarHBondContact O-CG 3.48Å; E220-L224 PolarHBondContact O-N 3.33Å; A221-L224 PolarHBondContact O-N 3.04Å; L222-L224 PolarHBondContact O-N 2.69Å; L224-I228 WeakPolarHBondContact O-CB 3.46Å; L224-I228 WeakPolarHBondContact O-CD1 3.44Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 3.3Å
225N96.8Very high96.3Very high90 Ų9093 Ų9348%0.48148%0.478SS..Hα-helixtrans-69.9-37.3173.9178.584.2000112.1A221 L222 R223 I228 Q229A221-N225 WeakPolarHBondContact O-CB 3.48Å; A221-N225 PolarHBondContact O-N 2.99Å; L222-N225 WeakPolarHBondContact O-CB 3.4Å; L222-N225 PolarHBondContact O-N 2.99Å; L222-N225 VanDerWaalsContact O-N 3.15Å; R223-N225 VanDerWaalsContact C-N 3.28Å; R223-N225 PolarHBondContact O-N 2.87Å; N225-I228 PolarHBondContact O-N 3.14Å; N225-Q229 PolarHBondContact O-N 3.16Å; N225-Q229 VanDerWaalsContact O-N 3.1Å
226D97.4Very high96.4Very high103 Ų10393.8 Ų93.855%0.55148%0.476SS*.Hα-helixtrans-65.6-46.4172.1-67-16.6000110.9L222 R223 I228 Q229 D230L222-D226 PolarHBondContact O-N 2.94Å; R223-D226 PolarHBondContact O-N 2.89Å; D226-I228 VanDerWaalsContact C-N 3.28Å; D226-I228 PolarHBondContact O-N 2.98Å; D226-Q229 PolarHBondContact O-N 3.03Å; D226-D230 PolarHBondContact O-N 3.47Å
227D97.5Very high96.5Very high75 Ų7594 Ų9440%0.40148%0.48SS..Hα-helixtrans-56.1-41.2174.6-67.4-39.4000111.6R223 Q229 D230 I231R223-D227 VanDerWaalsContact O-CG 3.31Å; R223-D227 PolarHBondContact O-N 3.47Å; D227-Q229 VanDerWaalsContact C-N 3.35Å; D227-D230 PolarHBondContact O-N 2.92Å; D227-I231 WeakPolarHBondContact O-CG1 3.48Å; D227-I231 PolarHBondContact O-N 2.93Å; D227-I231 VanDerWaalsContact O-N 3.13Å
228I97Very high96.7Very high82 Ų8294 Ų9442%0.42148%0.481SS..Hα-helixtrans-65.5-35.3175.9-75.7165.2000111.9L224 N225 D226 R232L224-I228 WeakPolarHBondContact O-CB 3.46Å; L224-I228 WeakPolarHBondContact O-CD1 3.44Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 3.3Å; N225-I228 PolarHBondContact O-N 3.14Å; D226-I228 VanDerWaalsContact C-N 3.28Å; D226-I228 PolarHBondContact O-N 2.98Å; I228-R232 WeakPolarHBondContact O-CG 3.45Å; I228-R232 PolarHBondContact O-N 3.07Å; I228-R232 VanDerWaalsContact O-N 3.14Å
229Q97.8Very high96.8Very high65 Ų6594.6 Ų94.630%0.30448%0.484SS..Hα-helixtrans-73.2-42.6177.2-168.459.450.700111.3N225 D226 D227 I231 R232 D233N225-Q229 PolarHBondContact O-N 3.16Å; N225-Q229 VanDerWaalsContact O-N 3.1Å; D226-Q229 PolarHBondContact O-N 3.03Å; D227-Q229 VanDerWaalsContact C-N 3.35Å; Q229-I231 PolarHBondContact O-N 3.02Å; Q229-R232 WeakPolarHBondContact O-CB 3.35Å; Q229-R232 PolarHBondContact O-N 3Å; Q229-D233 PolarHBondContact NE2-OD1 2.96Å; Q229-D233 PolarHBondContact O-N 3.34Å
230D97.9Very high96.8Very high106 Ų10699.3 Ų99.357%0.56749%0.493SS*.Hα-helixtrans-57.9-33.4174-100.921000112.2D226 D227 Q234D226-D230 PolarHBondContact O-N 3.47Å; D227-D230 PolarHBondContact O-N 2.92Å; D230-Q234 VanDerWaalsContact O-CG 3.27Å; D230-Q234 WeakPolarHBondContact O-CG 3.31Å; D230-Q234 PolarHBondContact O-N 2.77Å; D230-Q234 PolarHBondContact O-NE2 3.26Å
231I96.9Very high96.8Very high96 Ų96102 Ų10249%0.49250%0.501SS..Hα-helixtrans-73.2-36.3174.1-69.4166.5000111.9D227 Q229 Q234 N235D227-I231 WeakPolarHBondContact O-CG1 3.48Å; D227-I231 PolarHBondContact O-N 2.93Å; D227-I231 VanDerWaalsContact O-N 3.13Å; Q229-I231 PolarHBondContact O-N 3.02Å; I231-Q234 PolarHBondContact O-N 3.38Å; I231-N235 PolarHBondContact O-N 3.13Å; I231-N235 PolarHBondContact O-ND2 2.85Å
232R97.1Very high97Very high126 Ų126103.7 Ų103.748%0.47550%0.501SS..Hα-helixtrans-65.8-48.8175.2-74.4168.9178.2160.31.6111.5I228 Q229 Q234 N235 E236I228-R232 WeakPolarHBondContact O-CG 3.45Å; I228-R232 PolarHBondContact O-N 3.07Å; I228-R232 VanDerWaalsContact O-N 3.14Å; Q229-R232 WeakPolarHBondContact O-CB 3.35Å; Q229-R232 PolarHBondContact O-N 3Å; R232-Q234 PolarHBondContact O-N 2.97Å; R232-N235 PolarHBondContact O-N 3.36Å; R232-E236 PolarHBondContact O-N 2.74Å
233D97.9Very high96.9Very high87 Ų87103 Ų10347%0.46550%0.498SS..Hα-helixtrans-58.5-34.2177-73.835.1000111.4Q229 L237Q229-D233 PolarHBondContact NE2-OD1 2.96Å; Q229-D233 PolarHBondContact O-N 3.34Å; D233-L237 WeakPolarHBondContact O-CB 3.46Å; D233-L237 PolarHBondContact O-N 3.04Å
234Q97.6Very high96.7Very high115 Ų115100.7 Ų100.754%0.53749%0.492SS..Hα-helixtrans-70.1-41.3172.1-78.2171.671.800113.2D230 I231 R232 L237 L238D230-Q234 VanDerWaalsContact O-CG 3.27Å; D230-Q234 WeakPolarHBondContact O-CG 3.31Å; D230-Q234 PolarHBondContact O-N 2.77Å; D230-Q234 PolarHBondContact O-NE2 3.26Å; I231-Q234 PolarHBondContact O-N 3.38Å; R232-Q234 PolarHBondContact O-N 2.97Å; Q234-L237 PolarHBondContact O-N 3.1Å; Q234-L238 WeakPolarHBondContact O-CG 3.33Å; Q234-L238 PolarHBondContact O-N 2.93Å
235N95.8Very high96.2Very high83 Ų83100.3 Ų100.344%0.44449%0.49SS..Hα-helixtrans-65.7-43.7177-74.5-22.5000111.8I231 R232 L237 L238 E239I231-N235 PolarHBondContact O-N 3.13Å; I231-N235 PolarHBondContact O-ND2 2.85Å; R232-N235 PolarHBondContact O-N 3.36Å; N235-L237 VanDerWaalsContact C-N 3.28Å; N235-L237 PolarHBondContact O-N 3.38Å; N235-L238 WeakPolarHBondContact O-CB 3.36Å; N235-L238 PolarHBondContact O-N 3.42Å; N235-E239 PolarHBondContact O-N 2.91Å
236E97.4Very high95.8Very high106 Ų106101 Ų10150%0.49549%0.491SS..Hα-helixtrans-56.8-43.3173.6-70.3-176.8-161.300111R232 L238 E239 F240R232-E236 PolarHBondContact O-N 2.74Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.81Å; E236-E239 PolarHBondContact O-N 3.36Å; E236-F240 HydrophobicContact CB-CE2 4.43Å; E236-F240 WeakPolarHBondContact O-CD2 3.19Å; E236-F240 PolarHBondContact O-N 2.98Å
237L97.8Very high95.4Very high120 Ų12099.2 Ų99.263%0.62848%0.479SS*.Hα-helixtrans-63.5-35.1175.6-176.962.6000113.1D233 Q234 N235 R241D233-L237 WeakPolarHBondContact O-CB 3.46Å; D233-L237 PolarHBondContact O-N 3.04Å; Q234-L237 PolarHBondContact O-N 3.1Å; N235-L237 VanDerWaalsContact C-N 3.28Å; N235-L237 PolarHBondContact O-N 3.38Å; L237-R241 WeakPolarHBondContact O-CB 3.4Å; L237-R241 PolarHBondContact O-N 2.9Å; L237-R241 VanDerWaalsContact O-N 3.07Å
238L96.8Very high94.8Very high103 Ų103102.1 Ų102.154%0.53949%0.485SS..Hα-helixtrans-70.6-40.4174.8-71.4171.4000111.8Q234 N235 E236 R241 I242Q234-L238 WeakPolarHBondContact O-CG 3.33Å; Q234-L238 PolarHBondContact O-N 2.93Å; N235-L238 WeakPolarHBondContact O-CB 3.36Å; N235-L238 PolarHBondContact O-N 3.42Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.81Å; L238-R241 CarbonylContact O-C 3.58Å; L238-R241 PolarHBondContact O-N 3Å; L238-R241 VanDerWaalsContact O-N 3.14Å; L238-I242 WeakPolarHBondContact O-CG1 3.27Å; L238-I242 PolarHBondContact O-N 3.41Å
239E96.4Very high94Very high127 Ų127105.2 Ų105.259%0.59350%0.497SS*.Hα-helixtrans-59.6-48.5173.4-71.6178.2-166.700111.3N235 E236 R241 I242 L243N235-E239 PolarHBondContact O-N 2.91Å; E236-E239 PolarHBondContact O-N 3.36Å; E239-R241 PolarHBondContact O-N 3.32Å; E239-I242 PolarHBondContact O-N 3.17Å; E239-L243 WeakPolarHBondContact O-CG 3.28Å; E239-L243 PolarHBondContact O-N 2.65Å
240F96.7Very high93.1Very high139 Ų139110.1 Ų110.161%0.6151%0.513SS*.Hα-helixtrans-58.2-37.3173.6-71.6-58.2000112.4E236 E244E236-F240 HydrophobicContact CB-CE2 4.43Å; E236-F240 WeakPolarHBondContact O-CD2 3.19Å; E236-F240 PolarHBondContact O-N 2.98Å; F240-E244 WeakPolarHBondContact O-CB 3.42Å; F240-E244 PolarHBondContact O-N 3.48Å
241R96.2Very high92.3Very high121 Ų121113.7 Ų113.746%0.45752%0.519SS..Hα-helixtrans-71.9-34.8178.7-178.955.4177.8-176.8-1112.8L237 L238 E239 E244 L245L237-R241 WeakPolarHBondContact O-CB 3.4Å; L237-R241 PolarHBondContact O-N 2.9Å; L237-R241 VanDerWaalsContact O-N 3.07Å; L238-R241 CarbonylContact O-C 3.58Å; L238-R241 PolarHBondContact O-N 3Å; L238-R241 VanDerWaalsContact O-N 3.14Å; E239-R241 PolarHBondContact O-N 3.32Å; R241-E244 WeakPolarHBondContact CD-OE2 3.44Å; R241-E244 IonicContact CZ-OE2 2.97Å; R241-E244 IonicContact NH1-OE1 2.71Å; R241-E244 IonicContact NH1-OE2 2.8Å; R241-E244 PolarHBondContact NH1-OE2 3.14Å; R241-E244 PolarHBondContact O-N 3.3Å; R241-L245 HydrophobicContact CG-CD1 4.3Å; R241-L245 VanDerWaalsContact O-CG 3.27Å; R241-L245 WeakPolarHBondContact O-CG 3.23Å; R241-L245 PolarHBondContact O-N 3.06Å
242I94.1Very high90.4Very high91 Ų91112.1 Ų112.147%0.46752%0.516SS..Hα-helixtrans-63.5-51173.5-70.6162.6000109.4L238 E239 E244 L245 E246L238-I242 WeakPolarHBondContact O-CG1 3.27Å; L238-I242 PolarHBondContact O-N 3.41Å; E239-I242 PolarHBondContact O-N 3.17Å; I242-E244 VanDerWaalsContact C-N 3.27Å; I242-E244 PolarHBondContact O-N 3.05Å; I242-L245 WeakPolarHBondContact O-CA 3.24Å; I242-L245 WeakPolarHBondContact O-CB 3.37Å; I242-L245 PolarHBondContact O-N 3.09Å; I242-E246 HydrophobicContact CG2-CG 4.28Å; I242-E246 WeakPolarHBondContact CG2-OE1 3.35Å; I242-E246 WeakPolarHBondContact O-CG 3.16Å; I242-E246 PolarHBondContact O-N 2.98Å
243L95.2Very high88.4Confident102 Ų102112.3 Ų112.353%0.53453%0.534SS..Hα-helixtrans-58.9-35.7177.2-64.7168.5000112.7E239 L245 E247E239-L243 WeakPolarHBondContact O-CG 3.28Å; E239-L243 PolarHBondContact O-N 2.65Å; L243-L245 VanDerWaalsContact C-N 3.29Å; L243-L245 PolarHBondContact O-N 3.2Å; L243-E247 PolarHBondContact O-N 3.31Å; L243-E247 VanDerWaalsContact O-N 3.13Å
244E93.3Very high86.3Confident86 Ų86110.5 Ų110.540%0.40254%0.536SS..Hα-helixtrans-70.1-22175.2-154.7-146.1161.800113.7F240 R241 I242 R248F240-E244 WeakPolarHBondContact O-CB 3.42Å; F240-E244 PolarHBondContact O-N 3.48Å; R241-E244 WeakPolarHBondContact CD-OE2 3.44Å; R241-E244 IonicContact CZ-OE2 2.97Å; R241-E244 IonicContact NH1-OE1 2.71Å; R241-E244 IonicContact NH1-OE2 2.8Å; R241-E244 PolarHBondContact NH1-OE2 3.14Å; R241-E244 PolarHBondContact O-N 3.3Å; I242-E244 VanDerWaalsContact C-N 3.27Å; I242-E244 PolarHBondContact O-N 3.05Å; E244-R248 WeakPolarHBondContact O-CG 3.43Å; E244-R248 PolarHBondContact O-NH1 2.85Å; E244-R248 VanDerWaalsContact O-NH1 3.11Å; E244-R248 IonicContact OE1-CZ 2.66Å; E244-R248 IonicContact OE1-NH1 3.7Å; E244-R248 PolarHBondContact OE1-NH1 3.28Å; E244-R248 IonicContact OE1-NH2 2.76Å; E244-R248 PolarHBondContact OE1-NH2 2.9Å; E244-R248 VanDerWaalsContact OE1-NH2 3.07Å; E244-R248 IonicContact OE2-NH1 3.86Å
245L87.3Confident84.2Confident83 Ų83111.8 Ų111.844%0.43555%0.545SS..Hα-helixtrans-88.5-42.5175.5-70.8168.2000111.1R241 I242 L243 R248 E249R241-L245 HydrophobicContact CG-CD1 4.3Å; R241-L245 VanDerWaalsContact O-CG 3.27Å; R241-L245 WeakPolarHBondContact O-CG 3.23Å; R241-L245 PolarHBondContact O-N 3.06Å; I242-L245 WeakPolarHBondContact O-CA 3.24Å; I242-L245 WeakPolarHBondContact O-CB 3.37Å; I242-L245 PolarHBondContact O-N 3.09Å; L243-L245 VanDerWaalsContact C-N 3.29Å; L243-L245 PolarHBondContact O-N 3.2Å; L245-R248 CarbonylContact O-C 3.52Å; L245-R248 WeakPolarHBondContact O-CA 3.27Å; L245-R248 VanDerWaalsContact O-CB 3.31Å; L245-R248 WeakPolarHBondContact O-CB 2.96Å; L245-R248 PolarHBondContact O-N 3.17Å; L245-R248 VanDerWaalsContact O-N 3.11Å; L245-E249 PolarHBondContact O-N 2.98Å
246E88Confident81.8Confident105 Ų105115.5 Ų115.549%0.49156%0.564SS.*Hα-helixtrans-59.7-47.8175.5-69.7175.4170.500112I242 R248 E249 R250I242-E246 HydrophobicContact CG2-CG 4.28Å; I242-E246 WeakPolarHBondContact CG2-OE1 3.35Å; I242-E246 WeakPolarHBondContact O-CG 3.16Å; I242-E246 PolarHBondContact O-N 2.98Å; E246-R248 PolarHBondContact O-N 2.77Å; E246-E249 PolarHBondContact O-N 3.18Å; E246-R250 WeakPolarHBondContact O-CB 3.39Å; E246-R250 PolarHBondContact O-N 3.03Å
247E89Confident79.6Confident65 Ų65117.5 Ų117.530%0.30457%0.572SS.*Hα-helixtrans-71.9-17.5177.1-178.461.8-17800112.4L243 R250 R251L243-E247 PolarHBondContact O-N 3.31Å; L243-E247 VanDerWaalsContact O-N 3.13Å; E247-R250 VanDerWaalsContact CD-NH2 3.28Å; E247-R250 IonicContact OE1-CZ 3.82Å; E247-R250 IonicContact OE1-NH2 2.6Å; E247-R250 PolarHBondContact OE1-NH2 3.4Å; E247-R250 IonicContact OE2-CZ 3.25Å; E247-R250 VanDerWaalsContact OE2-CZ 3.25Å; E247-R250 IonicContact OE2-NE 2.71Å; E247-R250 PolarHBondContact OE2-NE 2.98Å; E247-R250 IonicContact OE2-NH2 2.73Å; E247-R250 PolarHBondContact OE2-NH2 2.76Å; E247-R251 WeakPolarHBondContact O-CB 3.35Å; E247-R251 WeakPolarHBondContact O-CD 3.18Å; E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 2.83Å; E247-R251 IonicContact OE1-CZ 2.76Å; E247-R251 IonicContact OE1-NE 3.18Å; E247-R251 PolarHBondContact OE1-NE 3.19Å; E247-R251 IonicContact OE1-NH2 2.63Å; E247-R251 PolarHBondContact OE1-NH2 3.05Å
248R85.3Confident77.4Confident137 Ų137120.3 Ų120.352%0.51758%0.579SS.*Hα-helixtrans-74.7-46.4166.8-96.3-167.7-175.379-2.5111.7E244 L245 E246 R251 S252E244-R248 WeakPolarHBondContact O-CG 3.43Å; E244-R248 PolarHBondContact O-NH1 2.85Å; E244-R248 VanDerWaalsContact O-NH1 3.11Å; E244-R248 IonicContact OE1-CZ 2.66Å; E244-R248 IonicContact OE1-NH1 3.7Å; E244-R248 PolarHBondContact OE1-NH1 3.28Å; E244-R248 IonicContact OE1-NH2 2.76Å; E244-R248 PolarHBondContact OE1-NH2 2.9Å; E244-R248 VanDerWaalsContact OE1-NH2 3.07Å; E244-R248 IonicContact OE2-NH1 3.86Å; L245-R248 CarbonylContact O-C 3.52Å; L245-R248 WeakPolarHBondContact O-CA 3.27Å; L245-R248 VanDerWaalsContact O-CB 3.31Å; L245-R248 WeakPolarHBondContact O-CB 2.96Å; L245-R248 PolarHBondContact O-N 3.17Å; L245-R248 VanDerWaalsContact O-N 3.11Å; E246-R248 PolarHBondContact O-N 2.77Å; R248-R251 CarbonylContact O-C 3.58Å; R248-R251 PolarHBondContact O-N 3.05Å; R248-S252 PolarHBondContact O-N 2.78Å
249E80.6Confident75.2Confident147 Ų147124.8 Ų124.869%0.68760%0.597SS**Hα-helixtrans-58.6-49.7176.5-178.7173.1-151.400110.3L245 E246 R251 S252L245-E249 PolarHBondContact O-N 2.98Å; E246-E249 PolarHBondContact O-N 3.18Å; E249-R251 PolarHBondContact O-N 3.04Å; E249-R251 VanDerWaalsContact O-N 3.12Å; E249-S252 WeakPolarHBondContact O-CB 3.38Å; E249-S252 PolarHBondContact O-N 3.31Å; E249-S252 PolarHBondContact O-OG 3.1Å
250R78.7Confident73.3Confident168 Ų168122.1 Ų122.163%0.63459%0.586SS**THydrogen-bonded Turntrans-64-16.3177.7-155.3-162.462694.2114.4E246 E247E246-R250 WeakPolarHBondContact O-CB 3.39Å; E246-R250 PolarHBondContact O-N 3.03Å; E247-R250 VanDerWaalsContact CD-NH2 3.28Å; E247-R250 IonicContact OE1-CZ 3.82Å; E247-R250 IonicContact OE1-NH2 2.6Å; E247-R250 PolarHBondContact OE1-NH2 3.4Å; E247-R250 IonicContact OE2-CZ 3.25Å; E247-R250 VanDerWaalsContact OE2-CZ 3.25Å; E247-R250 IonicContact OE2-NE 2.71Å; E247-R250 PolarHBondContact OE2-NE 2.98Å; E247-R250 IonicContact OE2-NH2 2.73Å; E247-R250 PolarHBondContact OE2-NH2 2.76Å
251R80.9Confident71.6Confident181 Ų181123.3 Ų123.368%0.68359%0.594SS**THydrogen-bonded Turntrans-101.9-7.7172.7-72.3-179.3-170.8-153.66.2113.8E247 R248 E249E247-R251 WeakPolarHBondContact O-CB 3.35Å; E247-R251 WeakPolarHBondContact O-CD 3.18Å; E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 2.83Å; E247-R251 IonicContact OE1-CZ 2.76Å; E247-R251 IonicContact OE1-NE 3.18Å; E247-R251 PolarHBondContact OE1-NE 3.19Å; E247-R251 IonicContact OE1-NH2 2.63Å; E247-R251 PolarHBondContact OE1-NH2 3.05Å; R248-R251 CarbonylContact O-C 3.58Å; R248-R251 PolarHBondContact O-N 3.05Å; E249-R251 PolarHBondContact O-N 3.04Å; E249-R251 VanDerWaalsContact O-N 3.12Å
252S55.4Low70Confident63 Ų63121.9 Ų121.944%0.44159%0.591SS.*SBendtrans-71.1145.2176.274.70000110.3R248 E249 G254R248-S252 PolarHBondContact O-N 2.78Å; E249-S252 WeakPolarHBondContact O-CB 3.38Å; E249-S252 PolarHBondContact O-N 3.31Å; E249-S252 PolarHBondContact O-OG 3.1Å; S252-G254 PolarHBondContact O-N 2.9Å
253P55.3Low68.7Low130 Ų130120.5 Ų120.584%0.84459%0.588SS**  trans-65.4101.9167.6-18.732.5000108.8I255P253-I255 PolarHBondContact O-N 2.93Å
254G54.2Low66.9Low49 Ų49125.4 Ų125.451%0.50561%0.608SS.*  trans-57.8124.3-169.900000113.5S252 N256S252-G254 PolarHBondContact O-N 2.9Å; G254-N256 PolarHBondContact O-N 3.19Å; G254-N256 VanDerWaalsContact O-N 3.14Å
255I54.5Low65.5Low142 Ų142125.1 Ų125.173%0.72863%0.628SS**  trans-68.5108163.2-58.8176.5000106.2P253 F257P253-I255 PolarHBondContact O-N 2.93Å; I255-F257 VanDerWaalsContact C-N 3.25Å; I255-F257 HydrophobicContact CB-CD2 4.41Å; I255-F257 HydrophobicContact CB-CE2 4.23Å; I255-F257 HydrophobicContact CG2-CD2 3.9Å; I255-F257 HydrophobicContact CG2-CE2 3.51Å; I255-F257 HydrophobicContact CG2-CZ 4.16Å; I255-F257 PolarHBondContact O-N 3.33Å
256N44.9Very low64.5Low160 Ų160124.3 Ų124.386%0.85662%0.624SS**  trans-72.373-172.9-81.2-69.8000112.6G254 K258G254-N256 PolarHBondContact O-N 3.19Å; G254-N256 VanDerWaalsContact O-N 3.14Å; N256-K258 PolarHBondContact O-N 2.87Å
