A0A087XHG2_POEFO Loading...

Family with sequence similarity 184 member A

AlphaFold DB , UniProt , Accession A0A087XHG2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,150 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M35.3Very low35.2Very low249 Ų249147.3 Ų147.3100%1.22779%0.791SS**  0135.40-49.5177-160.400106.7
2A33.9Very low35.5Very low87 Ų87144.4 Ų144.472%0.71979%0.789SS**  cis-154156.3-12.900000110.5
3T37.1Very low36.8Very low141 Ų141140.8 Ų140.887%0.86578%0.777SS**  trans8.9144.9149.7560000121
4G37.1Very low36.8Very low66 Ų66141.1 Ų141.168%0.6879%0.785SS**  cis150.2173.50.800000113.3
5S38.6Very low36.8Very low137 Ų137136.2 Ų136.296%0.95878%0.779SS**  trans71141.7170-52.70000118.9
6G34.7Very low36.7Very low62 Ų62140.9 Ų140.964%0.63979%0.792SS**  cis163.3150-14.500000117.7
7W34.7Very low36.4Very low236 Ų236136.8 Ų136.889%0.89479%0.789SS**  trans68.7149.8152.3-63.662.5000118.7
8Q36.6Very low36.5Very low147 Ų147139.7 Ų139.769%0.68779%0.79SS**  cis-139.3-103.58.8-164.6169.7-23.700116.8
9Q37Very low36.1Very low124 Ų124141.9 Ų141.958%0.57979%0.791SS**  trans-147.6-164.2-159.6-63.2164.2-61.600112.1
10Y32.6Very low36Very low173 Ų173141.1 Ų141.168%0.67879%0.79SS**  cis-171.2171.714.9-135.5-18.1000115
11Y30Very low36.7Very low198 Ų198140 Ų14078%0.77679%0.789SS**  trans74.7160.7156.6-89.6-81.2000125.1
12C38.5Very low36.3Very low113 Ų113135.9 Ų135.976%0.76477%0.771SS**  trans-167-164.4-171.8-145.30000108.2
13P52.6Low36.2Very low98 Ų98136.5 Ų136.564%0.63677%0.77SS**  cis-144.9-155.50.343.9-20.1000117.2
14T36.7Very low35.9Very low145 Ų145136.3 Ų136.389%0.8977%0.768SS**  trans72.1156.1161.950.90000120.9
15G36.6Very low35.6Very low67 Ų67137.3 Ų137.369%0.69177%0.771SS**  cis165.6165.6-10.400000116.2
16Q35.4Very low35.2Very low212 Ų212136.2 Ų136.299%0.99176%0.763SS**  trans74.4158.4169.1-51.6-177.4-2.800120.2
17G32Very low35.1Very low71 Ų71143.4 Ų143.473%0.73278%0.777SS**  cis161135.4-20.400000119.5
18K37.2Very low34.9Very low188 Ų188140.9 Ų140.982%0.81778%0.775SS**  trans74.4165.7161.4-58.9-175.2177.9179.50119.3
19F28.7Very low34.5Very low183 Ų183139.9 Ų139.980%0.80378%0.784SS**  cis-156.3168.530.1-110.6-78.1000116.2
20T34.4Very low34.2Very low125 Ų125137.1 Ų137.177%0.76779%0.789SS**  trans-149.4153.2166.957.10000112.1
21P50.4Low34.6Very low119 Ų119135.7 Ų135.777%0.77380%0.798SS**  -150.8-152.7105.236.6-13.6000112.7
22L28.4Very low34.8Very low162 Ų162131 Ų13185%0.84880%0.8SS**  cis-156.4-156.85.1-157.680.9000110.9
23S31.1Very low34.8Very low99 Ų99133.8 Ų133.869%0.69280%0.804SS**  trans-148.2171.7-166.7-59.30000117.4
24T30.5Very low34.3Very low137 Ų137138.6 Ų138.684%0.8482%0.818SS**  trans86.1118144.830.50000125.9
25A31.3Very low34.6Very low88 Ų88140.8 Ų140.873%0.72781%0.811SS**  89.3132.5121.300000125.7
26S30Very low35.2Very low113 Ų113142.8 Ų142.879%0.7981%0.81SS**  trans65.7134144.4-62.20000123.7
27F32.5Very low36.3Very low213 Ų213141.4 Ų141.493%0.93480%0.804SS**  -165.4172.5122.5-118.8-81.5000112.4
28Q30.6Very low37.8Very low183 Ų183142 Ų14286%0.85579%0.79SS**  trans-142.2171.8-168.7-147-172.122.500112.9
29S28.7Very low39.2Very low126 Ų126136.7 Ų136.788%0.88177%0.77SS**  trans84.3158.3170.7-150.70000117
30G30.6Very low40.9Very low66 Ų66134.4 Ų134.468%0.6876%0.762SS**  trans-136.4179.7-166.200000114.7
31V41Very low42.7Very low144 Ų144133.2 Ų133.287%0.87375%0.75SS**  trans-132.7134.7-179.4178.40000109
32A33.2Very low43.8Very low98 Ų98135.2 Ų135.281%0.8174%0.742SS**  trans-90.8130.9172.600000110.7
33M38.9Very low45.8Very low173 Ų173132.7 Ų132.785%0.85273%0.727SS**  trans-147.3139.3160.1-109.5-176.1175.400108.9Y35M33-Y35 PolarHBondContact O-N 3.17Å
34E42.8Very low47.6Very low199 Ų199130.7 Ų130.793%0.9371%0.713SS**  trans-71.7111.8-176.5-63.8179119.700110.7
35Y43Very low49.7Very low190 Ų190130.9 Ų130.975%0.74570%0.703SS**  trans-126.9136.8164.3-103.9-88.5000109.5M33 L39M33-Y35 PolarHBondContact O-N 3.17Å; Y35-L39 HydrophobicContact CD1-CD2 3.48Å; Y35-L39 VanDerWaalsContact CD1-CD2 3.48Å; Y35-L39 HydrophobicContact CE1-CD2 3.84Å; Y35-L39 HydrophobicContact CG-CD2 4.4Å
36T47.8Very low52Low110 Ų110133.1 Ų133.168%0.67570%0.696SS**  trans-64.5142.7-168.6500000112.5D38 L39T36-D38 PolarHBondContact O-N 2.89Å; T36-L39 PolarHBondContact O-N 2.84Å
37Q59.6Low54.3Low183 Ų183132.2 Ų132.286%0.85568%0.682SS**Hα-helixtrans-56.7-22.9-167.6-165171.23.100114.7
38D62.1Low56.1Low84 Ų84125 Ų12545%0.44966%0.661SS.*Hα-helixtrans-73.4-32.6176.5-174.752.6000113.6T36 L41 R42T36-D38 PolarHBondContact O-N 2.89Å; D38-L41 PolarHBondContact O-N 3.49Å; D38-R42 WeakPolarHBondContact O-CG 3.46Å; D38-R42 PolarHBondContact O-N 3.26Å; D38-R42 IonicContact OD1-NE 3.65Å; D38-R42 IonicContact OD1-NH2 3.03Å; D38-R42 IonicContact OD2-CZ 2.85Å; D38-R42 IonicContact OD2-NE 3.63Å; D38-R42 PolarHBondContact OD2-NE 3Å; D38-R42 IonicContact OD2-NH2 2.72Å; D38-R42 PolarHBondContact OD2-NH2 3.46Å
39L67.9Low58.1Low76 Ų76122.4 Ų122.440%0.39865%0.649SS.*Hα-helixtrans-68.1-43.1179.8-175.764000111.4Y35 T36 L41 R42 M43Y35-L39 HydrophobicContact CD1-CD2 3.48Å; Y35-L39 VanDerWaalsContact CD1-CD2 3.48Å; Y35-L39 HydrophobicContact CE1-CD2 3.84Å; Y35-L39 HydrophobicContact CG-CD2 4.4Å; T36-L39 PolarHBondContact O-N 2.84Å; L39-L41 VanDerWaalsContact C-N 3.29Å; L39-L41 PolarHBondContact O-N 2.68Å; L39-R42 PolarHBondContact O-N 3.46Å; L39-M43 PolarHBondContact O-N 3.39Å
40H64.8Low60.4Low134 Ų134121.2 Ų121.262%0.6263%0.632SS**Hα-helixtrans-62.5-37.7179.2-157.3-60.9000111.4R42 M43 S44H40-R42 VanDerWaalsContact C-N 3.35Å; H40-R42 PolarHBondContact O-N 3.49Å; H40-M43 PolarHBondContact O-N 2.96Å; H40-S44 PolarHBondContact O-N 3.27Å; H40-S44 PolarHBondContact O-OG 3.4Å
41L70.8Confident62.4Low100 Ų100122.1 Ų122.152%0.52462%0.624SS.*Hα-helixtrans-64.7-38176.6-15780.5000112.2D38 L39 K45D38-L41 PolarHBondContact O-N 3.49Å; L39-L41 VanDerWaalsContact C-N 3.29Å; L39-L41 PolarHBondContact O-N 2.68Å; L41-K45 WeakPolarHBondContact O-CG 3.45Å; L41-K45 PolarHBondContact O-N 3.09Å; L41-K45 VanDerWaalsContact O-N 3.15Å
42R74.7Confident64.2Low161 Ų161123.1 Ų123.161%0.60862%0.617SS**Hα-helixtrans-68.4-41.9175.2-65.7173.5-168-138.47.8111.6D38 L39 H40 K45 K46D38-R42 WeakPolarHBondContact O-CG 3.46Å; D38-R42 PolarHBondContact O-N 3.26Å; D38-R42 IonicContact OD1-NE 3.65Å; D38-R42 IonicContact OD1-NH2 3.03Å; D38-R42 IonicContact OD2-CZ 2.85Å; D38-R42 IonicContact OD2-NE 3.63Å; D38-R42 PolarHBondContact OD2-NE 3Å; D38-R42 IonicContact OD2-NH2 2.72Å; D38-R42 PolarHBondContact OD2-NH2 3.46Å; L39-R42 PolarHBondContact O-N 3.46Å; H40-R42 VanDerWaalsContact C-N 3.35Å; H40-R42 PolarHBondContact O-N 3.49Å; R42-K45 PolarHBondContact O-N 3.23Å; R42-K46 PolarHBondContact O-N 3.34Å; R42-K46 VanDerWaalsContact O-N 3.07Å
43M70.3Confident66.5Low109 Ų109122.5 Ų122.554%0.53760%0.603SS.*Hα-helixtrans-61.4-50.6173.4-81.1179.960.900112L39 H40 K45 K46 I47L39-M43 PolarHBondContact O-N 3.39Å; H40-M43 PolarHBondContact O-N 2.96Å; M43-K45 VanDerWaalsContact C-N 3.29Å; M43-K45 PolarHBondContact O-N 3.32Å; M43-K46 WeakPolarHBondContact O-CB 3.36Å; M43-K46 PolarHBondContact O-N 3.32Å; M43-I47 WeakPolarHBondContact O-CG1 3.43Å; M43-I47 PolarHBondContact O-N 3.19Å
44S67.9Low68.3Low57 Ų57118.7 Ų118.740%0.39959%0.585SS.*Hα-helixtrans-57.9-38.9178.9-630000112.6H40 A48H40-S44 PolarHBondContact O-N 3.27Å; H40-S44 PolarHBondContact O-OG 3.4Å; S44-A48 WeakPolarHBondContact O-CB 3.47Å; S44-A48 PolarHBondContact O-N 3.26Å
45K74.8Confident70.1Confident141 Ų141117.4 Ų117.461%0.61357%0.573SS**Hα-helixtrans-64.8-40.8173-77.2179.9177.4178.50112.8L41 R42 M43 A48 Q49L41-K45 WeakPolarHBondContact O-CG 3.45Å; L41-K45 PolarHBondContact O-N 3.09Å; L41-K45 VanDerWaalsContact O-N 3.15Å; R42-K45 PolarHBondContact O-N 3.23Å; M43-K45 VanDerWaalsContact C-N 3.29Å; M43-K45 PolarHBondContact O-N 3.32Å; K45-A48 PolarHBondContact O-N 3.12Å; K45-Q49 PolarHBondContact O-N 3.19Å
46K80.3Confident71.7Confident135 Ų135111.2 Ų111.259%0.58756%0.561SS**Hα-helixtrans-67-42.3178.3-151.376.6174.7-177.80111.6R42 M43 Q49 L50R42-K46 PolarHBondContact O-N 3.34Å; R42-K46 VanDerWaalsContact O-N 3.07Å; M43-K46 WeakPolarHBondContact O-CB 3.36Å; M43-K46 PolarHBondContact O-N 3.32Å; K46-Q49 PolarHBondContact O-N 2.93Å; K46-L50 WeakPolarHBondContact O-CG 3.26Å; K46-L50 PolarHBondContact O-N 3Å
47I77.3Confident73.3Confident95 Ų95111.3 Ų111.349%0.48756%0.557SS.*Hα-helixtrans-60.5-51.6173.5-66.3165.9000109.6M43 Q49 L50 T51M43-I47 WeakPolarHBondContact O-CG1 3.43Å; M43-I47 PolarHBondContact O-N 3.19Å; I47-Q49 VanDerWaalsContact C-N 3.31Å; I47-Q49 PolarHBondContact O-N 3.48Å; I47-L50 CarbonylContact O-C 3.57Å; I47-L50 PolarHBondContact O-N 3.28Å; I47-T51 PolarHBondContact O-N 3.36Å; I47-T51 PolarHBondContact O-OG1 3.41Å; I47-T51 VanDerWaalsContact O-OG1 3.05Å
48A70.8Confident74.2Confident60 Ų60106.9 Ų106.950%0.49654%0.539SS..Hα-helixtrans-60-36.4179.600000113.4S44 K45 K52S44-A48 WeakPolarHBondContact O-CB 3.47Å; S44-A48 PolarHBondContact O-N 3.26Å; K45-A48 PolarHBondContact O-N 3.12Å; A48-K52 WeakPolarHBondContact O-CB 3.36Å; A48-K52 PolarHBondContact O-N 3.1Å
49Q73.7Confident75Confident129 Ų129104.9 Ų104.960%0.60353%0.53SS*.Hα-helixtrans-64.3-46.2171.4-79.2-173-47.100112K45 K46 I47 K52 V53K45-Q49 PolarHBondContact O-N 3.19Å; K46-Q49 PolarHBondContact O-N 2.93Å; I47-Q49 VanDerWaalsContact C-N 3.31Å; I47-Q49 PolarHBondContact O-N 3.48Å; Q49-K52 PolarHBondContact O-N 3.35Å; Q49-V53 WeakPolarHBondContact O-CG2 3.4Å; Q49-V53 PolarHBondContact O-N 3.22Å
50L75.9Confident75.6Confident102 Ų102106.7 Ų106.753%0.53454%0.535SS..Hα-helixtrans-62.9-45.9177-72.7167.5000111.5K46 I47 K52 V53 I54K46-L50 WeakPolarHBondContact O-CG 3.26Å; K46-L50 PolarHBondContact O-N 3Å; I47-L50 CarbonylContact O-C 3.57Å; I47-L50 PolarHBondContact O-N 3.28Å; L50-K52 VanDerWaalsContact C-N 3.3Å; L50-K52 PolarHBondContact O-N 3.31Å; L50-V53 PolarHBondContact O-N 3.31Å; L50-V53 VanDerWaalsContact O-N 3.16Å; L50-I54 WeakPolarHBondContact O-CB 3.46Å; L50-I54 VanDerWaalsContact O-CG1 3.26Å; L50-I54 WeakPolarHBondContact O-CG1 3.45Å; L50-I54 PolarHBondContact O-N 3.36Å
51T73.6Confident76.5Confident84 Ų84104 Ų10452%0.51553%0.525SS..Hα-helixtrans-57.7-41175-54.40000111.8I47 Y55I47-T51 PolarHBondContact O-N 3.36Å; I47-T51 PolarHBondContact O-OG1 3.41Å; I47-T51 VanDerWaalsContact O-OG1 3.05Å; T51-Y55 VanDerWaalsContact O-CB 3.31Å; T51-Y55 WeakPolarHBondContact O-CB 3.48Å; T51-Y55 PolarHBondContact O-N 3.42Å
52K77.3Confident77.1Confident165 Ų165103.7 Ų103.772%0.71752%0.524SS*.Hα-helixtrans-67.4-37.7176.9-173.1172.1-178.7176.70112.7A48 Q49 L50 A56A48-K52 WeakPolarHBondContact O-CB 3.36Å; A48-K52 PolarHBondContact O-N 3.1Å; Q49-K52 PolarHBondContact O-N 3.35Å; L50-K52 VanDerWaalsContact C-N 3.3Å; L50-K52 PolarHBondContact O-N 3.31Å; K52-A56 WeakPolarHBondContact O-CB 3.33Å; K52-A56 PolarHBondContact O-N 3.42Å
53V81.6Confident77.4Confident85 Ų85101.6 Ų101.652%0.51552%0.521SS..Hα-helixtrans-71.3-41.8176.4171.90000111.3Q49 L50 A56 L57Q49-V53 WeakPolarHBondContact O-CG2 3.4Å; Q49-V53 PolarHBondContact O-N 3.22Å; L50-V53 PolarHBondContact O-N 3.31Å; L50-V53 VanDerWaalsContact O-N 3.16Å; V53-A56 PolarHBondContact O-N 2.71Å; V53-L57 HydrophobicContact CG1-CD1 3.95Å; V53-L57 WeakPolarHBondContact O-CB 3.26Å; V53-L57 WeakPolarHBondContact O-CG 3.36Å; V53-L57 PolarHBondContact O-N 3.04Å
54I78.2Confident78Confident94 Ų94101.3 Ų101.348%0.48252%0.518SS..Hα-helixtrans-62.4-45.2174.8-68.7163.5000110.2L50 A56 L57 N58L50-I54 WeakPolarHBondContact O-CB 3.46Å; L50-I54 VanDerWaalsContact O-CG1 3.26Å; L50-I54 WeakPolarHBondContact O-CG1 3.45Å; L50-I54 PolarHBondContact O-N 3.36Å; I54-A56 PolarHBondContact O-N 3.2Å; I54-L57 PolarHBondContact O-N 3.34Å; I54-N58 WeakPolarHBondContact O-CB 3.41Å; I54-N58 PolarHBondContact O-N 3.24Å; I54-N58 PolarHBondContact O-OD1 3.46Å
55Y80.8Confident78.9Confident171 Ų171104.2 Ų104.267%0.67153%0.525SS*.Hα-helixtrans-59.9-47.7175.9-170.7-83000111.4T51 L57 N58 T59T51-Y55 VanDerWaalsContact O-CB 3.31Å; T51-Y55 WeakPolarHBondContact O-CB 3.48Å; T51-Y55 PolarHBondContact O-N 3.42Å; Y55-L57 VanDerWaalsContact C-N 3.33Å; Y55-L57 PolarHBondContact O-N 3.24Å; Y55-N58 PolarHBondContact O-N 2.99Å; Y55-T59 VanDerWaalsContact CE1-OG1 3.26Å; Y55-T59 WeakPolarHBondContact CE1-OG1 3.36Å; Y55-T59 PolarHBondContact O-N 3.2Å; Y55-T59 PolarHBondContact O-OG1 3.13Å; Y55-T59 VanDerWaalsContact O-OG1 3.07Å
56A75.7Confident79.3Confident60 Ų60100.2 Ų100.250%0.49652%0.518SS..Hα-helixtrans-65.3-32.6178.800000113.6K52 V53 I54 K60K52-A56 WeakPolarHBondContact O-CB 3.33Å; K52-A56 PolarHBondContact O-N 3.42Å; V53-A56 PolarHBondContact O-N 2.71Å; I54-A56 PolarHBondContact O-N 3.2Å; A56-K60 WeakPolarHBondContact O-CB 3.23Å; A56-K60 PolarHBondContact O-N 3.17Å
57L80.9Confident79.4Confident112 Ų11296.3 Ų96.359%0.58651%0.511SS*.Hα-helixtrans-72.3-43.1173-81.2167.8000111.9V53 I54 Y55 K60 N61V53-L57 HydrophobicContact CG1-CD1 3.95Å; V53-L57 WeakPolarHBondContact O-CB 3.26Å; V53-L57 WeakPolarHBondContact O-CG 3.36Å; V53-L57 PolarHBondContact O-N 3.04Å; I54-L57 PolarHBondContact O-N 3.34Å; Y55-L57 VanDerWaalsContact C-N 3.33Å; Y55-L57 PolarHBondContact O-N 3.24Å; L57-K60 PolarHBondContact O-N 3.49Å; L57-N61 WeakPolarHBondContact O-CB 3.38Å; L57-N61 PolarHBondContact O-N 2.91Å
58N78.7Confident79.7Confident90 Ų9096.2 Ų96.248%0.48151%0.511SS..Hα-helixtrans-63.8-52.4176.8-78.230.7000110.7I54 Y55 K60 N61 D62I54-N58 WeakPolarHBondContact O-CB 3.41Å; I54-N58 PolarHBondContact O-N 3.24Å; I54-N58 PolarHBondContact O-OD1 3.46Å; Y55-N58 PolarHBondContact O-N 2.99Å; N58-K60 PolarHBondContact O-N 3.48Å; N58-K60 VanDerWaalsContact O-N 3.16Å; N58-N61 CarbonylContact O-C 3.5Å; N58-N61 WeakPolarHBondContact O-CA 3.45Å; N58-N61 WeakPolarHBondContact O-CB 3.3Å; N58-N61 PolarHBondContact O-N 2.92Å; N58-D62 PolarHBondContact O-N 3.04Å
59T79.6Confident80.3Confident43 Ų4395.9 Ų95.926%0.26451%0.508SS..Hα-helixtrans-55.1-39176.8-56.30000111.9Y55 D62 E63Y55-T59 VanDerWaalsContact CE1-OG1 3.26Å; Y55-T59 WeakPolarHBondContact CE1-OG1 3.36Å; Y55-T59 PolarHBondContact O-N 3.2Å; Y55-T59 PolarHBondContact O-OG1 3.13Å; Y55-T59 VanDerWaalsContact O-OG1 3.07Å; T59-D62 PolarHBondContact O-N 3.19Å; T59-E63 WeakPolarHBondContact O-CB 3.33Å; T59-E63 WeakPolarHBondContact O-CG 3.19Å; T59-E63 PolarHBondContact O-N 3.39Å
60K79.8Confident80.8Confident114 Ų11493.8 Ų93.850%0.49650%0.504SS..Hα-helixtrans-70.8-31.4175.1-170.6171.4-178.5-178.40113.4A56 L57 N58 H64A56-K60 WeakPolarHBondContact O-CB 3.23Å; A56-K60 PolarHBondContact O-N 3.17Å; L57-K60 PolarHBondContact O-N 3.49Å; N58-K60 PolarHBondContact O-N 3.48Å; N58-K60 VanDerWaalsContact O-N 3.16Å; K60-H64 VanDerWaalsContact CE-NE2 3.3Å; K60-H64 WeakPolarHBondContact CE-NE2 3.47Å; K60-H64 WeakPolarHBondContact O-CB 3.38Å; K60-H64 PolarHBondContact O-CD2 3.16Å; K60-H64 PolarHBondContact O-N 3.12Å
61N83.5Confident81.2Confident78 Ų7894.2 Ų94.242%0.41751%0.506SS..Hα-helixtrans-70.2-42.5171.9-171.385.1000111L57 N58 E63 H64 E65L57-N61 WeakPolarHBondContact O-CB 3.38Å; L57-N61 PolarHBondContact O-N 2.91Å; N58-N61 CarbonylContact O-C 3.5Å; N58-N61 WeakPolarHBondContact O-CA 3.45Å; N58-N61 WeakPolarHBondContact O-CB 3.3Å; N58-N61 PolarHBondContact O-N 2.92Å; N61-E63 VanDerWaalsContact C-N 3.34Å; N61-E63 PolarHBondContact O-N 3.49Å; N61-H64 CarbonylContact O-C 3.46Å; N61-H64 PolarHBondContact O-N 2.77Å; N61-H64 VanDerWaalsContact O-N 3.1Å; N61-E65 PolarHBondContact ND2-OE1 3.31Å; N61-E65 PolarHBondContact O-N 3.37Å
62D83.6Confident81.8Confident92 Ų9296.8 Ų96.849%0.49251%0.51SS..Hα-helixtrans-60.5-42.7174.6-51.9-30.2000110.6N58 T59 E65 A66N58-D62 PolarHBondContact O-N 3.04Å; T59-D62 PolarHBondContact O-N 3.19Å; D62-E65 PolarHBondContact O-N 3.18Å; D62-A66 VanDerWaalsContact O-CB 3.31Å; D62-A66 WeakPolarHBondContact O-CB 3.48Å; D62-A66 PolarHBondContact O-N 2.91Å
63E82Confident82.2Confident118 Ų11894.9 Ų94.955%0.55150%0.504SS*.Hα-helixtrans-60.1-41.4171.1-76.5167-175.800112.3T59 N61 A67T59-E63 WeakPolarHBondContact O-CB 3.33Å; T59-E63 WeakPolarHBondContact O-CG 3.19Å; T59-E63 PolarHBondContact O-N 3.39Å; N61-E63 VanDerWaalsContact C-N 3.34Å; N61-E63 PolarHBondContact O-N 3.49Å; E63-A67 WeakPolarHBondContact O-CB 3.41Å; E63-A67 PolarHBondContact O-N 2.99Å
64H82.8Confident82.3Confident102 Ų10293 Ų9347%0.47250%0.497SS..Hα-helixtrans-71.5-38.7177-76.9-45.9000112.9K60 N61 A67 I68K60-H64 VanDerWaalsContact CE-NE2 3.3Å; K60-H64 WeakPolarHBondContact CE-NE2 3.47Å; K60-H64 WeakPolarHBondContact O-CB 3.38Å; K60-H64 PolarHBondContact O-CD2 3.16Å; K60-H64 PolarHBondContact O-N 3.12Å; N61-H64 CarbonylContact O-C 3.46Å; N61-H64 PolarHBondContact O-N 2.77Å; N61-H64 VanDerWaalsContact O-N 3.1Å; H64-A67 PolarHBondContact O-N 3.01Å; H64-I68 VanDerWaalsContact O-CG1 3.29Å; H64-I68 WeakPolarHBondContact O-CG1 3.16Å; H64-I68 PolarHBondContact O-N 3.02Å
65E85.4Confident82.6Confident119 Ų11993.7 Ų93.756%0.55650%0.498SS*.Hα-helixtrans-67.3-39.5174.9-74.6-175.5-15700111.3N61 D62 I68 A69N61-E65 PolarHBondContact ND2-OE1 3.31Å; N61-E65 PolarHBondContact O-N 3.37Å; D62-E65 PolarHBondContact O-N 3.18Å; E65-I68 PolarHBondContact O-N 3.5Å; E65-A69 WeakPolarHBondContact O-CB 3.23Å; E65-A69 PolarHBondContact O-N 3.44Å
66A83.2Confident82.9Confident56 Ų5691.9 Ų91.946%0.46350%0.496SS..Hα-helixtrans-61.2-43.4171.700000112.3D62 I68 A69 T70D62-A66 VanDerWaalsContact O-CB 3.31Å; D62-A66 WeakPolarHBondContact O-CB 3.48Å; D62-A66 PolarHBondContact O-N 2.91Å; A66-I68 VanDerWaalsContact C-N 3.31Å; A66-I68 PolarHBondContact O-N 3.34Å; A66-A69 WeakPolarHBondContact O-CB 3.47Å; A66-A69 PolarHBondContact O-N 2.92Å; A66-T70 PolarHBondContact O-N 3.33Å; A66-T70 VanDerWaalsContact O-N 3.07Å; A66-T70 PolarHBondContact O-OG1 3Å
67A82.2Confident83.4Confident54 Ų5495.4 Ų95.445%0.44650%0.502SS..Hα-helixtrans-67.2-28.6176.200000113.5E63 H64 T70 L71E63-A67 WeakPolarHBondContact O-CB 3.41Å; E63-A67 PolarHBondContact O-N 2.99Å; H64-A67 PolarHBondContact O-N 3.01Å; A67-T70 PolarHBondContact O-OG1 3.45Å; A67-L71 WeakPolarHBondContact O-CB 3.23Å; A67-L71 PolarHBondContact O-N 3.4Å
68I83.9Confident83.6Confident93 Ų9395.1 Ų95.148%0.47750%0.498SS..Hα-helixtrans-76.6-33172.5-70.8165.7000111H64 E65 A66 K72H64-I68 VanDerWaalsContact O-CG1 3.29Å; H64-I68 WeakPolarHBondContact O-CG1 3.16Å; H64-I68 PolarHBondContact O-N 3.02Å; E65-I68 PolarHBondContact O-N 3.5Å; A66-I68 VanDerWaalsContact C-N 3.31Å; A66-I68 PolarHBondContact O-N 3.34Å; I68-K72 HydrophobicContact CG2-CD 4.39Å; I68-K72 WeakPolarHBondContact O-CG 3.24Å; I68-K72 PolarHBondContact O-N 2.94Å
69A83.5Confident84Confident52 Ų5294.8 Ų94.843%0.4350%0.499SS..Hα-helixtrans-65.8-50.4176.100000111.6E65 A66 L71 K72 E73E65-A69 WeakPolarHBondContact O-CB 3.23Å; E65-A69 PolarHBondContact O-N 3.44Å; A66-A69 WeakPolarHBondContact O-CB 3.47Å; A66-A69 PolarHBondContact O-N 2.92Å; A69-L71 VanDerWaalsContact C-N 3.31Å; A69-L71 PolarHBondContact O-N 2.98Å; A69-K72 WeakPolarHBondContact O-CB 3Å; A69-K72 PolarHBondContact O-N 3.31Å; A69-K72 VanDerWaalsContact O-N 3.12Å; A69-E73 PolarHBondContact O-N 2.79Å
70T84.1Confident84.3Confident85 Ų8599.1 Ų99.152%0.52152%0.516SS..Hα-helixtrans-64.2-33.9179.254.40000112.9A66 A67 E73 A74A66-T70 PolarHBondContact O-N 3.33Å; A66-T70 VanDerWaalsContact O-N 3.07Å; A66-T70 PolarHBondContact O-OG1 3Å; A67-T70 PolarHBondContact O-OG1 3.45Å; T70-E73 PolarHBondContact O-N 3.47Å; T70-A74 WeakPolarHBondContact O-CB 3.35Å; T70-A74 PolarHBondContact O-N 3.04Å
71L84.9Confident84.6Confident111 Ų11199.3 Ų99.358%0.58152%0.519SS*.Hα-helixtrans-68.2-33.3174.7-171.667.1000112.7A67 A69 H75A67-L71 WeakPolarHBondContact O-CB 3.23Å; A67-L71 PolarHBondContact O-N 3.4Å; A69-L71 VanDerWaalsContact C-N 3.31Å; A69-L71 PolarHBondContact O-N 2.98Å; L71-H75 PolarHBondContact O-N 3.08Å
72K85.4Confident84.8Confident139 Ų139100.5 Ų100.560%0.60452%0.524SS*.Hα-helixtrans-70.5-44.7173.2-75171178.5176.40111.7I68 A69 H75 E76I68-K72 HydrophobicContact CG2-CD 4.39Å; I68-K72 WeakPolarHBondContact O-CG 3.24Å; I68-K72 PolarHBondContact O-N 2.94Å; A69-K72 WeakPolarHBondContact O-CB 3Å; A69-K72 PolarHBondContact O-N 3.31Å; A69-K72 VanDerWaalsContact O-N 3.12Å; K72-H75 PolarHBondContact O-N 2.93Å; K72-E76 WeakPolarHBondContact O-CB 3.27Å; K72-E76 PolarHBondContact O-N 3.43Å
73E85.7Confident84.8Confident125 Ų125100.6 Ų100.658%0.58452%0.524SS*.Hα-helixtrans-58.1-48.7178.4-166.2163.9-144.800110.4A69 T70 H75 E76 E77A69-E73 PolarHBondContact O-N 2.79Å; T70-E73 PolarHBondContact O-N 3.47Å; E73-H75 PolarHBondContact O-N 2.95Å; E73-E76 PolarHBondContact O-N 2.98Å; E73-E76 VanDerWaalsContact O-N 3.13Å; E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 3.41Å
74A84.1Confident84.9Confident45 Ų4598.2 Ų98.237%0.37252%0.521SS..Hα-helixtrans-59.2-42.6174.900000113.7T70 E76 E77 E78T70-A74 WeakPolarHBondContact O-CB 3.35Å; T70-A74 PolarHBondContact O-N 3.04Å; A74-E76 VanDerWaalsContact C-N 3.35Å; A74-E77 PolarHBondContact O-N 2.86Å; A74-E78 WeakPolarHBondContact O-CG 3.31Å; A74-E78 PolarHBondContact O-N 2.8Å
75H85Confident85.1Confident108 Ų10896.6 Ų96.650%0.551%0.513SS..Hα-helixtrans-68.1-31.8175.3-91.1-40000113.2L71 K72 E73 E78 V79L71-H75 PolarHBondContact O-N 3.08Å; K72-H75 PolarHBondContact O-N 2.93Å; E73-H75 PolarHBondContact O-N 2.95Å; H75-E78 IonicContact CE1-OE2 3Å; H75-E78 PolarHBondContact CE1-OE2 3.34Å; H75-E78 IonicContact CG-OE2 2.66Å; H75-E78 IonicContact ND1-OE2 2.67Å; H75-E78 PolarHBondContact ND1-OE2 3.33Å; H75-V79 VanDerWaalsContact O-CG2 3.31Å; H75-V79 WeakPolarHBondContact O-CG2 3.25Å; H75-V79 PolarHBondContact O-N 3.25Å
76E87.3Confident85.1Confident133 Ų13394 Ų9462%0.62151%0.506SS*.Hα-helixtrans-74-32.9177-165.2154.2-148.400111.3K72 E73 A74 Q80K72-E76 WeakPolarHBondContact O-CB 3.27Å; K72-E76 PolarHBondContact O-N 3.43Å; E73-E76 PolarHBondContact O-N 2.98Å; E73-E76 VanDerWaalsContact O-N 3.13Å; A74-E76 VanDerWaalsContact C-N 3.35Å; E76-Q80 WeakPolarHBondContact O-CG 3.19Å; E76-Q80 PolarHBondContact O-N 3.01Å; E76-Q80 VanDerWaalsContact O-N 3.12Å
77E86.1Confident85.1Confident134 Ų134100.1 Ų100.163%0.62652%0.517SS*.Hα-helixtrans-63.7-48.8166.7-69.9-176.3148.500112.2E73 A74 V79 Q80 Q81E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 3.41Å; A74-E77 PolarHBondContact O-N 2.86Å; E77-V79 VanDerWaalsContact C-N 3.32Å; E77-V79 PolarHBondContact O-N 3.46Å; E77-Q80 PolarHBondContact O-N 3.47Å; E77-Q80 VanDerWaalsContact O-N 3.15Å; E77-Q81 PolarHBondContact O-N 3.36Å
78E85.5Confident85.3Confident107 Ų107103 Ų10350%0.552%0.521SS..Hα-helixtrans-54.9-45.6175.5-77.5-179.8159.700112A74 H75 Q80 Q81 I82A74-E78 WeakPolarHBondContact O-CG 3.31Å; A74-E78 PolarHBondContact O-N 2.8Å; H75-E78 IonicContact CE1-OE2 3Å; H75-E78 PolarHBondContact CE1-OE2 3.34Å; H75-E78 IonicContact CG-OE2 2.66Å; H75-E78 IonicContact ND1-OE2 2.67Å; H75-E78 PolarHBondContact ND1-OE2 3.33Å; E78-Q80 PolarHBondContact O-N 2.96Å; E78-Q81 PolarHBondContact O-N 3.43Å; E78-I82 WeakPolarHBondContact O-CG1 3.28Å; E78-I82 PolarHBondContact O-N 2.89Å
79V86.1Confident85.5Confident83 Ų83103.1 Ų103.150%0.50352%0.518SS..Hα-helixtrans-64.6-39.4178.6168.60000111.5H75 E77 I82 L83H75-V79 VanDerWaalsContact O-CG2 3.31Å; H75-V79 WeakPolarHBondContact O-CG2 3.25Å; H75-V79 PolarHBondContact O-N 3.25Å; E77-V79 VanDerWaalsContact C-N 3.32Å; E77-V79 PolarHBondContact O-N 3.46Å; V79-I82 PolarHBondContact O-N 3.31Å; V79-L83 HydrophobicContact CG1-CD1 4.11Å; V79-L83 VanDerWaalsContact O-CG 3.31Å; V79-L83 WeakPolarHBondContact O-CG 3.5Å; V79-L83 PolarHBondContact O-N 2.75Å; V79-L83 VanDerWaalsContact O-N 3.09Å
80Q86Confident85.5Confident133 Ų133105.2 Ų105.262%0.62152%0.521SS*.Hα-helixtrans-67.5-37.7175.2-73.9-16755.400112.5E76 E77 E78 L83 S84E76-Q80 WeakPolarHBondContact O-CG 3.19Å; E76-Q80 PolarHBondContact O-N 3.01Å; E76-Q80 VanDerWaalsContact O-N 3.12Å; E77-Q80 PolarHBondContact O-N 3.47Å; E77-Q80 VanDerWaalsContact O-N 3.15Å; E78-Q80 PolarHBondContact O-N 2.96Å; Q80-L83 PolarHBondContact O-N 3.2Å; Q80-S84 PolarHBondContact O-N 2.96Å; Q80-S84 PolarHBondContact O-OG 3.43Å
81Q87.2Confident85.6Confident119 Ų119106.9 Ų106.956%0.55653%0.526SS*.Hα-helixtrans-63.1-46.1173.5-177.8177.8-29.800111.8E77 E78 L83 S84 E85E77-Q81 PolarHBondContact O-N 3.36Å; E78-Q81 PolarHBondContact O-N 3.43Å; Q81-L83 VanDerWaalsContact C-N 3.25Å; Q81-L83 PolarHBondContact O-N 2.79Å; Q81-S84 PolarHBondContact O-N 3.46Å; Q81-S84 PolarHBondContact O-OG 2.8Å; Q81-E85 HydrophobicContact CG-CG 4.37Å; Q81-E85 PolarHBondContact NE2-OE1 3.37Å; Q81-E85 WeakPolarHBondContact O-CB 3.23Å; Q81-E85 WeakPolarHBondContact O-CG 3.43Å; Q81-E85 PolarHBondContact O-N 2.66Å