257F51.4Low63.6Low149 Ų149121.5 Ų121.565%0.65462%0.616SS**  trans-68126.1157.9-70.5-75.8000108.9I255 Q259 Y272I255-F257 VanDerWaalsContact C-N 3.25Å; I255-F257 HydrophobicContact CB-CD2 4.41Å; I255-F257 HydrophobicContact CB-CE2 4.23Å; I255-F257 HydrophobicContact CG2-CD2 3.9Å; I255-F257 HydrophobicContact CG2-CE2 3.51Å; I255-F257 HydrophobicContact CG2-CZ 4.16Å; I255-F257 PolarHBondContact O-N 3.33Å; F257-Q259 PolarHBondContact O-N 3.18Å; F257-Y272 HydrophobicContact CD1-CE1 4.47Å
258K51.8Low62.5Low179 Ų179121.7 Ų121.778%0.77862%0.622SS**  trans-65.9121175.1-67.2173.9-177.2168.80108N256 L260N256-K258 PolarHBondContact O-N 2.87Å; K258-L260 PolarHBondContact O-N 3.16Å
259Q50.9Low61.6Low197 Ų197121.2 Ų121.292%0.92163%0.629SS**  trans-68.593.9-179-168.2172.411.400110.3F257F257-Q259 PolarHBondContact O-N 3.18Å
260L56.1Low61Low70 Ų70118.2 Ų118.237%0.36662%0.615SS.*  trans-77.6145.2173.8-69.4168.5000110K258 F262 I271 Y272K258-L260 PolarHBondContact O-N 3.16Å; L260-F262 HydrophobicContact CB-CE1 4.35Å; L260-F262 PolarHBondContact O-N 2.94Å; L260-I271 HydrophobicContact CB-CG2 4.42Å; L260-I271 HydrophobicContact CD1-CG2 4.1Å; L260-Y272 HydrophobicContact CD1-CD1 4.24Å; L260-Y272 HydrophobicContact CD1-CE1 3.96Å
261H60Low60.7Low165 Ų165111.1 Ų111.176%0.76459%0.59SS**  trans-79.6114.4173.7175.4-69.9000109.3P263H261-P263 WeakPolarHBondContact O-CD 3.08Å
262F63.4Low60.2Low91 Ų91106.2 Ų106.240%0.39957%0.572SS.*  trans-86.1108.5179.3-49.8-66.7000110.9L260 P268 I271 Y272L260-F262 HydrophobicContact CB-CE1 4.35Å; L260-F262 PolarHBondContact O-N 2.94Å; F262-P268 HydrophobicContact CD1-CB 4.13Å; F262-P268 HydrophobicContact CD1-CG 4.38Å; F262-P268 HydrophobicContact CE1-CB 3.78Å; F262-P268 HydrophobicContact CE1-CG 4.42Å; F262-P268 HydrophobicContact CG-CG 4.48Å; F262-P268 HydrophobicContact CZ-CB 4.02Å; F262-I271 HydrophobicContact CB-CD1 4.07Å; F262-I271 HydrophobicContact CD1-CB 4.23Å; F262-I271 HydrophobicContact CD1-CD1 3.7Å; F262-I271 HydrophobicContact CD1-CG2 4.09Å; F262-I271 HydrophobicContact CE1-CG2 4.26Å; F262-I271 HydrophobicContact CG-CD1 4.38Å; F262-Y272 HydrophobicContact CE1-CE2 4.43Å; F262-Y272 HydrophobicContact CZ-CE2 4.44Å
263P66.1Low61Low62 Ų62104.5 Ų104.540%0.40356%0.56SS.*  trans-67.2151.4170.229.5-37.3000112H261 G265 L266 I271H261-P263 WeakPolarHBondContact O-CD 3.08Å; P263-G265 PolarHBondContact O-N 3.32Å; P263-L266 HydrophobicContact CG-CD1 4.26Å; P263-I271 HydrophobicContact CG-CD1 4.35Å
264E57.8Low61.8Low205 Ų205102.6 Ų102.696%0.95854%0.539SS*.THydrogen-bonded Turntrans-64.8129.4-178.5-167.1166.3-143.500111.5
265G64.1Low62.7Low80 Ų80103.6 Ų103.683%0.82554%0.543SS*.THydrogen-bonded Turntrans102.8-9.9-179.600000116.2P263P263-G265 PolarHBondContact O-N 3.32Å
266L66.8Low63.6Low66 Ų66104.6 Ų104.635%0.34655%0.545SS..SBendtrans-110.2140.7172.1-68.8178.2000111.2P263 I271P263-L266 HydrophobicContact CG-CD1 4.26Å; L266-I271 HydrophobicContact CB-CD1 3.74Å; L266-I271 HydrophobicContact CB-CG1 4.04Å; L266-I271 HydrophobicContact CD1-CD1 4.38Å; L266-I271 HydrophobicContact CD1-CG1 4.18Å
267S67.4Low64.9Low46 Ų4699.9 Ų99.932%0.32253%0.534SS..  trans-74.1149.117464.60000111.5L269 Q270 I271S267-L269 PolarHBondContact O-N 3.41Å; S267-L269 VanDerWaalsContact O-N 3.17Å; S267-Q270 WeakPolarHBondContact O-CB 3.37Å; S267-Q270 PolarHBondContact O-N 3.44Å; S267-Q270 VanDerWaalsContact O-N 3.09Å; S267-Q270 WeakPolarHBondContact OG-CB 3.49Å; S267-Q270 WeakPolarHBondContact OG-CG 3.4Å; S267-Q270 PolarHBondContact OG-N 3.2Å; S267-Q270 VanDerWaalsContact OG-N 3.14Å; S267-Q270 PolarHBondContact OG-OE1 2.95Å; S267-I271 PolarHBondContact O-N 3Å; S267-I271 VanDerWaalsContact O-N 3.14Å
268P67.8Low65.7Low68 Ų6895.9 Ų95.944%0.44252%0.522SS..Hα-helixtrans-55.7-32.8173.1-2836.3000113F262 I271 Y272F262-P268 HydrophobicContact CD1-CB 4.13Å; F262-P268 HydrophobicContact CD1-CG 4.38Å; F262-P268 HydrophobicContact CE1-CB 3.78Å; F262-P268 HydrophobicContact CE1-CG 4.42Å; F262-P268 HydrophobicContact CG-CG 4.48Å; F262-P268 HydrophobicContact CZ-CB 4.02Å; P268-I271 PolarHBondContact O-N 3.49Å; P268-Y272 WeakPolarHBondContact O-CD2 3.3Å; P268-Y272 PolarHBondContact O-N 2.88Å; P268-Y272 VanDerWaalsContact O-N 3.12Å
269L66.1Low66.4Low127 Ų12792.5 Ų92.567%0.66552%0.516SS*.Hα-helixtrans-66.5-45.4175.7-176.761.9000112.1S267 I271 Y272 C273S267-L269 PolarHBondContact O-N 3.41Å; S267-L269 VanDerWaalsContact O-N 3.17Å; L269-I271 VanDerWaalsContact C-N 3.26Å; L269-I271 PolarHBondContact O-N 2.98Å; L269-Y272 PolarHBondContact O-N 2.84Å; L269-C273 PolarHBondContact O-N 2.86Å; L269-C273 PolarHBondContact O-SG 3.39Å
270Q68Low67.3Low84 Ų8489.3 Ų89.339%0.39351%0.505SS..Hα-helixtrans-54.9-44.7172.3-85.2165.2-76.800111.3S267 Y272 C273 E274S267-Q270 WeakPolarHBondContact O-CB 3.37Å; S267-Q270 PolarHBondContact O-N 3.44Å; S267-Q270 VanDerWaalsContact O-N 3.09Å; S267-Q270 WeakPolarHBondContact OG-CB 3.49Å; S267-Q270 WeakPolarHBondContact OG-CG 3.4Å; S267-Q270 PolarHBondContact OG-N 3.2Å; S267-Q270 VanDerWaalsContact OG-N 3.14Å; S267-Q270 PolarHBondContact OG-OE1 2.95Å; Q270-Y272 VanDerWaalsContact C-N 3.33Å; Q270-Y272 PolarHBondContact O-N 2.95Å; Q270-C273 CarbonylContact O-C 3.41Å; Q270-C273 PolarHBondContact O-N 2.88Å; Q270-C273 VanDerWaalsContact O-N 3.11Å; Q270-E274 WeakPolarHBondContact O-CB 3.29Å; Q270-E274 VanDerWaalsContact O-CG 3.31Å; Q270-E274 WeakPolarHBondContact O-CG 3.33Å; Q270-E274 PolarHBondContact O-N 3.45Å
271I72.5Confident68.1Low19 Ų1990.4 Ų90.410%0.09751%0.511CS..Hα-helixtrans-68.5-31.7-175.8-71163000112.2L260 F262 P263 L266 S267 P268 L269 A275L260-I271 HydrophobicContact CB-CG2 4.42Å; L260-I271 HydrophobicContact CD1-CG2 4.1Å; F262-I271 HydrophobicContact CB-CD1 4.07Å; F262-I271 HydrophobicContact CD1-CB 4.23Å; F262-I271 HydrophobicContact CD1-CD1 3.7Å; F262-I271 HydrophobicContact CD1-CG2 4.09Å; F262-I271 HydrophobicContact CE1-CG2 4.26Å; F262-I271 HydrophobicContact CG-CD1 4.38Å; P263-I271 HydrophobicContact CG-CD1 4.35Å; L266-I271 HydrophobicContact CB-CD1 3.74Å; L266-I271 HydrophobicContact CB-CG1 4.04Å; L266-I271 HydrophobicContact CD1-CD1 4.38Å; L266-I271 HydrophobicContact CD1-CG1 4.18Å; S267-I271 PolarHBondContact O-N 3Å; S267-I271 VanDerWaalsContact O-N 3.14Å; P268-I271 PolarHBondContact O-N 3.49Å; L269-I271 VanDerWaalsContact C-N 3.26Å; L269-I271 PolarHBondContact O-N 2.98Å; I271-A275 VanDerWaalsContact O-CB 3.28Å; I271-A275 WeakPolarHBondContact O-CB 3.46Å; I271-A275 PolarHBondContact O-N 3.03Å; I271-A275 VanDerWaalsContact O-N 3.15Å
272Y70.3Confident69.3Low78 Ų7885.5 Ų85.531%0.30649%0.492SS..Hα-helixtrans-72.2-39.9168.4-76.7-65000112.6F257 L260 F262 P268 L269 Q270 A275 E276F257-Y272 HydrophobicContact CD1-CE1 4.47Å; L260-Y272 HydrophobicContact CD1-CD1 4.24Å; L260-Y272 HydrophobicContact CD1-CE1 3.96Å; F262-Y272 HydrophobicContact CE1-CE2 4.43Å; F262-Y272 HydrophobicContact CZ-CE2 4.44Å; P268-Y272 WeakPolarHBondContact O-CD2 3.3Å; P268-Y272 PolarHBondContact O-N 2.88Å; P268-Y272 VanDerWaalsContact O-N 3.12Å; L269-Y272 PolarHBondContact O-N 2.84Å; Q270-Y272 VanDerWaalsContact C-N 3.33Å; Q270-Y272 PolarHBondContact O-N 2.95Å; Y272-A275 PolarHBondContact O-N 3.44Å; Y272-E276 WeakPolarHBondContact O-CG 3.47Å; Y272-E276 PolarHBondContact O-N 3.39Å; Y272-E276 VanDerWaalsContact O-N 3.12Å
273C71.3Confident70.4Confident27 Ų2782.1 Ų82.118%0.18248%0.478CS..Hα-helixtrans-64.2-46176-67.80000112L269 Q270 A275 E276 G277 V278L269-C273 PolarHBondContact O-N 2.86Å; L269-C273 PolarHBondContact O-SG 3.39Å; Q270-C273 CarbonylContact O-C 3.41Å; Q270-C273 PolarHBondContact O-N 2.88Å; Q270-C273 VanDerWaalsContact O-N 3.11Å; C273-A275 VanDerWaalsContact C-N 3.32Å; C273-A275 PolarHBondContact O-N 3.26Å; C273-E276 CarbonylContact O-C 3.56Å; C273-E276 PolarHBondContact O-N 3.36Å; C273-E276 VanDerWaalsContact O-N 3.12Å; C273-G277 PolarHBondContact O-N 3.07Å; C273-G277 VanDerWaalsContact O-N 3.1Å; C273-V278 CarbonylContact C-O 3.43Å; C273-V278 HydrophobicContact CB-CB 4.23Å; C273-V278 WeakPolarHBondContact CB-O 3.4Å; C273-V278 WeakPolarHBondContact O-CA 3.41Å; C273-V278 PolarHBondContact O-N 3.32Å
274E72.9Confident71.3Confident90 Ų9082.2 Ų82.242%0.42148%0.478SS..Hα-helixtrans-59.8-39.2174.5-73.9169.6-160.400111.8Q270 E276 G277Q270-E274 WeakPolarHBondContact O-CB 3.29Å; Q270-E274 VanDerWaalsContact O-CG 3.31Å; Q270-E274 WeakPolarHBondContact O-CG 3.33Å; Q270-E274 PolarHBondContact O-N 3.45Å; E274-E276 VanDerWaalsContact C-N 3.31Å; E274-E276 PolarHBondContact O-N 3.05Å; E274-G277 PolarHBondContact O-N 3.4Å
275A72.4Confident72.8Confident71 Ų7176.9 Ų76.959%0.58745%0.453SS*.Hα-helixtrans-66.4-29.7175.300000113.5I271 Y272 C273 G277I271-A275 VanDerWaalsContact O-CB 3.28Å; I271-A275 WeakPolarHBondContact O-CB 3.46Å; I271-A275 PolarHBondContact O-N 3.03Å; I271-A275 VanDerWaalsContact O-N 3.15Å; Y272-A275 PolarHBondContact O-N 3.44Å; C273-A275 VanDerWaalsContact C-N 3.32Å; C273-A275 PolarHBondContact O-N 3.26Å; A275-G277 VanDerWaalsContact C-N 3.3Å
276E73.1Confident74.1Confident162 Ų16276.1 Ų76.176%0.75743%0.43SS*.THydrogen-bonded Turntrans-863.6170.3-65-69147.700112.7Y272 C273 E274 V278Y272-E276 WeakPolarHBondContact O-CG 3.47Å; Y272-E276 PolarHBondContact O-N 3.39Å; Y272-E276 VanDerWaalsContact O-N 3.12Å; C273-E276 CarbonylContact O-C 3.56Å; C273-E276 PolarHBondContact O-N 3.36Å; C273-E276 VanDerWaalsContact O-N 3.12Å; E274-E276 VanDerWaalsContact C-N 3.31Å; E274-E276 PolarHBondContact O-N 3.05Å; E276-V278 HydrophobicContact CB-CG2 4.34Å
277G71.9Confident75.2Confident61 Ų6173.9 Ų73.963%0.62942%0.418SS*.THydrogen-bonded Turntrans7814179.800000115.3C273 E274 A275C273-G277 PolarHBondContact O-N 3.07Å; C273-G277 VanDerWaalsContact O-N 3.1Å; E274-G277 PolarHBondContact O-N 3.4Å; A275-G277 VanDerWaalsContact C-N 3.3Å
278V69.9Low76.4Confident65 Ų6577.5 Ų77.539%0.39443%0.427SS..  trans-99.791-176.5-174.90000110.1C273 E276 I281C273-V278 CarbonylContact C-O 3.43Å; C273-V278 HydrophobicContact CB-CB 4.23Å; C273-V278 WeakPolarHBondContact CB-O 3.4Å; C273-V278 WeakPolarHBondContact O-CA 3.41Å; C273-V278 PolarHBondContact O-N 3.32Å; E276-V278 HydrophobicContact CB-CG2 4.34Å; V278-I281 HydrophobicContact CG1-CD1 3.94Å; V278-I281 HydrophobicContact CG1-CG1 3.51Å
279T65.2Low77.5Confident109 Ų10979.3 Ų79.367%0.66943%0.429SS*.  trans-86.2-38.8-179.7600000113.5
280D69.5Low78.7Confident129 Ų12974.6 Ų74.669%0.6940%0.404SS*.  trans-126.493.3-170.4-68.6-84.4000111.9V282D280-V282 VanDerWaalsContact C-N 3.33Å; D280-V282 PolarHBondContact O-N 3.26Å
281I74.7Confident79.8Confident94 Ų9473.2 Ų73.248%0.48240%0.399SS..  trans-82.378.9176.1-55.4-177.7000109.7V278 I283 L286V278-I281 HydrophobicContact CG1-CD1 3.94Å; V278-I281 HydrophobicContact CG1-CG1 3.51Å; I281-I283 PolarHBondContact O-N 3.24Å; I281-I283 VanDerWaalsContact O-N 3.08Å; I281-L286 HydrophobicContact CG2-CD1 3.76Å
282V83.7Confident80.7Confident61 Ų6177.4 Ų77.437%0.3742%0.42SS..  trans-75.297175.1-172.70000109.7D280 T284 E285 L286D280-V282 VanDerWaalsContact C-N 3.33Å; D280-V282 PolarHBondContact O-N 3.26Å; V282-T284 VanDerWaalsContact C-N 3.27Å; V282-T284 PolarHBondContact O-N 3.31Å; V282-E285 HydrophobicContact CB-CB 4.21Å; V282-E285 HydrophobicContact CB-CG 4.07Å; V282-E285 HydrophobicContact CG1-CB 4.3Å; V282-E285 HydrophobicContact CG1-CG 3.88Å; V282-E285 WeakPolarHBondContact O-CB 3.4Å; V282-E285 PolarHBondContact O-N 3.15Å; V282-L286 PolarHBondContact O-N 3.17Å
283I86.1Confident81.6Confident21 Ų2177.8 Ų77.811%0.10843%0.427CS..Hα-helixtrans-54.9-41.2-177-64.3-177.3000112.1I281 E285 L286 L287 L314 A317 E318 L321I281-I283 PolarHBondContact O-N 3.24Å; I281-I283 VanDerWaalsContact O-N 3.08Å; I283-E285 PolarHBondContact O-N 2.91Å; I283-L286 PolarHBondContact O-N 3.32Å; I283-L286 VanDerWaalsContact O-N 3.09Å; I283-L287 HydrophobicContact CG2-CD1 3.92Å; I283-L287 HydrophobicContact CG2-CG 4.18Å; I283-L287 WeakPolarHBondContact O-CG 3.28Å; I283-L287 PolarHBondContact O-N 3.43Å; I283-L314 HydrophobicContact CG1-CD2 4.31Å; I283-L314 HydrophobicContact CG2-CB 4.05Å; I283-L314 HydrophobicContact CG2-CD2 4.12Å; I283-A317 HydrophobicContact CD1-CB 3.87Å; I283-E318 HydrophobicContact CG2-CB 4.07Å; I283-L321 HydrophobicContact CD1-CD1 3.68Å
284T86.6Confident82.2Confident64 Ų6478.6 Ų78.639%0.39344%0.441SS..Hα-helixtrans-64.2-20.7177.765.10000113.7V282 K288 E318V282-T284 VanDerWaalsContact C-N 3.27Å; V282-T284 PolarHBondContact O-N 3.31Å; T284-K288 WeakPolarHBondContact O-CD 3.42Å; T284-K288 VanDerWaalsContact O-CE 3.28Å; T284-K288 WeakPolarHBondContact O-CE 3.45Å; T284-K288 WeakPolarHBondContact O-CG 3.46Å; T284-K288 PolarHBondContact O-N 2.77Å; T284-E318 WeakPolarHBondContact CG2-OE1 3.5Å
285E89.6Confident82.8Confident92 Ų9281 Ų8143%0.4346%0.456SS..Hα-helixtrans-83.8-37.9170.4-72.4-166.4-168.500112.6V282 I283 L287 K288 K289V282-E285 HydrophobicContact CB-CB 4.21Å; V282-E285 HydrophobicContact CB-CG 4.07Å; V282-E285 HydrophobicContact CG1-CB 4.3Å; V282-E285 HydrophobicContact CG1-CG 3.88Å; V282-E285 WeakPolarHBondContact O-CB 3.4Å; V282-E285 PolarHBondContact O-N 3.15Å; I283-E285 PolarHBondContact O-N 2.91Å; E285-L287 VanDerWaalsContact C-N 3.34Å; E285-K288 PolarHBondContact O-N 3.35Å; E285-K289 WeakPolarHBondContact O-CB 3.41Å; E285-K289 WeakPolarHBondContact O-CD 3.42Å; E285-K289 VanDerWaalsContact O-CG 3.26Å; E285-K289 WeakPolarHBondContact O-CG 3.37Å; E285-K289 PolarHBondContact O-N 2.82Å; E285-K289 IonicContact OE2-NZ 2.75Å; E285-K289 PolarHBondContact OE2-NZ 3.22Å
286L89.9Confident82.9Confident65 Ų6583.7 Ų83.734%0.3446%0.461SS..Hα-helixtrans-65.4-39.9176.2-66-178.2000111.2I281 V282 I283 K289 L290 L314I281-L286 HydrophobicContact CG2-CD1 3.76Å; V282-L286 PolarHBondContact O-N 3.17Å; I283-L286 PolarHBondContact O-N 3.32Å; I283-L286 VanDerWaalsContact O-N 3.09Å; L286-K289 HydrophobicContact CD2-CD 4.37Å; L286-K289 PolarHBondContact O-N 3.07Å; L286-L290 WeakPolarHBondContact O-CG 3.27Å; L286-L290 PolarHBondContact O-N 3.29Å; L286-L314 HydrophobicContact CB-CD1 3.65Å; L286-L314 HydrophobicContact CB-CD2 4.44Å; L286-L314 HydrophobicContact CD1-CD2 4.11Å
287L90.3Very high83.1Confident18 Ų1877.9 Ų77.99%0.09444%0.44CS..Hα-helixtrans-59.1-49.8171.7-72.6172000111.3I283 E285 K289 L290 D291 R311 L314 E318I283-L287 HydrophobicContact CG2-CD1 3.92Å; I283-L287 HydrophobicContact CG2-CG 4.18Å; I283-L287 WeakPolarHBondContact O-CG 3.28Å; I283-L287 PolarHBondContact O-N 3.43Å; E285-L287 VanDerWaalsContact C-N 3.34Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 3.08Å; L287-L290 PolarHBondContact O-N 2.75Å; L287-L290 VanDerWaalsContact O-N 3.11Å; L287-D291 PolarHBondContact O-N 3.03Å; L287-R311 HydrophobicContact CD2-CG 3.92Å; L287-L314 HydrophobicContact CD2-CB 3.67Å; L287-L314 HydrophobicContact CD2-CD1 4.32Å; L287-L314 HydrophobicContact CG-CB 4.08Å; L287-E318 WeakPolarHBondContact CD1-OE2 3.43Å
288K92.1Very high83.6Confident122 Ų12283.5 Ų83.553%0.5346%0.456SS..Hα-helixtrans-57.5-40.4174.8-71163.4-165.6157.90112.7T284 E285 D291 I292T284-K288 WeakPolarHBondContact O-CD 3.42Å; T284-K288 VanDerWaalsContact O-CE 3.28Å; T284-K288 WeakPolarHBondContact O-CE 3.45Å; T284-K288 WeakPolarHBondContact O-CG 3.46Å; T284-K288 PolarHBondContact O-N 2.77Å; E285-K288 PolarHBondContact O-N 3.35Å; K288-D291 PolarHBondContact O-N 2.73Å; K288-I292 WeakPolarHBondContact O-CB 3.3Å; K288-I292 WeakPolarHBondContact O-CD1 3.32Å; K288-I292 VanDerWaalsContact O-CG1 3.23Å; K288-I292 WeakPolarHBondContact O-CG1 3.45Å; K288-I292 PolarHBondContact O-N 3.02Å
289K91.1Very high84.5Confident107 Ų10782 Ų8247%0.46545%0.446SS..Hα-helixtrans-65.5-39.3177.2-73.6158.8-176.9154.90111.2E285 L286 L287 L293E285-K289 WeakPolarHBondContact O-CB 3.41Å; E285-K289 WeakPolarHBondContact O-CD 3.42Å; E285-K289 VanDerWaalsContact O-CG 3.26Å; E285-K289 WeakPolarHBondContact O-CG 3.37Å; E285-K289 PolarHBondContact O-N 2.82Å; E285-K289 IonicContact OE2-NZ 2.75Å; E285-K289 PolarHBondContact OE2-NZ 3.22Å; L286-K289 HydrophobicContact CD2-CD 4.37Å; L286-K289 PolarHBondContact O-N 3.07Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 3.08Å; K289-L293 WeakPolarHBondContact O-CD1 3.45Å; K289-L293 VanDerWaalsContact O-CG 3.27Å; K289-L293 WeakPolarHBondContact O-CG 3.42Å; K289-L293 PolarHBondContact O-N 2.96Å; K289-L293 VanDerWaalsContact O-N 3.11Å