82I86.4Confident85.6Confident103 Ų103106 Ų10653%0.52852%0.519SS..Hα-helixtrans-59.6-39177.6-68.8164.7000110.9E78 V79 T86E78-I82 WeakPolarHBondContact O-CG1 3.28Å; E78-I82 PolarHBondContact O-N 2.89Å; V79-I82 PolarHBondContact O-N 3.31Å; I82-T86 VanDerWaalsContact O-CB 3.29Å; I82-T86 WeakPolarHBondContact O-CB 3.43Å; I82-T86 PolarHBondContact O-N 3.37Å; I82-T86 PolarHBondContact O-OG1 2.94Å
83L84.1Confident85.6Confident94 Ų94105.6 Ų105.649%0.49252%0.518SS..Hα-helixtrans-71.3-36.1178.6-72.9172.2000113.6V79 Q80 Q81 R87V79-L83 HydrophobicContact CG1-CD1 4.11Å; V79-L83 VanDerWaalsContact O-CG 3.31Å; V79-L83 WeakPolarHBondContact O-CG 3.5Å; V79-L83 PolarHBondContact O-N 2.75Å; V79-L83 VanDerWaalsContact O-N 3.09Å; Q80-L83 PolarHBondContact O-N 3.2Å; Q81-L83 VanDerWaalsContact C-N 3.25Å; Q81-L83 PolarHBondContact O-N 2.79Å; L83-R87 WeakPolarHBondContact O-CG 3.41Å; L83-R87 PolarHBondContact O-N 3.12Å
84S84.8Confident85.5Confident68 Ų68106.8 Ų106.848%0.47652%0.521SS..Hα-helixtrans-69.7-49.6175.662.80000111Q80 Q81 T86 R87 E88Q80-S84 PolarHBondContact O-N 2.96Å; Q80-S84 PolarHBondContact O-OG 3.43Å; Q81-S84 PolarHBondContact O-N 3.46Å; Q81-S84 PolarHBondContact O-OG 2.8Å; S84-T86 VanDerWaalsContact C-N 3.25Å; S84-T86 PolarHBondContact O-N 3.38Å; S84-R87 PolarHBondContact O-N 2.77Å; S84-R87 VanDerWaalsContact O-N 3.13Å; S84-E88 PolarHBondContact O-N 3.09Å
85E86.6Confident85.6Confident67 Ų67107.9 Ų107.931%0.31353%0.526SS..Hα-helixtrans-54.6-40.6174.7-77.4-171.4-145.300112.4Q81 E88 K89Q81-E85 HydrophobicContact CG-CG 4.37Å; Q81-E85 PolarHBondContact NE2-OE1 3.37Å; Q81-E85 WeakPolarHBondContact O-CB 3.23Å; Q81-E85 WeakPolarHBondContact O-CG 3.43Å; Q81-E85 PolarHBondContact O-N 2.66Å; E85-E88 PolarHBondContact O-N 2.96Å; E85-K89 WeakPolarHBondContact O-CB 3.43Å; E85-K89 VanDerWaalsContact O-CD 3.29Å; E85-K89 WeakPolarHBondContact O-CD 3.38Å; E85-K89 WeakPolarHBondContact O-CG 3.21Å; E85-K89 PolarHBondContact O-N 2.9Å; E85-K89 IonicContact OE2-NZ 2.75Å; E85-K89 PolarHBondContact OE2-NZ 2.86Å
86T84.1Confident85.6Confident66 Ų66108.4 Ų108.441%0.40553%0.526SS..Hα-helixtrans-67.9-39.8-179.8-60.10000111.8I82 S84 I90I82-T86 VanDerWaalsContact O-CB 3.29Å; I82-T86 WeakPolarHBondContact O-CB 3.43Å; I82-T86 PolarHBondContact O-N 3.37Å; I82-T86 PolarHBondContact O-OG1 2.94Å; S84-T86 VanDerWaalsContact C-N 3.25Å; S84-T86 PolarHBondContact O-N 3.38Å; T86-I90 HydrophobicContact CG2-CD1 4.32Å; T86-I90 WeakPolarHBondContact O-CG1 3.49Å; T86-I90 PolarHBondContact O-N 2.82Å
87R85Confident85.4Confident183 Ų183107.1 Ų107.169%0.69152%0.523SS*.Hα-helixtrans-65.1-40.5175-73.4174.1-179.8-179.53111.8L83 S84 I90 L91L83-R87 WeakPolarHBondContact O-CG 3.41Å; L83-R87 PolarHBondContact O-N 3.12Å; S84-R87 PolarHBondContact O-N 2.77Å; S84-R87 VanDerWaalsContact O-N 3.13Å; R87-I90 PolarHBondContact O-N 3.29Å; R87-L91 PolarHBondContact O-N 2.78Å
88E86.4Confident85.3Confident116 Ų116103.9 Ų103.954%0.54252%0.515SS..Hα-helixtrans-64.8-47.3178.4-169.2175.9-173.600111.6S84 E85 I90 L91 Q92S84-E88 PolarHBondContact O-N 3.09Å; E85-E88 PolarHBondContact O-N 2.96Å; E88-I90 VanDerWaalsContact C-N 3.27Å; E88-I90 PolarHBondContact O-N 3.25Å; E88-L91 PolarHBondContact O-N 3.05Å; E88-Q92 WeakPolarHBondContact O-CG 3.46Å; E88-Q92 PolarHBondContact O-N 2.9Å
89K87.8Confident85.4Confident95 Ų95102.4 Ų102.441%0.41351%0.511SS..Hα-helixtrans-54.7-41.5174.8-70.9159.9-165.9167.10111.7E85 Q92 F93E85-K89 WeakPolarHBondContact O-CB 3.43Å; E85-K89 VanDerWaalsContact O-CD 3.29Å; E85-K89 WeakPolarHBondContact O-CD 3.38Å; E85-K89 WeakPolarHBondContact O-CG 3.21Å; E85-K89 PolarHBondContact O-N 2.9Å; E85-K89 IonicContact OE2-NZ 2.75Å; E85-K89 PolarHBondContact OE2-NZ 2.86Å; K89-Q92 PolarHBondContact O-N 2.73Å; K89-F93 WeakPolarHBondContact O-CD2 3.46Å; K89-F93 PolarHBondContact O-N 3.43Å; K89-F93 VanDerWaalsContact O-N 3.13Å
90I83.3Confident85.3Confident96 Ų96103.5 Ų103.549%0.49251%0.51SS..Hα-helixtrans-63.3-40.7176.4-69.9165.9000112.5T86 R87 E88 F93 K94T86-I90 HydrophobicContact CG2-CD1 4.32Å; T86-I90 WeakPolarHBondContact O-CG1 3.49Å; T86-I90 PolarHBondContact O-N 2.82Å; R87-I90 PolarHBondContact O-N 3.29Å; E88-I90 VanDerWaalsContact C-N 3.27Å; E88-I90 PolarHBondContact O-N 3.25Å; I90-F93 PolarHBondContact O-N 3.17Å; I90-K94 PolarHBondContact O-N 3.49Å
91L85.4Confident85.3Confident120 Ų120102.3 Ų102.363%0.62851%0.506SS*.Hα-helixtrans-68.5-41.2177.7-72169.4000111.7R87 E88 F93 K94 S95R87-L91 PolarHBondContact O-N 2.78Å; E88-L91 PolarHBondContact O-N 3.05Å; L91-F93 VanDerWaalsContact C-N 3.31Å; L91-F93 PolarHBondContact O-N 3.06Å; L91-K94 PolarHBondContact O-N 2.97Å; L91-K94 VanDerWaalsContact O-N 3.17Å; L91-S95 PolarHBondContact O-N 3Å; L91-S95 VanDerWaalsContact O-N 3.11Å
92Q84.7Confident85.2Confident91 Ų91100.6 Ų100.643%0.42550%0.501SS..Hα-helixtrans-58.8-40174.8-67.5177.811.600112.2E88 K89 S95 K96E88-Q92 WeakPolarHBondContact O-CG 3.46Å; E88-Q92 PolarHBondContact O-N 2.9Å; K89-Q92 PolarHBondContact O-N 2.73Å; Q92-S95 PolarHBondContact O-N 3.18Å; Q92-K96 WeakPolarHBondContact O-CG 3.44Å; Q92-K96 PolarHBondContact O-N 2.79Å
93F85.3Confident85.3Confident132 Ų132101 Ų10158%0.57950%0.503SS*.Hα-helixtrans-66.1-39175.2-74-59.4000113K89 I90 L91 S95 K96 I97K89-F93 WeakPolarHBondContact O-CD2 3.46Å; K89-F93 PolarHBondContact O-N 3.43Å; K89-F93 VanDerWaalsContact O-N 3.13Å; I90-F93 PolarHBondContact O-N 3.17Å; L91-F93 VanDerWaalsContact C-N 3.31Å; L91-F93 PolarHBondContact O-N 3.06Å; F93-S95 VanDerWaalsContact C-N 3.35Å; F93-S95 PolarHBondContact O-N 3.14Å; F93-K96 PolarHBondContact O-N 2.83Å; F93-I97 WeakPolarHBondContact O-CG1 3.4Å; F93-I97 PolarHBondContact O-N 3Å
94K83.6Confident85.3Confident149 Ų149101.9 Ų101.965%0.64850%0.503SS*.Hα-helixtrans-63.1-38.8175.7-77.6-171.6173.5-174.50112.8I90 L91 S98I90-K94 PolarHBondContact O-N 3.49Å; L91-K94 PolarHBondContact O-N 2.97Å; L91-K94 VanDerWaalsContact O-N 3.17Å; K94-S98 PolarHBondContact O-N 2.93Å
95S86.1Confident85.4Confident69 Ų69104.1 Ų104.148%0.48350%0.504SS..Hα-helixtrans-62.3-48.8176.1-160.10000111.5L91 Q92 F93 I97 S98 D99L91-S95 PolarHBondContact O-N 3Å; L91-S95 VanDerWaalsContact O-N 3.11Å; Q92-S95 PolarHBondContact O-N 3.18Å; F93-S95 VanDerWaalsContact C-N 3.35Å; F93-S95 PolarHBondContact O-N 3.14Å; S95-I97 VanDerWaalsContact C-N 3.26Å; S95-I97 PolarHBondContact O-N 2.97Å; S95-S98 WeakPolarHBondContact O-CB 3.38Å; S95-S98 PolarHBondContact O-N 2.85Å; S95-D99 PolarHBondContact O-N 2.96Å; S95-D99 VanDerWaalsContact O-N 3.09Å
96K85.8Confident85.4Confident118 Ų118108.5 Ų108.551%0.51352%0.518SS..Hα-helixtrans-58.1-35.9-179.1-70.7168.7-177.3174.70113.2Q92 F93 S98 D99 E100Q92-K96 WeakPolarHBondContact O-CG 3.44Å; Q92-K96 PolarHBondContact O-N 2.79Å; F93-K96 PolarHBondContact O-N 2.83Å; K96-S98 VanDerWaalsContact C-N 3.34Å; K96-D99 PolarHBondContact O-N 3.1Å; K96-E100 PolarHBondContact O-N 2.78Å; K96-E100 VanDerWaalsContact O-N 3.1Å
97I83.9Confident85.4Confident107 Ų107109.6 Ų109.655%0.54952%0.52SS..Hα-helixtrans-66.3-35.5176-67.6165.8000111.5F93 S95 M101F93-I97 WeakPolarHBondContact O-CG1 3.4Å; F93-I97 PolarHBondContact O-N 3Å; S95-I97 VanDerWaalsContact C-N 3.26Å; S95-I97 PolarHBondContact O-N 2.97Å; I97-M101 WeakPolarHBondContact O-CG 3.48Å; I97-M101 PolarHBondContact O-N 2.85Å
98S84.3Confident85.4Confident65 Ų65106.1 Ų106.146%0.45551%0.512SS..Hα-helixtrans-69.4-45175.4-159.70000111.4K94 S95 K96 E100 M101 D102K94-S98 PolarHBondContact O-N 2.93Å; S95-S98 WeakPolarHBondContact O-CB 3.38Å; S95-S98 PolarHBondContact O-N 2.85Å; K96-S98 VanDerWaalsContact C-N 3.34Å; S98-E100 VanDerWaalsContact C-N 3.29Å; S98-E100 PolarHBondContact O-N 3.43Å; S98-M101 PolarHBondContact O-N 2.89Å; S98-D102 PolarHBondContact O-N 2.66Å
99D86.6Confident85.3Confident77 Ų77103.2 Ų103.241%0.41250%0.504SS..Hα-helixtrans-57.9-41.4178.2-63.9-16.1000111.5S95 K96 M101 D102 L103S95-D99 PolarHBondContact O-N 2.96Å; S95-D99 VanDerWaalsContact O-N 3.09Å; K96-D99 PolarHBondContact O-N 3.1Å; D99-M101 VanDerWaalsContact C-N 3.34Å; D99-M101 PolarHBondContact O-N 3.15Å; D99-D102 PolarHBondContact O-N 3.01Å; D99-L103 WeakPolarHBondContact O-CB 3.49Å; D99-L103 WeakPolarHBondContact O-CG 2.98Å; D99-L103 PolarHBondContact O-N 2.87Å
100E84.6Confident85.2Confident105 Ų105102.8 Ų102.849%0.49151%0.506SS..Hα-helixtrans-59.8-39.2173.6-90.9-161.9-151.900113.5K96 S98 K104K96-E100 PolarHBondContact O-N 2.78Å; K96-E100 VanDerWaalsContact O-N 3.1Å; S98-E100 VanDerWaalsContact C-N 3.29Å; S98-E100 PolarHBondContact O-N 3.43Å; E100-K104 WeakPolarHBondContact O-CD 3.3Å; E100-K104 VanDerWaalsContact O-CG 3.3Å; E100-K104 WeakPolarHBondContact O-CG 3.27Å; E100-K104 PolarHBondContact O-N 3.38Å; E100-K104 IonicContact OE2-NZ 3.5Å; E100-K104 PolarHBondContact OE2-NZ 3.48Å
101M84.8Confident85.3Confident109 Ų109103.4 Ų103.454%0.53751%0.507SS..Hα-helixtrans-68.6-36.2-177.7-74.2-174.767.500112.1I97 S98 D99 K105I97-M101 WeakPolarHBondContact O-CG 3.48Å; I97-M101 PolarHBondContact O-N 2.85Å; S98-M101 PolarHBondContact O-N 2.89Å; D99-M101 VanDerWaalsContact C-N 3.34Å; D99-M101 PolarHBondContact O-N 3.15Å; M101-K105 WeakPolarHBondContact O-CG 3.38Å; M101-K105 PolarHBondContact O-N 3.17Å
102D85.9Confident85.4Confident83 Ų83103.5 Ų103.544%0.44450%0.504SS..Hα-helixtrans-81.2-30.8178.2-70.7-35.4000112.6S98 D99 K104 K105 R106S98-D102 PolarHBondContact O-N 2.66Å; D99-D102 PolarHBondContact O-N 3.01Å; D102-K104 VanDerWaalsContact C-N 3.35Å; D102-K105 PolarHBondContact O-N 2.92Å; D102-K105 WeakPolarHBondContact OD1-CD 3.4Å; D102-K105 WeakPolarHBondContact OD1-CE 3.11Å; D102-K105 IonicContact OD1-NZ 2.86Å; D102-K105 PolarHBondContact OD1-NZ 3.27Å; D102-R106 PolarHBondContact O-N 3.47Å
103L87.3Confident85.3Confident111 Ų111102 Ų10258%0.58150%0.504SS*.Hα-helixtrans-59-44.5166.5-78.2168.2000111.8D99 K105 R106 I107D99-L103 WeakPolarHBondContact O-CB 3.49Å; D99-L103 WeakPolarHBondContact O-CG 2.98Å; D99-L103 PolarHBondContact O-N 2.87Å; L103-K105 PolarHBondContact O-N 2.84Å; L103-R106 PolarHBondContact O-N 2.95Å; L103-R106 VanDerWaalsContact O-N 3.14Å; L103-I107 WeakPolarHBondContact O-CG1 3.44Å; L103-I107 PolarHBondContact O-N 2.85Å
104K84.6Confident85.3Confident113 Ų113102.1 Ų102.149%0.49151%0.508SS..Hα-helixtrans-59.4-44.8177.1-76.5160-179.5156.80112.2E100 D102 R106 I107 Q108E100-K104 WeakPolarHBondContact O-CD 3.3Å; E100-K104 VanDerWaalsContact O-CG 3.3Å; E100-K104 WeakPolarHBondContact O-CG 3.27Å; E100-K104 PolarHBondContact O-N 3.38Å; E100-K104 IonicContact OE2-NZ 3.5Å; E100-K104 PolarHBondContact OE2-NZ 3.48Å; D102-K104 VanDerWaalsContact C-N 3.35Å; K104-R106 VanDerWaalsContact C-N 3.33Å; K104-R106 PolarHBondContact O-N 3.48Å; K104-I107 PolarHBondContact O-N 3.44Å; K104-Q108 WeakPolarHBondContact O-CG 3.04Å; K104-Q108 PolarHBondContact O-N 2.75Å; K104-Q108 VanDerWaalsContact O-N 3.11Å
105K86.6Confident85.4Confident114 Ų11499.5 Ų99.550%0.49650%0.498SS..Hα-helixtrans-61.9-38.9173.8-63.8167.7-161.5164.10112.5M101 D102 L103 Q108 S109M101-K105 WeakPolarHBondContact O-CG 3.38Å; M101-K105 PolarHBondContact O-N 3.17Å; D102-K105 PolarHBondContact O-N 2.92Å; D102-K105 WeakPolarHBondContact OD1-CD 3.4Å; D102-K105 WeakPolarHBondContact OD1-CE 3.11Å; D102-K105 IonicContact OD1-NZ 2.86Å; D102-K105 PolarHBondContact OD1-NZ 3.27Å; L103-K105 PolarHBondContact O-N 2.84Å; K105-Q108 PolarHBondContact O-N 2.77Å; K105-S109 PolarHBondContact O-N 3.44Å; K105-S109 VanDerWaalsContact O-N 3.09Å
106R88.1Confident85.5Confident160 Ų160101 Ų10160%0.60450%0.5SS*.Hα-helixtrans-70.3-33.6-179.5-172.257175.7-1773.1112.3D102 L103 K104 L110D102-R106 PolarHBondContact O-N 3.47Å; L103-R106 PolarHBondContact O-N 2.95Å; L103-R106 VanDerWaalsContact O-N 3.14Å; K104-R106 VanDerWaalsContact C-N 3.33Å; K104-R106 PolarHBondContact O-N 3.48Å; R106-L110 WeakPolarHBondContact O-CG 3.03Å; R106-L110 PolarHBondContact O-N 3.29Å
107I82.5Confident85.5Confident88 Ų88102 Ų10245%0.45151%0.506SS..Hα-helixtrans-64.2-52171.9-70.2164.5000109.8L103 K104 S109 L110 E111L103-I107 WeakPolarHBondContact O-CG1 3.44Å; L103-I107 PolarHBondContact O-N 2.85Å; K104-I107 PolarHBondContact O-N 3.44Å; I107-S109 VanDerWaalsContact C-N 3.34Å; I107-S109 PolarHBondContact O-N 3.46Å; I107-L110 WeakPolarHBondContact O-CA 3.39Å; I107-L110 WeakPolarHBondContact O-CB 3.12Å; I107-L110 PolarHBondContact O-N 3.39Å; I107-E111 HydrophobicContact CG2-CG 4.19Å; I107-E111 WeakPolarHBondContact CG2-OE1 3.28Å; I107-E111 WeakPolarHBondContact O-CG 2.9Å; I107-E111 PolarHBondContact O-N 2.83Å
108Q84.9Confident85.4Confident111 Ų111101.4 Ų101.452%0.51950%0.501SS..Hα-helixtrans-54.6-46.1178.1-69.8-178.7-62.300112.8K104 K105 L110 E111 E112K104-Q108 WeakPolarHBondContact O-CG 3.04Å; K104-Q108 PolarHBondContact O-N 2.75Å; K104-Q108 VanDerWaalsContact O-N 3.11Å; K105-Q108 PolarHBondContact O-N 2.77Å; Q108-L110 VanDerWaalsContact C-N 3.26Å; Q108-L110 PolarHBondContact O-N 3.02Å; Q108-E111 WeakPolarHBondContact CA-OE2 3.12Å; Q108-E111 PolarHBondContact O-N 3.19Å; Q108-E112 WeakPolarHBondContact O-CB 3.34Å; Q108-E112 VanDerWaalsContact O-CG 3.31Å; Q108-E112 WeakPolarHBondContact O-CG 3.42Å; Q108-E112 PolarHBondContact O-N 2.88Å
109S85.8Confident85.5Confident55 Ų55104.6 Ų104.639%0.38550%0.503SS..Hα-helixtrans-64.1-27.3177.4173.70000113.8K105 I107 S113K105-S109 PolarHBondContact O-N 3.44Å; K105-S109 VanDerWaalsContact O-N 3.09Å; I107-S109 VanDerWaalsContact C-N 3.34Å; I107-S109 PolarHBondContact O-N 3.46Å; S109-S113 WeakPolarHBondContact O-CB 3.35Å; S109-S113 PolarHBondContact O-N 2.83Å
110L84.9Confident85.5Confident86 Ų86106.5 Ų106.545%0.4551%0.511SS..Hα-helixtrans-78.9-41.6173.5-72.8168.8000111.2R106 I107 Q108 S113 M114R106-L110 WeakPolarHBondContact O-CG 3.03Å; R106-L110 PolarHBondContact O-N 3.29Å; I107-L110 WeakPolarHBondContact O-CA 3.39Å; I107-L110 WeakPolarHBondContact O-CB 3.12Å; I107-L110 PolarHBondContact O-N 3.39Å; Q108-L110 VanDerWaalsContact C-N 3.26Å; Q108-L110 PolarHBondContact O-N 3.02Å; L110-S113 PolarHBondContact O-N 3.22Å; L110-S113 PolarHBondContact O-OG 3Å; L110-M114 PolarHBondContact O-N 2.86Å
111E85.5Confident85.6Confident108 Ų108108 Ų10851%0.50552%0.516SS..Hα-helixtrans-57.9-50.5174.1-68.5168.5152.100110.8I107 Q108 S113 M114 E115I107-E111 HydrophobicContact CG2-CG 4.19Å; I107-E111 WeakPolarHBondContact CG2-OE1 3.28Å; I107-E111 WeakPolarHBondContact O-CG 2.9Å; I107-E111 PolarHBondContact O-N 2.83Å; Q108-E111 WeakPolarHBondContact CA-OE2 3.12Å; Q108-E111 PolarHBondContact O-N 3.19Å; E111-S113 VanDerWaalsContact C-N 3.29Å; E111-S113 PolarHBondContact O-N 3.44Å; E111-M114 PolarHBondContact O-N 3.3Å; E111-M114 VanDerWaalsContact O-N 3.12Å; E111-E115 WeakPolarHBondContact O-CG 3.47Å; E111-E115 PolarHBondContact O-N 2.82Å
112E86.6Confident85.7Confident123 Ų123109.8 Ų109.858%0.57552%0.517SS*.Hα-helixtrans-54.3-42.2173.4-72.7170175.500112.5Q108 L116Q108-E112 WeakPolarHBondContact O-CB 3.34Å; Q108-E112 VanDerWaalsContact O-CG 3.31Å; Q108-E112 WeakPolarHBondContact O-CG 3.42Å; Q108-E112 PolarHBondContact O-N 2.88Å; E112-L116 WeakPolarHBondContact O-CB 3.15Å; E112-L116 PolarHBondContact O-N 2.95Å
113S84.3Confident85.7Confident60 Ų60111.2 Ų111.242%0.4252%0.521SS..Hα-helixtrans-70.2-34.6178.978.40000112.9S109 L110 E111 H117S109-S113 WeakPolarHBondContact O-CB 3.35Å; S109-S113 PolarHBondContact O-N 2.83Å; L110-S113 PolarHBondContact O-N 3.22Å; L110-S113 PolarHBondContact O-OG 3Å; E111-S113 VanDerWaalsContact C-N 3.29Å; E111-S113 PolarHBondContact O-N 3.44Å; S113-H117 PolarHBondContact O-N 3.02Å
114M84.3Confident85.6Confident134 Ų134108.6 Ų108.666%0.6652%0.515SS*.Hα-helixtrans-70.1-45.3174-78.6-176.256.100111.1L110 E111 L116 H117 E118L110-M114 PolarHBondContact O-N 2.86Å; E111-M114 PolarHBondContact O-N 3.3Å; E111-M114 VanDerWaalsContact O-N 3.12Å; M114-L116 VanDerWaalsContact C-N 3.28Å; M114-L116 PolarHBondContact O-N 3.36Å; M114-H117 PolarHBondContact O-N 3.36Å; M114-E118 WeakPolarHBondContact O-CG 3.45Å; M114-E118 PolarHBondContact O-N 2.82Å
115E86.8Confident85.6Confident94 Ų94107.5 Ų107.544%0.43951%0.514SS..Hα-helixtrans-58.1-41.5174.2-68.1-166.815200111.6E111 E118 R119E111-E115 WeakPolarHBondContact O-CG 3.47Å; E111-E115 PolarHBondContact O-N 2.82Å; E115-E118 PolarHBondContact O-N 2.82Å; E115-R119 VanDerWaalsContact CB-NH1 3.26Å; E115-R119 WeakPolarHBondContact O-CB 3.11Å; E115-R119 WeakPolarHBondContact O-CG 3.49Å; E115-R119 PolarHBondContact O-N 2.7Å; E115-R119 IonicContact OE1-NH2 2.68Å; E115-R119 IonicContact OE2-CZ 2.66Å; E115-R119 IonicContact OE2-NH1 3.43Å; E115-R119 PolarHBondContact OE2-NH1 3.2Å; E115-R119 IonicContact OE2-NH2 2.66Å; E115-R119 PolarHBondContact OE2-NH2 2.74Å
116L87Confident85.7Confident100 Ų100104.5 Ų104.552%0.52451%0.511SS..Hα-helixtrans-62.6-45.8176.1-177.262.5000111.4E112 M114 E118 R119 M120E112-L116 WeakPolarHBondContact O-CB 3.15Å; E112-L116 PolarHBondContact O-N 2.95Å; M114-L116 VanDerWaalsContact C-N 3.28Å; M114-L116 PolarHBondContact O-N 3.36Å; L116-E118 VanDerWaalsContact C-N 3.34Å; L116-E118 PolarHBondContact O-N 3.3Å; L116-R119 WeakPolarHBondContact O-CB 3.41Å; L116-R119 PolarHBondContact O-N 3.11Å; L116-M120 HydrophobicContact CG-SD 4.48Å; L116-M120 WeakPolarHBondContact O-CG 3.26Å; L116-M120 PolarHBondContact O-N 3.11Å
117H86.1Confident85.7Confident138 Ų138101.8 Ų101.864%0.63950%0.504SS*.Hα-helixtrans-66.3-35177.9-161.8-29.6000112.2S113 M114 K121S113-H117 PolarHBondContact O-N 3.02Å; M114-H117 PolarHBondContact O-N 3.36Å; H117-K121 WeakPolarHBondContact O-CB 3.49Å; H117-K121 PolarHBondContact O-N 2.83Å
118E81.6Confident86Confident96 Ų96103.9 Ų103.945%0.44951%0.511SS..Hα-helixtrans-67.8-40.7171.2-69.5-153.6137.100112.5M114 E115 L116 K121 R122M114-E118 WeakPolarHBondContact O-CG 3.45Å; M114-E118 PolarHBondContact O-N 2.82Å; E115-E118 PolarHBondContact O-N 2.82Å; L116-E118 VanDerWaalsContact C-N 3.34Å; L116-E118 PolarHBondContact O-N 3.3Å; E118-K121 PolarHBondContact O-N 2.73Å; E118-R122 VanDerWaalsContact CB-NH1 3.29Å; E118-R122 WeakPolarHBondContact O-CB 2.89Å; E118-R122 WeakPolarHBondContact O-CG 3.06Å; E118-R122 PolarHBondContact O-N 2.7Å; E118-R122 IonicContact OE1-NH2 3.46Å; E118-R122 IonicContact OE2-CZ 3.17Å; E118-R122 IonicContact OE2-NH1 2.77Å; E118-R122 PolarHBondContact OE2-NH1 2.9Å; E118-R122 IonicContact OE2-NH2 3.87Å; E118-R122 PolarHBondContact OE2-NH2 2.84Å
119R87.7Confident86Confident132 Ų132104 Ų10450%0.49851%0.511SS..Hα-helixtrans-58.8-47.6174.6-75.6165.9-176.3126.59.6110.3E115 L116 K121 R122 Q123E115-R119 VanDerWaalsContact CB-NH1 3.26Å; E115-R119 WeakPolarHBondContact O-CB 3.11Å; E115-R119 WeakPolarHBondContact O-CG 3.49Å; E115-R119 PolarHBondContact O-N 2.7Å; E115-R119 IonicContact OE1-NH2 2.68Å; E115-R119 IonicContact OE2-CZ 2.66Å; E115-R119 IonicContact OE2-NH1 3.43Å; E115-R119 PolarHBondContact OE2-NH1 3.2Å; E115-R119 IonicContact OE2-NH2 2.66Å; E115-R119 PolarHBondContact OE2-NH2 2.74Å; L116-R119 WeakPolarHBondContact O-CB 3.41Å; L116-R119 PolarHBondContact O-N 3.11Å; R119-K121 VanDerWaalsContact C-N 3.34Å; R119-K121 PolarHBondContact O-N 3.45Å; R119-R122 PolarHBondContact O-N 2.73Å; R119-Q123 WeakPolarHBondContact O-CB 3.18Å; R119-Q123 PolarHBondContact O-N 2.81Å
120M85.7Confident86Confident116 Ų116103.7 Ų103.757%0.57151%0.509SS*.Hα-helixtrans-60.7-40174.4-69178.673.600112.3L116 Q123 A124L116-M120 HydrophobicContact CG-SD 4.48Å; L116-M120 WeakPolarHBondContact O-CG 3.26Å; L116-M120 PolarHBondContact O-N 3.11Å; M120-Q123 PolarHBondContact O-N 3.13Å; M120-A124 WeakPolarHBondContact O-CB 3.21Å; M120-A124 PolarHBondContact O-N 3.37Å
121K87.4Confident86Confident137 Ų137106.4 Ų106.460%0.59651%0.514SS*.Hα-helixtrans-65.5-44175.7-176.4-177.4175.5-1740112.2H117 E118 R119 Q123 A124 L125H117-K121 WeakPolarHBondContact O-CB 3.49Å; H117-K121 PolarHBondContact O-N 2.83Å; E118-K121 PolarHBondContact O-N 2.73Å; R119-K121 VanDerWaalsContact C-N 3.34Å; R119-K121 PolarHBondContact O-N 3.45Å; K121-Q123 VanDerWaalsContact C-N 3.35Å; K121-A124 PolarHBondContact O-N 2.85Å; K121-L125 HydrophobicContact CG-CD1 4.27Å; K121-L125 WeakPolarHBondContact O-CG 3.43Å; K121-L125 PolarHBondContact O-N 2.83Å; K121-L125 VanDerWaalsContact O-N 3.08Å
122R85.9Confident86.3Confident147 Ų147107.2 Ų107.256%0.55551%0.513SS*.Hα-helixtrans-62.6-42.4175.6-72.3176.4-176.9107.110.2111E118 R119 L125 A126E118-R122 VanDerWaalsContact CB-NH1 3.29Å; E118-R122 WeakPolarHBondContact O-CB 2.89Å; E118-R122 WeakPolarHBondContact O-CG 3.06Å; E118-R122 PolarHBondContact O-N 2.7Å; E118-R122 IonicContact OE1-NH2 3.46Å; E118-R122 IonicContact OE2-CZ 3.17Å; E118-R122 IonicContact OE2-NH1 2.77Å; E118-R122 PolarHBondContact OE2-NH1 2.9Å; E118-R122 IonicContact OE2-NH2 3.87Å; E118-R122 PolarHBondContact OE2-NH2 2.84Å; R119-R122 PolarHBondContact O-N 2.73Å; R122-L125 PolarHBondContact O-N 3.14Å; R122-A126 WeakPolarHBondContact O-CB 3.33Å; R122-A126 PolarHBondContact O-N 2.91Å
123Q85.9Confident86.3Confident113 Ų113106.6 Ų106.653%0.52851%0.51SS..Hα-helixtrans-63.3-49.1176.3-179175.9-15.500111.9R119 M120 K121 L125 A126 E127R119-Q123 WeakPolarHBondContact O-CB 3.18Å; R119-Q123 PolarHBondContact O-N 2.81Å; M120-Q123 PolarHBondContact O-N 3.13Å; K121-Q123 VanDerWaalsContact C-N 3.35Å; Q123-L125 VanDerWaalsContact C-N 3.27Å; Q123-L125 PolarHBondContact O-N 2.78Å; Q123-A126 PolarHBondContact O-N 3.48Å; Q123-E127 HydrophobicContact CG-CG 4.34Å; Q123-E127 VanDerWaalsContact CG-OE1 3.24Å; Q123-E127 WeakPolarHBondContact CG-OE1 3.23Å; Q123-E127 PolarHBondContact NE2-OE1 2.83Å; Q123-E127 WeakPolarHBondContact O-CB 2.99Å; Q123-E127 WeakPolarHBondContact O-CG 3.44Å; Q123-E127 PolarHBondContact O-N 3.28Å
124A84.8Confident86.5Confident55 Ų55110.6 Ų110.646%0.45552%0.516SS..Hα-helixtrans-61.8-33.8178.500000113M120 K121 F128M120-A124 WeakPolarHBondContact O-CB 3.21Å; M120-A124 PolarHBondContact O-N 3.37Å; K121-A124 PolarHBondContact O-N 2.85Å; A124-F128 WeakPolarHBondContact O-CB 3.22Å; A124-F128 PolarHBondContact O-N 3.32Å
125L86Confident86.5Confident90 Ų90106.2 Ų106.247%0.47150%0.497SS..Hα-helixtrans-68.6-47172.6-72.5168.8000111.7K121 R122 Q123 E127 F128 E129K121-L125 HydrophobicContact CG-CD1 4.27Å; K121-L125 WeakPolarHBondContact O-CG 3.43Å; K121-L125 PolarHBondContact O-N 2.83Å; K121-L125 VanDerWaalsContact O-N 3.08Å; R122-L125 PolarHBondContact O-N 3.14Å; Q123-L125 VanDerWaalsContact C-N 3.27Å; Q123-L125 PolarHBondContact O-N 2.78Å; L125-E127 VanDerWaalsContact C-N 3.32Å; L125-E127 PolarHBondContact O-N 3.49Å; L125-F128 PolarHBondContact O-N 3.33Å; L125-E129 WeakPolarHBondContact O-CG 3.42Å; L125-E129 PolarHBondContact O-N 3.04Å
126A88.1Confident86.6Confident52 Ų52105.1 Ų105.143%0.4349%0.491SS..Hα-helixtrans-63.5-36.2176.500000112.6R122 Q123 S130R122-A126 WeakPolarHBondContact O-CB 3.33Å; R122-A126 PolarHBondContact O-N 2.91Å; Q123-A126 PolarHBondContact O-N 3.48Å; A126-S130 WeakPolarHBondContact O-CB 3.48Å; A126-S130 PolarHBondContact O-N 2.79Å
127E88.7Confident86.6Confident102 Ų102104 Ų10448%0.47749%0.486SS..Hα-helixtrans-65.2-43173.2-75.8173.5-170.300111.2Q123 L125 S130 Y131Q123-E127 HydrophobicContact CG-CG 4.34Å; Q123-E127 VanDerWaalsContact CG-OE1 3.24Å; Q123-E127 WeakPolarHBondContact CG-OE1 3.23Å; Q123-E127 PolarHBondContact NE2-OE1 2.83Å; Q123-E127 WeakPolarHBondContact O-CB 2.99Å; Q123-E127 WeakPolarHBondContact O-CG 3.44Å; Q123-E127 PolarHBondContact O-N 3.28Å; L125-E127 VanDerWaalsContact C-N 3.32Å; L125-E127 PolarHBondContact O-N 3.49Å; E127-S130 PolarHBondContact O-N 2.92Å; E127-S130 PolarHBondContact O-OG 2.88Å; E127-Y131 WeakPolarHBondContact O-CB 3.33Å; E127-Y131 PolarHBondContact O-N 3.26Å
128F87.3Confident86.6Confident132 Ų132103.3 Ų103.358%0.57948%0.484SS*.Hα-helixtrans-64.7-43174.4-178.4-97000112.7A124 L125 Y131 R132A124-F128 WeakPolarHBondContact O-CB 3.22Å; A124-F128 PolarHBondContact O-N 3.32Å; L125-F128 PolarHBondContact O-N 3.33Å; F128-Y131 PolarHBondContact O-N 3.3Å; F128-Y131 VanDerWaalsContact O-N 3.17Å; F128-R132 PolarHBondContact O-N 2.88Å
129E86.7Confident86.5Confident115 Ų115103.8 Ų103.854%0.53749%0.487SS..Hα-helixtrans-61.3-44.6174.1-73.4170.2174.200111L125 Y131 R132 Q133L125-E129 WeakPolarHBondContact O-CG 3.42Å; L125-E129 PolarHBondContact O-N 3.04Å; E129-Y131 VanDerWaalsContact C-N 3.25Å; E129-Y131 PolarHBondContact O-N 2.92Å; E129-R132 PolarHBondContact O-N 3.43Å; E129-Q133 WeakPolarHBondContact O-CB 3.42Å; E129-Q133 PolarHBondContact O-N 3.36Å
130S85.6Confident86.5Confident48 Ų48102.6 Ų102.634%0.33649%0.49SS..Hα-helixtrans-63.4-29.5174.684.10000113.2A126 E127 R134A126-S130 WeakPolarHBondContact O-CB 3.48Å; A126-S130 PolarHBondContact O-N 2.79Å; E127-S130 PolarHBondContact O-N 2.92Å; E127-S130 PolarHBondContact O-OG 2.88Å; S130-R134 WeakPolarHBondContact O-CB 3.27Å; S130-R134 VanDerWaalsContact O-CG 3.29Å; S130-R134 WeakPolarHBondContact O-CG 3.31Å; S130-R134 PolarHBondContact O-N 3.21Å; S130-R134 VanDerWaalsContact O-N 3.13Å; S130-R134 PolarHBondContact O-NE 2.78Å; S130-R134 PolarHBondContact OG-NH2 3.36Å