290L92.4Very high85.7Confident27 Ų2779.5 Ų79.514%0.14143%0.433CS..Hα-helixtrans-70.9-39.2174.6-70.3177.4000113.2L286 L287 L293 G294 V307 A310 R311 L314L286-L290 WeakPolarHBondContact O-CG 3.27Å; L286-L290 PolarHBondContact O-N 3.29Å; L287-L290 PolarHBondContact O-N 2.75Å; L287-L290 VanDerWaalsContact O-N 3.11Å; L290-L293 PolarHBondContact O-N 3.05Å; L290-G294 PolarHBondContact O-N 3.03Å; L290-V307 HydrophobicContact CB-CG1 4.41Å; L290-V307 HydrophobicContact CD2-CG1 4.29Å; L290-V307 HydrophobicContact CD2-CG2 4.41Å; L290-A310 HydrophobicContact CD1-CB 3.79Å; L290-A310 HydrophobicContact CD2-CB 4.37Å; L290-R311 HydrophobicContact CD1-CB 4.11Å; L290-L314 HydrophobicContact CD1-CD1 3.68Å
291D90.3Very high86.7Confident55 Ų5579.3 Ų79.329%0.29443%0.432SS..Hα-helixtrans-60.7-48.5175-69.6-33.3000110.3L287 K288 L293 G294 D295 R311L287-D291 PolarHBondContact O-N 3.03Å; K288-D291 PolarHBondContact O-N 2.73Å; D291-L293 VanDerWaalsContact C-N 3.3Å; D291-L293 PolarHBondContact O-N 2.92Å; D291-G294 PolarHBondContact O-N 3.36Å; D291-G294 VanDerWaalsContact O-N 3.15Å; D291-D295 PolarHBondContact O-N 2.96Å; D291-R311 IonicContact OD1-CZ 2.77Å; D291-R311 IonicContact OD1-NE 2.67Å; D291-R311 PolarHBondContact OD1-NE 3.39Å; D291-R311 IonicContact OD1-NH2 2.9Å; D291-R311 PolarHBondContact OD1-NH2 3.23Å; D291-R311 IonicContact OD2-NH2 2.99Å
292I90.9Very high87.5Confident107 Ų10782.5 Ų82.555%0.54945%0.445SS..Hα-helixtrans-59-40.1175.6-69164.9000111.8K288 N296K288-I292 WeakPolarHBondContact O-CB 3.3Å; K288-I292 WeakPolarHBondContact O-CD1 3.32Å; K288-I292 VanDerWaalsContact O-CG1 3.23Å; K288-I292 WeakPolarHBondContact O-CG1 3.45Å; K288-I292 PolarHBondContact O-N 3.02Å; I292-N296 WeakPolarHBondContact O-CB 3.42Å; I292-N296 PolarHBondContact O-N 3.02Å; I292-N296 PolarHBondContact O-ND2 3.47Å
293L89.6Confident87.8Confident86 Ų8684.3 Ų84.345%0.4545%0.449SS..Hα-helixtrans-67.4-39176.4-76.5166.6000112.5K289 L290 D291 A297K289-L293 WeakPolarHBondContact O-CD1 3.45Å; K289-L293 VanDerWaalsContact O-CG 3.27Å; K289-L293 WeakPolarHBondContact O-CG 3.42Å; K289-L293 PolarHBondContact O-N 2.96Å; K289-L293 VanDerWaalsContact O-N 3.11Å; L290-L293 PolarHBondContact O-N 3.05Å; D291-L293 VanDerWaalsContact C-N 3.3Å; D291-L293 PolarHBondContact O-N 2.92Å; L293-A297 WeakPolarHBondContact O-CB 3.48Å; L293-A297 PolarHBondContact O-N 2.77Å
294G84.8Confident87.9Confident45 Ų4587.6 Ų87.646%0.46446%0.464SS..Hα-helixtrans-65.8-39176.100000113.2L290 D291L290-G294 PolarHBondContact O-N 3.03Å; D291-G294 PolarHBondContact O-N 3.36Å; D291-G294 VanDerWaalsContact O-N 3.15Å
295D84.1Confident88.1Confident140 Ų14088.1 Ų88.175%0.74947%0.467SS*.Hα-helixtrans-79.7-25.9-176.7-74.1-17.4000114.2D291D291-D295 PolarHBondContact O-N 2.96Å
296N75.8Confident88.2Confident127 Ų12788.1 Ų88.168%0.67947%0.473SS*.Hα-helixtrans-124.2-4.4-164-61.2-90.7000116.2I292I292-N296 WeakPolarHBondContact O-CB 3.42Å; I292-N296 PolarHBondContact O-N 3.02Å; I292-N296 PolarHBondContact O-ND2 3.47Å
297A77Confident88.2Confident40 Ų4086.1 Ų86.133%0.33146%0.464SS..  trans-112.5140.6-17600000113.3L293 L299L293-A297 WeakPolarHBondContact O-CB 3.48Å; L293-A297 PolarHBondContact O-N 2.77Å; A297-L299 HydrophobicContact CB-CD2 3.79Å; A297-L299 HydrophobicContact CB-CG 3.84Å; A297-L299 PolarHBondContact O-N 3.35Å
298N82.9Confident88.2Confident180 Ų18090.2 Ų90.296%0.96349%0.485SS*.  trans-75.362.7170.1-77.12.8000110.7
299L88.2Confident88.2Confident34 Ų3490.1 Ų90.118%0.17849%0.486CS..  trans-68.8139.5178.1-59.8179.3000110.9A297 E303 Q304 V307A297-L299 HydrophobicContact CB-CD2 3.79Å; A297-L299 HydrophobicContact CB-CG 3.84Å; A297-L299 PolarHBondContact O-N 3.35Å; L299-E303 HydrophobicContact CB-CB 3.99Å; L299-E303 HydrophobicContact CD2-CB 4.18Å; L299-Q304 HydrophobicContact CB-CG 3.66Å; L299-Q304 HydrophobicContact CD1-CG 4.37Å; L299-Q304 PolarHBondContact O-NE2 2.76Å; L299-V307 HydrophobicContact CD1-CG2 3.92Å
300S90.9Very high88.2Confident56 Ų5686.8 Ų86.839%0.39248%0.479SS..  trans-66.8163.2165.968.70000111.5E302 E303 Q304S300-E302 PolarHBondContact O-N 3.34Å; S300-E303 WeakPolarHBondContact CB-OE2 3.29Å; S300-E303 PolarHBondContact N-OE2 3.29Å; S300-E303 PolarHBondContact O-N 2.93Å; S300-E303 VanDerWaalsContact O-N 3.08Å; S300-E303 WeakPolarHBondContact OG-CG 3.34Å; S300-E303 PolarHBondContact OG-OE2 2.97Å; S300-Q304 WeakPolarHBondContact O-CG 3.29Å; S300-Q304 PolarHBondContact O-N 3.01Å
301N90.6Very high88.3Confident125 Ų12590.7 Ų90.767%0.66849%0.491SS*.Hα-helixtrans-57.3-34.6-178.6-63.2-3000112.8V305N301-V305 WeakPolarHBondContact O-CB 3.18Å; N301-V305 VanDerWaalsContact O-CG2 3.25Å; N301-V305 WeakPolarHBondContact O-CG2 3.45Å; N301-V305 PolarHBondContact O-N 3.43Å
302E91.4Very high88.5Confident161 Ų16191.7 Ų91.775%0.75250%0.5SS*.Hα-helixtrans-71.5-38.2178.1-62.6-176172.900111.7S300 T306S300-E302 PolarHBondContact O-N 3.34Å; E302-T306 WeakPolarHBondContact O-CB 3.32Å; E302-T306 PolarHBondContact O-N 3.18Å; E302-T306 PolarHBondContact O-OG1 2.8Å
303E88.7Confident88.7Confident98 Ų9891.3 Ų91.346%0.45850%0.502SS..Hα-helixtrans-69.4-40.6174.9-68.4164.1122.100111.6L299 S300 T306 V307L299-E303 HydrophobicContact CB-CB 3.99Å; L299-E303 HydrophobicContact CD2-CB 4.18Å; S300-E303 WeakPolarHBondContact CB-OE2 3.29Å; S300-E303 PolarHBondContact N-OE2 3.29Å; S300-E303 PolarHBondContact O-N 2.93Å; S300-E303 VanDerWaalsContact O-N 3.08Å; S300-E303 WeakPolarHBondContact OG-CG 3.34Å; S300-E303 PolarHBondContact OG-OE2 2.97Å; E303-T306 WeakPolarHBondContact O-CB 3.49Å; E303-T306 PolarHBondContact O-N 2.67Å; E303-T306 VanDerWaalsContact O-N 3.14Å; E303-V307 WeakPolarHBondContact O-CG2 3.34Å; E303-V307 PolarHBondContact O-N 2.88Å
304Q88.6Confident88.8Confident90 Ų9088.6 Ų88.642%0.42149%0.488SS..Hα-helixtrans-59.3-47.8173.3-67.8174.629.800111.3L299 S300 T306 V307 I308L299-Q304 HydrophobicContact CB-CG 3.66Å; L299-Q304 HydrophobicContact CD1-CG 4.37Å; L299-Q304 PolarHBondContact O-NE2 2.76Å; S300-Q304 WeakPolarHBondContact O-CG 3.29Å; S300-Q304 PolarHBondContact O-N 3.01Å; Q304-T306 VanDerWaalsContact C-N 3.26Å; Q304-T306 PolarHBondContact O-N 3.42Å; Q304-V307 PolarHBondContact O-N 3.47Å; Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.35Å; Q304-I308 PolarHBondContact O-N 2.84Å
305V91.3Very high89.2Confident75 Ų7588.5 Ų88.546%0.45548%0.478SS..Hα-helixtrans-60.7-36.5174.9167.90000111.2N301 H309N301-V305 WeakPolarHBondContact O-CB 3.18Å; N301-V305 VanDerWaalsContact O-CG2 3.25Å; N301-V305 WeakPolarHBondContact O-CG2 3.45Å; N301-V305 PolarHBondContact O-N 3.43Å; V305-H309 WeakPolarHBondContact CG1-ND1 3.49Å; V305-H309 PolarHBondContact O-N 2.76Å; V305-H309 VanDerWaalsContact O-N 3.08Å; V305-H309 PolarHBondContact O-ND1 3.21Å
306T90.9Very high89.7Confident92 Ų9286.5 Ų86.556%0.56447%0.467SS*.Hα-helixtrans-68-43.9176.7-58.50000111.9E302 E303 Q304 I308 H309 A310E302-T306 WeakPolarHBondContact O-CB 3.32Å; E302-T306 PolarHBondContact O-N 3.18Å; E302-T306 PolarHBondContact O-OG1 2.8Å; E303-T306 WeakPolarHBondContact O-CB 3.49Å; E303-T306 PolarHBondContact O-N 2.67Å; E303-T306 VanDerWaalsContact O-N 3.14Å; Q304-T306 VanDerWaalsContact C-N 3.26Å; Q304-T306 PolarHBondContact O-N 3.42Å; T306-I308 PolarHBondContact O-N 3.34Å; T306-H309 PolarHBondContact O-N 3.36Å; T306-A310 WeakPolarHBondContact O-CB 3.33Å; T306-A310 PolarHBondContact O-N 3.46Å
307V90.1Very high90.4Very high23 Ų2382.3 Ų82.314%0.13945%0.45CS..Hα-helixtrans-61.2-43.5175.2167.70000111.3L290 L299 E303 Q304 A310 R311L290-V307 HydrophobicContact CB-CG1 4.41Å; L290-V307 HydrophobicContact CD2-CG1 4.29Å; L290-V307 HydrophobicContact CD2-CG2 4.41Å; L299-V307 HydrophobicContact CD1-CG2 3.92Å; E303-V307 WeakPolarHBondContact O-CG2 3.34Å; E303-V307 PolarHBondContact O-N 2.88Å; Q304-V307 PolarHBondContact O-N 3.47Å; V307-A310 PolarHBondContact O-N 2.91Å; V307-R311 VanDerWaalsContact O-CB 3.27Å; V307-R311 WeakPolarHBondContact O-CB 3.46Å; V307-R311 PolarHBondContact O-N 3.25Å
308I90.9Very high90.9Very high104 Ų10483.5 Ų83.553%0.53345%0.449SS..Hα-helixtrans-62.1-44.7177.4-69165.2000111.5Q304 T306 R311 T312Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.35Å; Q304-I308 PolarHBondContact O-N 2.84Å; T306-I308 PolarHBondContact O-N 3.34Å; I308-R311 PolarHBondContact O-N 3.47Å; I308-T312 PolarHBondContact O-N 3.15Å; I308-T312 PolarHBondContact O-OG1 2.97Å
309H92.1Very high91.4Very high120 Ų12081 Ų8156%0.55643%0.429SS*.Hα-helixtrans-64.1-47.4175.8-76.7107.5000112.1V305 T306 R311 T312 V313V305-H309 WeakPolarHBondContact CG1-ND1 3.49Å; V305-H309 PolarHBondContact O-N 2.76Å; V305-H309 VanDerWaalsContact O-N 3.08Å; V305-H309 PolarHBondContact O-ND1 3.21Å; T306-H309 PolarHBondContact O-N 3.36Å; H309-R311 VanDerWaalsContact C-N 3.29Å; H309-R311 PolarHBondContact O-N 2.85Å; H309-T312 PolarHBondContact O-N 3.42Å; H309-T312 VanDerWaalsContact O-N 3.16Å; H309-V313 WeakPolarHBondContact O-CG2 3.25Å; H309-V313 PolarHBondContact O-N 2.78Å
310A91.5Very high91.7Very high38 Ų3888.3 Ų88.331%0.31446%0.455SS..Hα-helixtrans-58.2-42.817800000111.7L290 T306 V307 V313 L314L290-A310 HydrophobicContact CD1-CB 3.79Å; L290-A310 HydrophobicContact CD2-CB 4.37Å; T306-A310 WeakPolarHBondContact O-CB 3.33Å; T306-A310 PolarHBondContact O-N 3.46Å; V307-A310 PolarHBondContact O-N 2.91Å; A310-V313 PolarHBondContact O-N 3.45Å; A310-L314 WeakPolarHBondContact O-CG 3.42Å; A310-L314 PolarHBondContact O-N 3.35Å
311R93.1Very high91.7Very high109 Ų10990.4 Ų90.441%0.41146%0.461SS..Hα-helixtrans-61.5-45.5175.4-169.1-176.7-164.9-84.7-3.2111.8L287 L290 D291 V307 I308 H309 L314 T315L287-R311 HydrophobicContact CD2-CG 3.92Å; L290-R311 HydrophobicContact CD1-CB 4.11Å; D291-R311 IonicContact OD1-CZ 2.77Å; D291-R311 IonicContact OD1-NE 2.67Å; D291-R311 PolarHBondContact OD1-NE 3.39Å; D291-R311 IonicContact OD1-NH2 2.9Å; D291-R311 PolarHBondContact OD1-NH2 3.23Å; D291-R311 IonicContact OD2-NH2 2.99Å; V307-R311 VanDerWaalsContact O-CB 3.27Å; V307-R311 WeakPolarHBondContact O-CB 3.46Å; V307-R311 PolarHBondContact O-N 3.25Å; I308-R311 PolarHBondContact O-N 3.47Å; H309-R311 VanDerWaalsContact C-N 3.29Å; H309-R311 PolarHBondContact O-N 2.85Å; R311-L314 PolarHBondContact O-N 3.04Å; R311-T315 PolarHBondContact O-N 3.45Å; R311-T315 PolarHBondContact O-OG1 2.99Å; R311-T315 VanDerWaalsContact O-OG1 3.13Å
312T95Very high91.7Very high76 Ų7690.9 Ų90.947%0.46646%0.459SS..Hα-helixtrans-63.7-42.7178-62.20000112I308 H309 T315 L316I308-T312 PolarHBondContact O-N 3.15Å; I308-T312 PolarHBondContact O-OG1 2.97Å; H309-T312 PolarHBondContact O-N 3.42Å; H309-T312 VanDerWaalsContact O-N 3.16Å; T312-T315 PolarHBondContact O-N 3.03Å; T312-L316 HydrophobicContact CG2-CD1 4.23Å; T312-L316 WeakPolarHBondContact O-CG 3.42Å; T312-L316 PolarHBondContact O-N 2.8Å
313V94.7Very high91.9Very high98 Ų9886.5 Ų86.559%0.59445%0.446SS*.Hα-helixtrans-62-44.61761710000111.1H309 A310 L316 A317H309-V313 WeakPolarHBondContact O-CG2 3.25Å; H309-V313 PolarHBondContact O-N 2.78Å; A310-V313 PolarHBondContact O-N 3.45Å; V313-L316 PolarHBondContact O-N 3.37Å; V313-A317 WeakPolarHBondContact O-CB 3.39Å; V313-A317 PolarHBondContact O-N 2.92Å
314L92.4Very high92.1Very high30 Ų3085.8 Ų85.816%0.15745%0.445CS..Hα-helixtrans-64.5-43.2177.6-74.5171.8000112.7I283 L286 L287 L290 A310 R311 L316 A317 E318I283-L314 HydrophobicContact CG1-CD2 4.31Å; I283-L314 HydrophobicContact CG2-CB 4.05Å; I283-L314 HydrophobicContact CG2-CD2 4.12Å; L286-L314 HydrophobicContact CB-CD1 3.65Å; L286-L314 HydrophobicContact CB-CD2 4.44Å; L286-L314 HydrophobicContact CD1-CD2 4.11Å; L287-L314 HydrophobicContact CD2-CB 3.67Å; L287-L314 HydrophobicContact CD2-CD1 4.32Å; L287-L314 HydrophobicContact CG-CB 4.08Å; L290-L314 HydrophobicContact CD1-CD1 3.68Å; A310-L314 WeakPolarHBondContact O-CG 3.42Å; A310-L314 PolarHBondContact O-N 3.35Å; R311-L314 PolarHBondContact O-N 3.04Å; L314-L316 VanDerWaalsContact C-N 3.28Å; L314-L316 PolarHBondContact O-N 3.08Å; L314-A317 PolarHBondContact O-N 3.1Å; L314-E318 WeakPolarHBondContact O-CB 3.37Å; L314-E318 PolarHBondContact O-N 2.94Å
315T92.8Very high92.3Very high42 Ų4285.7 Ų85.726%0.25844%0.444SS..Hα-helixtrans-64.8-29.7175.1-58.60000112.9R311 T312 K319R311-T315 PolarHBondContact O-N 3.45Å; R311-T315 PolarHBondContact O-OG1 2.99Å; R311-T315 VanDerWaalsContact O-OG1 3.13Å; T312-T315 PolarHBondContact O-N 3.03Å; T315-K319 WeakPolarHBondContact O-CG 3.3Å; T315-K319 PolarHBondContact O-N 3.39Å
316L94.4Very high92.5Very high99 Ų9986.7 Ų86.752%0.51845%0.45SS..Hα-helixtrans-73.6-42.2172.1-71.7171.5000111.6T312 V313 L314 K319 W320T312-L316 HydrophobicContact CG2-CD1 4.23Å; T312-L316 WeakPolarHBondContact O-CG 3.42Å; T312-L316 PolarHBondContact O-N 2.8Å; V313-L316 PolarHBondContact O-N 3.37Å; L314-L316 VanDerWaalsContact C-N 3.28Å; L314-L316 PolarHBondContact O-N 3.08Å; L316-K319 PolarHBondContact O-N 3.2Å; L316-W320 PolarHBondContact O-N 3.14Å; L316-W320 VanDerWaalsContact O-N 3.08Å
317A90.1Very high92.7Very high39 Ų3985.9 Ų85.932%0.32245%0.445SS..Hα-helixtrans-62.8-40.2176.400000112.3I283 V313 L314 K319 W320 L321I283-A317 HydrophobicContact CD1-CB 3.87Å; V313-A317 WeakPolarHBondContact O-CB 3.39Å; V313-A317 PolarHBondContact O-N 2.92Å; L314-A317 PolarHBondContact O-N 3.1Å; A317-K319 PolarHBondContact O-N 3.14Å; A317-W320 PolarHBondContact O-N 3.28Å; A317-L321 WeakPolarHBondContact O-CG 3.34Å; A317-L321 PolarHBondContact O-N 3.4Å
318E89.3Confident92.8Very high65 Ų6589 Ų8930%0.30446%0.457SS..Hα-helixtrans-57.1-49.1175.5-170.4164.8-124.800112I283 T284 L287 L314 W320 L321 E322I283-E318 HydrophobicContact CG2-CB 4.07Å; T284-E318 WeakPolarHBondContact CG2-OE1 3.5Å; L287-E318 WeakPolarHBondContact CD1-OE2 3.43Å; L314-E318 WeakPolarHBondContact O-CB 3.37Å; L314-E318 PolarHBondContact O-N 2.94Å; E318-W320 VanDerWaalsContact C-N 3.32Å; E318-W320 PolarHBondContact O-N 3.34Å; E318-L321 PolarHBondContact O-N 3.48Å; E318-E322 PolarHBondContact O-N 2.96Å
319K92.8Very high93Very high128 Ų12886.8 Ų86.856%0.55745%0.451SS*.Hα-helixtrans-65-33.2176.5-69.3176.5179.2-1760113.3T315 L316 A317 S323T315-K319 WeakPolarHBondContact O-CG 3.3Å; T315-K319 PolarHBondContact O-N 3.39Å; L316-K319 PolarHBondContact O-N 3.2Å; A317-K319 PolarHBondContact O-N 3.14Å; K319-S323 WeakPolarHBondContact O-CB 3.49Å; K319-S323 PolarHBondContact O-N 3.16Å; K319-S323 VanDerWaalsContact O-N 3.1Å
320W94.8Very high93.2Very high187 Ų18783.6 Ų83.671%0.70845%0.445SS*.Hα-helixtrans-68.3-42.2173.5-9484.8000111.7L316 A317 E318 S323 I324L316-W320 PolarHBondContact O-N 3.14Å; L316-W320 VanDerWaalsContact O-N 3.08Å; A317-W320 PolarHBondContact O-N 3.28Å; E318-W320 VanDerWaalsContact C-N 3.32Å; E318-W320 PolarHBondContact O-N 3.34Å; W320-S323 PolarHBondContact O-N 2.88Å; W320-I324 WeakPolarHBondContact O-CD1 3.41Å; W320-I324 VanDerWaalsContact O-CG1 3.24Å; W320-I324 WeakPolarHBondContact O-CG1 3.41Å; W320-I324 PolarHBondContact O-N 3.3Å
321L89.5Confident93.3Very high100 Ų10087 Ų8752%0.52446%0.458SS..Hα-helixtrans-65.6-40.9175.3-69.8179.3000112.3I283 A317 E318 S323 I324 E325I283-L321 HydrophobicContact CD1-CD1 3.68Å; A317-L321 WeakPolarHBondContact O-CG 3.34Å; A317-L321 PolarHBondContact O-N 3.4Å; E318-L321 PolarHBondContact O-N 3.48Å; L321-S323 PolarHBondContact O-N 3.04Å; L321-I324 PolarHBondContact O-N 3.05Å; L321-E325 PolarHBondContact O-N 3.31Å
322E91.9Very high93.4Very high135 Ų13587.1 Ų87.163%0.63146%0.463SS*.Hα-helixtrans-58.6-46.8174.1-175.3177.8-151.800111.4E318 I324 E325 V326E318-E322 PolarHBondContact O-N 2.96Å; E322-I324 VanDerWaalsContact C-N 3.34Å; E322-I324 PolarHBondContact O-N 2.94Å; E322-E325 PolarHBondContact O-N 3.44Å; E322-V326 WeakPolarHBondContact O-CG2 3.49Å; E322-V326 PolarHBondContact O-N 3.26Å
323S95.1Very high93.5Very high69 Ų6988.3 Ų88.348%0.48346%0.463SS..Hα-helixtrans-61.1-39.4174.7-173.20000112.9K319 W320 L321 T327K319-S323 WeakPolarHBondContact O-CB 3.49Å; K319-S323 PolarHBondContact O-N 3.16Å; K319-S323 VanDerWaalsContact O-N 3.1Å; W320-S323 PolarHBondContact O-N 2.88Å; L321-S323 PolarHBondContact O-N 3.04Å; S323-T327 WeakPolarHBondContact O-CG2 3.47Å; S323-T327 PolarHBondContact O-N 3.17Å; S323-T327 PolarHBondContact O-OG1 2.88Å