131Y84.7Confident86.5Confident142 Ų142100.4 Ų100.456%0.55749%0.485SS*.Hα-helixtrans-76.1-45.6176.1176.8-95.7000110.6E127 F128 E129 Q133 R134 V135E127-Y131 WeakPolarHBondContact O-CB 3.33Å; E127-Y131 PolarHBondContact O-N 3.26Å; F128-Y131 PolarHBondContact O-N 3.3Å; F128-Y131 VanDerWaalsContact O-N 3.17Å; E129-Y131 VanDerWaalsContact C-N 3.25Å; E129-Y131 PolarHBondContact O-N 2.92Å; Y131-Q133 VanDerWaalsContact C-N 3.33Å; Y131-Q133 PolarHBondContact O-N 3.37Å; Y131-R134 PolarHBondContact O-N 3.26Å; Y131-V135 HydrophobicContact CD1-CG2 4.36Å; Y131-V135 HydrophobicContact CE1-CG2 3.87Å; Y131-V135 HydrophobicContact CE2-CG2 4.32Å; Y131-V135 WeakPolarHBondContact O-CG2 3.11Å; Y131-V135 PolarHBondContact O-N 3Å
132R90.8Very high86.2Confident126 Ų12696.8 Ų96.848%0.47548%0.475SS..Hα-helixtrans-56.3-48.6174.7-159-160.182.1-148.4-5.6110.5F128 E129 R134 V135 E136F128-R132 PolarHBondContact O-N 2.88Å; E129-R132 PolarHBondContact O-N 3.43Å; R132-R134 PolarHBondContact O-N 3.07Å; R132-V135 WeakPolarHBondContact O-CB 3.27Å; R132-V135 PolarHBondContact O-N 3.36Å; R132-V135 VanDerWaalsContact O-N 3.1Å; R132-E136 WeakPolarHBondContact CD-OE1 3.28Å; R132-E136 IonicContact CZ-OE1 2.79Å; R132-E136 IonicContact CZ-OE2 3.18Å; R132-E136 VanDerWaalsContact NE-CD 3.3Å; R132-E136 IonicContact NE-OE1 2.98Å; R132-E136 PolarHBondContact NE-OE1 3.38Å; R132-E136 IonicContact NE-OE2 3.09Å; R132-E136 PolarHBondContact NE-OE2 3.29Å; R132-E136 IonicContact NH2-OE1 3.99Å; R132-E136 PolarHBondContact NH2-OE1 3.07Å; R132-E136 IonicContact NH2-OE2 3.17Å; R132-E136 PolarHBondContact NH2-OE2 2.83Å; R132-E136 WeakPolarHBondContact O-CG 3.4Å; R132-E136 PolarHBondContact O-N 3.33Å
133Q86.3Confident85.9Confident109 Ų10995.6 Ų95.651%0.50948%0.475SS..Hα-helixtrans-65.9-38.5179.1-170.3160400112.4E129 Y131 V135 E136 D137E129-Q133 WeakPolarHBondContact O-CB 3.42Å; E129-Q133 PolarHBondContact O-N 3.36Å; Y131-Q133 VanDerWaalsContact C-N 3.33Å; Y131-Q133 PolarHBondContact O-N 3.37Å; Q133-V135 VanDerWaalsContact C-N 3.28Å; Q133-V135 PolarHBondContact O-N 3.05Å; Q133-E136 PolarHBondContact O-N 3.34Å; Q133-D137 WeakPolarHBondContact O-CB 3.37Å; Q133-D137 PolarHBondContact O-N 2.93Å
134R89.1Confident85.7Confident144 Ų14492.8 Ų92.854%0.54347%0.471SS..Hα-helixtrans-63.3-30171.5-81.4176.5-73.3159-6.8113.7S130 Y131 R132 M138S130-R134 WeakPolarHBondContact O-CB 3.27Å; S130-R134 VanDerWaalsContact O-CG 3.29Å; S130-R134 WeakPolarHBondContact O-CG 3.31Å; S130-R134 PolarHBondContact O-N 3.21Å; S130-R134 VanDerWaalsContact O-N 3.13Å; S130-R134 PolarHBondContact O-NE 2.78Å; S130-R134 PolarHBondContact OG-NH2 3.36Å; Y131-R134 PolarHBondContact O-N 3.26Å; R132-R134 PolarHBondContact O-N 3.07Å; R134-M138 WeakPolarHBondContact O-CB 3.37Å; R134-M138 PolarHBondContact O-N 2.95Å; R134-M138 VanDerWaalsContact O-N 3.08Å
135V85.4Confident85.5Confident43 Ų4394.4 Ų94.426%0.26147%0.47SS..Hα-helixtrans-74.6-41.8173.1172.30000110.8Y131 R132 Q133 M138 Q139Y131-V135 HydrophobicContact CD1-CG2 4.36Å; Y131-V135 HydrophobicContact CE1-CG2 3.87Å; Y131-V135 HydrophobicContact CE2-CG2 4.32Å; Y131-V135 WeakPolarHBondContact O-CG2 3.11Å; Y131-V135 PolarHBondContact O-N 3Å; R132-V135 WeakPolarHBondContact O-CB 3.27Å; R132-V135 PolarHBondContact O-N 3.36Å; R132-V135 VanDerWaalsContact O-N 3.1Å; Q133-V135 VanDerWaalsContact C-N 3.28Å; Q133-V135 PolarHBondContact O-N 3.05Å; V135-M138 PolarHBondContact O-N 3.16Å; V135-Q139 WeakPolarHBondContact O-CB 3.37Å; V135-Q139 VanDerWaalsContact O-CG 3.3Å; V135-Q139 WeakPolarHBondContact O-CG 3.41Å; V135-Q139 PolarHBondContact O-N 3.24Å
136E87.6Confident85.1Confident70 Ų7095.4 Ų95.433%0.32747%0.472SS..Hα-helixtrans-61.1-50174.6-70.3164.3170.100111R132 Q133 M138 Q139 L140R132-E136 WeakPolarHBondContact CD-OE1 3.28Å; R132-E136 IonicContact CZ-OE1 2.79Å; R132-E136 IonicContact CZ-OE2 3.18Å; R132-E136 VanDerWaalsContact NE-CD 3.3Å; R132-E136 IonicContact NE-OE1 2.98Å; R132-E136 PolarHBondContact NE-OE1 3.38Å; R132-E136 IonicContact NE-OE2 3.09Å; R132-E136 PolarHBondContact NE-OE2 3.29Å; R132-E136 IonicContact NH2-OE1 3.99Å; R132-E136 PolarHBondContact NH2-OE1 3.07Å; R132-E136 IonicContact NH2-OE2 3.17Å; R132-E136 PolarHBondContact NH2-OE2 2.83Å; R132-E136 WeakPolarHBondContact O-CG 3.4Å; R132-E136 PolarHBondContact O-N 3.33Å; Q133-E136 PolarHBondContact O-N 3.34Å; E136-M138 VanDerWaalsContact C-N 3.34Å; E136-M138 PolarHBondContact O-N 3.27Å; E136-Q139 PolarHBondContact O-N 3.05Å; E136-L140 WeakPolarHBondContact O-CB 3.09Å; E136-L140 WeakPolarHBondContact O-CG 3.26Å; E136-L140 PolarHBondContact O-N 3.02Å
137D87.9Confident84.9Confident78 Ų7897.1 Ų97.142%0.41748%0.477SS..Hα-helixtrans-60.4-40.6175.5-69-28.4000111.9Q133 C141Q133-D137 WeakPolarHBondContact O-CB 3.37Å; Q133-D137 PolarHBondContact O-N 2.93Å; D137-C141 WeakPolarHBondContact O-CB 3.23Å; D137-C141 PolarHBondContact O-N 3.48Å; D137-C141 PolarHBondContact O-SG 3.32Å
138M84.7Confident84.6Confident122 Ų12298.9 Ų98.960%0.60149%0.485SS*.Hα-helixtrans-71.4-36.7178.5-177.5157.451.700112.3R134 V135 E136 C141 T142R134-M138 WeakPolarHBondContact O-CB 3.37Å; R134-M138 PolarHBondContact O-N 2.95Å; R134-M138 VanDerWaalsContact O-N 3.08Å; V135-M138 PolarHBondContact O-N 3.16Å; E136-M138 VanDerWaalsContact C-N 3.34Å; E136-M138 PolarHBondContact O-N 3.27Å; M138-C141 PolarHBondContact O-N 2.83Å; M138-T142 WeakPolarHBondContact O-CG2 3.36Å; M138-T142 PolarHBondContact O-N 2.8Å; M138-T142 PolarHBondContact O-OG1 2.77Å
139Q81.2Confident84.5Confident107 Ų10799.1 Ų99.150%0.548%0.482SS..Hα-helixtrans-61-51.6170.9-77.6173.2-13.200110.3V135 E136 C141 T142 E143V135-Q139 WeakPolarHBondContact O-CB 3.37Å; V135-Q139 VanDerWaalsContact O-CG 3.3Å; V135-Q139 WeakPolarHBondContact O-CG 3.41Å; V135-Q139 PolarHBondContact O-N 3.24Å; E136-Q139 PolarHBondContact O-N 3.05Å; Q139-C141 VanDerWaalsContact C-N 3.28Å; Q139-C141 PolarHBondContact O-N 3.21Å; Q139-T142 PolarHBondContact O-N 3.38Å; Q139-T142 PolarHBondContact O-OG1 2.77Å; Q139-E143 WeakPolarHBondContact O-CG 3.16Å; Q139-E143 PolarHBondContact O-N 3.15Å
140L86.4Confident84.3Confident106 Ų10698 Ų9856%0.55548%0.483SS*.Hα-helixtrans-56.7-39.7175-71.1170.1000112.4E136 E143 A144E136-L140 WeakPolarHBondContact O-CB 3.09Å; E136-L140 WeakPolarHBondContact O-CG 3.26Å; E136-L140 PolarHBondContact O-N 3.02Å; L140-E143 PolarHBondContact O-N 2.82Å; L140-A144 WeakPolarHBondContact O-CB 3.44Å; L140-A144 PolarHBondContact O-N 2.84Å
141C86.3Confident84.4Confident71 Ų71100.4 Ų100.448%0.4850%0.496SS..Hα-helixtrans-64.9-39.7174.1-72.80000112.6D137 M138 Q139 Q145D137-C141 WeakPolarHBondContact O-CB 3.23Å; D137-C141 PolarHBondContact O-N 3.48Å; D137-C141 PolarHBondContact O-SG 3.32Å; M138-C141 PolarHBondContact O-N 2.83Å; Q139-C141 VanDerWaalsContact C-N 3.28Å; Q139-C141 PolarHBondContact O-N 3.21Å; C141-Q145 WeakPolarHBondContact O-CB 3.28Å; C141-Q145 VanDerWaalsContact O-CG 3.3Å; C141-Q145 WeakPolarHBondContact O-CG 3.15Å; C141-Q145 PolarHBondContact O-N 3.29Å
142T81Confident84.4Confident61 Ų6196.4 Ų96.437%0.37449%0.488SS..Hα-helixtrans-69.2-40.6175.154.40000112.2M138 Q139 Q145 H146M138-T142 WeakPolarHBondContact O-CG2 3.36Å; M138-T142 PolarHBondContact O-N 2.8Å; M138-T142 PolarHBondContact O-OG1 2.77Å; Q139-T142 PolarHBondContact O-N 3.38Å; Q139-T142 PolarHBondContact O-OG1 2.77Å; T142-Q145 PolarHBondContact O-N 2.72Å; T142-H146 WeakPolarHBondContact O-CB 3.4Å; T142-H146 PolarHBondContact O-CD2 3.02Å; T142-H146 PolarHBondContact O-N 3.41Å
143E80.6Confident84Confident121 Ų12196.3 Ų96.357%0.56549%0.494SS*.Hα-helixtrans-65.5-40175.7-69.7-179.5176.200111.9Q139 L140 H146 T147Q139-E143 WeakPolarHBondContact O-CG 3.16Å; Q139-E143 PolarHBondContact O-N 3.15Å; L140-E143 PolarHBondContact O-N 2.82Å; E143-H146 PolarHBondContact O-N 3.11Å; E143-T147 WeakPolarHBondContact O-CB 3.09Å; E143-T147 WeakPolarHBondContact O-CG2 3.25Å; E143-T147 PolarHBondContact O-N 3.13Å; E143-T147 PolarHBondContact O-OG1 2.91Å
144A79.9Confident83.5Confident54 Ų5494.1 Ų94.145%0.44649%0.491SS..Hα-helixtrans-61.4-42.6171.200000111.7L140 T147 Q148L140-A144 WeakPolarHBondContact O-CB 3.44Å; L140-A144 PolarHBondContact O-N 2.84Å; A144-T147 WeakPolarHBondContact CA-OG1 3.3Å; A144-T147 PolarHBondContact O-OG1 3.38Å; A144-T147 VanDerWaalsContact O-OG1 3.07Å; A144-Q148 WeakPolarHBondContact O-CB 3.33Å; A144-Q148 PolarHBondContact O-N 3.43Å
145Q80.8Confident83.4Confident90 Ų9094.7 Ų94.742%0.42149%0.493SS..Hα-helixtrans-67.6-38.7175.2-75.3179.831.600112.8C141 T142 R149C141-Q145 WeakPolarHBondContact O-CB 3.28Å; C141-Q145 VanDerWaalsContact O-CG 3.3Å; C141-Q145 WeakPolarHBondContact O-CG 3.15Å; C141-Q145 PolarHBondContact O-N 3.29Å; T142-Q145 PolarHBondContact O-N 2.72Å; Q145-R149 WeakPolarHBondContact O-CB 3.43Å; Q145-R149 VanDerWaalsContact O-CG 3.25Å; Q145-R149 WeakPolarHBondContact O-CG 3.48Å; Q145-R149 PolarHBondContact O-N 2.86Å
146H79.1Confident83.4Confident111 Ų11196.9 Ų96.951%0.51450%0.501SS..Hα-helixtrans-66.6-46177.1-78.3-63.8000111.4T142 E143 R149 V150T142-H146 WeakPolarHBondContact O-CB 3.4Å; T142-H146 PolarHBondContact O-CD2 3.02Å; T142-H146 PolarHBondContact O-N 3.41Å; E143-H146 PolarHBondContact O-N 3.11Å; H146-R149 PolarHBondContact O-N 2.81Å; H146-V150 WeakPolarHBondContact O-CG2 3.39Å; H146-V150 PolarHBondContact O-N 3.08Å
147T83.1Confident83.2Confident88 Ų8897.8 Ų97.854%0.5451%0.511SS..Hα-helixtrans-64.7-40.1174.950.30000111.8E143 A144 R149 V150 V151E143-T147 WeakPolarHBondContact O-CB 3.09Å; E143-T147 WeakPolarHBondContact O-CG2 3.25Å; E143-T147 PolarHBondContact O-N 3.13Å; E143-T147 PolarHBondContact O-OG1 2.91Å; A144-T147 WeakPolarHBondContact CA-OG1 3.3Å; A144-T147 PolarHBondContact O-OG1 3.38Å; A144-T147 VanDerWaalsContact O-OG1 3.07Å; T147-R149 PolarHBondContact O-N 3.09Å; T147-V150 PolarHBondContact O-N 2.84Å; T147-V151 WeakPolarHBondContact O-CG2 3.11Å; T147-V151 PolarHBondContact O-N 3.02Å
148Q82.9Confident83.1Confident139 Ų13998.6 Ų98.665%0.6551%0.512SS*.Hα-helixtrans-61.8-42.3174.3-174.3-179.912.500112.6A144 V151 S152A144-Q148 WeakPolarHBondContact O-CB 3.33Å; A144-Q148 PolarHBondContact O-N 3.43Å; Q148-V151 PolarHBondContact O-N 3.12Å; Q148-S152 PolarHBondContact O-N 3.14Å
149R84.6Confident83.2Confident136 Ų13696.8 Ų96.851%0.51350%0.502SS..Hα-helixtrans-64.2-41.9175.2-72.1174.5-143.3175.47.8111.8Q145 H146 T147 S152 M153Q145-R149 WeakPolarHBondContact O-CB 3.43Å; Q145-R149 VanDerWaalsContact O-CG 3.25Å; Q145-R149 WeakPolarHBondContact O-CG 3.48Å; Q145-R149 PolarHBondContact O-N 2.86Å; H146-R149 PolarHBondContact O-N 2.81Å; T147-R149 PolarHBondContact O-N 3.09Å; R149-S152 PolarHBondContact O-N 3.48Å; R149-M153 WeakPolarHBondContact O-CG 3.38Å; R149-M153 PolarHBondContact O-N 3.33Å
150V82.4Confident83.3Confident92 Ų9296.6 Ų96.656%0.55850%0.502SS*.Hα-helixtrans-61.3-45174.3170.70000110.8H146 T147 S152 M153 S154H146-V150 WeakPolarHBondContact O-CG2 3.39Å; H146-V150 PolarHBondContact O-N 3.08Å; T147-V150 PolarHBondContact O-N 2.84Å; V150-S152 PolarHBondContact O-N 3.33Å; V150-M153 PolarHBondContact O-N 2.95Å; V150-S154 WeakPolarHBondContact O-CB 3.46Å; V150-S154 PolarHBondContact O-N 2.72Å; V150-S154 PolarHBondContact O-OG 3.48Å
151V86.8Confident83.3Confident99 Ų9999.1 Ų99.160%0.651%0.505SS*.Hα-helixtrans-63.7-38.2177169.70000112.1T147 Q148 R155T147-V151 WeakPolarHBondContact O-CG2 3.11Å; T147-V151 PolarHBondContact O-N 3.02Å; Q148-V151 PolarHBondContact O-N 3.12Å; V151-R155 VanDerWaalsContact O-CB 3.31Å; V151-R155 WeakPolarHBondContact O-CB 3.47Å; V151-R155 PolarHBondContact O-N 2.91Å
152S86.7Confident83.3Confident57 Ų57101.7 Ų101.740%0.39950%0.504SS..Hα-helixtrans-61.4-52.7172.8-160.70000111Q148 R149 V150 S154 R155 E156Q148-S152 PolarHBondContact O-N 3.14Å; R149-S152 PolarHBondContact O-N 3.48Å; V150-S152 PolarHBondContact O-N 3.33Å; S152-S154 VanDerWaalsContact C-N 3.34Å; S152-S154 PolarHBondContact O-N 3.2Å; S152-R155 CarbonylContact O-C 3.56Å; S152-R155 WeakPolarHBondContact O-CA 3.42Å; S152-R155 WeakPolarHBondContact O-CB 3.17Å; S152-R155 PolarHBondContact O-N 3.12Å; S152-E156 WeakPolarHBondContact CB-OE1 3.49Å; S152-E156 VanDerWaalsContact O-CG 3.3Å; S152-E156 WeakPolarHBondContact O-CG 3.38Å; S152-E156 PolarHBondContact O-N 2.9Å; S152-E156 PolarHBondContact OG-OE1 3.4Å