324I92.9Very high93.6Very high83 Ų8390 Ų9043%0.42646%0.462SS..Hα-helixtrans-65.3-43.3175.5-72163.7000111W320 L321 E322 T327 K328W320-I324 WeakPolarHBondContact O-CD1 3.41Å; W320-I324 VanDerWaalsContact O-CG1 3.24Å; W320-I324 WeakPolarHBondContact O-CG1 3.41Å; W320-I324 PolarHBondContact O-N 3.3Å; L321-I324 PolarHBondContact O-N 3.05Å; E322-I324 VanDerWaalsContact C-N 3.34Å; E322-I324 PolarHBondContact O-N 2.94Å; I324-T327 WeakPolarHBondContact CA-OG1 3.35Å; I324-T327 PolarHBondContact O-N 2.92Å; I324-T327 PolarHBondContact O-OG1 3.38Å; I324-K328 WeakPolarHBondContact O-CB 3.45Å; I324-K328 PolarHBondContact O-N 3.35Å
325E92.9Very high93.8Very high87 Ų8795 Ų9541%0.40749%0.486SS..Hα-helixtrans-70.1-35.5-179-165.659.1-144.700112.2L321 E322 K328 S329L321-E325 PolarHBondContact O-N 3.31Å; E322-E325 PolarHBondContact O-N 3.44Å; E325-K328 IonicContact OE1-NZ 3.13Å; E325-K328 PolarHBondContact OE1-NZ 2.84Å; E325-K328 WeakPolarHBondContact OE2-CD 3.47Å; E325-K328 IonicContact OE2-NZ 2.7Å; E325-K328 PolarHBondContact OE2-NZ 3.23Å; E325-S329 WeakPolarHBondContact O-CB 3.48Å; E325-S329 PolarHBondContact O-N 3Å; E325-S329 PolarHBondContact O-OG 3.32Å
326V96.1Very high94Very high97 Ų9797.4 Ų97.459%0.58850%0.498SS*.Hα-helixtrans-64-46.9171.4170.60000111.4E322 S329 A330E322-V326 WeakPolarHBondContact O-CG2 3.49Å; E322-V326 PolarHBondContact O-N 3.26Å; V326-S329 PolarHBondContact O-N 3.36Å; V326-A330 PolarHBondContact O-N 2.97Å
327T93.7Very high94Very high74 Ų7495.9 Ų95.945%0.45449%0.49SS..Hα-helixtrans-68.4-37.6179.149.90000112.4S323 I324 A330 L331S323-T327 WeakPolarHBondContact O-CG2 3.47Å; S323-T327 PolarHBondContact O-N 3.17Å; S323-T327 PolarHBondContact O-OG1 2.88Å; I324-T327 WeakPolarHBondContact CA-OG1 3.35Å; I324-T327 PolarHBondContact O-N 2.92Å; I324-T327 PolarHBondContact O-OG1 3.38Å; T327-A330 PolarHBondContact O-N 3.4Å; T327-L331 WeakPolarHBondContact O-CB 3.44Å; T327-L331 WeakPolarHBondContact O-CG 3.41Å; T327-L331 PolarHBondContact O-N 2.81Å
328K92.6Very high94.3Very high88 Ų8898.9 Ų98.938%0.38350%0.5SS..Hα-helixtrans-58.6-46.6170.5170.7173.8163.1-1180112I324 E325 A330 L331 Q332I324-K328 WeakPolarHBondContact O-CB 3.45Å; I324-K328 PolarHBondContact O-N 3.35Å; E325-K328 IonicContact OE1-NZ 3.13Å; E325-K328 PolarHBondContact OE1-NZ 2.84Å; E325-K328 WeakPolarHBondContact OE2-CD 3.47Å; E325-K328 IonicContact OE2-NZ 2.7Å; E325-K328 PolarHBondContact OE2-NZ 3.23Å; K328-A330 PolarHBondContact O-N 2.94Å; K328-L331 PolarHBondContact O-N 2.66Å; K328-Q332 WeakPolarHBondContact O-CG 3.37Å; K328-Q332 PolarHBondContact O-N 3.08Å
329S95.8Very high94.7Very high59 Ų59100 Ų10041%0.41351%0.505SS..Hα-helixtrans-61.3-43.3176.1-59.50000111.8E325 V326 L331 Q332 Q333E325-S329 WeakPolarHBondContact O-CB 3.48Å; E325-S329 PolarHBondContact O-N 3Å; E325-S329 PolarHBondContact O-OG 3.32Å; V326-S329 PolarHBondContact O-N 3.36Å; S329-L331 PolarHBondContact O-N 2.76Å; S329-Q332 PolarHBondContact O-N 3.29Å; S329-Q333 PolarHBondContact O-N 3.33Å
330A95.9Very high94.8Very high53 Ų5398.4 Ų98.444%0.43850%0.502SS..Hα-helixtrans-66.5-33.5176.400000113.2V326 T327 K328 K334V326-A330 PolarHBondContact O-N 2.97Å; T327-A330 PolarHBondContact O-N 3.4Å; K328-A330 PolarHBondContact O-N 2.94Å; A330-K334 WeakPolarHBondContact O-CG 3.19Å; A330-K334 PolarHBondContact O-N 3.19Å
331L94.4Very high94.9Very high109 Ų10995 Ų9557%0.57149%0.494SS*.Hα-helixtrans-70.3-41.2173-74.4168.2000111.9T327 K328 S329 Q333 K334 M335T327-L331 WeakPolarHBondContact O-CB 3.44Å; T327-L331 WeakPolarHBondContact O-CG 3.41Å; T327-L331 PolarHBondContact O-N 2.81Å; K328-L331 PolarHBondContact O-N 2.66Å; S329-L331 PolarHBondContact O-N 2.76Å; L331-Q333 PolarHBondContact O-N 3.07Å; L331-K334 PolarHBondContact O-N 3.44Å; L331-M335 WeakPolarHBondContact O-CG 3.43Å; L331-M335 PolarHBondContact O-N 2.96Å
332Q95.4Very high95.2Very high111 Ų11193.8 Ų93.852%0.51949%0.485SS..Hα-helixtrans-61.5-41.7175.6-74.7175.1-19.400111.9K328 S329 M335 L336K328-Q332 WeakPolarHBondContact O-CG 3.37Å; K328-Q332 PolarHBondContact O-N 3.08Å; S329-Q332 PolarHBondContact O-N 3.29Å; Q332-M335 PolarHBondContact O-N 3.48Å; Q332-L336 PolarHBondContact O-N 2.95Å; Q332-L336 VanDerWaalsContact O-N 3.16Å
333Q96.9Very high95.4Very high102 Ų10290.4 Ų90.448%0.47747%0.471SS..Hα-helixtrans-60.7-49.1173.1-17559.453.300111.3S329 L331 M335 L336 D337S329-Q333 PolarHBondContact O-N 3.33Å; L331-Q333 PolarHBondContact O-N 3.07Å; Q333-M335 VanDerWaalsContact C-N 3.28Å; Q333-M335 PolarHBondContact O-N 2.94Å; Q333-L336 WeakPolarHBondContact O-CA 3.3Å; Q333-L336 WeakPolarHBondContact O-CB 3.48Å; Q333-L336 PolarHBondContact O-N 3.37Å; Q333-D337 PolarHBondContact NE2-OD1 2.97Å; Q333-D337 PolarHBondContact O-N 3.49Å
334K96.4Very high95.5Very high132 Ų13291.7 Ų91.757%0.57447%0.472SS*.Hα-helixtrans-59.3-35.5177.4-75.8-177.7176.8-173.60113.6A330 L331 D337 I338A330-K334 WeakPolarHBondContact O-CG 3.19Å; A330-K334 PolarHBondContact O-N 3.19Å; L331-K334 PolarHBondContact O-N 3.44Å; K334-D337 PolarHBondContact O-N 3.13Å; K334-I338 WeakPolarHBondContact O-CB 3.49Å; K334-I338 WeakPolarHBondContact O-CD1 3.35Å; K334-I338 VanDerWaalsContact O-CG1 3.23Å; K334-I338 WeakPolarHBondContact O-CG1 3.19Å; K334-I338 PolarHBondContact O-N 3.47Å
335M96.3Very high95.5Very high135 Ų13593.8 Ų93.867%0.66548%0.478SS*.Hα-helixtrans-63.6-41.6173.9-73.9177.563.300111.7L331 Q332 Q333 E339L331-M335 WeakPolarHBondContact O-CG 3.43Å; L331-M335 PolarHBondContact O-N 2.96Å; Q332-M335 PolarHBondContact O-N 3.48Å; Q333-M335 VanDerWaalsContact C-N 3.28Å; Q333-M335 PolarHBondContact O-N 2.94Å; M335-E339 WeakPolarHBondContact O-CB 3.32Å; M335-E339 PolarHBondContact O-N 2.91Å
336L96Very high95.6Very high94 Ų9496.3 Ų96.349%0.49248%0.484SS..Hα-helixtrans-65.9-42.1175.5-179.162.1000111.7Q332 Q333 E339 N340Q332-L336 PolarHBondContact O-N 2.95Å; Q332-L336 VanDerWaalsContact O-N 3.16Å; Q333-L336 WeakPolarHBondContact O-CA 3.3Å; Q333-L336 WeakPolarHBondContact O-CB 3.48Å; Q333-L336 PolarHBondContact O-N 3.37Å; L336-E339 PolarHBondContact O-N 3.39Å; L336-N340 PolarHBondContact O-N 2.95Å; L336-N340 PolarHBondContact O-ND2 3.12Å
337D95.9Very high95.6Very high66 Ų6697.8 Ų97.835%0.35348%0.482SS..Hα-helixtrans-60.9-46.4177.6-58.2-29.4000111.2Q333 K334 E339 N340 E341Q333-D337 PolarHBondContact NE2-OD1 2.97Å; Q333-D337 PolarHBondContact O-N 3.49Å; K334-D337 PolarHBondContact O-N 3.13Å; D337-E339 VanDerWaalsContact C-N 3.34Å; D337-E339 PolarHBondContact O-N 3.08Å; D337-N340 WeakPolarHBondContact O-CB 3.47Å; D337-N340 PolarHBondContact O-N 2.75Å; D337-E341 PolarHBondContact O-N 3.43Å
338I96Very high95.7Very high103 Ų10398.5 Ų98.553%0.52848%0.481SS..Hα-helixtrans-63.9-36.9176.3-69.2165.5000111.7K334 K342K334-I338 WeakPolarHBondContact O-CB 3.49Å; K334-I338 WeakPolarHBondContact O-CD1 3.35Å; K334-I338 VanDerWaalsContact O-CG1 3.23Å; K334-I338 WeakPolarHBondContact O-CG1 3.19Å; K334-I338 PolarHBondContact O-N 3.47Å; I338-K342 VanDerWaalsContact O-CB 3.22Å; I338-K342 WeakPolarHBondContact O-CB 3.41Å; I338-K342 PolarHBondContact O-N 3.07Å
339E96.5Very high95.7Very high88 Ų88100 Ų10041%0.41149%0.487SS..Hα-helixtrans-63.4-42.4175.2-163.465.5-156.300111.2M335 L336 D337 K342 D343M335-E339 WeakPolarHBondContact O-CB 3.32Å; M335-E339 PolarHBondContact O-N 2.91Å; L336-E339 PolarHBondContact O-N 3.39Å; D337-E339 VanDerWaalsContact C-N 3.34Å; D337-E339 PolarHBondContact O-N 3.08Å; E339-K342 VanDerWaalsContact CD-CE 3.5Å; E339-K342 PolarHBondContact O-N 3.46Å; E339-K342 WeakPolarHBondContact OE1-CE 3.33Å; E339-K342 IonicContact OE1-NZ 2.78Å; E339-K342 PolarHBondContact OE1-NZ 2.81Å; E339-K342 WeakPolarHBondContact OE2-CE 3.38Å; E339-K342 IonicContact OE2-NZ 3.79Å; E339-K342 PolarHBondContact OE2-NZ 2.98Å; E339-D343 PolarHBondContact O-N 3.22Å; E339-D343 VanDerWaalsContact O-N 3.11Å
340N95.4Very high95.6Very high95 Ų9598.3 Ų98.351%0.50848%0.48SS..Hα-helixtrans-66-45.1176.1-69.9-46.5000112.5L336 D337 D343 L344L336-N340 PolarHBondContact O-N 2.95Å; L336-N340 PolarHBondContact O-ND2 3.12Å; D337-N340 WeakPolarHBondContact O-CB 3.47Å; D337-N340 PolarHBondContact O-N 2.75Å; N340-D343 PolarHBondContact O-N 2.9Å; N340-L344 PolarHBondContact O-N 3.4Å
341E96.6Very high95.4Very high115 Ų115103.3 Ų103.354%0.53749%0.488SS..Hα-helixtrans-60.6-44.6175.4-75.3-173.6171.200111.5D337 D343 L344 F345D337-E341 PolarHBondContact O-N 3.43Å; E341-D343 VanDerWaalsContact C-N 3.28Å; E341-D343 PolarHBondContact O-N 2.86Å; E341-L344 WeakPolarHBondContact O-CB 3.26Å; E341-L344 PolarHBondContact O-N 3.46Å; E341-L344 VanDerWaalsContact O-N 3.08Å; E341-F345 HydrophobicContact CB-CE2 4.39Å; E341-F345 WeakPolarHBondContact O-CD2 3.31Å; E341-F345 PolarHBondContact O-N 2.84Å
342K96.3Very high95.4Very high74 Ų74103.5 Ų103.532%0.32249%0.489SS..Hα-helixtrans-58.4-39.6176.3-177.3-176.970.2-173.50112I338 E339 F345 R346I338-K342 VanDerWaalsContact O-CB 3.22Å; I338-K342 WeakPolarHBondContact O-CB 3.41Å; I338-K342 PolarHBondContact O-N 3.07Å; E339-K342 VanDerWaalsContact CD-CE 3.5Å; E339-K342 PolarHBondContact O-N 3.46Å; E339-K342 WeakPolarHBondContact OE1-CE 3.33Å; E339-K342 IonicContact OE1-NZ 2.78Å; E339-K342 PolarHBondContact OE1-NZ 2.81Å; E339-K342 WeakPolarHBondContact OE2-CE 3.38Å; E339-K342 IonicContact OE2-NZ 3.79Å; E339-K342 PolarHBondContact OE2-NZ 2.98Å; K342-F345 PolarHBondContact O-N 2.96Å; K342-R346 WeakPolarHBondContact O-CB 3.17Å; K342-R346 WeakPolarHBondContact O-CD 3.47Å; K342-R346 VanDerWaalsContact O-CG 3.24Å; K342-R346 WeakPolarHBondContact O-CG 3.19Å; K342-R346 PolarHBondContact O-N 2.7Å
343D96.3Very high95.3Very high64 Ų64101.5 Ų101.534%0.34248%0.482SS..Hα-helixtrans-73-26.9175.5-90.65.3000113.8E339 N340 E341 R346 K347E339-D343 PolarHBondContact O-N 3.22Å; E339-D343 VanDerWaalsContact O-N 3.11Å; N340-D343 PolarHBondContact O-N 2.9Å; E341-D343 VanDerWaalsContact C-N 3.28Å; E341-D343 PolarHBondContact O-N 2.86Å; D343-R346 WeakPolarHBondContact OD1-CD 3.48Å; D343-R346 IonicContact OD1-CZ 3.88Å; D343-R346 IonicContact OD1-NE 3.71Å; D343-R346 IonicContact OD1-NH1 3.85Å; D343-R346 PolarHBondContact OD1-NH1 3.02Å; D343-K347 WeakPolarHBondContact O-CD 3.4Å; D343-K347 VanDerWaalsContact O-CG 3.31Å; D343-K347 WeakPolarHBondContact O-CG 3.33Å; D343-K347 PolarHBondContact O-N 3.32Å
344L96.3Very high95.2Very high97 Ų97102.8 Ų102.851%0.50849%0.488SS..Hα-helixtrans-69.4-47168.1-177.761000111.1N340 E341 R346 K347 Q348N340-L344 PolarHBondContact O-N 3.4Å; E341-L344 WeakPolarHBondContact O-CB 3.26Å; E341-L344 PolarHBondContact O-N 3.46Å; E341-L344 VanDerWaalsContact O-N 3.08Å; L344-R346 VanDerWaalsContact C-N 3.33Å; L344-R346 PolarHBondContact O-N 3.43Å; L344-K347 PolarHBondContact O-N 2.83Å; L344-K347 VanDerWaalsContact O-N 3.17Å; L344-Q348 WeakPolarHBondContact O-CG 3.48Å; L344-Q348 PolarHBondContact O-N 3.19Å
345F94.7Very high94.9Very high127 Ų127100 Ų10056%0.55748%0.477SS*.Hα-helixtrans-61.6-38.1176.1-75.3-60.7000112.6E341 K342 K347 Q348 K349E341-F345 HydrophobicContact CB-CE2 4.39Å; E341-F345 WeakPolarHBondContact O-CD2 3.31Å; E341-F345 PolarHBondContact O-N 2.84Å; K342-F345 PolarHBondContact O-N 2.96Å; F345-K347 PolarHBondContact O-N 2.68Å; F345-Q348 PolarHBondContact O-N 3.1Å; F345-K349 WeakPolarHBondContact O-CB 3.48Å; F345-K349 PolarHBondContact O-N 2.9Å
346R94.8Very high94.7Very high140 Ų14098.6 Ų98.653%0.52847%0.472SS..Hα-helixtrans-57.7-44.8172.6-78.6161.3167176.9-4.7112K342 D343 L344 K349 G350K342-R346 WeakPolarHBondContact O-CB 3.17Å; K342-R346 WeakPolarHBondContact O-CD 3.47Å; K342-R346 VanDerWaalsContact O-CG 3.24Å; K342-R346 WeakPolarHBondContact O-CG 3.19Å; K342-R346 PolarHBondContact O-N 2.7Å; D343-R346 WeakPolarHBondContact OD1-CD 3.48Å; D343-R346 IonicContact OD1-CZ 3.88Å; D343-R346 IonicContact OD1-NE 3.71Å; D343-R346 IonicContact OD1-NH1 3.85Å; D343-R346 PolarHBondContact OD1-NH1 3.02Å; L344-R346 VanDerWaalsContact C-N 3.33Å; L344-R346 PolarHBondContact O-N 3.43Å; R346-K349 PolarHBondContact O-N 2.98Å; R346-G350 PolarHBondContact O-N 2.95Å; R346-G350 VanDerWaalsContact O-N 3.08Å
347K96.6Very high94.7Very high127 Ų12798.5 Ų98.555%0.55247%0.472SS*.Hα-helixtrans-66.7-45.4177.2-68.5161.8-171.1164.50111.7D343 L344 F345 K349 G350 Y351D343-K347 WeakPolarHBondContact O-CD 3.4Å; D343-K347 VanDerWaalsContact O-CG 3.31Å; D343-K347 WeakPolarHBondContact O-CG 3.33Å; D343-K347 PolarHBondContact O-N 3.32Å; L344-K347 PolarHBondContact O-N 2.83Å; L344-K347 VanDerWaalsContact O-N 3.17Å; F345-K347 PolarHBondContact O-N 2.68Å; K347-K349 VanDerWaalsContact C-N 3.32Å; K347-K349 PolarHBondContact O-N 3.13Å; K347-G350 PolarHBondContact O-N 2.95Å; K347-G350 VanDerWaalsContact O-N 3.14Å; K347-Y351 HydrophobicContact CB-CE2 4.44Å; K347-Y351 WeakPolarHBondContact O-CD2 3.24Å; K347-Y351 PolarHBondContact O-N 3.47Å; K347-Y351 VanDerWaalsContact O-N 3.13Å
348Q94Very high94.7Very high90 Ų90101.4 Ų101.442%0.42148%0.482SS..Hα-helixtrans-59.1-41.4175.8-71.7176-7.900112.2L344 F345 Y351 L352L344-Q348 WeakPolarHBondContact O-CG 3.48Å; L344-Q348 PolarHBondContact O-N 3.19Å; F345-Q348 PolarHBondContact O-N 3.1Å; Q348-Y351 PolarHBondContact O-N 2.88Å; Q348-L352 WeakPolarHBondContact O-CG 3.4Å; Q348-L352 PolarHBondContact O-N 3.46Å
349K93.1Very high94.4Very high118 Ų118102.2 Ų102.251%0.51348%0.478SS..Hα-helixtrans-61.2-45.5173.5-168-160.5177.5-60.40111.4F345 R346 K347 Y351 L352 D353F345-K349 WeakPolarHBondContact O-CB 3.48Å; F345-K349 PolarHBondContact O-N 2.9Å; R346-K349 PolarHBondContact O-N 2.98Å; K347-K349 VanDerWaalsContact C-N 3.32Å; K347-K349 PolarHBondContact O-N 3.13Å; K349-Y351 PolarHBondContact O-N 3.44Å; K349-L352 WeakPolarHBondContact O-CB 3.25Å; K349-L352 PolarHBondContact O-N 3.08Å; K349-D353 IonicContact NZ-OD1 3.05Å; K349-D353 PolarHBondContact NZ-OD1 2.88Å; K349-D353 IonicContact NZ-OD2 3.79Å; K349-D353 PolarHBondContact NZ-OD2 3.38Å; K349-D353 VanDerWaalsContact O-CG 3.28Å; K349-D353 PolarHBondContact O-N 3.35Å
350G92.9Very high94.3Very high25 Ų25103.7 Ų103.726%0.25848%0.483SS..Hα-helixtrans-53.8-50177.400000112.8R346 K347 L352 D353 E354R346-G350 PolarHBondContact O-N 2.95Å; R346-G350 VanDerWaalsContact O-N 3.08Å; K347-G350 PolarHBondContact O-N 2.95Å; K347-G350 VanDerWaalsContact O-N 3.14Å; G350-L352 VanDerWaalsContact C-N 3.28Å; G350-L352 PolarHBondContact O-N 3.42Å; G350-D353 PolarHBondContact O-N 3.5Å; G350-E354 WeakPolarHBondContact O-CG 3.32Å; G350-E354 PolarHBondContact O-N 3.13Å
351Y93.7Very high94.3Very high158 Ų158105.1 Ų105.162%0.6249%0.487SS*.Hα-helixtrans-62.5-31.8176.6-61.5-51.8000113.7K347 Q348 K349 E355K347-Y351 HydrophobicContact CB-CE2 4.44Å; K347-Y351 WeakPolarHBondContact O-CD2 3.24Å; K347-Y351 PolarHBondContact O-N 3.47Å; K347-Y351 VanDerWaalsContact O-N 3.13Å; Q348-Y351 PolarHBondContact O-N 2.88Å; K349-Y351 PolarHBondContact O-N 3.44Å; Y351-E355 VanDerWaalsContact O-CB 3.32Å; Y351-E355 WeakPolarHBondContact O-CB 3.38Å; Y351-E355 PolarHBondContact O-N 3.17Å; Y351-E355 VanDerWaalsContact O-N 3.1Å
352L93.4Very high94Very high113 Ų113102.6 Ų102.659%0.59248%0.482SS*.Hα-helixtrans-74.3-36.8175.3-70.2171.5000112.3Q348 K349 G350 L356Q348-L352 WeakPolarHBondContact O-CG 3.4Å; Q348-L352 PolarHBondContact O-N 3.46Å; K349-L352 WeakPolarHBondContact O-CB 3.25Å; K349-L352 PolarHBondContact O-N 3.08Å; G350-L352 VanDerWaalsContact C-N 3.28Å; G350-L352 PolarHBondContact O-N 3.42Å; L352-L356 WeakPolarHBondContact O-CB 3.19Å; L352-L356 VanDerWaalsContact O-CG 3.23Å; L352-L356 WeakPolarHBondContact O-CG 3.16Å; L352-L356 PolarHBondContact O-N 3.41Å
353D92.8Very high93.8Very high69 Ų69104.4 Ų104.437%0.36949%0.492SS..Hα-helixtrans-64.5-46.8173.3-61.4-35.2000110.2K349 G350 E355 L356 D357K349-D353 IonicContact NZ-OD1 3.05Å; K349-D353 PolarHBondContact NZ-OD1 2.88Å; K349-D353 IonicContact NZ-OD2 3.79Å; K349-D353 PolarHBondContact NZ-OD2 3.38Å; K349-D353 VanDerWaalsContact O-CG 3.28Å; K349-D353 PolarHBondContact O-N 3.35Å; G350-D353 PolarHBondContact O-N 3.5Å; D353-E355 PolarHBondContact O-N 2.87Å; D353-L356 PolarHBondContact O-N 3.41Å; D353-D357 PolarHBondContact O-N 3.14Å
354E94.4Very high93.8Very high128 Ų128105.3 Ų105.360%0.59850%0.498SS*.Hα-helixtrans-58.3-46.3176.9-73.6171.3-178.300112.5G350 L356 D357 F358G350-E354 WeakPolarHBondContact O-CG 3.32Å; G350-E354 PolarHBondContact O-N 3.13Å; E354-L356 VanDerWaalsContact C-N 3.34Å; E354-L356 PolarHBondContact O-N 3.48Å; E354-D357 PolarHBondContact O-N 2.92Å; E354-F358 PolarHBondContact O-N 3.06Å
355E91.9Very high93.6Very high74 Ų74107.5 Ų107.535%0.34651%0.505SS..Hα-helixtrans-68.8-30.7178.1176.564.7-162.900112.4Y351 D353 R359Y351-E355 VanDerWaalsContact O-CB 3.32Å; Y351-E355 WeakPolarHBondContact O-CB 3.38Å; Y351-E355 PolarHBondContact O-N 3.17Å; Y351-E355 VanDerWaalsContact O-N 3.1Å; D353-E355 PolarHBondContact O-N 2.87Å; E355-R359 VanDerWaalsContact CD-NH2 3.32Å; E355-R359 VanDerWaalsContact O-CG 3.3Å; E355-R359 WeakPolarHBondContact O-CG 3.23Å; E355-R359 PolarHBondContact O-N 3.06Å; E355-R359 IonicContact OE1-CZ 2.73Å; E355-R359 IonicContact OE1-NE 3.88Å; E355-R359 PolarHBondContact OE1-NE 2.97Å; E355-R359 IonicContact OE1-NH2 3.82Å; E355-R359 PolarHBondContact OE1-NH2 2.93Å
356L92.1Very high93.4Very high105 Ų105103.9 Ų103.955%0.5550%0.499SS..Hα-helixtrans-68.9-44.1172.4-77.9169.4000111.5L352 D353 E354 F358 R359 K360L352-L356 WeakPolarHBondContact O-CB 3.19Å; L352-L356 VanDerWaalsContact O-CG 3.23Å; L352-L356 WeakPolarHBondContact O-CG 3.16Å; L352-L356 PolarHBondContact O-N 3.41Å; D353-L356 PolarHBondContact O-N 3.41Å; E354-L356 VanDerWaalsContact C-N 3.34Å; E354-L356 PolarHBondContact O-N 3.48Å; L356-F358 VanDerWaalsContact C-N 3.34Å; L356-R359 PolarHBondContact O-N 3.1Å; L356-K360 WeakPolarHBondContact O-CB 3.42Å; L356-K360 PolarHBondContact O-N 3.21Å
357D96.1Very high93.1Very high93 Ų93102 Ų10250%0.49750%0.495SS..Hα-helixtrans-64.5-37.4175.3-91-21.2000111.9D353 E354 K360 Q361D353-D357 PolarHBondContact O-N 3.14Å; E354-D357 PolarHBondContact O-N 2.92Å; D357-K360 PolarHBondContact O-N 3.5Å; D357-Q361 WeakPolarHBondContact O-CB 3.38Å; D357-Q361 VanDerWaalsContact O-CG 3.27Å; D357-Q361 WeakPolarHBondContact O-CG 3.43Å; D357-Q361 PolarHBondContact O-N 3.48Å; D357-Q361 PolarHBondContact O-NE2 3.19Å
358F94.7Very high93Very high127 Ų127102 Ų10256%0.55750%0.495SS*.Hα-helixtrans-62.3-48.2173.3178.2-103.7000112.2E354 L356 K360 Q361 S362E354-F358 PolarHBondContact O-N 3.06Å; L356-F358 VanDerWaalsContact C-N 3.34Å; F358-K360 VanDerWaalsContact C-N 3.3Å; F358-K360 PolarHBondContact O-N 3.22Å; F358-Q361 PolarHBondContact O-N 3.28Å; F358-S362 PolarHBondContact O-N 3.31Å
359R90.6Very high93Very high119 Ų119103.1 Ų103.145%0.44950%0.496SS..Hα-helixtrans-62.5-37.8177.1-72.5173.7-169.1152.14.2112.2E355 L356 S362 M363E355-R359 VanDerWaalsContact CD-NH2 3.32Å; E355-R359 VanDerWaalsContact O-CG 3.3Å; E355-R359 WeakPolarHBondContact O-CG 3.23Å; E355-R359 PolarHBondContact O-N 3.06Å; E355-R359 IonicContact OE1-CZ 2.73Å; E355-R359 IonicContact OE1-NE 3.88Å; E355-R359 PolarHBondContact OE1-NE 2.97Å; E355-R359 IonicContact OE1-NH2 3.82Å; E355-R359 PolarHBondContact OE1-NH2 2.93Å; L356-R359 PolarHBondContact O-N 3.1Å; R359-S362 PolarHBondContact O-N 2.93Å; R359-M363 WeakPolarHBondContact O-CB 3.5Å; R359-M363 PolarHBondContact O-N 3.37Å
360K93.9Very high92.9Very high120 Ų120101.6 Ų101.652%0.52249%0.492SS..Hα-helixtrans-63.1-49.2174.3-176.8-176.6172.3-169.80111.4L356 D357 F358 S362 M363 D364L356-K360 WeakPolarHBondContact O-CB 3.42Å; L356-K360 PolarHBondContact O-N 3.21Å; D357-K360 PolarHBondContact O-N 3.5Å; F358-K360 VanDerWaalsContact C-N 3.3Å; F358-K360 PolarHBondContact O-N 3.22Å; K360-S362 VanDerWaalsContact C-N 3.3Å; K360-S362 PolarHBondContact O-N 2.93Å; K360-M363 WeakPolarHBondContact O-CB 3.2Å; K360-M363 PolarHBondContact O-N 2.94Å; K360-M363 VanDerWaalsContact O-N 3.13Å; K360-D364 PolarHBondContact O-N 3.36Å
361Q94.3Very high92.9Very high125 Ų125105.8 Ų105.858%0.58451%0.509SS*.Hα-helixtrans-58.7-40.8176.1-72.7170.253.400112.2D357 F358 D364 Q365D357-Q361 WeakPolarHBondContact O-CB 3.38Å; D357-Q361 VanDerWaalsContact O-CG 3.27Å; D357-Q361 WeakPolarHBondContact O-CG 3.43Å; D357-Q361 PolarHBondContact O-N 3.48Å; D357-Q361 PolarHBondContact O-NE2 3.19Å; F358-Q361 PolarHBondContact O-N 3.28Å; Q361-D364 PolarHBondContact O-N 2.93Å; Q361-Q365 VanDerWaalsContact O-CB 3.31Å; Q361-Q365 WeakPolarHBondContact O-CB 3.41Å; Q361-Q365 PolarHBondContact O-N 2.63Å
362S91.8Very high93Very high62 Ų62101.5 Ų101.543%0.43449%0.494SS..Hα-helixtrans-63.5-41.3175.2-174.30000112.3F358 R359 K360 Q365 A366F358-S362 PolarHBondContact O-N 3.31Å; R359-S362 PolarHBondContact O-N 2.93Å; K360-S362 VanDerWaalsContact C-N 3.3Å; K360-S362 PolarHBondContact O-N 2.93Å; S362-Q365 PolarHBondContact O-N 3.4Å; S362-A366 WeakPolarHBondContact O-CB 3.41Å; S362-A366 PolarHBondContact O-N 3.43Å
363M91.1Very high93Very high111 Ų11199.8 Ų99.855%0.54749%0.485SS..Hα-helixtrans-66.1-45.3175.5-168.9-167.9-5800112.1R359 K360 Q365 A366 H367R359-M363 WeakPolarHBondContact O-CB 3.5Å; R359-M363 PolarHBondContact O-N 3.37Å; K360-M363 WeakPolarHBondContact O-CB 3.2Å; K360-M363 PolarHBondContact O-N 2.94Å; K360-M363 VanDerWaalsContact O-N 3.13Å; M363-Q365 VanDerWaalsContact C-N 3.31Å; M363-Q365 PolarHBondContact O-N 3.37Å; M363-A366 WeakPolarHBondContact O-CB 3.35Å; M363-A366 PolarHBondContact O-N 2.91Å; M363-A366 VanDerWaalsContact O-N 3.16Å; M363-H367 VanDerWaalsContact CG-CE1 3.49Å; M363-H367 WeakPolarHBondContact CG-CE1 3.31Å; M363-H367 PolarHBondContact O-N 3.46Å; M363-H367 PolarHBondContact O-ND1 2.84Å
364D95.8Very high92.7Very high84 Ų84101.6 Ų101.645%0.44949%0.491SS..Hα-helixtrans-63.3-37.6177-70.2-25.1000111.3K360 Q361 K368K360-D364 PolarHBondContact O-N 3.36Å; Q361-D364 PolarHBondContact O-N 2.93Å; D364-K368 WeakPolarHBondContact O-CB 3.38Å; D364-K368 PolarHBondContact O-N 3.29Å
365Q93.8Very high92.6Very high142 Ų14297.8 Ų97.866%0.66448%0.482SS*.Hα-helixtrans-65-41172.4-173.6179.812.300112.1Q361 S362 M363 K368 R369Q361-Q365 VanDerWaalsContact O-CB 3.31Å; Q361-Q365 WeakPolarHBondContact O-CB 3.41Å; Q361-Q365 PolarHBondContact O-N 2.63Å; S362-Q365 PolarHBondContact O-N 3.4Å; M363-Q365 VanDerWaalsContact C-N 3.31Å; M363-Q365 PolarHBondContact O-N 3.37Å; Q365-K368 PolarHBondContact O-N 2.76Å; Q365-R369 WeakPolarHBondContact O-CB 3.27Å; Q365-R369 PolarHBondContact O-N 2.73Å
366A89.3Confident92.6Very high51 Ų5198.6 Ų98.642%0.42149%0.487SS..Hα-helixtrans-65.4-46.3176.200000111.8S362 M363 K368 R369 I370S362-A366 WeakPolarHBondContact O-CB 3.41Å; S362-A366 PolarHBondContact O-N 3.43Å; M363-A366 WeakPolarHBondContact O-CB 3.35Å; M363-A366 PolarHBondContact O-N 2.91Å; M363-A366 VanDerWaalsContact O-N 3.16Å; A366-K368 PolarHBondContact O-N 2.77Å; A366-R369 PolarHBondContact O-N 3.34Å; A366-R369 VanDerWaalsContact O-N 3.12Å; A366-I370 WeakPolarHBondContact O-CG1 3.35Å; A366-I370 PolarHBondContact O-N 3.18Å
367H89.3Confident92.4Very high100 Ų10098.9 Ų98.946%0.46349%0.488SS..Hα-helixtrans-59.3-45.1174.1-69.7140.1000112.1M363 R369 I370 L371M363-H367 VanDerWaalsContact CG-CE1 3.49Å; M363-H367 WeakPolarHBondContact CG-CE1 3.31Å; M363-H367 PolarHBondContact O-N 3.46Å; M363-H367 PolarHBondContact O-ND1 2.84Å; H367-R369 VanDerWaalsContact C-N 3.28Å; H367-R369 PolarHBondContact O-N 2.86Å; H367-I370 PolarHBondContact O-N 3.37Å; H367-L371 WeakPolarHBondContact O-CG 3.49Å; H367-L371 PolarHBondContact O-N 3.49Å
368K94.9Very high92Very high127 Ų127101 Ų10155%0.55249%0.493SS*.Hα-helixtrans-57.6-42.1173.6-177.5175.8-177.3-830111.5D364 Q365 A366 L371 E372D364-K368 WeakPolarHBondContact O-CB 3.38Å; D364-K368 PolarHBondContact O-N 3.29Å; Q365-K368 PolarHBondContact O-N 2.76Å; A366-K368 PolarHBondContact O-N 2.77Å; K368-L371 PolarHBondContact O-N 3.26Å; K368-E372 IonicContact NZ-OE1 2.64Å; K368-E372 PolarHBondContact NZ-OE1 2.88Å; K368-E372 WeakPolarHBondContact O-CG 3.26Å; K368-E372 PolarHBondContact O-N 2.78Å
369R93Very high91.7Very high115 Ų115100.3 Ų100.343%0.43449%0.492SS..Hα-helixtrans-69.6-32.1-179.9-173.856-171.7157.26.2113Q365 A366 H367 E372 L373Q365-R369 WeakPolarHBondContact O-CB 3.27Å; Q365-R369 PolarHBondContact O-N 2.73Å; A366-R369 PolarHBondContact O-N 3.34Å; A366-R369 VanDerWaalsContact O-N 3.12Å; H367-R369 VanDerWaalsContact C-N 3.28Å; H367-R369 PolarHBondContact O-N 2.86Å; R369-E372 WeakPolarHBondContact CD-OE2 3.49Å; R369-E372 IonicContact CZ-OE2 2.76Å; R369-E372 IonicContact NE-OE2 3.61Å; R369-E372 IonicContact NH1-OE2 2.69Å; R369-E372 PolarHBondContact NH1-OE2 3.43Å; R369-L373 HydrophobicContact CG-CD1 4.25Å; R369-L373 WeakPolarHBondContact O-CD1 3.45Å; R369-L373 VanDerWaalsContact O-CG 3.29Å; R369-L373 WeakPolarHBondContact O-CG 3.33Å; R369-L373 PolarHBondContact O-N 2.79Å
370I90.6Very high91.3Very high85 Ų8597.2 Ų97.244%0.43649%0.492SS..Hα-helixtrans-63.1-50.7171.1-68.9164.5000109.8A366 H367 E372 L373 E374A366-I370 WeakPolarHBondContact O-CG1 3.35Å; A366-I370 PolarHBondContact O-N 3.18Å; H367-I370 PolarHBondContact O-N 3.37Å; I370-E372 VanDerWaalsContact C-N 3.31Å; I370-E372 PolarHBondContact O-N 3.48Å; I370-L373 WeakPolarHBondContact O-CA 3.38Å; I370-L373 WeakPolarHBondContact O-CB 3.24Å; I370-L373 PolarHBondContact O-N 2.82Å; I370-E374 HydrophobicContact CG2-CG 4.25Å; I370-E374 WeakPolarHBondContact O-CG 3.25Å; I370-E374 PolarHBondContact O-N 3.28Å
371L93.6Very high90.6Very high114 Ų11496 Ų9660%0.59749%0.491SS*.Hα-helixtrans-59.7-37.9178.1-67.8168.1000112.8H367 K368 A375H367-L371 WeakPolarHBondContact O-CG 3.49Å; H367-L371 PolarHBondContact O-N 3.49Å; K368-L371 PolarHBondContact O-N 3.26Å; L371-A375 WeakPolarHBondContact O-CB 3.34Å; L371-A375 PolarHBondContact O-N 2.86Å
372E95.2Very high89.8Confident67 Ų6795 Ų9531%0.31349%0.486SS..Hα-helixtrans-62.4-41.8171.9-73.7170.9-171.700112.5K368 R369 I370 M376K368-E372 IonicContact NZ-OE1 2.64Å; K368-E372 PolarHBondContact NZ-OE1 2.88Å; K368-E372 WeakPolarHBondContact O-CG 3.26Å; K368-E372 PolarHBondContact O-N 2.78Å; R369-E372 WeakPolarHBondContact CD-OE2 3.49Å; R369-E372 IonicContact CZ-OE2 2.76Å; R369-E372 IonicContact NE-OE2 3.61Å; R369-E372 IonicContact NH1-OE2 2.69Å; R369-E372 PolarHBondContact NH1-OE2 3.43Å; I370-E372 VanDerWaalsContact C-N 3.31Å; I370-E372 PolarHBondContact O-N 3.48Å; E372-M376 WeakPolarHBondContact O-CE 3.37Å; E372-M376 WeakPolarHBondContact O-CG 3.39Å; E372-M376 PolarHBondContact O-N 3.14Å; E372-M376 VanDerWaalsContact O-N 3.08Å
373L93.1Very high88.9Confident77 Ų7798.5 Ų98.540%0.40350%0.495SS..Hα-helixtrans-68.7-42177.8-74.2162.6000111.7R369 I370 M376 L377R369-L373 HydrophobicContact CG-CD1 4.25Å; R369-L373 WeakPolarHBondContact O-CD1 3.45Å; R369-L373 VanDerWaalsContact O-CG 3.29Å; R369-L373 WeakPolarHBondContact O-CG 3.33Å; R369-L373 PolarHBondContact O-N 2.79Å; I370-L373 WeakPolarHBondContact O-CA 3.38Å; I370-L373 WeakPolarHBondContact O-CB 3.24Å; I370-L373 PolarHBondContact O-N 2.82Å; L373-M376 HydrophobicContact CD2-CE 3.82Å; L373-M376 HydrophobicContact CG-CE 4.31Å; L373-M376 PolarHBondContact O-N 3.08Å; L373-L377 WeakPolarHBondContact O-CB 3.41Å; L373-L377 VanDerWaalsContact O-CG 3.27Å; L373-L377 WeakPolarHBondContact O-CG 3.23Å; L373-L377 PolarHBondContact O-N 3.46Å
374E88.4Confident87.7Confident107 Ų10795.3 Ų95.350%0.548%0.479SS..Hα-helixtrans-62.2-43175.6-71.4174.7162.300111.5I370 L377 F378I370-E374 HydrophobicContact CG2-CG 4.25Å; I370-E374 WeakPolarHBondContact O-CG 3.25Å; I370-E374 PolarHBondContact O-N 3.28Å; E374-L377 PolarHBondContact O-N 2.86Å; E374-F378 WeakPolarHBondContact O-CB 3.45Å; E374-F378 PolarHBondContact O-N 2.93Å
375A90.6Very high86.1Confident49 Ų4996.3 Ų96.341%0.40548%0.481SS..Hα-helixtrans-61.3-48.7174.400000112L371 L377 F378 E379L371-A375 WeakPolarHBondContact O-CB 3.34Å; L371-A375 PolarHBondContact O-N 2.86Å; A375-L377 VanDerWaalsContact C-N 3.32Å; A375-L377 PolarHBondContact O-N 2.74Å; A375-F378 PolarHBondContact O-N 3.14Å; A375-E379 WeakPolarHBondContact O-CG 3.27Å; A375-E379 PolarHBondContact O-N 3.49Å
376M92.9Very high84.7Confident90 Ų9093.5 Ų93.544%0.44348%0.482SS..Hα-helixtrans-63.4-35.8177.5-71.1-176.9-60.800112.7E372 L373 A380E372-M376 WeakPolarHBondContact O-CE 3.37Å; E372-M376 WeakPolarHBondContact O-CG 3.39Å; E372-M376 PolarHBondContact O-N 3.14Å; E372-M376 VanDerWaalsContact O-N 3.08Å; L373-M376 HydrophobicContact CD2-CE 3.82Å; L373-M376 HydrophobicContact CG-CE 4.31Å; L373-M376 PolarHBondContact O-N 3.08Å; M376-A380 WeakPolarHBondContact O-CB 3.49Å; M376-A380 PolarHBondContact O-N 3.01Å
377L87.6Confident83.2Confident112 Ų11295.1 Ų95.159%0.58649%0.491SS*.Hα-helixtrans-66.4-41173.5-74.8168.1000111.6L373 E374 A375 A380 L381L373-L377 WeakPolarHBondContact O-CB 3.41Å; L373-L377 VanDerWaalsContact O-CG 3.27Å; L373-L377 WeakPolarHBondContact O-CG 3.23Å; L373-L377 PolarHBondContact O-N 3.46Å; E374-L377 PolarHBondContact O-N 2.86Å; A375-L377 VanDerWaalsContact C-N 3.32Å; A375-L377 PolarHBondContact O-N 2.74Å; L377-A380 PolarHBondContact O-N 2.94Å; L377-L381 WeakPolarHBondContact O-CB 3.44Å; L377-L381 VanDerWaalsContact O-CG 3.3Å; L377-L381 WeakPolarHBondContact O-CG 3.43Å; L377-L381 PolarHBondContact O-N 3.23Å
378F88.8Confident81.6Confident137 Ų13795.3 Ų95.360%0.60149%0.487SS*.Hα-helixtrans-68.9-34.8177.6-168-108.3000112.6E374 A375 Q382E374-F378 WeakPolarHBondContact O-CB 3.45Å; E374-F378 PolarHBondContact O-N 2.93Å; A375-F378 PolarHBondContact O-N 3.14Å; F378-Q382 VanDerWaalsContact CD1-NE2 3.26Å; F378-Q382 WeakPolarHBondContact O-CB 3.45Å; F378-Q382 WeakPolarHBondContact O-CG 3.47Å; F378-Q382 PolarHBondContact O-N 3.35Å; F378-Q382 VanDerWaalsContact O-N 3.08Å; F378-Q382 PolarHBondContact O-NE2 3.38Å
379E87.7Confident79.3Confident112 Ų11294.2 Ų94.252%0.52349%0.491SS..Hα-helixtrans-67.1-43.3170.1-74179.8-174.200112.1A375 Q382 Q383A375-E379 WeakPolarHBondContact O-CG 3.27Å; A375-E379 PolarHBondContact O-N 3.49Å; E379-Q382 PolarHBondContact O-N 3.01Å; E379-Q383 WeakPolarHBondContact O-CG 3.39Å; E379-Q383 PolarHBondContact O-N 3.25Å
380A82.8Confident77.3Confident55 Ų5595.5 Ų95.546%0.45552%0.515SS..Hα-helixtrans-62.9-42.9177.600000112.2M376 L377 Q383 E384M376-A380 WeakPolarHBondContact O-CB 3.49Å; M376-A380 PolarHBondContact O-N 3.01Å; L377-A380 PolarHBondContact O-N 2.94Å; A380-Q383 PolarHBondContact O-N 3.48Å; A380-E384 PolarHBondContact O-N 2.93Å
381L78.9Confident75.3Confident95 Ų9595.1 Ų95.150%0.49753%0.532SS..Hα-helixtrans-63.7-40.9174.6-71.9167.8000111.9L377 Q383 E384 E385L377-L381 WeakPolarHBondContact O-CB 3.44Å; L377-L381 VanDerWaalsContact O-CG 3.3Å; L377-L381 WeakPolarHBondContact O-CG 3.43Å; L377-L381 PolarHBondContact O-N 3.23Å; L381-Q383 VanDerWaalsContact C-N 3.31Å; L381-Q383 PolarHBondContact O-N 3Å; L381-E384 PolarHBondContact O-N 3.35Å; L381-E385 PolarHBondContact O-N 3.01Å
382Q77.6Confident73Confident104 Ų10496.2 Ų96.249%0.48654%0.537SS..Hα-helixtrans-64.5-32.8173-80.7179.292.400112.8F378 E379 E385 A386F378-Q382 VanDerWaalsContact CD1-NE2 3.26Å; F378-Q382 WeakPolarHBondContact O-CB 3.45Å; F378-Q382 WeakPolarHBondContact O-CG 3.47Å; F378-Q382 PolarHBondContact O-N 3.35Å; F378-Q382 VanDerWaalsContact O-N 3.08Å; F378-Q382 PolarHBondContact O-NE2 3.38Å; E379-Q382 PolarHBondContact O-N 3.01Å; Q382-E385 PolarHBondContact O-N 2.6Å; Q382-A386 WeakPolarHBondContact O-CB 3.22Å; Q382-A386 PolarHBondContact O-N 2.91Å
383Q73.1Confident70.5Confident134 Ų134100 Ų10063%0.62656%0.557SS**Hα-helixtrans-72.5-33.4174.5-71176.940.500112.5E379 A380 L381 E385 S387E379-Q383 WeakPolarHBondContact O-CG 3.39Å; E379-Q383 PolarHBondContact O-N 3.25Å; A380-Q383 PolarHBondContact O-N 3.48Å; L381-Q383 VanDerWaalsContact C-N 3.31Å; L381-Q383 PolarHBondContact O-N 3Å; Q383-E385 VanDerWaalsContact C-N 3.33Å; Q383-S387 VanDerWaalsContact O-CB 3.32Å; Q383-S387 WeakPolarHBondContact O-CB 3.44Å; Q383-S387 PolarHBondContact O-N 3.18Å; Q383-S387 PolarHBondContact O-OG 3.27Å
384E64.8Low68.2Low44 Ų44107.2 Ų107.221%0.20659%0.585CS.*Hα-helixtrans-62.6-39168-166.7-169.5151.400111.3A380 L381 S387 R398 L399A380-E384 PolarHBondContact O-N 2.93Å; L381-E384 PolarHBondContact O-N 3.35Å; E384-S387 PolarHBondContact O-OG 3.45Å; E384-R398 VanDerWaalsContact OE1-CA 3.27Å; E384-R398 WeakPolarHBondContact OE1-CA 3.36Å; E384-R398 WeakPolarHBondContact OE1-CB 3.31Å; E384-R398 WeakPolarHBondContact OE1-CG 3.4Å; E384-L399 PolarHBondContact OE1-N 3.23Å
385E62.9Low66.1Low106 Ų106105.5 Ų105.550%0.49560%0.595SS.*Hα-helixtrans-78.8-31.9178.3-65-161.1150.600113.5L381 Q382 Q383 R388 R398L381-E385 PolarHBondContact O-N 3.01Å; Q382-E385 PolarHBondContact O-N 2.6Å; Q383-E385 VanDerWaalsContact C-N 3.33Å; E385-R388 WeakPolarHBondContact O-CB 3.24Å; E385-R398 IonicContact OE1-CZ 3.54Å; E385-R398 IonicContact OE1-NH2 2.7Å; E385-R398 PolarHBondContact OE1-NH2 2.92Å
386A63Low63.9Low83 Ų83110.3 Ų110.369%0.68661%0.61SS**Hα-helixtrans-80.7-24.8179.100000114.2Q382 R388Q382-A386 WeakPolarHBondContact O-CB 3.22Å; Q382-A386 PolarHBondContact O-N 2.91Å; A386-R388 PolarHBondContact O-N 2.75Å