153M80.6Confident83.7Confident124 Ų124100.5 Ų100.561%0.61150%0.499SS*.Hα-helixtrans-60.9-39.8178.6-71-175.470.300112.8R149 V150 E156 V157R149-M153 WeakPolarHBondContact O-CG 3.38Å; R149-M153 PolarHBondContact O-N 3.33Å; V150-M153 PolarHBondContact O-N 2.95Å; M153-E156 PolarHBondContact O-N 3.21Å; M153-V157 WeakPolarHBondContact O-CB 3.42Å; M153-V157 VanDerWaalsContact O-CG2 3.27Å; M153-V157 WeakPolarHBondContact O-CG2 3.34Å; M153-V157 PolarHBondContact O-N 3.23Å
154S76.4Confident83.8Confident63 Ų63100.9 Ų100.944%0.44150%0.499SS..Hα-helixtrans-61.3-44173.2-68.60000111.4V150 S152 V157 E158V150-S154 WeakPolarHBondContact O-CB 3.46Å; V150-S154 PolarHBondContact O-N 2.72Å; V150-S154 PolarHBondContact O-OG 3.48Å; S152-S154 VanDerWaalsContact C-N 3.34Å; S152-S154 PolarHBondContact O-N 3.2Å; S154-V157 PolarHBondContact O-N 3.28Å; S154-E158 WeakPolarHBondContact O-CG 3.22Å; S154-E158 PolarHBondContact O-N 3.32Å
155R86.7Confident84.1Confident156 Ų156102.6 Ų102.659%0.58950%0.498SS*.Hα-helixtrans-63.9-43.7176.5179.9-179.6174.7132.913.2112.1V151 S152 V157 E158 E159V151-R155 VanDerWaalsContact O-CB 3.31Å; V151-R155 WeakPolarHBondContact O-CB 3.47Å; V151-R155 PolarHBondContact O-N 2.91Å; S152-R155 CarbonylContact O-C 3.56Å; S152-R155 WeakPolarHBondContact O-CA 3.42Å; S152-R155 WeakPolarHBondContact O-CB 3.17Å; S152-R155 PolarHBondContact O-N 3.12Å; R155-V157 VanDerWaalsContact C-N 3.34Å; R155-V157 PolarHBondContact O-N 2.83Å; R155-E158 PolarHBondContact O-N 2.87Å; R155-E159 HydrophobicContact CG-CG 4.43Å; R155-E159 IonicContact CZ-OE1 2.74Å; R155-E159 IonicContact NE-OE1 2.84Å; R155-E159 PolarHBondContact NE-OE1 3.24Å; R155-E159 IonicContact NH2-OE1 3.2Å; R155-E159 PolarHBondContact NH2-OE1 2.79Å; R155-E159 WeakPolarHBondContact O-CB 3.24Å; R155-E159 WeakPolarHBondContact O-CG 3.32Å; R155-E159 PolarHBondContact O-N 3.5Å
156E85Confident84.5Confident90 Ų90104.7 Ų104.742%0.42151%0.507SS..Hα-helixtrans-62.4-40.6176.6-69.6155-134.100111.3S152 M153 E159 M160S152-E156 WeakPolarHBondContact CB-OE1 3.49Å; S152-E156 VanDerWaalsContact O-CG 3.3Å; S152-E156 WeakPolarHBondContact O-CG 3.38Å; S152-E156 PolarHBondContact O-N 2.9Å; S152-E156 PolarHBondContact OG-OE1 3.4Å; M153-E156 PolarHBondContact O-N 3.21Å; E156-E159 PolarHBondContact O-N 2.84Å; E156-M160 WeakPolarHBondContact O-CB 3.29Å; E156-M160 WeakPolarHBondContact O-CG 3.34Å; E156-M160 PolarHBondContact O-N 3.29Å
157V83.5Confident85Confident88 Ų88105.3 Ų105.353%0.53351%0.509SS..Hα-helixtrans-65.6-39.2173.4168.60000111.8M153 S154 R155 M160 R161M153-V157 WeakPolarHBondContact O-CB 3.42Å; M153-V157 VanDerWaalsContact O-CG2 3.27Å; M153-V157 WeakPolarHBondContact O-CG2 3.34Å; M153-V157 PolarHBondContact O-N 3.23Å; S154-V157 PolarHBondContact O-N 3.28Å; R155-V157 VanDerWaalsContact C-N 3.34Å; R155-V157 PolarHBondContact O-N 2.83Å; V157-M160 HydrophobicContact CG2-CE 4.15Å; V157-R161 VanDerWaalsContact O-CB 3.27Å; V157-R161 WeakPolarHBondContact O-CB 3.18Å; V157-R161 PolarHBondContact O-N 2.89Å
158E85.4Confident85Confident95 Ų95106.6 Ų106.644%0.44451%0.511SS..Hα-helixtrans-68.1-39.6173.4-74.7-179-171.400113.1S154 R155 R161 R162S154-E158 WeakPolarHBondContact O-CG 3.22Å; S154-E158 PolarHBondContact O-N 3.32Å; R155-E158 PolarHBondContact O-N 2.87Å; E158-R161 PolarHBondContact O-N 2.84Å; E158-R162 VanDerWaalsContact O-CG 3.3Å; E158-R162 WeakPolarHBondContact O-CG 3.41Å; E158-R162 PolarHBondContact O-N 3.43Å; E158-R162 IonicContact OE2-CZ 2.65Å; E158-R162 IonicContact OE2-NH1 2.71Å; E158-R162 IonicContact OE2-NH2 3.67Å; E158-R162 PolarHBondContact OE2-NH2 3.03Å
159E88Confident85.4Confident84 Ų84108 Ų10839%0.39351%0.511SS..Hα-helixtrans-69.1-39.8177.1-73177.7-178.400111R155 E156 R162 S163R155-E159 HydrophobicContact CG-CG 4.43Å; R155-E159 IonicContact CZ-OE1 2.74Å; R155-E159 IonicContact NE-OE1 2.84Å; R155-E159 PolarHBondContact NE-OE1 3.24Å; R155-E159 IonicContact NH2-OE1 3.2Å; R155-E159 PolarHBondContact NH2-OE1 2.79Å; R155-E159 WeakPolarHBondContact O-CB 3.24Å; R155-E159 WeakPolarHBondContact O-CG 3.32Å; R155-E159 PolarHBondContact O-N 3.5Å; E156-E159 PolarHBondContact O-N 2.84Å; E159-R162 PolarHBondContact O-N 3.12Å; E159-S163 PolarHBondContact O-N 2.76Å
160M83.9Confident85.5Confident103 Ų103105.1 Ų105.151%0.50751%0.508SS..Hα-helixtrans-58.6-48.1167.2-78.2-171-75.700111.4E156 V157 R162 S163 F164E156-M160 WeakPolarHBondContact O-CB 3.29Å; E156-M160 WeakPolarHBondContact O-CG 3.34Å; E156-M160 PolarHBondContact O-N 3.29Å; V157-M160 HydrophobicContact CG2-CE 4.15Å; M160-R162 PolarHBondContact O-N 2.78Å; M160-S163 WeakPolarHBondContact O-CB 3.48Å; M160-S163 PolarHBondContact O-N 2.8Å; M160-S163 VanDerWaalsContact O-N 3.13Å; M160-S163 PolarHBondContact O-OG 2.62Å; M160-F164 VanDerWaalsContact O-CD2 3.24Å; M160-F164 WeakPolarHBondContact O-CD2 3.47Å; M160-F164 PolarHBondContact O-N 2.77Å
161R84.7Confident85.7Confident159 Ų159107.3 Ų107.360%0.651%0.51SS*.Hα-helixtrans-58.6-47.6178178.4-178.9165.1-163.1-11.5111.8V157 E158 S163 F164 E165V157-R161 VanDerWaalsContact O-CB 3.27Å; V157-R161 WeakPolarHBondContact O-CB 3.18Å; V157-R161 PolarHBondContact O-N 2.89Å; E158-R161 PolarHBondContact O-N 2.84Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.36Å; R161-F164 PolarHBondContact O-N 3.43Å; R161-F164 VanDerWaalsContact O-N 3.07Å; R161-E165 HydrophobicContact CG-CG 4.44Å; R161-E165 IonicContact CZ-OE1 3.85Å; R161-E165 IonicContact NE-OE1 3.41Å; R161-E165 PolarHBondContact NE-OE1 3.08Å; R161-E165 IonicContact NE-OE2 2.76Å; R161-E165 IonicContact NH2-OE1 3.19Å; R161-E165 PolarHBondContact NH2-OE1 2.89Å; R161-E165 WeakPolarHBondContact O-CG 3.4Å; R161-E165 PolarHBondContact O-N 3.23Å
162R87.2Confident85.5Confident125 Ų125105.9 Ų105.947%0.47251%0.505SS..Hα-helixtrans-56.9-43174.3-71.6173.4-163.2109.49.8110.9E158 E159 M160 F164 E165 E166E158-R162 VanDerWaalsContact O-CG 3.3Å; E158-R162 WeakPolarHBondContact O-CG 3.41Å; E158-R162 PolarHBondContact O-N 3.43Å; E158-R162 IonicContact OE2-CZ 2.65Å; E158-R162 IonicContact OE2-NH1 2.71Å; E158-R162 IonicContact OE2-NH2 3.67Å; E158-R162 PolarHBondContact OE2-NH2 3.03Å; E159-R162 PolarHBondContact O-N 3.12Å; M160-R162 PolarHBondContact O-N 2.78Å; R162-F164 VanDerWaalsContact C-N 3.3Å; R162-F164 PolarHBondContact O-N 2.86Å; R162-E165 PolarHBondContact O-N 2.77Å; R162-E166 VanDerWaalsContact O-CB 3.32Å; R162-E166 WeakPolarHBondContact O-CB 3.5Å; R162-E166 PolarHBondContact O-N 2.79Å
163S88.8Confident85.5Confident37 Ų37107.7 Ų107.726%0.25951%0.507SS..Hα-helixtrans-64.6-31176.887.80000113.4E159 M160 R161 K167E159-S163 PolarHBondContact O-N 2.76Å; M160-S163 WeakPolarHBondContact O-CB 3.48Å; M160-S163 PolarHBondContact O-N 2.8Å; M160-S163 VanDerWaalsContact O-N 3.13Å; M160-S163 PolarHBondContact O-OG 2.62Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.36Å; S163-K167 WeakPolarHBondContact O-CB 3.39Å; S163-K167 WeakPolarHBondContact O-CD 3.41Å; S163-K167 WeakPolarHBondContact O-CG 3.47Å; S163-K167 PolarHBondContact O-N 3.28Å
164F83.1Confident85.8Confident128 Ų128103.4 Ų103.456%0.56149%0.491SS*.Hα-helixtrans-75.9-41.3173.5-81.1-69000112M160 R161 R162 E166 K167 L168M160-F164 VanDerWaalsContact O-CD2 3.24Å; M160-F164 WeakPolarHBondContact O-CD2 3.47Å; M160-F164 PolarHBondContact O-N 2.77Å; R161-F164 PolarHBondContact O-N 3.43Å; R161-F164 VanDerWaalsContact O-N 3.07Å; R162-F164 VanDerWaalsContact C-N 3.3Å; R162-F164 PolarHBondContact O-N 2.86Å; F164-E166 VanDerWaalsContact C-N 3.31Å; F164-E166 PolarHBondContact O-N 3.21Å; F164-K167 PolarHBondContact O-N 3.43Å; F164-L168 WeakPolarHBondContact O-CB 3.33Å; F164-L168 VanDerWaalsContact O-CG 3.27Å; F164-L168 WeakPolarHBondContact O-CG 3.33Å; F164-L168 PolarHBondContact O-N 2.93Å
165E87.3Confident86.1Confident91 Ų91104.8 Ų104.843%0.42549%0.491SS..Hα-helixtrans-63.5-37.2174.4-71173.6167.500111.5R161 R162 R169R161-E165 HydrophobicContact CG-CG 4.44Å; R161-E165 IonicContact CZ-OE1 3.85Å; R161-E165 IonicContact NE-OE1 3.41Å; R161-E165 PolarHBondContact NE-OE1 3.08Å; R161-E165 IonicContact NE-OE2 2.76Å; R161-E165 IonicContact NH2-OE1 3.19Å; R161-E165 PolarHBondContact NH2-OE1 2.89Å; R161-E165 WeakPolarHBondContact O-CG 3.4Å; R161-E165 PolarHBondContact O-N 3.23Å; R162-E165 PolarHBondContact O-N 2.77Å; E165-R169 WeakPolarHBondContact O-CB 3.49Å; E165-R169 PolarHBondContact O-N 2.8Å
166E87.9Confident86Confident133 Ų133100 Ų10062%0.62149%0.485SS*.Hα-helixtrans-68.7-45.4172.9-173.8166.8-14000112.2R162 F164 L168 R169 T170R162-E166 VanDerWaalsContact O-CB 3.32Å; R162-E166 WeakPolarHBondContact O-CB 3.5Å; R162-E166 PolarHBondContact O-N 2.79Å; F164-E166 VanDerWaalsContact C-N 3.31Å; F164-E166 PolarHBondContact O-N 3.21Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.7Å; E166-R169 WeakPolarHBondContact O-CB 3.44Å; E166-R169 PolarHBondContact O-N 2.88Å; E166-R169 VanDerWaalsContact O-N 3.15Å; E166-T170 PolarHBondContact O-N 3.43Å; E166-T170 PolarHBondContact O-OG1 3.1Å
167K88.9Confident86Confident125 Ų125101.2 Ų101.254%0.54349%0.49SS..Hα-helixtrans-58.7-43.8173.2-77.6164.8-173.4165.50112S163 F164 T170 F171S163-K167 WeakPolarHBondContact O-CB 3.39Å; S163-K167 WeakPolarHBondContact O-CD 3.41Å; S163-K167 WeakPolarHBondContact O-CG 3.47Å; S163-K167 PolarHBondContact O-N 3.28Å; F164-K167 PolarHBondContact O-N 3.43Å; K167-T170 WeakPolarHBondContact CA-OG1 3.14Å; K167-T170 PolarHBondContact O-N 3.31Å; K167-T170 PolarHBondContact O-OG1 2.98Å; K167-F171 WeakPolarHBondContact O-CB 3.45Å; K167-F171 PolarHBondContact O-N 3.27Å
168L84.8Confident86.1Confident114 Ų114104 Ų10460%0.59750%0.495SS*.Hα-helixtrans-60.9-43.9174.2-75.6168.6000111.3F164 E166 F171 S172F164-L168 WeakPolarHBondContact O-CB 3.33Å; F164-L168 VanDerWaalsContact O-CG 3.27Å; F164-L168 WeakPolarHBondContact O-CG 3.33Å; F164-L168 PolarHBondContact O-N 2.93Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.7Å; L168-F171 PolarHBondContact O-N 2.75Å; L168-S172 PolarHBondContact O-N 2.78Å; L168-S172 PolarHBondContact O-OG 2.85Å
169R90.2Very high86Confident170 Ų170103.2 Ų103.264%0.64249%0.492SS*.Hα-helixtrans-60.7-45.6174.4175.7176.6169.2144.3-4.1112.2E165 E166 F171 S172 Q173E165-R169 WeakPolarHBondContact O-CB 3.49Å; E165-R169 PolarHBondContact O-N 2.8Å; E166-R169 WeakPolarHBondContact O-CB 3.44Å; E166-R169 PolarHBondContact O-N 2.88Å; E166-R169 VanDerWaalsContact O-N 3.15Å; R169-F171 VanDerWaalsContact C-N 3.32Å; R169-F171 PolarHBondContact O-N 3.04Å; R169-S172 PolarHBondContact O-N 2.84Å; R169-Q173 WeakPolarHBondContact O-CB 3.29Å; R169-Q173 WeakPolarHBondContact O-CG 3.48Å; R169-Q173 PolarHBondContact O-N 2.81Å
170T87.8Confident86Confident75 Ų75105.9 Ų105.946%0.4650%0.504SS..Hα-helixtrans-65.5-35.9176.5560000112E166 K167 Q173 A174E166-T170 PolarHBondContact O-N 3.43Å; E166-T170 PolarHBondContact O-OG1 3.1Å; K167-T170 WeakPolarHBondContact CA-OG1 3.14Å; K167-T170 PolarHBondContact O-N 3.31Å; K167-T170 PolarHBondContact O-OG1 2.98Å; T170-Q173 PolarHBondContact O-N 3.01Å; T170-A174 WeakPolarHBondContact O-CB 3.24Å; T170-A174 PolarHBondContact O-N 2.82Å
171F86.3Confident86.1Confident137 Ų137106.5 Ų106.560%0.60151%0.506SS*.Hα-helixtrans-66.3-44.5174.9-179.9-93.8000111.7K167 L168 R169 Q173 A174 Q175K167-F171 WeakPolarHBondContact O-CB 3.45Å; K167-F171 PolarHBondContact O-N 3.27Å; L168-F171 PolarHBondContact O-N 2.75Å; R169-F171 VanDerWaalsContact C-N 3.32Å; R169-F171 PolarHBondContact O-N 3.04Å; F171-Q173 VanDerWaalsContact C-N 3.31Å; F171-Q173 PolarHBondContact O-N 3.3Å; F171-A174 PolarHBondContact O-N 3.46Å; F171-Q175 WeakPolarHBondContact O-CB 3.18Å; F171-Q175 PolarHBondContact O-N 3.39Å
172S83.3Confident86.2Confident69 Ų69105.8 Ų105.848%0.48351%0.507SS..Hα-helixtrans-64.7-33.8174.3-62.90000112.8L168 R169 A176L168-S172 PolarHBondContact O-N 2.78Å; L168-S172 PolarHBondContact O-OG 2.85Å; R169-S172 PolarHBondContact O-N 2.84Å; S172-A176 WeakPolarHBondContact O-CB 3.27Å; S172-A176 PolarHBondContact O-N 3.36Å
173Q86.5Confident86.1Confident96 Ų96105.6 Ų105.645%0.44951%0.51SS..Hα-helixtrans-67.5-44.3172.4-74.7177.6-35.300111.7R169 T170 F171 A176 Q177R169-Q173 WeakPolarHBondContact O-CB 3.29Å; R169-Q173 WeakPolarHBondContact O-CG 3.48Å; R169-Q173 PolarHBondContact O-N 2.81Å; T170-Q173 PolarHBondContact O-N 3.01Å; F171-Q173 VanDerWaalsContact C-N 3.31Å; F171-Q173 PolarHBondContact O-N 3.3Å; Q173-A176 PolarHBondContact O-N 3.3Å; Q173-Q177 WeakPolarHBondContact O-CG 3.39Å; Q173-Q177 PolarHBondContact O-N 2.81Å
174A86.1Confident85.9Confident33 Ų33106.5 Ų106.527%0.27352%0.52SS..Hα-helixtrans-63.7-40.9174.400000112.1T170 F171 A176 Q177 F178T170-A174 WeakPolarHBondContact O-CB 3.24Å; T170-A174 PolarHBondContact O-N 2.82Å; F171-A174 PolarHBondContact O-N 3.46Å; A174-A176 PolarHBondContact O-N 2.83Å; A174-Q177 WeakPolarHBondContact O-CB 3.3Å; A174-Q177 PolarHBondContact O-N 3.31Å; A174-F178 WeakPolarHBondContact O-CD2 3.42Å; A174-F178 PolarHBondContact O-N 2.85Å
175Q82.1Confident86.1Confident93 Ų93103 Ų10344%0.43551%0.514SS..Hα-helixtrans-60.7-45.2173-175.7-170.3-29.500111.1F171 Q177 F178 E179F171-Q175 WeakPolarHBondContact O-CB 3.18Å; F171-Q175 PolarHBondContact O-N 3.39Å; Q175-Q177 VanDerWaalsContact C-N 3.3Å; Q175-Q177 PolarHBondContact O-N 2.83Å; Q175-F178 PolarHBondContact O-N 2.69Å; Q175-E179 PolarHBondContact NE2-OE1 2.78Å; Q175-E179 WeakPolarHBondContact O-CB 3.36Å; Q175-E179 WeakPolarHBondContact O-CG 3.39Å; Q175-E179 PolarHBondContact O-N 3.2Å
176A85.1Confident85.9Confident56 Ų56102.6 Ų102.646%0.46352%0.515SS..Hα-helixtrans-62.7-37.6177.200000112S172 Q173 A174 Q180S172-A176 WeakPolarHBondContact O-CB 3.27Å; S172-A176 PolarHBondContact O-N 3.36Å; Q173-A176 PolarHBondContact O-N 3.3Å; A174-A176 PolarHBondContact O-N 2.83Å; A176-Q180 VanDerWaalsContact O-CB 3.29Å; A176-Q180 WeakPolarHBondContact O-CB 3.47Å; A176-Q180 PolarHBondContact O-N 2.76Å
177Q85.6Confident85.8Confident115 Ų115100.4 Ų100.454%0.53750%0.504SS..Hα-helixtrans-64.2-52.7172.7-74.2169.1-28.200111.5Q173 A174 Q175 E179 Q180 E181Q173-Q177 WeakPolarHBondContact O-CG 3.39Å; Q173-Q177 PolarHBondContact O-N 2.81Å; A174-Q177 WeakPolarHBondContact O-CB 3.3Å; A174-Q177 PolarHBondContact O-N 3.31Å; Q175-Q177 VanDerWaalsContact C-N 3.3Å; Q175-Q177 PolarHBondContact O-N 2.83Å; Q177-E179 VanDerWaalsContact C-N 3.28Å; Q177-E179 PolarHBondContact O-N 3.18Å; Q177-Q180 CarbonylContact O-C 3.59Å; Q177-Q180 WeakPolarHBondContact O-CA 3.31Å; Q177-Q180 WeakPolarHBondContact O-CB 3.48Å; Q177-Q180 PolarHBondContact O-N 2.77Å; Q177-E181 WeakPolarHBondContact O-CB 3.39Å; Q177-E181 WeakPolarHBondContact O-CG 3.34Å; Q177-E181 PolarHBondContact O-N 3.42Å
178F84.9Confident85.8Confident145 Ų145100.1 Ų100.164%0.63651%0.505SS*.Hα-helixtrans-59-37175.8-79.5-59.3000112.8A174 Q175 K182A174-F178 WeakPolarHBondContact O-CD2 3.42Å; A174-F178 PolarHBondContact O-N 2.85Å; Q175-F178 PolarHBondContact O-N 2.69Å; F178-K182 WeakPolarHBondContact O-CB 3.24Å; F178-K182 PolarHBondContact O-N 3.25Å
179E84.7Confident85.8Confident79 Ų7999.7 Ų99.737%0.36950%0.503SS..Hα-helixtrans-67.6-36173-84.1-167.4-138.700112.9Q175 Q177 K183Q175-E179 PolarHBondContact NE2-OE1 2.78Å; Q175-E179 WeakPolarHBondContact O-CB 3.36Å; Q175-E179 WeakPolarHBondContact O-CG 3.39Å; Q175-E179 PolarHBondContact O-N 3.2Å; Q177-E179 VanDerWaalsContact C-N 3.28Å; Q177-E179 PolarHBondContact O-N 3.18Å; E179-K183 WeakPolarHBondContact O-CB 3.38Å; E179-K183 WeakPolarHBondContact O-CD 3.39Å; E179-K183 WeakPolarHBondContact O-CE 3.31Å; E179-K183 WeakPolarHBondContact O-CG 3.4Å; E179-K183 PolarHBondContact O-N 2.76Å; E179-K183 IonicContact OE2-NZ 3.58Å; E179-K183 PolarHBondContact OE2-NZ 3.36Å
180Q86.9Confident85.6Confident141 Ų14196.4 Ų96.466%0.65949%0.493SS*.Hα-helixtrans-72.4-43.3176.8-177.7172.8-700111.4A176 Q177 K183 A184A176-Q180 VanDerWaalsContact O-CB 3.29Å; A176-Q180 WeakPolarHBondContact O-CB 3.47Å; A176-Q180 PolarHBondContact O-N 2.76Å; Q177-Q180 CarbonylContact O-C 3.59Å; Q177-Q180 WeakPolarHBondContact O-CA 3.31Å; Q177-Q180 WeakPolarHBondContact O-CB 3.48Å; Q177-Q180 PolarHBondContact O-N 2.77Å; Q180-K183 PolarHBondContact O-N 3.5Å; Q180-A184 WeakPolarHBondContact O-CB 3.39Å; Q180-A184 PolarHBondContact O-N 2.75Å
181E85.6Confident85.4Confident115 Ų11594.6 Ų94.654%0.53749%0.486SS..Hα-helixtrans-62.2-44.2173.2-71.9171.3-175.500111Q177 K183 A184 A185Q177-E181 WeakPolarHBondContact O-CB 3.39Å; Q177-E181 WeakPolarHBondContact O-CG 3.34Å; Q177-E181 PolarHBondContact O-N 3.42Å; E181-K183 VanDerWaalsContact C-N 3.33Å; E181-K183 PolarHBondContact O-N 3.38Å; E181-A184 PolarHBondContact O-N 3.5Å; E181-A185 WeakPolarHBondContact O-CB 3.19Å; E181-A185 PolarHBondContact O-N 2.82Å
182K87Confident85.2Confident145 Ų14592 Ų9263%0.6348%0.476SS*.Hα-helixtrans-60.3-40172.2179.6173179.6174.20112.3F178 L186F178-K182 WeakPolarHBondContact O-CB 3.24Å; F178-K182 PolarHBondContact O-N 3.25Å; K182-L186 HydrophobicContact CG-CD1 4.08Å; K182-L186 VanDerWaalsContact O-CB 3.27Å; K182-L186 WeakPolarHBondContact O-CB 3.31Å; K182-L186 WeakPolarHBondContact O-CD1 3.43Å; K182-L186 WeakPolarHBondContact O-CG 3.26Å; K182-L186 PolarHBondContact O-N 3.35Å
183K85.4Confident85Confident121 Ų12193.5 Ų93.553%0.52648%0.475SS..Hα-helixtrans-67.9-39175.1-73.2157.7-162.8157.90111.3E179 Q180 E181 E187E179-K183 WeakPolarHBondContact O-CB 3.38Å; E179-K183 WeakPolarHBondContact O-CD 3.39Å; E179-K183 WeakPolarHBondContact O-CE 3.31Å; E179-K183 WeakPolarHBondContact O-CG 3.4Å; E179-K183 PolarHBondContact O-N 2.76Å; E179-K183 IonicContact OE2-NZ 3.58Å; E179-K183 PolarHBondContact OE2-NZ 3.36Å; Q180-K183 PolarHBondContact O-N 3.5Å; E181-K183 VanDerWaalsContact C-N 3.33Å; E181-K183 PolarHBondContact O-N 3.38Å; K183-E187 PolarHBondContact O-N 2.81Å
184A85.4Confident85Confident56 Ų5694.5 Ų94.546%0.46347%0.474SS..Hα-helixtrans-65.6-52.917600000111.5Q180 E181 L186 E187 E188Q180-A184 WeakPolarHBondContact O-CB 3.39Å; Q180-A184 PolarHBondContact O-N 2.75Å; E181-A184 PolarHBondContact O-N 3.5Å; A184-L186 VanDerWaalsContact C-N 3.26Å; A184-L186 PolarHBondContact O-N 3.48Å; A184-E187 CarbonylContact O-C 3.58Å; A184-E187 PolarHBondContact O-N 2.99Å; A184-E188 WeakPolarHBondContact O-CB 3.34Å; A184-E188 PolarHBondContact O-N 3.15Å
185A85.5Confident84.8Confident55 Ų5598.2 Ų98.246%0.45549%0.486SS..Hα-helixtrans-59.4-34.5176.300000112.5E181 L189E181-A185 WeakPolarHBondContact O-CB 3.19Å; E181-A185 PolarHBondContact O-N 2.82Å; A185-L189 WeakPolarHBondContact O-CB 3.3Å; A185-L189 PolarHBondContact O-N 2.89Å
186L84.3Confident84.7Confident82 Ų8298.8 Ų98.843%0.42949%0.489SS..Hα-helixtrans-71.1-35.7173.3-77.1170.4000113.3K182 A184 K190K182-L186 HydrophobicContact CG-CD1 4.08Å; K182-L186 VanDerWaalsContact O-CB 3.27Å; K182-L186 WeakPolarHBondContact O-CB 3.31Å; K182-L186 WeakPolarHBondContact O-CD1 3.43Å; K182-L186 WeakPolarHBondContact O-CG 3.26Å; K182-L186 PolarHBondContact O-N 3.35Å; A184-L186 VanDerWaalsContact C-N 3.26Å; A184-L186 PolarHBondContact O-N 3.48Å; L186-K190 WeakPolarHBondContact O-CB 3.49Å; L186-K190 WeakPolarHBondContact O-CD 3.43Å; L186-K190 WeakPolarHBondContact O-CG 3.35Å; L186-K190 PolarHBondContact O-N 3.12Å
187E86.4Confident84.6Confident86 Ų8699.6 Ų99.640%0.40249%0.485SS..Hα-helixtrans-77.1-29.3172.8-78.3-53.9138.300113.1K183 A184 K190 A191 R194K183-E187 PolarHBondContact O-N 2.81Å; A184-E187 CarbonylContact O-C 3.58Å; A184-E187 PolarHBondContact O-N 2.99Å; E187-K190 CarbonylContact O-C 3.51Å; E187-K190 VanDerWaalsContact OE1-CD 3.27Å; E187-K190 WeakPolarHBondContact OE1-CD 3.25Å; E187-K190 WeakPolarHBondContact OE1-CE 3.36Å; E187-K190 IonicContact OE1-NZ 2.73Å; E187-K190 PolarHBondContact OE1-NZ 3.14Å; E187-A191 VanDerWaalsContact O-CB 3.23Å; E187-A191 WeakPolarHBondContact O-CB 3.45Å; E187-A191 PolarHBondContact O-N 2.83Å; E187-R194 PolarHBondContact O-NH2 3.31Å; E187-R194 IonicContact OE2-CZ 3.83Å; E187-R194 IonicContact OE2-NH1 2.76Å; E187-R194 PolarHBondContact OE2-NH1 3.1Å; E187-R194 IonicContact OE2-NH2 3.18Å; E187-R194 PolarHBondContact OE2-NH2 3.18Å
188E88.1Confident84.4Confident119 Ų11999 Ų9956%0.55648%0.482SS*.Hα-helixtrans-68.2-48.6171.2-176.1171-171.100110.9A184 K190 A191 Q192A184-E188 WeakPolarHBondContact O-CB 3.34Å; A184-E188 PolarHBondContact O-N 3.15Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3Å; E188-A191 CarbonylContact O-C 3.6Å; E188-A191 WeakPolarHBondContact O-CA 3.35Å; E188-A191 WeakPolarHBondContact O-CB 3.35Å; E188-A191 PolarHBondContact O-N 3.5Å; E188-Q192 WeakPolarHBondContact O-CG 3.48Å; E188-Q192 PolarHBondContact O-N 2.83Å
189L85.3Confident84.2Confident106 Ų10698 Ų9856%0.55548%0.479SS*.Hα-helixtrans-60.9-39.2174.1-175.965.2000111.4A185 A191 H193A185-L189 WeakPolarHBondContact O-CB 3.3Å; A185-L189 PolarHBondContact O-N 2.89Å; L189-A191 VanDerWaalsContact C-N 3.32Å; L189-H193 VanDerWaalsContact O-CB 3.23Å; L189-H193 WeakPolarHBondContact O-CB 3.48Å; L189-H193 PolarHBondContact O-N 2.87Å
190K85.1Confident83.9Confident100 Ų10099.9 Ų99.944%0.43549%0.491SS..Hα-helixtrans-66.4-32.2169.6-71.4167.1-161.2175.10112.2L186 E187 E188 R194L186-K190 WeakPolarHBondContact O-CB 3.49Å; L186-K190 WeakPolarHBondContact O-CD 3.43Å; L186-K190 WeakPolarHBondContact O-CG 3.35Å; L186-K190 PolarHBondContact O-N 3.12Å; E187-K190 CarbonylContact O-C 3.51Å; E187-K190 VanDerWaalsContact OE1-CD 3.27Å; E187-K190 WeakPolarHBondContact OE1-CD 3.25Å; E187-K190 WeakPolarHBondContact OE1-CE 3.36Å; E187-K190 IonicContact OE1-NZ 2.73Å; E187-K190 PolarHBondContact OE1-NZ 3.14Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3Å; K190-R194 VanDerWaalsContact C-NE 3.34Å; K190-R194 VanDerWaalsContact CB-NH2 3.27Å; K190-R194 WeakPolarHBondContact O-CB 3.49Å; K190-R194 WeakPolarHBondContact O-CD 3.3Å; K190-R194 WeakPolarHBondContact O-CG 3.25Å; K190-R194 PolarHBondContact O-N 2.77Å; K190-R194 PolarHBondContact O-NE 3.41Å
191A84.3Confident83.4Confident38 Ų3897.5 Ų97.531%0.31448%0.482SS..Hα-helixtrans-71-46178.100000110.8E187 E188 L189 R194 Q195E187-A191 VanDerWaalsContact O-CB 3.23Å; E187-A191 WeakPolarHBondContact O-CB 3.45Å; E187-A191 PolarHBondContact O-N 2.83Å; E188-A191 CarbonylContact O-C 3.6Å; E188-A191 WeakPolarHBondContact O-CA 3.35Å; E188-A191 WeakPolarHBondContact O-CB 3.35Å; E188-A191 PolarHBondContact O-N 3.5Å; L189-A191 VanDerWaalsContact C-N 3.32Å; A191-R194 CarbonylContact O-C 3.54Å; A191-R194 PolarHBondContact O-N 3.34Å; A191-Q195 WeakPolarHBondContact O-CG 3.26Å; A191-Q195 PolarHBondContact O-N 3.11Å
192Q82.9Confident83Confident83 Ų8399.2 Ų99.239%0.38848%0.484SS..Hα-helixtrans-55.7-51.9169.5-68.1170.11.800109.9E188 R194 Q195 E196E188-Q192 WeakPolarHBondContact O-CG 3.48Å; E188-Q192 PolarHBondContact O-N 2.83Å; Q192-R194 VanDerWaalsContact C-N 3.32Å; Q192-R194 PolarHBondContact O-N 3.49Å; Q192-Q195 CarbonylContact O-C 3.57Å; Q192-Q195 WeakPolarHBondContact O-CA 3.46Å; Q192-Q195 WeakPolarHBondContact O-CB 3.48Å; Q192-Q195 PolarHBondContact O-N 2.79Å; Q192-E196 WeakPolarHBondContact O-CG 3.45Å; Q192-E196 PolarHBondContact O-N 3.47Å
193H78.1Confident82.2Confident100 Ų10094.6 Ų94.646%0.46347%0.47SS..Hα-helixtrans-63-33.8176.9-168.453.8000113.8L189 Q195 E196 I197L189-H193 VanDerWaalsContact O-CB 3.23Å; L189-H193 WeakPolarHBondContact O-CB 3.48Å; L189-H193 PolarHBondContact O-N 2.87Å; H193-Q195 VanDerWaalsContact C-N 3.35Å; H193-E196 IonicContact CG-OE2 2.69Å; H193-E196 IonicContact ND1-OE2 3.17Å; H193-E196 PolarHBondContact ND1-OE2 2.81Å; H193-I197 WeakPolarHBondContact O-CB 3.33Å; H193-I197 VanDerWaalsContact O-CG1 3.27Å; H193-I197 WeakPolarHBondContact O-CG1 3.39Å; H193-I197 PolarHBondContact O-N 2.73Å
194R85.9Confident81.5Confident116 Ų11694 Ų9444%0.43847%0.469SS..Hα-helixtrans-68.3-32.5171.1-77.2170.4-68.8-148.92.2111.8E187 K190 A191 Q192 Q198E187-R194 PolarHBondContact O-NH2 3.31Å; E187-R194 IonicContact OE2-CZ 3.83Å; E187-R194 IonicContact OE2-NH1 2.76Å; E187-R194 PolarHBondContact OE2-NH1 3.1Å; E187-R194 IonicContact OE2-NH2 3.18Å; E187-R194 PolarHBondContact OE2-NH2 3.18Å; K190-R194 VanDerWaalsContact C-NE 3.34Å; K190-R194 VanDerWaalsContact CB-NH2 3.27Å; K190-R194 WeakPolarHBondContact O-CB 3.49Å; K190-R194 WeakPolarHBondContact O-CD 3.3Å; K190-R194 WeakPolarHBondContact O-CG 3.25Å; K190-R194 PolarHBondContact O-N 2.77Å; K190-R194 PolarHBondContact O-NE 3.41Å; A191-R194 CarbonylContact O-C 3.54Å; A191-R194 PolarHBondContact O-N 3.34Å; Q192-R194 VanDerWaalsContact C-N 3.32Å; Q192-R194 PolarHBondContact O-N 3.49Å; R194-Q198 WeakPolarHBondContact O-CB 3.27Å; R194-Q198 VanDerWaalsContact O-CG 3.23Å; R194-Q198 WeakPolarHBondContact O-CG 3.24Å; R194-Q198 PolarHBondContact O-N 3.29Å; R194-Q198 VanDerWaalsContact O-N 3.11Å