387S58Low61.9Low85 Ų85107.3 Ų107.359%0.59460%0.602SS**SBendtrans-70.6-13.9174.349.90000113.3Q383 E384 T389Q383-S387 VanDerWaalsContact O-CB 3.32Å; Q383-S387 WeakPolarHBondContact O-CB 3.44Å; Q383-S387 PolarHBondContact O-N 3.18Å; Q383-S387 PolarHBondContact O-OG 3.27Å; E384-S387 PolarHBondContact O-OG 3.45Å; S387-T389 VanDerWaalsContact C-N 3.35Å; S387-T389 PolarHBondContact O-N 3.33Å
388R56Low60.2Low104 Ų104107.6 Ų107.639%0.39260%0.595SS.*SBendtrans-72.481.5172.6-64.2170.6162.3-143.1-26.6111.6E385 A386 P390 G397 R398E385-R388 WeakPolarHBondContact O-CB 3.24Å; A386-R388 PolarHBondContact O-N 2.75Å; R388-P390 WeakPolarHBondContact O-CD 3.46Å; R388-G397 PolarHBondContact NH2-O 3.48Å; R388-R398 VanDerWaalsContact NH2-N 3.11Å
389T48Very low58.4Low103 Ų103105.9 Ų105.963%0.63259%0.592SS**  trans-54.9117.6176.625.70000111.7S387 G391S387-T389 VanDerWaalsContact C-N 3.35Å; S387-T389 PolarHBondContact O-N 3.33Å; T389-G391 VanDerWaalsContact C-N 3.32Å; T389-G391 PolarHBondContact O-N 3.03Å
390P49.2Very low56.6Low143 Ų143103 Ų10393%0.92958%0.584SS**THydrogen-bonded Turntrans-73.578.9-177-18.933.7000112.9R388R388-P390 WeakPolarHBondContact O-CD 3.46Å
391G49.6Very low55.2Low77 Ų77105 Ų10579%0.79459%0.587SS**THydrogen-bonded Turntrans159.1-11.2171.100000117.8T389T389-G391 VanDerWaalsContact C-N 3.32Å; T389-G391 PolarHBondContact O-N 3.03Å
392L44.7Very low54.1Low136 Ų136106.4 Ų106.471%0.71259%0.593SS**SBendtrans-136.6148.2-178.7-147.868.2000111.2
393M42.8Very low53.3Low147 Ų147104.5 Ų104.572%0.72459%0.585SS**  trans56.674.6-172.8-57.9-48.1-17100115.8G395M393-G395 PolarHBondContact O-N 2.78Å
394K44.7Very low53.5Low229 Ų229102 Ų102100%0.99658%0.579SS**THydrogen-bonded Turntrans-70.470.2162.4-171.9-175.3178.9179.50110.4
395G45.3Very low54Low70 Ų70105.7 Ų105.772%0.72260%0.597SS**THydrogen-bonded Turntrans-164.2-32.9-175.700000115.5M393 G397M393-G395 PolarHBondContact O-N 2.78Å; G395-G397 PolarHBondContact O-N 2.9Å
396E43.7Very low54.9Low150 Ų150102.7 Ų102.770%0.70160%0.595SS**  trans-87.1108.1176.7-71172.417400109.5
397G51.3Low55.8Low28 Ų28103.2 Ų103.229%0.28958%0.583SS.*  trans-84.5-141.5-179.200000113R388 G395 D401R388-G397 PolarHBondContact NH2-O 3.48Å; G395-G397 PolarHBondContact O-N 2.9Å; G397-D401 WeakPolarHBondContact CA-OD2 3.27Å
398R51.7Low56.7Low118 Ų118101 Ų10145%0.44556%0.562SS.*  trans-76.2173.7172-88.3175.7168.6-128-10.1110.9E384 E385 R388 S400 D401 M402E384-R398 VanDerWaalsContact OE1-CA 3.27Å; E384-R398 WeakPolarHBondContact OE1-CA 3.36Å; E384-R398 WeakPolarHBondContact OE1-CB 3.31Å; E384-R398 WeakPolarHBondContact OE1-CG 3.4Å; E385-R398 IonicContact OE1-CZ 3.54Å; E385-R398 IonicContact OE1-NH2 2.7Å; E385-R398 PolarHBondContact OE1-NH2 2.92Å; R388-R398 VanDerWaalsContact NH2-N 3.11Å; R398-S400 PolarHBondContact O-N 3.02Å; R398-S400 VanDerWaalsContact O-N 3.15Å; R398-D401 PolarHBondContact N-OD2 2.98Å; R398-D401 PolarHBondContact O-N 3.04Å; R398-M402 PolarHBondContact O-N 3.02Å
399L51.5Low58Low100 Ų10099.7 Ų99.752%0.52456%0.561SS.*Hα-helixtrans-36.8-45.9153.766.853.8000112.1E384 D401 M402E384-L399 PolarHBondContact OE1-N 3.23Å; L399-D401 VanDerWaalsContact C-N 3.34Å; L399-D401 PolarHBondContact O-N 2.95Å; L399-M402 HydrophobicContact CD2-CE 4.09Å
400S50Low59.9Low52 Ų52100.1 Ų100.136%0.36456%0.556SS.*Hα-helixtrans-49-50.2170.7161.50000112.8R398 M402 L403 K408R398-S400 PolarHBondContact O-N 3.02Å; R398-S400 VanDerWaalsContact O-N 3.15Å; S400-M402 VanDerWaalsContact C-N 3.34Å; S400-M402 PolarHBondContact O-N 3.45Å; S400-L403 PolarHBondContact O-N 3.26Å; S400-L403 VanDerWaalsContact O-O 3.06Å; S400-K408 WeakPolarHBondContact O-CE 3.49Å; S400-K408 PolarHBondContact O-NZ 3.09Å; S400-K408 VanDerWaalsContact O-NZ 3.12Å; S400-K408 PolarHBondContact OG-NZ 3.26Å; S400-K408 VanDerWaalsContact OG-NZ 3.09Å
401D51.9Low61.5Low97 Ų9798.5 Ų98.552%0.51954%0.538SS..Hα-helixtrans-90.1-7.1-159.9-45.5-32.5000112.4G397 R398 L399G397-D401 WeakPolarHBondContact CA-OD2 3.27Å; R398-D401 PolarHBondContact N-OD2 2.98Å; R398-D401 PolarHBondContact O-N 3.04Å; L399-D401 VanDerWaalsContact C-N 3.34Å; L399-D401 PolarHBondContact O-N 2.95Å
402M56.8Low63.1Low125 Ų125100 Ų10062%0.61652%0.52SS*.Hα-helixtrans-85.1-27.9164.8-65.7-138.9-59.800113.2R398 L399 S400R398-M402 PolarHBondContact O-N 3.02Å; L399-M402 HydrophobicContact CD2-CE 4.09Å; S400-M402 VanDerWaalsContact C-N 3.34Å; S400-M402 PolarHBondContact O-N 3.45Å
403L60.2Low65.3Low63 Ų6398.2 Ų98.233%0.3350%0.504SS..SBendtrans-82.1132176-67171.1000109.7S400 E407 K408 L411S400-L403 PolarHBondContact O-N 3.26Å; S400-L403 VanDerWaalsContact O-O 3.06Å; L403-E407 HydrophobicContact CB-CB 4.29Å; L403-E407 HydrophobicContact CD2-CB 4.06Å; L403-K408 HydrophobicContact CB-CG 4.05Å; L403-K408 VanDerWaalsContact O-CE 3.24Å; L403-K408 WeakPolarHBondContact O-CE 3.38Å; L403-L411 HydrophobicContact CD1-CD2 4.27Å
404T77.6Confident67.5Low81 Ų8193.7 Ų93.750%0.49749%0.49SS..  trans-65156.1169.864.70000110.5G406 E407 K408T404-G406 PolarHBondContact O-N 3.02Å; T404-G406 VanDerWaalsContact O-N 3.11Å; T404-E407 VanDerWaalsContact CB-OE2 3.28Å; T404-E407 WeakPolarHBondContact CB-OE2 3.27Å; T404-E407 WeakPolarHBondContact CG2-OE2 3.5Å; T404-E407 PolarHBondContact N-OE2 2.91Å; T404-E407 PolarHBondContact O-N 3.27Å; T404-E407 WeakPolarHBondContact OG1-CG 3.12Å; T404-E407 PolarHBondContact OG1-N 3.11Å; T404-E407 PolarHBondContact OG1-OE2 3.49Å; T404-K408 PolarHBondContact O-N 3.31Å
405E75.8Confident69.4Low122 Ų12286.8 Ų86.857%0.5746%0.462SS*.Hα-helixtrans-56.9-29.4177-65.7-57.5135.300112.6K408 E409E405-K408 WeakPolarHBondContact OE1-CD 3.28Å; E405-K408 WeakPolarHBondContact OE1-CE 3.35Å; E405-K408 IonicContact OE1-NZ 3.96Å; E405-K408 PolarHBondContact OE1-NZ 3.1Å; E405-E409 WeakPolarHBondContact O-CB 3.24Å; E405-E409 PolarHBondContact O-N 3.48Å
406G82.2Confident71.3Confident44 Ų4486.3 Ų86.345%0.45444%0.443SS..Hα-helixtrans-62.7-47.417200000112.7T404 E409 E410T404-G406 PolarHBondContact O-N 3.02Å; T404-G406 VanDerWaalsContact O-N 3.11Å; G406-E409 PolarHBondContact O-N 3.13Å; G406-E410 WeakPolarHBondContact O-CB 3.41Å; G406-E410 PolarHBondContact O-N 3.42Å
407E81.4Confident73.5Confident94 Ų9484.8 Ų84.844%0.43944%0.436SS..Hα-helixtrans-69.6-33.3178.1-66.8160.1121.900112.4L403 T404 E410 L411L403-E407 HydrophobicContact CB-CB 4.29Å; L403-E407 HydrophobicContact CD2-CB 4.06Å; T404-E407 VanDerWaalsContact CB-OE2 3.28Å; T404-E407 WeakPolarHBondContact CB-OE2 3.27Å; T404-E407 WeakPolarHBondContact CG2-OE2 3.5Å; T404-E407 PolarHBondContact N-OE2 2.91Å; T404-E407 PolarHBondContact O-N 3.27Å; T404-E407 WeakPolarHBondContact OG1-CG 3.12Å; T404-E407 PolarHBondContact OG1-N 3.11Å; T404-E407 PolarHBondContact OG1-OE2 3.49Å; E407-E410 WeakPolarHBondContact O-CB 3.37Å; E407-E410 PolarHBondContact O-N 2.8Å; E407-L411 WeakPolarHBondContact O-CB 3.14Å; E407-L411 PolarHBondContact O-N 3.06Å
408K77Confident75.5Confident38 Ų3891.5 Ų91.517%0.16545%0.453CS..Hα-helixtrans-61.6-44.4169.5-67.1178.5-168.1177.50111.5S400 L403 T404 E405 E410 L411 R412S400-K408 WeakPolarHBondContact O-CE 3.49Å; S400-K408 PolarHBondContact O-NZ 3.09Å; S400-K408 VanDerWaalsContact O-NZ 3.12Å; S400-K408 PolarHBondContact OG-NZ 3.26Å; S400-K408 VanDerWaalsContact OG-NZ 3.09Å; L403-K408 HydrophobicContact CB-CG 4.05Å; L403-K408 VanDerWaalsContact O-CE 3.24Å; L403-K408 WeakPolarHBondContact O-CE 3.38Å; T404-K408 PolarHBondContact O-N 3.31Å; E405-K408 WeakPolarHBondContact OE1-CD 3.28Å; E405-K408 WeakPolarHBondContact OE1-CE 3.35Å; E405-K408 IonicContact OE1-NZ 3.96Å; E405-K408 PolarHBondContact OE1-NZ 3.1Å; K408-E410 VanDerWaalsContact C-N 3.33Å; K408-L411 PolarHBondContact O-N 3.08Å; K408-R412 VanDerWaalsContact O-CB 3.3Å; K408-R412 WeakPolarHBondContact O-CB 3.5Å; K408-R412 PolarHBondContact O-N 2.96Å
409E82.1Confident77Confident77 Ų7790.3 Ų90.336%0.3645%0.451SS..Hα-helixtrans-68.4-35177.5-151.763.3-118.400111.1E405 G406 R412 R413E405-E409 WeakPolarHBondContact O-CB 3.24Å; E405-E409 PolarHBondContact O-N 3.48Å; G406-E409 PolarHBondContact O-N 3.13Å; E409-R412 IonicContact OE1-CZ 2.9Å; E409-R412 IonicContact OE1-NE 2.75Å; E409-R412 IonicContact OE1-NH1 2.66Å; E409-R412 PolarHBondContact OE1-NH1 3Å; E409-R412 IonicContact OE2-CZ 3.13Å; E409-R412 IonicContact OE2-NH1 3.67Å; E409-R412 PolarHBondContact OE2-NH1 2.87Å; E409-R412 IonicContact OE2-NH2 2.6Å; E409-R413 VanDerWaalsContact O-CB 3.26Å; E409-R413 WeakPolarHBondContact O-CB 3.44Å; E409-R413 WeakPolarHBondContact O-CG 3.42Å; E409-R413 PolarHBondContact O-N 2.94Å; E409-R413 PolarHBondContact O-NE 3.44Å
410E87.7Confident78.8Confident111 Ų11192.9 Ų92.952%0.51945%0.454SS..Hα-helixtrans-59.7-52171.2-150.776.4-114.100111.1G406 E407 K408 R412 R413 A414G406-E410 WeakPolarHBondContact O-CB 3.41Å; G406-E410 PolarHBondContact O-N 3.42Å; E407-E410 WeakPolarHBondContact O-CB 3.37Å; E407-E410 PolarHBondContact O-N 2.8Å; K408-E410 VanDerWaalsContact C-N 3.33Å; E410-R412 PolarHBondContact O-N 3.38Å; E410-R413 PolarHBondContact O-N 2.92Å; E410-R413 IonicContact OE1-CZ 3.85Å; E410-R413 VanDerWaalsContact OE1-CZ 3.27Å; E410-R413 IonicContact OE1-NH1 2.66Å; E410-R413 PolarHBondContact OE1-NH1 3.24Å; E410-R413 IonicContact OE1-NH2 3.27Å; E410-R413 PolarHBondContact OE1-NH2 3.24Å; E410-R413 VanDerWaalsContact OE1-NH2 3.13Å; E410-R413 IonicContact OE2-CZ 3.92Å; E410-R413 IonicContact OE2-NH1 3.82Å; E410-R413 IonicContact OE2-NH2 3.81Å; E410-R413 PolarHBondContact OE2-NH2 3.02Å; E410-A414 WeakPolarHBondContact O-CB 3.43Å; E410-A414 PolarHBondContact O-N 3.48Å
411L83.6Confident80.7Confident109 Ų10993.7 Ų93.757%0.57146%0.458SS*.Hα-helixtrans-65.1-38.7-179.9-176.761.3000112.1L403 E407 K408 A414 M415L403-L411 HydrophobicContact CD1-CD2 4.27Å; E407-L411 WeakPolarHBondContact O-CB 3.14Å; E407-L411 PolarHBondContact O-N 3.06Å; K408-L411 PolarHBondContact O-N 3.08Å; L411-A414 PolarHBondContact O-N 3Å; L411-M415 WeakPolarHBondContact O-CB 3.32Å; L411-M415 PolarHBondContact O-N 3.47Å
412R83.5Confident82.4Confident109 Ų10991.2 Ų91.241%0.41145%0.446SS..Hα-helixtrans-63.5-49.7173.8-166.5-175.9-55.8141.57.3110.9K408 E409 E410 A414 M415 D416K408-R412 VanDerWaalsContact O-CB 3.3Å; K408-R412 WeakPolarHBondContact O-CB 3.5Å; K408-R412 PolarHBondContact O-N 2.96Å; E409-R412 IonicContact OE1-CZ 2.9Å; E409-R412 IonicContact OE1-NE 2.75Å; E409-R412 IonicContact OE1-NH1 2.66Å; E409-R412 PolarHBondContact OE1-NH1 3Å; E409-R412 IonicContact OE2-CZ 3.13Å; E409-R412 IonicContact OE2-NH1 3.67Å; E409-R412 PolarHBondContact OE2-NH1 2.87Å; E409-R412 IonicContact OE2-NH2 2.6Å; E410-R412 PolarHBondContact O-N 3.38Å; R412-A414 VanDerWaalsContact C-N 3.3Å; R412-A414 PolarHBondContact O-N 2.86Å; R412-M415 PolarHBondContact O-N 3.34Å; R412-D416 WeakPolarHBondContact O-CB 3.46Å; R412-D416 PolarHBondContact O-N 3.47Å
413R90.3Very high83.6Confident99 Ų9989.8 Ų89.837%0.37444%0.44SS..Hα-helixtrans-58.3-40.1175.1-75.3176.9-72.1120.3-6112E409 E410 Q417E409-R413 VanDerWaalsContact O-CB 3.26Å; E409-R413 WeakPolarHBondContact O-CB 3.44Å; E409-R413 WeakPolarHBondContact O-CG 3.42Å; E409-R413 PolarHBondContact O-N 2.94Å; E409-R413 PolarHBondContact O-NE 3.44Å; E410-R413 PolarHBondContact O-N 2.92Å; E410-R413 IonicContact OE1-CZ 3.85Å; E410-R413 VanDerWaalsContact OE1-CZ 3.27Å; E410-R413 IonicContact OE1-NH1 2.66Å; E410-R413 PolarHBondContact OE1-NH1 3.24Å; E410-R413 IonicContact OE1-NH2 3.27Å; E410-R413 PolarHBondContact OE1-NH2 3.24Å; E410-R413 VanDerWaalsContact OE1-NH2 3.13Å; E410-R413 IonicContact OE2-CZ 3.92Å; E410-R413 IonicContact OE2-NH1 3.82Å; E410-R413 IonicContact OE2-NH2 3.81Å; E410-R413 PolarHBondContact OE2-NH2 3.02Å; R413-Q417 WeakPolarHBondContact O-CB 3.37Å; R413-Q417 VanDerWaalsContact O-CG 3.23Å; R413-Q417 WeakPolarHBondContact O-CG 3.5Å; R413-Q417 PolarHBondContact O-N 3.25Å
414A90.1Very high84.8Confident51 Ų5190.4 Ų90.442%0.42145%0.448SS..Hα-helixtrans-68.3-46176.800000112.5E410 L411 R412 D416 Q417 W418E410-A414 WeakPolarHBondContact O-CB 3.43Å; E410-A414 PolarHBondContact O-N 3.48Å; L411-A414 PolarHBondContact O-N 3Å; R412-A414 VanDerWaalsContact C-N 3.3Å; R412-A414 PolarHBondContact O-N 2.86Å; A414-D416 VanDerWaalsContact C-N 3.33Å; A414-D416 PolarHBondContact O-N 3Å; A414-Q417 WeakPolarHBondContact O-CB 3.35Å; A414-Q417 PolarHBondContact O-N 3.37Å; A414-W418 PolarHBondContact O-N 3.41Å
415M83.4Confident85.3Confident84 Ų8490.6 Ų90.641%0.41444%0.443SS..Hα-helixtrans-59.6-43.4174.9-179.1-170.654.900111.3L411 R412 Q417 W418 K419L411-M415 WeakPolarHBondContact O-CB 3.32Å; L411-M415 PolarHBondContact O-N 3.47Å; R412-M415 PolarHBondContact O-N 3.34Å; M415-Q417 VanDerWaalsContact C-N 3.34Å; M415-W418 PolarHBondContact O-N 3.13Å; M415-K419 VanDerWaalsContact CE-NZ 3.3Å; M415-K419 HydrophobicContact CG-CD 4.32Å; M415-K419 WeakPolarHBondContact O-CG 3.2Å; M415-K419 PolarHBondContact O-N 2.98Å; M415-K419 PolarHBondContact SD-NZ 3.42Å
416D86.6Confident85.7Confident61 Ų6189.1 Ų89.133%0.32644%0.439SS..Hα-helixtrans-75.5-22.3-179.6-66.9-26.4000112.6R412 A414 K419 R420R412-D416 WeakPolarHBondContact O-CB 3.46Å; R412-D416 PolarHBondContact O-N 3.47Å; A414-D416 VanDerWaalsContact C-N 3.33Å; A414-D416 PolarHBondContact O-N 3Å; D416-K419 IonicContact OD1-NZ 2.67Å; D416-K419 PolarHBondContact OD1-NZ 3.03Å; D416-R420 WeakPolarHBondContact O-CG 2.79Å; D416-R420 PolarHBondContact O-N 3.27Å; D416-R420 PolarHBondContact O-NE 2.93Å; D416-R420 PolarHBondContact O-NH2 3.49Å
417Q89.7Confident85.9Confident117 Ų11794.6 Ų94.655%0.54745%0.446SS..Hα-helixtrans-69.3-47.7164.5-76.8174.140.800111.2R413 A414 M415 K419 R420 C421R413-Q417 WeakPolarHBondContact O-CB 3.37Å; R413-Q417 VanDerWaalsContact O-CG 3.23Å; R413-Q417 WeakPolarHBondContact O-CG 3.5Å; R413-Q417 PolarHBondContact O-N 3.25Å; A414-Q417 WeakPolarHBondContact O-CB 3.35Å; A414-Q417 PolarHBondContact O-N 3.37Å; M415-Q417 VanDerWaalsContact C-N 3.34Å; Q417-K419 PolarHBondContact O-N 3.08Å; Q417-R420 VanDerWaalsContact CG-NH2 3.33Å; Q417-R420 WeakPolarHBondContact O-CB 3.31Å; Q417-R420 PolarHBondContact O-N 3.21Å; Q417-R420 VanDerWaalsContact O-N 3.16Å; Q417-C421 PolarHBondContact O-N 3.41Å
418W91.6Very high86.3Confident169 Ų16996.4 Ų96.464%0.6445%0.454SS*.Hα-helixtrans-60.1-47.1178.2176.277.2000112.2A414 M415 R420 C421 V422A414-W418 PolarHBondContact O-N 3.41Å; M415-W418 PolarHBondContact O-N 3.13Å; W418-R420 VanDerWaalsContact C-N 3.29Å; W418-R420 PolarHBondContact O-N 3.49Å; W418-C421 WeakPolarHBondContact O-CB 3.39Å; W418-C421 PolarHBondContact O-N 3.1Å; W418-C421 VanDerWaalsContact O-N 3.08Å; W418-V422 HydrophobicContact CD2-CG2 4.18Å; W418-V422 HydrophobicContact CH2-CG2 4.49Å; W418-V422 HydrophobicContact CZ2-CG2 3.85Å; W418-V422 WeakPolarHBondContact O-CG2 3.16Å; W418-V422 PolarHBondContact O-N 3.48Å
419K83.4Confident86.7Confident94 Ų94102.5 Ų102.541%0.40948%0.476SS..Hα-helixtrans-55.5-42.3173.6-74.6173.7-176.6166.60112.2M415 D416 Q417 M423M415-K419 VanDerWaalsContact CE-NZ 3.3Å; M415-K419 HydrophobicContact CG-CD 4.32Å; M415-K419 WeakPolarHBondContact O-CG 3.2Å; M415-K419 PolarHBondContact O-N 2.98Å; M415-K419 PolarHBondContact SD-NZ 3.42Å; D416-K419 IonicContact OD1-NZ 2.67Å; D416-K419 PolarHBondContact OD1-NZ 3.03Å; Q417-K419 PolarHBondContact O-N 3.08Å; K419-M423 WeakPolarHBondContact O-CB 3.34Å; K419-M423 WeakPolarHBondContact O-CG 3.48Å; K419-M423 PolarHBondContact O-N 3.27Å
420R90Very high86.7Confident154 Ų154103.9 Ų103.958%0.58149%0.486SS*.Hα-helixtrans-65.8-40.6175.9-81.2176.7-73.7155.8-6.4112D416 Q417 W418 M423 C424D416-R420 WeakPolarHBondContact O-CG 2.79Å; D416-R420 PolarHBondContact O-N 3.27Å; D416-R420 PolarHBondContact O-NE 2.93Å; D416-R420 PolarHBondContact O-NH2 3.49Å; Q417-R420 VanDerWaalsContact CG-NH2 3.33Å; Q417-R420 WeakPolarHBondContact O-CB 3.31Å; Q417-R420 PolarHBondContact O-N 3.21Å; Q417-R420 VanDerWaalsContact O-N 3.16Å; W418-R420 VanDerWaalsContact C-N 3.29Å; W418-R420 PolarHBondContact O-N 3.49Å; R420-M423 PolarHBondContact O-N 3.23Å; R420-C424 PolarHBondContact O-N 3.44Å; R420-C424 PolarHBondContact O-SG 2.84Å; R420-C424 VanDerWaalsContact O-SG 3.32Å
421C89.6Confident86.6Confident68 Ų68100.4 Ų100.446%0.45948%0.476SS..Hα-helixtrans-59.7-54.1176.2-157.80000111.1Q417 W418 M423 C424 E425Q417-C421 PolarHBondContact O-N 3.41Å; W418-C421 WeakPolarHBondContact O-CB 3.39Å; W418-C421 PolarHBondContact O-N 3.1Å; W418-C421 VanDerWaalsContact O-N 3.08Å; C421-M423 VanDerWaalsContact C-N 3.33Å; C421-M423 PolarHBondContact O-N 3Å; C421-C424 WeakPolarHBondContact O-CA 3.25Å; C421-C424 WeakPolarHBondContact O-CB 3.47Å; C421-C424 PolarHBondContact O-N 2.89Å; C421-E425 WeakPolarHBondContact O-CG 3.01Å; C421-E425 PolarHBondContact O-N 3.34Å; C421-E425 PolarHBondContact SG-OE1 3.49Å
422V87.6Confident86.9Confident45 Ų4599 Ų9927%0.27347%0.467SS..Hα-helixtrans-58.8-41.4178.51750000112W418 C424 E425 L426W418-V422 HydrophobicContact CD2-CG2 4.18Å; W418-V422 HydrophobicContact CH2-CG2 4.49Å; W418-V422 HydrophobicContact CZ2-CG2 3.85Å; W418-V422 WeakPolarHBondContact O-CG2 3.16Å; W418-V422 PolarHBondContact O-N 3.48Å; V422-C424 VanDerWaalsContact C-N 3.3Å; V422-C424 PolarHBondContact O-N 3.21Å; V422-E425 PolarHBondContact O-N 3.26Å; V422-L426 HydrophobicContact CG1-CD1 4.05Å; V422-L426 WeakPolarHBondContact O-CB 3.41Å; V422-L426 WeakPolarHBondContact O-CG 3.39Å; V422-L426 PolarHBondContact O-N 2.77Å
423M81.5Confident87.1Confident96 Ų9697.6 Ų97.647%0.47347%0.467SS..Hα-helixtrans-69.2-24.7176.6-71.2-63.7-60.900113.7K419 R420 C421 L426 R427K419-M423 WeakPolarHBondContact O-CB 3.34Å; K419-M423 WeakPolarHBondContact O-CG 3.48Å; K419-M423 PolarHBondContact O-N 3.27Å; R420-M423 PolarHBondContact O-N 3.23Å; C421-M423 VanDerWaalsContact C-N 3.33Å; C421-M423 PolarHBondContact O-N 3Å; M423-L426 HydrophobicContact SD-CD1 4.42Å; M423-R427 VanDerWaalsContact O-CD 3.26Å; M423-R427 WeakPolarHBondContact O-CD 3.46Å; M423-R427 VanDerWaalsContact O-CG 3.25Å; M423-R427 WeakPolarHBondContact O-CG 3.47Å
424C86.6Confident87Confident75 Ų7598 Ų9851%0.50748%0.476SS..Hα-helixtrans-77.4-46.7170.3-72.50000111.3R420 C421 V422 L426 R427 E428R420-C424 PolarHBondContact O-N 3.44Å; R420-C424 PolarHBondContact O-SG 2.84Å; R420-C424 VanDerWaalsContact O-SG 3.32Å; C421-C424 WeakPolarHBondContact O-CA 3.25Å; C421-C424 WeakPolarHBondContact O-CB 3.47Å; C421-C424 PolarHBondContact O-N 2.89Å; V422-C424 VanDerWaalsContact C-N 3.3Å; V422-C424 PolarHBondContact O-N 3.21Å; C424-L426 VanDerWaalsContact C-N 3.33Å; C424-L426 PolarHBondContact O-N 2.96Å; C424-R427 PolarHBondContact O-N 3.02Å; C424-E428 PolarHBondContact O-N 2.87Å
425E87.2Confident87Confident85 Ų85100 Ų10040%0.39747%0.473SS..Hα-helixtrans-58.4-41.5178-71.9171.9-132.800112.3C421 V422 E428 R429C421-E425 WeakPolarHBondContact O-CG 3.01Å; C421-E425 PolarHBondContact O-N 3.34Å; C421-E425 PolarHBondContact SG-OE1 3.49Å; V422-E425 PolarHBondContact O-N 3.26Å; E425-E428 PolarHBondContact O-N 2.93Å; E425-R429 WeakPolarHBondContact O-CG 3.49Å; E425-R429 PolarHBondContact O-N 3.16Å
426L84.3Confident87.3Confident91 Ų9199.7 Ų99.748%0.47647%0.473SS..Hα-helixtrans-60.4-49174.8-76.3167.6000111.8V422 M423 C424 E428 R429 D430V422-L426 HydrophobicContact CG1-CD1 4.05Å; V422-L426 WeakPolarHBondContact O-CB 3.41Å; V422-L426 WeakPolarHBondContact O-CG 3.39Å; V422-L426 PolarHBondContact O-N 2.77Å; M423-L426 HydrophobicContact SD-CD1 4.42Å; C424-L426 VanDerWaalsContact C-N 3.33Å; C424-L426 PolarHBondContact O-N 2.96Å; L426-E428 VanDerWaalsContact C-N 3.29Å; L426-E428 PolarHBondContact O-N 2.91Å; L426-R429 WeakPolarHBondContact O-CB 3.31Å; L426-R429 PolarHBondContact O-N 2.6Å; L426-D430 PolarHBondContact O-N 2.67Å
427R87.3Confident87Confident159 Ų159103.6 Ų103.660%0.648%0.483SS*.Hα-helixtrans-63.1-35177.8-70168.7-178.7163.4-1.5112.6M423 C424 A431M423-R427 VanDerWaalsContact O-CD 3.26Å; M423-R427 WeakPolarHBondContact O-CD 3.46Å; M423-R427 VanDerWaalsContact O-CG 3.25Å; M423-R427 WeakPolarHBondContact O-CG 3.47Å; C424-R427 PolarHBondContact O-N 3.02Å; R427-A431 VanDerWaalsContact O-CB 3.23Å; R427-A431 WeakPolarHBondContact O-CB 3.46Å; R427-A431 PolarHBondContact O-N 3.08Å
428E89.6Confident86.5Confident132 Ų132102.5 Ų102.562%0.61748%0.478SS*.Hα-helixtrans-69.5-38176.4-174.7167.1-141.200111.8C424 E425 L426 A431 Q432C424-E428 PolarHBondContact O-N 2.87Å; E425-E428 PolarHBondContact O-N 2.93Å; L426-E428 VanDerWaalsContact C-N 3.29Å; L426-E428 PolarHBondContact O-N 2.91Å; E428-A431 PolarHBondContact O-N 3.01Å; E428-Q432 PolarHBondContact O-N 3.07Å
429R84.4Confident86.2Confident167 Ų16799.8 Ų99.863%0.6347%0.473SS*.Hα-helixtrans-65.2-46.6172.3-67.2-83.1166.664.29.6111.7E425 L426 A431 Q432 I433E425-R429 WeakPolarHBondContact O-CG 3.49Å; E425-R429 PolarHBondContact O-N 3.16Å; L426-R429 WeakPolarHBondContact O-CB 3.31Å; L426-R429 PolarHBondContact O-N 2.6Å; R429-A431 VanDerWaalsContact C-N 3.32Å; R429-A431 PolarHBondContact O-N 3Å; R429-Q432 PolarHBondContact O-N 3.34Å; R429-Q432 VanDerWaalsContact O-N 3.15Å; R429-I433 WeakPolarHBondContact O-CG1 3.43Å; R429-I433 PolarHBondContact O-N 2.67Å
430D83.4Confident86.3Confident105 Ų105100.8 Ų100.856%0.56148%0.482SS*.Hα-helixtrans-59.6-43.5175.3-70.3-30.4000111.3L426 Q432 I433 L434L426-D430 PolarHBondContact O-N 2.67Å; D430-Q432 VanDerWaalsContact C-N 3.33Å; D430-Q432 PolarHBondContact O-N 3.35Å; D430-I433 PolarHBondContact O-N 3.4Å; D430-L434 PolarHBondContact O-N 3.41Å
431A85.8Confident85.7Confident38 Ų3898.4 Ų98.431%0.31448%0.48SS..Hα-helixtrans-66.3-32.4176.200000112.8R427 E428 R429 R435R427-A431 VanDerWaalsContact O-CB 3.23Å; R427-A431 WeakPolarHBondContact O-CB 3.46Å; R427-A431 PolarHBondContact O-N 3.08Å; E428-A431 PolarHBondContact O-N 3.01Å; R429-A431 VanDerWaalsContact C-N 3.32Å; R429-A431 PolarHBondContact O-N 3Å; A431-R435 WeakPolarHBondContact O-CG 3.49Å; A431-R435 PolarHBondContact O-N 3.28Å; A431-R435 PolarHBondContact O-NH1 3.05Å
432Q90.3Very high85.1Confident79 Ų79100.6 Ų100.637%0.36948%0.484SS..Hα-helixtrans-68.5-48.1172.5-17162.144.400111.2E428 R429 D430 L434 R435 D436E428-Q432 PolarHBondContact O-N 3.07Å; R429-Q432 PolarHBondContact O-N 3.34Å; R429-Q432 VanDerWaalsContact O-N 3.15Å; D430-Q432 VanDerWaalsContact C-N 3.33Å; D430-Q432 PolarHBondContact O-N 3.35Å; Q432-L434 PolarHBondContact O-N 3.14Å; Q432-R435 WeakPolarHBondContact O-CA 3.49Å; Q432-R435 WeakPolarHBondContact O-CB 3.19Å; Q432-R435 PolarHBondContact O-N 2.89Å; Q432-R435 VanDerWaalsContact OE1-CZ 3.3Å; Q432-D436 PolarHBondContact NE2-OD1 3.36Å; Q432-D436 PolarHBondContact O-N 2.8Å
433I86.1Confident84.6Confident81 Ų81104 Ų10442%0.41550%0.5SS..Hα-helixtrans-57.1-35.1176.1-66.6163.4000111R429 D430 R437R429-I433 WeakPolarHBondContact O-CG1 3.43Å; R429-I433 PolarHBondContact O-N 2.67Å; D430-I433 PolarHBondContact O-N 3.4Å; I433-R437 WeakPolarHBondContact O-CB 3.4Å; I433-R437 VanDerWaalsContact O-CG 3.23Å; I433-R437 WeakPolarHBondContact O-CG 3.27Å; I433-R437 PolarHBondContact O-N 3.3Å; I433-R437 VanDerWaalsContact O-N 3.17Å
434L88.8Confident84.1Confident108 Ų108103.3 Ų103.357%0.56550%0.501SS*.Hα-helixtrans-68.7-42.4174-160.875.8000112.5D430 Q432 M438D430-L434 PolarHBondContact O-N 3.41Å; Q432-L434 PolarHBondContact O-N 3.14Å; L434-M438 WeakPolarHBondContact O-CG 3.39Å; L434-M438 PolarHBondContact O-N 2.98Å
435R90.5Very high82.9Confident93 Ų93104 Ų10435%0.35150%0.497SS..Hα-helixtrans-60.1-53173.8-74.6-177.1-69.3-91.19.2111.4A431 Q432 R437 M438 E439A431-R435 WeakPolarHBondContact O-CG 3.49Å; A431-R435 PolarHBondContact O-N 3.28Å; A431-R435 PolarHBondContact O-NH1 3.05Å; Q432-R435 WeakPolarHBondContact O-CA 3.49Å; Q432-R435 WeakPolarHBondContact O-CB 3.19Å; Q432-R435 PolarHBondContact O-N 2.89Å; Q432-R435 VanDerWaalsContact OE1-CZ 3.3Å; R435-R437 PolarHBondContact O-N 2.86Å; R435-M438 HydrophobicContact CG-CE 4.47Å; R435-M438 WeakPolarHBondContact O-CA 3.43Å; R435-M438 WeakPolarHBondContact O-CB 3.45Å; R435-M438 PolarHBondContact O-N 3.16Å; R435-E439 PolarHBondContact O-N 3.36Å
436D88.8Confident81.4Confident77 Ų77106.5 Ų106.541%0.41251%0.509SS..Hα-helixtrans-55.9-41.5-179-56.4-21.1000111.3Q432 L440Q432-D436 PolarHBondContact NE2-OD1 3.36Å; Q432-D436 PolarHBondContact O-N 2.8Å; D436-L440 WeakPolarHBondContact O-CB 3.45Å; D436-L440 PolarHBondContact O-N 2.93Å
437R80.6Confident79.9Confident143 Ų143105.4 Ų105.454%0.5451%0.507SS..Hα-helixtrans-68-39.7175.3-74.9175.1177.1-166.71113I433 R435 L441I433-R437 WeakPolarHBondContact O-CB 3.4Å; I433-R437 VanDerWaalsContact O-CG 3.23Å; I433-R437 WeakPolarHBondContact O-CG 3.27Å; I433-R437 PolarHBondContact O-N 3.3Å; I433-R437 VanDerWaalsContact O-N 3.17Å; R435-R437 PolarHBondContact O-N 2.86Å; R437-L441 WeakPolarHBondContact O-CB 3.41Å; R437-L441 VanDerWaalsContact O-CG 3.24Å; R437-L441 WeakPolarHBondContact O-CG 3.43Å; R437-L441 PolarHBondContact O-N 3.5Å
438M78.7Confident78.1Confident93 Ų93101.2 Ų101.246%0.45850%0.499SS..Hα-helixtrans-65.5-41.1175.5-75-170.8-60.700111.8L434 R435 L441 Q442L434-M438 WeakPolarHBondContact O-CG 3.39Å; L434-M438 PolarHBondContact O-N 2.98Å; R435-M438 HydrophobicContact CG-CE 4.47Å; R435-M438 WeakPolarHBondContact O-CA 3.43Å; R435-M438 WeakPolarHBondContact O-CB 3.45Å; R435-M438 PolarHBondContact O-N 3.16Å; M438-L441 PolarHBondContact O-N 2.99Å; M438-Q442 VanDerWaalsContact O-CG 3.32Å; M438-Q442 WeakPolarHBondContact O-CG 3.38Å; M438-Q442 PolarHBondContact O-N 2.99Å
439E86.7Confident76.3Confident113 Ų113102.5 Ų102.553%0.52850%0.498SS..Hα-helixtrans-63.5-45176.4-70.9178.5-15900111.3R435 L441 Q442 L443R435-E439 PolarHBondContact O-N 3.36Å; E439-L441 VanDerWaalsContact C-N 3.33Å; E439-L441 PolarHBondContact O-N 3.49Å; E439-Q442 PolarHBondContact O-N 3.35Å; E439-Q442 VanDerWaalsContact O-N 3.16Å; E439-L443 WeakPolarHBondContact O-CB 3.47Å; E439-L443 PolarHBondContact O-N 3.44Å
440L84.5Confident74.8Confident115 Ų11596 Ų9660%0.60248%0.484SS*.Hα-helixtrans-62.9-36.8175.3-169.766.4000112.8D436 L443 T444D436-L440 WeakPolarHBondContact O-CB 3.45Å; D436-L440 PolarHBondContact O-N 2.93Å; L440-L443 PolarHBondContact O-N 3.22Å; L440-T444 PolarHBondContact O-N 2.7Å; L440-T444 PolarHBondContact O-OG1 2.96Å
441L77.2Confident73.4Confident103 Ų10397 Ų9754%0.53949%0.485SS..Hα-helixtrans-69.2-31.9174-76.9168.9000113R437 M438 E439 T444 Q445R437-L441 WeakPolarHBondContact O-CB 3.41Å; R437-L441 VanDerWaalsContact O-CG 3.24Å; R437-L441 WeakPolarHBondContact O-CG 3.43Å; R437-L441 PolarHBondContact O-N 3.5Å; M438-L441 PolarHBondContact O-N 2.99Å; E439-L441 VanDerWaalsContact C-N 3.33Å; E439-L441 PolarHBondContact O-N 3.49Å; L441-T444 WeakPolarHBondContact CA-OG1 3.45Å; L441-T444 PolarHBondContact O-OG1 2.91Å; L441-Q445 WeakPolarHBondContact O-CB 3.45Å; L441-Q445 VanDerWaalsContact O-CG 3.28Å; L441-Q445 WeakPolarHBondContact O-CG 3.27Å; L441-Q445 PolarHBondContact O-N 2.88Å; L441-Q445 PolarHBondContact O-NE2 2.76Å
442Q78.3Confident71.8Confident115 Ų115101.2 Ų101.254%0.53750%0.498SS..Hα-helixtrans-72.7-41.8172.8-71.2174.129.900111M438 E439 T444 Q445 Q446M438-Q442 VanDerWaalsContact O-CG 3.32Å; M438-Q442 WeakPolarHBondContact O-CG 3.38Å; M438-Q442 PolarHBondContact O-N 2.99Å; E439-Q442 PolarHBondContact O-N 3.35Å; E439-Q442 VanDerWaalsContact O-N 3.16Å; Q442-T444 VanDerWaalsContact C-N 3.29Å; Q442-T444 PolarHBondContact O-N 2.9Å; Q442-Q445 PolarHBondContact O-N 2.91Å; Q442-Q445 VanDerWaalsContact O-N 3.09Å; Q442-Q446 PolarHBondContact O-N 3.4Å
443L76Confident70.3Confident115 Ų115101.5 Ų101.560%0.60251%0.505SS*.Hα-helixtrans-61.7-31.2175.2-84.4159.1000113.4E439 L440 P447E439-L443 WeakPolarHBondContact O-CB 3.47Å; E439-L443 PolarHBondContact O-N 3.44Å; L440-L443 PolarHBondContact O-N 3.22Å; L443-P447 WeakPolarHBondContact O-CD 3.4Å
444T70.4Confident69Low82 Ų82102 Ų10250%0.50351%0.509SS..Hα-helixtrans-83.8-20.4172.637.80000113.7L440 L441 Q442 T448L440-T444 PolarHBondContact O-N 2.7Å; L440-T444 PolarHBondContact O-OG1 2.96Å; L441-T444 WeakPolarHBondContact CA-OG1 3.45Å; L441-T444 PolarHBondContact O-OG1 2.91Å; Q442-T444 VanDerWaalsContact C-N 3.29Å; Q442-T444 PolarHBondContact O-N 2.9Å; T444-T448 PolarHBondContact O-OG1 3.07Å; T444-T448 VanDerWaalsContact O-OG1 3.06Å
445Q62.6Low67.5Low91 Ų91100.3 Ų100.343%0.42550%0.503SS..Hα-helixtrans-82-26.9175-80.8175.170.700114.3L441 Q442 T448 R449L441-Q445 WeakPolarHBondContact O-CB 3.45Å; L441-Q445 VanDerWaalsContact O-CG 3.28Å; L441-Q445 WeakPolarHBondContact O-CG 3.27Å; L441-Q445 PolarHBondContact O-N 2.88Å; L441-Q445 PolarHBondContact O-NE2 2.76Å; Q442-Q445 PolarHBondContact O-N 2.91Å; Q442-Q445 VanDerWaalsContact O-N 3.09Å; Q445-T448 WeakPolarHBondContact CA-OG1 3.39Å; Q445-T448 PolarHBondContact O-OG1 2.68Å; Q445-R449 WeakPolarHBondContact O-CG 3.37Å; Q445-R449 PolarHBondContact O-N 3.11Å
446Q55.8Low66.2Low137 Ų137101.8 Ų101.864%0.6451%0.514SS*.Hα-helixtrans-65.2-47.6176.8-69.8-172.728.200113Q442 T448 R449 G450Q442-Q446 PolarHBondContact O-N 3.4Å; Q446-T448 VanDerWaalsContact C-N 3.34Å; Q446-T448 PolarHBondContact O-N 2.64Å; Q446-R449 PolarHBondContact O-N 2.68Å; Q446-G450 PolarHBondContact O-N 3.25Å; Q446-G450 VanDerWaalsContact O-N 3.1Å
447P52.9Low65.2Low67 Ų67103.9 Ų103.944%0.43552%0.521SS..Hα-helixtrans-59.5-41.7174.7-25.434.6000112.8L443 R449 G450 H451L443-P447 WeakPolarHBondContact O-CD 3.4Å; P447-R449 PolarHBondContact O-N 3.45Å; P447-G450 PolarHBondContact O-N 3.03Å; P447-H451 PolarHBondContact O-N 3.17Å; P447-H451 PolarHBondContact O-ND1 2.69Å
448T49.1Very low64.2Low71 Ų71100.8 Ų100.844%0.43652%0.52SS..Hα-helixtrans-69.5-31.3-179.141.60000112.6T444 Q445 Q446 Q452T444-T448 PolarHBondContact O-OG1 3.07Å; T444-T448 VanDerWaalsContact O-OG1 3.06Å; Q445-T448 WeakPolarHBondContact CA-OG1 3.39Å; Q445-T448 PolarHBondContact O-OG1 2.68Å; Q446-T448 VanDerWaalsContact C-N 3.34Å; Q446-T448 PolarHBondContact O-N 2.64Å; T448-Q452 WeakPolarHBondContact O-CB 3.37Å; T448-Q452 WeakPolarHBondContact O-CG 3.48Å; T448-Q452 PolarHBondContact O-N 2.94Å
449R52.1Low63.5Low159 Ų159103.8 Ų103.860%0.653%0.527SS*.Hα-helixtrans-65.2-41.1167.7-72.8-179.6-170.1-171.54.9112.5Q445 Q446 P447 Q452 V453Q445-R449 WeakPolarHBondContact O-CG 3.37Å; Q445-R449 PolarHBondContact O-N 3.11Å; Q446-R449 PolarHBondContact O-N 2.68Å; P447-R449 PolarHBondContact O-N 3.45Å; R449-Q452 PolarHBondContact O-N 3.06Å; R449-V453 WeakPolarHBondContact O-CG2 3.42Å; R449-V453 PolarHBondContact O-N 3.2Å
450G52.8Low62.7Low32 Ų32103.9 Ų103.933%0.3353%0.53SS..Hα-helixtrans-56.7-58.4173.800000111.7Q446 P447 Q452 V453 D454Q446-G450 PolarHBondContact O-N 3.25Å; Q446-G450 VanDerWaalsContact O-N 3.1Å; P447-G450 PolarHBondContact O-N 3.03Å; G450-Q452 PolarHBondContact O-N 2.9Å; G450-Q452 VanDerWaalsContact O-N 3.17Å; G450-V453 PolarHBondContact O-N 3.08Å; G450-D454 PolarHBondContact O-N 2.74Å
451H53.9Low61.7Low126 Ų126101 Ų10158%0.58352%0.519SS*.Hα-helixtrans-58.9-31.3177.9-66.489.2000113.1P447 T455P447-H451 PolarHBondContact O-N 3.17Å; P447-H451 PolarHBondContact O-ND1 2.69Å; H451-T455 WeakPolarHBondContact O-CB 3.42Å; H451-T455 PolarHBondContact O-N 3.18Å; H451-T455 PolarHBondContact O-OG1 3.45Å
452Q51.3Low61.2Low125 Ų125101.6 Ų101.658%0.58452%0.523SS*.Hα-helixtrans-67.4-44.6173-78.9168.711.700112.2T448 R449 G450 T455 Q456T448-Q452 WeakPolarHBondContact O-CB 3.37Å; T448-Q452 WeakPolarHBondContact O-CG 3.48Å; T448-Q452 PolarHBondContact O-N 2.94Å; R449-Q452 PolarHBondContact O-N 3.06Å; G450-Q452 PolarHBondContact O-N 2.9Å; G450-Q452 VanDerWaalsContact O-N 3.17Å; Q452-T455 PolarHBondContact O-N 3.06Å; Q452-Q456 VanDerWaalsContact O-CB 3.27Å; Q452-Q456 WeakPolarHBondContact O-CB 3.23Å; Q452-Q456 PolarHBondContact O-N 3.14Å
453V59.5Low60.7Low85 Ų85100.1 Ų100.152%0.51552%0.519SS..Hα-helixtrans-61.7-47.7174.6171.30000110.5R449 G450 T455 Q456 Q457R449-V453 WeakPolarHBondContact O-CG2 3.42Å; R449-V453 PolarHBondContact O-N 3.2Å; G450-V453 PolarHBondContact O-N 3.08Å; V453-T455 PolarHBondContact O-N 3.37Å; V453-Q456 CarbonylContact O-C 3.58Å; V453-Q456 PolarHBondContact O-N 3.08Å; V453-Q456 VanDerWaalsContact O-N 3.1Å; V453-Q457 WeakPolarHBondContact O-CB 3.39Å; V453-Q457 PolarHBondContact O-N 2.89Å
454D58.5Low60.4Low93 Ų93101 Ų10150%0.49752%0.519SS..Hα-helixtrans-60.6-43.9177.6-61.8-36.7000111.4G450 Q456 Q457 C458G450-D454 PolarHBondContact O-N 2.74Å; D454-Q456 VanDerWaalsContact C-N 3.29Å; D454-Q456 PolarHBondContact O-N 2.86Å; D454-Q457 PolarHBondContact O-N 3.4Å; D454-C458 WeakPolarHBondContact O-CB 3.26Å; D454-C458 PolarHBondContact O-N 2.86Å; D454-C458 PolarHBondContact O-SG 2.94Å
455T57.5Low59.8Low72 Ų72101.8 Ų101.844%0.44252%0.521SS..Hα-helixtrans-65.7-30.9176.3-58.40000112.4H451 Q452 V453 R459H451-T455 WeakPolarHBondContact O-CB 3.42Å; H451-T455 PolarHBondContact O-N 3.18Å; H451-T455 PolarHBondContact O-OG1 3.45Å; Q452-T455 PolarHBondContact O-N 3.06Å; V453-T455 PolarHBondContact O-N 3.37Å; T455-R459 PolarHBondContact O-N 2.91Å; T455-R459 VanDerWaalsContact O-N 3.13Å
456Q63.6Low59.6Low123 Ų123106.5 Ų106.558%0.57553%0.534SS*.Hα-helixtrans-79-37.1177.4-169.8162.4-4.100111.5Q452 V453 D454 R459 L460Q452-Q456 VanDerWaalsContact O-CB 3.27Å; Q452-Q456 WeakPolarHBondContact O-CB 3.23Å; Q452-Q456 PolarHBondContact O-N 3.14Å; V453-Q456 CarbonylContact O-C 3.58Å; V453-Q456 PolarHBondContact O-N 3.08Å; V453-Q456 VanDerWaalsContact O-N 3.1Å; D454-Q456 VanDerWaalsContact C-N 3.29Å; D454-Q456 PolarHBondContact O-N 2.86Å; Q456-R459 PolarHBondContact O-N 2.84Å; Q456-L460 WeakPolarHBondContact O-CG 3.28Å; Q456-L460 PolarHBondContact O-N 3.35Å
457Q66.8Low60Low122 Ų122106.4 Ų106.457%0.5753%0.534SS*.Hα-helixtrans-69.9-36.8174.2-169.2165.1-4.100112V453 D454 S461V453-Q457 WeakPolarHBondContact O-CB 3.39Å; V453-Q457 PolarHBondContact O-N 2.89Å; D454-Q457 PolarHBondContact O-N 3.4Å; Q457-S461 WeakPolarHBondContact O-CB 3.16Å; Q457-S461 PolarHBondContact O-N 3.28Å; Q457-S461 PolarHBondContact O-OG 3.29Å
458C59.8Low60.4Low78 Ų78106.5 Ų106.553%0.52753%0.533SS..Hα-helixtrans-61.8-41.7167.4-75.10000112.2D454 S461 L462D454-C458 WeakPolarHBondContact O-CB 3.26Å; D454-C458 PolarHBondContact O-N 2.86Å; D454-C458 PolarHBondContact O-SG 2.94Å; C458-S461 PolarHBondContact O-N 3.2Å; C458-L462 WeakPolarHBondContact O-CG 3.45Å; C458-L462 PolarHBondContact O-N 2.88Å
459R63.6Low60.7Low156 Ų156107.5 Ų107.559%0.58954%0.54SS*.Hα-helixtrans-62.7-49.6174.7-95.3-176.7-87.6-169.1-7.4112.5T455 Q456 S461 L462 D463T455-R459 PolarHBondContact O-N 2.91Å; T455-R459 VanDerWaalsContact O-N 3.13Å; Q456-R459 PolarHBondContact O-N 2.84Å; R459-S461 PolarHBondContact O-N 3.15Å; R459-L462 WeakPolarHBondContact O-CB 3.43Å; R459-L462 PolarHBondContact O-N 2.89Å; R459-D463 PolarHBondContact O-N 3.33Å
460L70.8Confident60.8Low114 Ų114101.8 Ų101.860%0.59753%0.53SS*.Hα-helixtrans-57.3-39.8175.9-69.9168.2000111.8Q456 D463 Q464Q456-L460 WeakPolarHBondContact O-CG 3.28Å; Q456-L460 PolarHBondContact O-N 3.35Å; L460-D463 PolarHBondContact O-N 3.11Å; L460-Q464 VanDerWaalsContact O-CB 3.31Å; L460-Q464 WeakPolarHBondContact O-CB 3.47Å; L460-Q464 PolarHBondContact O-N 2.84Å
461S64.3Low60.8Low54 Ų54105.4 Ų105.438%0.37854%0.541SS..Hα-helixtrans-65.9-36.6175.3-55.50000112.5Q457 C458 R459 N465Q457-S461 WeakPolarHBondContact O-CB 3.16Å; Q457-S461 PolarHBondContact O-N 3.28Å; Q457-S461 PolarHBondContact O-OG 3.29Å; C458-S461 PolarHBondContact O-N 3.2Å; R459-S461 PolarHBondContact O-N 3.15Å; S461-N465 WeakPolarHBondContact O-CB 3.18Å; S461-N465 PolarHBondContact O-N 3.11Å; S461-N465 PolarHBondContact O-ND2 2.97Å
462L66.1Low60.5Low117 Ų117102.8 Ų102.861%0.61354%0.536SS*.Hα-helixtrans-70.2-41.6176.1-74.9167.8000112.1C458 R459 N465 R466C458-L462 WeakPolarHBondContact O-CG 3.45Å; C458-L462 PolarHBondContact O-N 2.88Å; R459-L462 WeakPolarHBondContact O-CB 3.43Å; R459-L462 PolarHBondContact O-N 2.89Å; L462-N465 PolarHBondContact O-N 2.93Å; L462-R466 WeakPolarHBondContact O-CB 3.39Å; L462-R466 PolarHBondContact O-N 3.32Å
463D68.1Low60.4Low84 Ų8499.9 Ų99.945%0.44953%0.53SS..Hα-helixtrans-66.3-39.1176-72.3-44.5000111.4R459 L460 N465 R466 E467R459-D463 PolarHBondContact O-N 3.33Å; L460-D463 PolarHBondContact O-N 3.11Å; D463-N465 PolarHBondContact O-N 3.02Å; D463-R466 CarbonylContact O-C 3.44Å; D463-R466 WeakPolarHBondContact O-CA 3.47Å; D463-R466 VanDerWaalsContact O-CB 3.29Å; D463-R466 WeakPolarHBondContact O-CB 3.31Å; D463-R466 PolarHBondContact O-N 3.48Å; D463-E467 PolarHBondContact O-N 3.27Å
464Q68.8Low60Low132 Ų13299 Ų9962%0.61753%0.527SS*.Hα-helixtrans-67.6-33.5175.4-162166.850.200113L460 R466 T468L460-Q464 VanDerWaalsContact O-CB 3.31Å; L460-Q464 WeakPolarHBondContact O-CB 3.47Å; L460-Q464 PolarHBondContact O-N 2.84Å; Q464-R466 VanDerWaalsContact C-N 3.34Å; Q464-T468 PolarHBondContact O-N 3.37Å; Q464-T468 VanDerWaalsContact O-N 3.16Å; Q464-T468 PolarHBondContact O-OG1 3.48Å
465N57.2Low59.6Low100 Ų100100.7 Ų100.754%0.53553%0.532SS..Hα-helixtrans-68.1-32.6167.9-81.4-63.9000112.2S461 L462 D463 T468 V469S461-N465 WeakPolarHBondContact O-CB 3.18Å; S461-N465 PolarHBondContact O-N 3.11Å; S461-N465 PolarHBondContact O-ND2 2.97Å; L462-N465 PolarHBondContact O-N 2.93Å; D463-N465 PolarHBondContact O-N 3.02Å; N465-T468 WeakPolarHBondContact CA-OG1 3.2Å; N465-T468 PolarHBondContact O-OG1 2.88Å; N465-T468 VanDerWaalsContact O-OG1 3.07Å; N465-V469 WeakPolarHBondContact O-CB 3.47Å; N465-V469 VanDerWaalsContact O-CG2 3.28Å; N465-V469 WeakPolarHBondContact O-CG2 3.46Å; N465-V469 PolarHBondContact O-N 3.09Å
466R60.3Low59.3Low189 Ų189101.8 Ų101.871%0.71354%0.539SS*.Hα-helixtrans-71.5-39.3177.2-166.2-179.4-174.2-175.11.7112.2L462 D463 Q464 G470L462-R466 WeakPolarHBondContact O-CB 3.39Å; L462-R466 PolarHBondContact O-N 3.32Å; D463-R466 CarbonylContact O-C 3.44Å; D463-R466 WeakPolarHBondContact O-CA 3.47Å; D463-R466 VanDerWaalsContact O-CB 3.29Å; D463-R466 WeakPolarHBondContact O-CB 3.31Å; D463-R466 PolarHBondContact O-N 3.48Å; Q464-R466 VanDerWaalsContact C-N 3.34Å; R466-G470 PolarHBondContact O-N 3.17Å
467E63.9Low58.7Low135 Ų13599.3 Ų99.363%0.63154%0.535SS*.Hα-helixtrans-64.1-45.9173.2-72-176.1155.100111.8D463 G470 L471D463-E467 PolarHBondContact O-N 3.27Å; E467-G470 WeakPolarHBondContact O-CA 3.42Å; E467-G470 PolarHBondContact O-N 2.91Å; E467-G470 VanDerWaalsContact O-N 3.14Å; E467-L471 WeakPolarHBondContact O-CG 3.39Å; E467-L471 PolarHBondContact O-N 2.92Å
468T59.8Low57.9Low69 Ų6995.4 Ų95.442%0.42353%0.528SS..Hα-helixtrans-65.6-39.3177.945.70000112.9Q464 N465 G470 L471 C472Q464-T468 PolarHBondContact O-N 3.37Å; Q464-T468 VanDerWaalsContact O-N 3.16Å; Q464-T468 PolarHBondContact O-OG1 3.48Å; N465-T468 WeakPolarHBondContact CA-OG1 3.2Å; N465-T468 PolarHBondContact O-OG1 2.88Å; N465-T468 VanDerWaalsContact O-OG1 3.07Å; T468-G470 VanDerWaalsContact C-N 3.32Å; T468-G470 PolarHBondContact O-N 3.19Å; T468-L471 PolarHBondContact O-N 3.23Å; T468-C472 PolarHBondContact O-N 2.86Å; T468-C472 PolarHBondContact O-SG 3.32Å; T468-C472 VanDerWaalsContact O-SG 3.34Å
469V56.2Low57.5Low93 Ų9396.4 Ų96.456%0.56453%0.528SS*.Hα-helixtrans-63.8-36.5170.5169.90000111.9N465 S473N465-V469 WeakPolarHBondContact O-CB 3.47Å; N465-V469 VanDerWaalsContact O-CG2 3.28Å; N465-V469 WeakPolarHBondContact O-CG2 3.46Å; N465-V469 PolarHBondContact O-N 3.09Å; V469-S473 WeakPolarHBondContact O-CB 3.27Å; V469-S473 PolarHBondContact O-N 3.11Å; V469-S473 PolarHBondContact O-OG 2.89Å
470G54.8Low56.8Low39 Ų3995.4 Ų95.440%0.40253%0.528SS..Hα-helixtrans-62.8-44.6173.100000112.9R466 E467 T468 S473 S474R466-G470 PolarHBondContact O-N 3.17Å; E467-G470 WeakPolarHBondContact O-CA 3.42Å; E467-G470 PolarHBondContact O-N 2.91Å; E467-G470 VanDerWaalsContact O-N 3.14Å; T468-G470 VanDerWaalsContact C-N 3.32Å; T468-G470 PolarHBondContact O-N 3.19Å; G470-S473 WeakPolarHBondContact O-CB 3.47Å; G470-S473 PolarHBondContact O-N 3.13Å; G470-S474 PolarHBondContact O-N 2.6Å
471L53Low56Low107 Ų10793 Ų9356%0.5652%0.524SS*.Hα-helixtrans-62.1-50.5176.1-72164.7000111.4E467 T468 S473 S474 E475E467-L471 WeakPolarHBondContact O-CG 3.39Å; E467-L471 PolarHBondContact O-N 2.92Å; T468-L471 PolarHBondContact O-N 3.23Å; L471-S473 PolarHBondContact O-N 3.08Å; L471-S474 WeakPolarHBondContact O-CA 3.19Å; L471-S474 WeakPolarHBondContact O-CB 3.36Å; L471-S474 PolarHBondContact O-N 3.21Å; L471-S474 PolarHBondContact O-OG 3.27Å; L471-E475 PolarHBondContact O-N 2.83Å
472C46.4Very low55.3Low72 Ų7297 Ų9749%0.48654%0.537SS..Hα-helixtrans-57.5-32.9174.6-68.50000112.9T468 T476T468-C472 PolarHBondContact O-N 2.86Å; T468-C472 PolarHBondContact O-SG 3.32Å; T468-C472 VanDerWaalsContact O-SG 3.34Å; C472-T476 WeakPolarHBondContact O-CB 3.17Å; C472-T476 WeakPolarHBondContact O-CG2 3.47Å; C472-T476 PolarHBondContact O-N 3.09Å; C472-T476 PolarHBondContact O-OG1 3.47Å
473S49.3Very low54.5Low64 Ų6497 Ų9745%0.44854%0.537SS..Hα-helixtrans-70.8-32.5175-57.60000112.6V469 G470 L471 T476 S477V469-S473 WeakPolarHBondContact O-CB 3.27Å; V469-S473 PolarHBondContact O-N 3.11Å; V469-S473 PolarHBondContact O-OG 2.89Å; G470-S473 WeakPolarHBondContact O-CB 3.47Å; G470-S473 PolarHBondContact O-N 3.13Å; L471-S473 PolarHBondContact O-N 3.08Å; S473-T476 WeakPolarHBondContact CA-OG1 3.5Å; S473-T476 PolarHBondContact O-OG1 2.9Å; S473-S477 WeakPolarHBondContact O-CB 3.35Å; S473-S477 PolarHBondContact O-N 3.04Å; S473-S477 PolarHBondContact O-OG 2.71Å
474S51.6Low53.6Low65 Ų6597.2 Ų97.246%0.45554%0.538SS..Hα-helixtrans-73.2-39.9174.274.70000112.4G470 L471 S477 G478G470-S474 PolarHBondContact O-N 2.6Å; L471-S474 WeakPolarHBondContact O-CA 3.19Å; L471-S474 WeakPolarHBondContact O-CB 3.36Å; L471-S474 PolarHBondContact O-N 3.21Å; L471-S474 PolarHBondContact O-OG 3.27Å; S474-S477 WeakPolarHBondContact CA-OG 3.37Å; S474-S477 PolarHBondContact O-OG 3.17Å; S474-G478 PolarHBondContact O-N 2.82Å
475E50.7Low52.7Low130 Ų13096.6 Ų96.661%0.60754%0.535SS*.Hα-helixtrans-69-40.8177.2-66.6-174.6151.900112.1L471 G478 N479L471-E475 PolarHBondContact O-N 2.83Å; E475-G478 PolarHBondContact O-N 2.97Å; E475-N479 PolarHBondContact O-N 3.14Å; E475-N479 PolarHBondContact O-ND2 2.71Å
476T50.3Low52.4Low94 Ų9494.6 Ų94.658%0.57753%0.529SS*.Hα-helixtrans-69.1-33.8177.547.90000113C472 S473 K480C472-T476 WeakPolarHBondContact O-CB 3.17Å; C472-T476 WeakPolarHBondContact O-CG2 3.47Å; C472-T476 PolarHBondContact O-N 3.09Å; C472-T476 PolarHBondContact O-OG1 3.47Å; S473-T476 WeakPolarHBondContact CA-OG1 3.5Å; S473-T476 PolarHBondContact O-OG1 2.9Å; T476-K480 WeakPolarHBondContact O-CB 3.34Å; T476-K480 PolarHBondContact O-N 2.96Å; T476-K480 VanDerWaalsContact O-N 3.08Å
477S51.1Low51.8Low71 Ų7189.5 Ų89.550%0.49752%0.521SS..Hα-helixtrans-71.7-36.6173.649.80000112.8S473 S474 K480 A481S473-S477 WeakPolarHBondContact O-CB 3.35Å; S473-S477 PolarHBondContact O-N 3.04Å; S473-S477 PolarHBondContact O-OG 2.71Å; S474-S477 WeakPolarHBondContact CA-OG 3.37Å; S474-S477 PolarHBondContact O-OG 3.17Å; S477-K480 PolarHBondContact O-N 2.7Å; S477-A481 PolarHBondContact O-N 3.17Å; S477-A481 VanDerWaalsContact O-N 3.15Å
478G50.5Low51.1Low41 Ų4187.1 Ų87.142%0.42352%0.518SS..Hα-helixtrans-59.9-50.6170.700000112.8S474 E475 K480 A481 Q482S474-G478 PolarHBondContact O-N 2.82Å; E475-G478 PolarHBondContact O-N 2.97Å; G478-K480 VanDerWaalsContact C-N 3.27Å; G478-K480 PolarHBondContact O-N 2.8Å; G478-A481 PolarHBondContact O-N 3.38Å; G478-Q482 PolarHBondContact O-N 2.7Å
479N50.7Low50.5Low98 Ų9889.5 Ų89.552%0.52453%0.525SS..Hα-helixtrans-59.9-36.1176.5-78.6-70.2000112.6E475 Q482 L483E475-N479 PolarHBondContact O-N 3.14Å; E475-N479 PolarHBondContact O-ND2 2.71Å; N479-Q482 PolarHBondContact O-N 3.28Å; N479-L483 PolarHBondContact O-N 3.12Å
480K49.6Very low50Low136 Ų13691.2 Ų91.259%0.59153%0.53SS*.Hα-helixtrans-65.7-45.5178.2-169172.1-177.8178.80112.4T476 S477 G478 Q482 L483 D484T476-K480 WeakPolarHBondContact O-CB 3.34Å; T476-K480 PolarHBondContact O-N 2.96Å; T476-K480 VanDerWaalsContact O-N 3.08Å; S477-K480 PolarHBondContact O-N 2.7Å; G478-K480 VanDerWaalsContact C-N 3.27Å; G478-K480 PolarHBondContact O-N 2.8Å; K480-Q482 PolarHBondContact O-N 3.38Å; K480-L483 PolarHBondContact O-N 2.94Å; K480-D484 PolarHBondContact O-N 3.12Å
481A52.9Low49.5Very low62 Ų6293 Ų9351%0.51254%0.541SS..Hα-helixtrans-60-33.3175.300000112.6S477 G478 H485S477-A481 PolarHBondContact O-N 3.17Å; S477-A481 VanDerWaalsContact O-N 3.15Å; G478-A481 PolarHBondContact O-N 3.38Å; A481-H485 WeakPolarHBondContact O-CB 3.31Å; A481-H485 PolarHBondContact O-N 2.92Å
482Q49.3Very low49.2Very low138 Ų13892.6 Ų92.665%0.64555%0.547SS*.Hα-helixtrans-74.1-33.2179-154.6163.5-0.600112.4G478 N479 K480 S486G478-Q482 PolarHBondContact O-N 2.7Å; N479-Q482 PolarHBondContact O-N 3.28Å; K480-Q482 PolarHBondContact O-N 3.38Å; Q482-S486 PolarHBondContact O-N 3.39Å; Q482-S486 PolarHBondContact O-OG 3.36Å
483L50.8Low49.2Very low118 Ų11894.9 Ų94.962%0.61856%0.559SS**Hα-helixtrans-69.6-46.4169.7-78.1162.5000112.2N479 K480 H485 S486 C487N479-L483 PolarHBondContact O-N 3.12Å; K480-L483 PolarHBondContact O-N 2.94Å; L483-H485 VanDerWaalsContact C-N 3.33Å; L483-H485 PolarHBondContact O-N 3.38Å; L483-S486 WeakPolarHBondContact O-CB 3.48Å; L483-S486 PolarHBondContact O-N 3.28Å; L483-C487 PolarHBondContact O-N 3.14Å
484D48.7Very low48.8Very low88 Ų88102.4 Ų102.447%0.47159%0.593SS.*Hα-helixtrans-60.8-42.3179.4-69-28000111K480 S486 C487 C488K480-D484 PolarHBondContact O-N 3.12Å; D484-S486 VanDerWaalsContact C-N 3.31Å; D484-S486 PolarHBondContact O-N 2.75Å; D484-C487 PolarHBondContact O-N 3.11Å; D484-C488 PolarHBondContact O-N 2.79Å; D484-C488 PolarHBondContact O-SG 3.1Å; D484-C488 VanDerWaalsContact O-SG 3.37Å
485H50.6Low48.6Very low120 Ų120104.3 Ų104.356%0.55660%0.6SS**Hα-helixtrans-63.6-32.8173.7-164.7-45.3000113A481 L483 Q489A481-H485 WeakPolarHBondContact O-CB 3.31Å; A481-H485 PolarHBondContact O-N 2.92Å; L483-H485 VanDerWaalsContact C-N 3.33Å; L483-H485 PolarHBondContact O-N 3.38Å; H485-Q489 PolarHBondContact O-N 3.12Å
486S50.5Low48.5Very low58 Ų58102.9 Ų102.941%0.40660%0.6SS.*Hα-helixtrans-71.9-40.3176.3-58.80000111.6Q482 L483 D484 Q489 L490Q482-S486 PolarHBondContact O-N 3.39Å; Q482-S486 PolarHBondContact O-OG 3.36Å; L483-S486 WeakPolarHBondContact O-CB 3.48Å; L483-S486 PolarHBondContact O-N 3.28Å; D484-S486 VanDerWaalsContact C-N 3.31Å; D484-S486 PolarHBondContact O-N 2.75Å; S486-Q489 PolarHBondContact O-N 2.98Å; S486-L490 PolarHBondContact O-N 2.79Å; S486-L490 VanDerWaalsContact O-N 3.14Å
487C46.9Very low48.4Very low82 Ų82103.4 Ų103.455%0.55460%0.601SS**Hα-helixtrans-60.6-43.8173.2-88.40000112.2L483 D484 Q489 L490 A491L483-C487 PolarHBondContact O-N 3.14Å; D484-C487 PolarHBondContact O-N 3.11Å; C487-Q489 VanDerWaalsContact C-N 3.28Å; C487-Q489 PolarHBondContact O-N 3.14Å; C487-L490 PolarHBondContact O-N 3.5Å; C487-A491 WeakPolarHBondContact O-CB 3.15Å; C487-A491 PolarHBondContact O-N 3.25Å
488C48.9Very low48.3Very low84 Ų84105.4 Ų105.457%0.56861%0.607SS**Hα-helixtrans-62.3-32.7177.9-68.70000113.3D484 S492D484-C488 PolarHBondContact O-N 2.79Å; D484-C488 PolarHBondContact O-SG 3.1Å; D484-C488 VanDerWaalsContact O-SG 3.37Å; C488-S492 PolarHBondContact O-N 3.45Å; C488-S492 PolarHBondContact O-OG 3.15Å
489Q47Very low48.1Very low120 Ų120109.4 Ų109.456%0.56162%0.619SS**Hα-helixtrans-72.7-42.2175.5-74.2-179.6-26.500112.2H485 S486 C487 A491 S492 T493H485-Q489 PolarHBondContact O-N 3.12Å; S486-Q489 PolarHBondContact O-N 2.98Å; C487-Q489 VanDerWaalsContact C-N 3.28Å; C487-Q489 PolarHBondContact O-N 3.14Å; Q489-A491 VanDerWaalsContact C-N 3.35Å; Q489-A491 PolarHBondContact O-N 2.88Å; Q489-S492 WeakPolarHBondContact O-CB 3.28Å; Q489-S492 PolarHBondContact O-N 3.45Å; Q489-S492 VanDerWaalsContact O-N 3.1Å; Q489-T493 PolarHBondContact O-OG1 3Å; Q489-T493 VanDerWaalsContact O-OG1 3.08Å
490L45.8Very low48Very low128 Ų128110.1 Ų110.167%0.6763%0.625SS**Hα-helixtrans-62-42174.6-74.2167.2000112S486 C487 S492 T493S486-L490 PolarHBondContact O-N 2.79Å; S486-L490 VanDerWaalsContact O-N 3.14Å; C487-L490 PolarHBondContact O-N 3.5Å; L490-S492 PolarHBondContact O-N 3.12Å; L490-S492 VanDerWaalsContact O-N 3.14Å; L490-T493 PolarHBondContact O-N 3.42Å
491A45.4Very low47.8Very low76 Ų76108.3 Ų108.363%0.62863%0.627SS**THydrogen-bonded Turntrans-67.3-7.7175.400000114.5C487 Q489C487-A491 WeakPolarHBondContact O-CB 3.15Å; C487-A491 PolarHBondContact O-N 3.25Å; Q489-A491 VanDerWaalsContact C-N 3.35Å; Q489-A491 PolarHBondContact O-N 2.88Å
492S45.3Very low47.4Very low100 Ų100111.8 Ų111.870%0.69964%0.636SS**THydrogen-bonded Turntrans-99.86.8176.4-56.80000113.3C488 Q489 L490C488-S492 PolarHBondContact O-N 3.45Å; C488-S492 PolarHBondContact O-OG 3.15Å; Q489-S492 WeakPolarHBondContact O-CB 3.28Å; Q489-S492 PolarHBondContact O-N 3.45Å; Q489-S492 VanDerWaalsContact O-N 3.1Å; L490-S492 PolarHBondContact O-N 3.12Å; L490-S492 VanDerWaalsContact O-N 3.14Å
493T47.1Very low47.3Very low119 Ų119109.7 Ų109.773%0.7364%0.636SS**  trans-130.120.4-174.4-29.10000113.2Q489 L490Q489-T493 PolarHBondContact O-OG1 3Å; Q489-T493 VanDerWaalsContact O-OG1 3.08Å; L490-T493 PolarHBondContact O-N 3.42Å
494L40.5Very low47Very low223 Ų223108.9 Ų108.9100%1.16864%0.637SS**  trans-128.70173.1-76.9169.7000109.5

Retrieved 494 of 494 residues in 479.6 ms (Link to these results)