195Q82.7Confident80.9Confident111 Ų11197.3 Ų97.352%0.51948%0.475SS..Hα-helixtrans-73.1-48.6172.6-74174.1-60.200111.1A191 Q192 H193 I197 Q198 E199A191-Q195 WeakPolarHBondContact O-CG 3.26Å; A191-Q195 PolarHBondContact O-N 3.11Å; Q192-Q195 CarbonylContact O-C 3.57Å; Q192-Q195 WeakPolarHBondContact O-CA 3.46Å; Q192-Q195 WeakPolarHBondContact O-CB 3.48Å; Q192-Q195 PolarHBondContact O-N 2.79Å; H193-Q195 VanDerWaalsContact C-N 3.35Å; Q195-I197 VanDerWaalsContact C-N 3.32Å; Q195-I197 PolarHBondContact O-N 3.38Å; Q195-Q198 CarbonylContact O-C 3.59Å; Q195-Q198 WeakPolarHBondContact O-CA 3.35Å; Q195-Q198 WeakPolarHBondContact O-CB 3.26Å; Q195-Q198 PolarHBondContact O-N 2.79Å; Q195-E199 WeakPolarHBondContact O-CB 3.37Å; Q195-E199 WeakPolarHBondContact O-CG 3.3Å; Q195-E199 PolarHBondContact O-N 2.67Å
196E79.4Confident80.4Confident105 Ų10597.4 Ų97.449%0.49147%0.472SS..Hα-helixtrans-53.1-46.9172.3-70.2171.8168.500111.4Q192 H193 Q198 E199 L200Q192-E196 WeakPolarHBondContact O-CG 3.45Å; Q192-E196 PolarHBondContact O-N 3.47Å; H193-E196 IonicContact CG-OE2 2.69Å; H193-E196 IonicContact ND1-OE2 3.17Å; H193-E196 PolarHBondContact ND1-OE2 2.81Å; E196-Q198 VanDerWaalsContact C-N 3.34Å; E196-Q198 PolarHBondContact O-N 3.29Å; E196-E199 PolarHBondContact O-N 2.82Å; E196-L200 VanDerWaalsContact O-CB 3.23Å; E196-L200 WeakPolarHBondContact O-CB 3.19Å; E196-L200 VanDerWaalsContact O-CG 3.24Å; E196-L200 WeakPolarHBondContact O-CG 3.45Å; E196-L200 PolarHBondContact O-N 3.36Å
197I83.1Confident79.5Confident73 Ų7398.7 Ų98.737%0.37448%0.476SS..Hα-helixtrans-62.8-40.6174.8-74168.7000110.9H193 Q195 E199 L201H193-I197 WeakPolarHBondContact O-CB 3.33Å; H193-I197 VanDerWaalsContact O-CG1 3.27Å; H193-I197 WeakPolarHBondContact O-CG1 3.39Å; H193-I197 PolarHBondContact O-N 2.73Å; Q195-I197 VanDerWaalsContact C-N 3.32Å; Q195-I197 PolarHBondContact O-N 3.38Å; I197-E199 VanDerWaalsContact C-N 3.35Å; I197-L201 HydrophobicContact CG2-CD1 3.8Å; I197-L201 HydrophobicContact CG2-CG 4.38Å; I197-L201 WeakPolarHBondContact O-CB 3.42Å; I197-L201 WeakPolarHBondContact O-CD1 3.42Å; I197-L201 WeakPolarHBondContact O-CG 3.18Å; I197-L201 PolarHBondContact O-N 3.45Å
198Q80.9Confident78.6Confident103 Ų10399.1 Ų99.148%0.48148%0.481SS..Hα-helixtrans-69.9-29.7176-76176.233.700113.3R194 Q195 E196 R202R194-Q198 WeakPolarHBondContact O-CB 3.27Å; R194-Q198 VanDerWaalsContact O-CG 3.23Å; R194-Q198 WeakPolarHBondContact O-CG 3.24Å; R194-Q198 PolarHBondContact O-N 3.29Å; R194-Q198 VanDerWaalsContact O-N 3.11Å; Q195-Q198 CarbonylContact O-C 3.59Å; Q195-Q198 WeakPolarHBondContact O-CA 3.35Å; Q195-Q198 WeakPolarHBondContact O-CB 3.26Å; Q195-Q198 PolarHBondContact O-N 2.79Å; E196-Q198 VanDerWaalsContact C-N 3.34Å; E196-Q198 PolarHBondContact O-N 3.29Å; Q198-R202 VanDerWaalsContact O-CB 3.27Å; Q198-R202 WeakPolarHBondContact O-CB 3.38Å; Q198-R202 VanDerWaalsContact O-CG 3.24Å; Q198-R202 WeakPolarHBondContact O-CG 3.35Å; Q198-R202 PolarHBondContact O-N 2.75Å
199E80.9Confident77.6Confident123 Ų12395.5 Ų95.558%0.57547%0.471SS*.Hα-helixtrans-82.4-35.6177.9-73.7-178-17700111.6Q195 E196 I197 R202 S203Q195-E199 WeakPolarHBondContact O-CB 3.37Å; Q195-E199 WeakPolarHBondContact O-CG 3.3Å; Q195-E199 PolarHBondContact O-N 2.67Å; E196-E199 PolarHBondContact O-N 2.82Å; I197-E199 VanDerWaalsContact C-N 3.35Å; E199-R202 PolarHBondContact O-N 2.87Å; E199-S203 WeakPolarHBondContact O-CA 3.34Å; E199-S203 WeakPolarHBondContact O-CB 3.44Å; E199-S203 PolarHBondContact O-N 3.21Å
200L78.4Confident77Confident119 Ų11994.3 Ų94.362%0.62347%0.465SS*.Hα-helixtrans-65.9-40.2166.4-72.8169.6000111E196 S203 H204E196-L200 VanDerWaalsContact O-CB 3.23Å; E196-L200 WeakPolarHBondContact O-CB 3.19Å; E196-L200 VanDerWaalsContact O-CG 3.24Å; E196-L200 WeakPolarHBondContact O-CG 3.45Å; E196-L200 PolarHBondContact O-N 3.36Å; L200-S203 PolarHBondContact O-N 3.4Å; L200-H204 WeakPolarHBondContact O-CB 3.16Å; L200-H204 PolarHBondContact O-N 2.9Å
201L76Confident76Confident91 Ų9197.9 Ų97.948%0.47648%0.477SS..Hα-helixtrans-68.6-39.8173.3-75.4170.1000112I197 Q205I197-L201 HydrophobicContact CG2-CD1 3.8Å; I197-L201 HydrophobicContact CG2-CG 4.38Å; I197-L201 WeakPolarHBondContact O-CB 3.42Å; I197-L201 WeakPolarHBondContact O-CD1 3.42Å; I197-L201 WeakPolarHBondContact O-CG 3.18Å; I197-L201 PolarHBondContact O-N 3.45Å; L201-Q205 WeakPolarHBondContact O-CB 3.45Å; L201-Q205 WeakPolarHBondContact O-CG 3.25Å; L201-Q205 PolarHBondContact O-N 3.21Å
202R78.5Confident75.3Confident152 Ų15299.3 Ų99.357%0.57449%0.485SS*.Hα-helixtrans-67.1-38.4172.2-81.4179-178.3124.22.1112.3Q198 E199 Q205 S206Q198-R202 VanDerWaalsContact O-CB 3.27Å; Q198-R202 WeakPolarHBondContact O-CB 3.38Å; Q198-R202 VanDerWaalsContact O-CG 3.24Å; Q198-R202 WeakPolarHBondContact O-CG 3.35Å; Q198-R202 PolarHBondContact O-N 2.75Å; E199-R202 PolarHBondContact O-N 2.87Å; R202-Q205 PolarHBondContact O-N 2.75Å; R202-S206 VanDerWaalsContact O-CB 3.27Å; R202-S206 WeakPolarHBondContact O-CB 3.39Å; R202-S206 PolarHBondContact O-N 2.64Å; R202-S206 PolarHBondContact O-OG 3.1Å
203S70.4Confident74.7Confident47 Ų47100.7 Ų100.733%0.32949%0.49SS..Hα-helixtrans-65.8-49.7175.8-1760000109.8E199 L200 Q205 S206 Q207E199-S203 WeakPolarHBondContact O-CA 3.34Å; E199-S203 WeakPolarHBondContact O-CB 3.44Å; E199-S203 PolarHBondContact O-N 3.21Å; L200-S203 PolarHBondContact O-N 3.4Å; S203-Q205 VanDerWaalsContact C-N 3.33Å; S203-Q205 PolarHBondContact O-N 2.92Å; S203-S206 PolarHBondContact O-N 3.3Å; S203-S206 PolarHBondContact O-OG 2.79Å; S203-Q207 VanDerWaalsContact O-CB 3.23Å; S203-Q207 WeakPolarHBondContact O-CB 3.44Å; S203-Q207 VanDerWaalsContact O-CG 3.23Å; S203-Q207 WeakPolarHBondContact O-CG 3.25Å; S203-Q207 PolarHBondContact O-N 3.32Å
204H70.8Confident74Confident110 Ų11099.8 Ų99.851%0.50949%0.488SS..Hα-helixtrans-62.7-36.3174-173.1-71.4000112.3L200 N208L200-H204 WeakPolarHBondContact O-CB 3.16Å; L200-H204 PolarHBondContact O-N 2.9Å; H204-N208 VanDerWaalsContact O-CB 3.27Å; H204-N208 WeakPolarHBondContact O-CB 3.26Å; H204-N208 PolarHBondContact O-N 3.12Å
205Q72.1Confident73Confident125 Ų125101 Ų10158%0.58450%0.498SS*.Hα-helixtrans-70.8-36.7173.9-77.1170.26.500112.5L201 R202 S203 A209L201-Q205 WeakPolarHBondContact O-CB 3.45Å; L201-Q205 WeakPolarHBondContact O-CG 3.25Å; L201-Q205 PolarHBondContact O-N 3.21Å; R202-Q205 PolarHBondContact O-N 2.75Å; S203-Q205 VanDerWaalsContact C-N 3.33Å; S203-Q205 PolarHBondContact O-N 2.92Å; Q205-A209 VanDerWaalsContact O-CB 3.23Å; Q205-A209 WeakPolarHBondContact O-CB 3.13Å; Q205-A209 PolarHBondContact O-N 3.46Å
206S74.3Confident72.3Confident56 Ų56100.9 Ų100.939%0.39250%0.498SS..Hα-helixtrans-74.8-35.7176.175.50000111.6R202 S203 A209 N210R202-S206 VanDerWaalsContact O-CB 3.27Å; R202-S206 WeakPolarHBondContact O-CB 3.39Å; R202-S206 PolarHBondContact O-N 2.64Å; R202-S206 PolarHBondContact O-OG 3.1Å; S203-S206 PolarHBondContact O-N 3.3Å; S203-S206 PolarHBondContact O-OG 2.79Å; S206-A209 PolarHBondContact O-N 3.24Å; S206-N210 VanDerWaalsContact O-CB 3.29Å; S206-N210 WeakPolarHBondContact O-CB 3.22Å; S206-N210 PolarHBondContact O-N 3.41Å; S206-N210 PolarHBondContact O-ND2 2.88Å
207Q65.3Low72Confident110 Ų110101.2 Ų101.251%0.51450%0.498SS..Hα-helixtrans-66.4-42.8170-73178.5200110.9S203 N210 Y211S203-Q207 VanDerWaalsContact O-CB 3.23Å; S203-Q207 WeakPolarHBondContact O-CB 3.44Å; S203-Q207 VanDerWaalsContact O-CG 3.23Å; S203-Q207 WeakPolarHBondContact O-CG 3.25Å; S203-Q207 PolarHBondContact O-N 3.32Å; Q207-N210 PolarHBondContact O-N 3.38Å; Q207-Y211 VanDerWaalsContact O-CB 3.31Å; Q207-Y211 WeakPolarHBondContact O-CB 3.19Å; Q207-Y211 PolarHBondContact O-N 3.16Å
208N68.6Low71.6Confident95 Ų95101.9 Ų101.951%0.50850%0.502SS..Hα-helixtrans-65.5-36.4170.5-100.1-3.2000112.3H204 N210 S212H204-N208 VanDerWaalsContact O-CB 3.27Å; H204-N208 WeakPolarHBondContact O-CB 3.26Å; H204-N208 PolarHBondContact O-N 3.12Å; N208-N210 VanDerWaalsContact C-N 3.34Å; N208-S212 WeakPolarHBondContact O-CA 3.38Å; N208-S212 WeakPolarHBondContact O-CB 3.29Å; N208-S212 PolarHBondContact O-N 2.96Å
209A67.8Low71.2Confident42 Ų4298.8 Ų98.835%0.34750%0.498SS..Hα-helixtrans-69.5-33.1175.600000111.9Q205 S206 K213Q205-A209 VanDerWaalsContact O-CB 3.23Å; Q205-A209 WeakPolarHBondContact O-CB 3.13Å; Q205-A209 PolarHBondContact O-N 3.46Å; S206-A209 PolarHBondContact O-N 3.24Å; A209-K213 WeakPolarHBondContact O-CB 3.49Å; A209-K213 WeakPolarHBondContact O-CD 3.4Å; A209-K213 WeakPolarHBondContact O-CG 3.33Å; A209-K213 PolarHBondContact O-N 2.74Å
210N72.3Confident70.9Confident82 Ų8298.4 Ų98.444%0.43950%0.496SS..Hα-helixtrans-76.1-47.4174.2-70.2-15.3000110.9S206 Q207 N208 S212 K213 D214S206-N210 VanDerWaalsContact O-CB 3.29Å; S206-N210 WeakPolarHBondContact O-CB 3.22Å; S206-N210 PolarHBondContact O-N 3.41Å; S206-N210 PolarHBondContact O-ND2 2.88Å; Q207-N210 PolarHBondContact O-N 3.38Å; N208-N210 VanDerWaalsContact C-N 3.34Å; N210-S212 VanDerWaalsContact C-N 3.29Å; N210-S212 PolarHBondContact O-N 2.78Å; N210-K213 CarbonylContact O-C 3.56Å; N210-K213 PolarHBondContact O-N 3.42Å; N210-K213 VanDerWaalsContact O-N 3.08Å; N210-D214 VanDerWaalsContact O-CB 3.31Å; N210-D214 WeakPolarHBondContact O-CB 3.14Å; N210-D214 VanDerWaalsContact O-CG 3.24Å; N210-D214 PolarHBondContact O-N 2.78Å
211Y64.1Low70.7Confident175 Ų17598.2 Ų98.269%0.68650%0.495SS*.Hα-helixtrans-56.1-42.2170.4-104.4-85.8000111.6Q207 D214 Q215Q207-Y211 VanDerWaalsContact O-CB 3.31Å; Q207-Y211 WeakPolarHBondContact O-CB 3.19Å; Q207-Y211 PolarHBondContact O-N 3.16Å; Y211-D214 PolarHBondContact O-N 2.84Å; Y211-Q215 WeakPolarHBondContact O-CA 3.35Å; Y211-Q215 WeakPolarHBondContact O-CB 3.42Å; Y211-Q215 PolarHBondContact O-N 3.03Å
212S68.8Low70.6Confident67 Ų6798.8 Ų98.847%0.46950%0.495SS..Hα-helixtrans-65.2-41.5175.4-179.70000111.5N208 N210 E216N208-S212 WeakPolarHBondContact O-CA 3.38Å; N208-S212 WeakPolarHBondContact O-CB 3.29Å; N208-S212 PolarHBondContact O-N 2.96Å; N210-S212 VanDerWaalsContact C-N 3.29Å; N210-S212 PolarHBondContact O-N 2.78Å; S212-E216 WeakPolarHBondContact O-CB 3.36Å; S212-E216 PolarHBondContact O-N 2.75Å
213K69.9Low70.8Confident113 Ų11397.3 Ų97.349%0.49149%0.493SS..Hα-helixtrans-68.8-32.3174.3-78.4170-177.9174.20113.3A209 N210 K217A209-K213 WeakPolarHBondContact O-CB 3.49Å; A209-K213 WeakPolarHBondContact O-CD 3.4Å; A209-K213 WeakPolarHBondContact O-CG 3.33Å; A209-K213 PolarHBondContact O-N 2.74Å; N210-K213 CarbonylContact O-C 3.56Å; N210-K213 PolarHBondContact O-N 3.42Å; N210-K213 VanDerWaalsContact O-N 3.08Å; K213-K217 WeakPolarHBondContact O-CB 3.44Å; K213-K217 WeakPolarHBondContact O-CG 3.21Å; K213-K217 PolarHBondContact O-N 3.3Å
214D64.4Low71.2Confident80 Ų8097.6 Ų97.643%0.42850%0.498SS..Hα-helixtrans-85.4-31.5-178.2-67.3-27.9000110.9N210 Y211 K217 L218N210-D214 VanDerWaalsContact O-CB 3.31Å; N210-D214 WeakPolarHBondContact O-CB 3.14Å; N210-D214 VanDerWaalsContact O-CG 3.24Å; N210-D214 PolarHBondContact O-N 2.78Å; Y211-D214 PolarHBondContact O-N 2.84Å; D214-K217 WeakPolarHBondContact OD1-CD 3.37Å; D214-K217 WeakPolarHBondContact OD1-CE 3.23Å; D214-K217 IonicContact OD1-NZ 2.78Å; D214-K217 PolarHBondContact OD1-NZ 3.29Å; D214-L218 WeakPolarHBondContact O-CB 3.31Å; D214-L218 PolarHBondContact O-N 2.86Å
215Q64.3Low71.6Confident141 Ų14198 Ų9866%0.65950%0.5SS*.Hα-helixtrans-68-35.3164-174.2178.418.400111.3Y211 G219Y211-Q215 WeakPolarHBondContact O-CA 3.35Å; Y211-Q215 WeakPolarHBondContact O-CB 3.42Å; Y211-Q215 PolarHBondContact O-N 3.03Å; Q215-G219 WeakPolarHBondContact O-CA 3.4Å; Q215-G219 PolarHBondContact O-N 3.09Å
216E68Low72Confident109 Ų10996.5 Ų96.551%0.50950%0.499SS..Hα-helixtrans-71-44.4172.7-176178-161.900111.3S212 G219 Q220S212-E216 WeakPolarHBondContact O-CB 3.36Å; S212-E216 PolarHBondContact O-N 2.75Å; E216-G219 CarbonylContact O-C 3.58Å; E216-G219 PolarHBondContact O-N 2.8Å; E216-Q220 WeakPolarHBondContact O-CB 3.32Å; E216-Q220 VanDerWaalsContact O-CG 3.24Å; E216-Q220 WeakPolarHBondContact O-CG 3.49Å; E216-Q220 PolarHBondContact O-N 2.93Å; E216-Q220 PolarHBondContact OE1-NE2 2.78Å
217K72.8Confident72.3Confident112 Ų11298.6 Ų98.649%0.48750%0.503SS..Hα-helixtrans-60-45.2170.9-74.3166.3-154.6164.50111.5K213 D214 G219 Q220 L221K213-K217 WeakPolarHBondContact O-CB 3.44Å; K213-K217 WeakPolarHBondContact O-CG 3.21Å; K213-K217 PolarHBondContact O-N 3.3Å; D214-K217 WeakPolarHBondContact OD1-CD 3.37Å; D214-K217 WeakPolarHBondContact OD1-CE 3.23Å; D214-K217 IonicContact OD1-NZ 2.78Å; D214-K217 PolarHBondContact OD1-NZ 3.29Å; K217-G219 VanDerWaalsContact C-N 3.31Å; K217-Q220 CarbonylContact O-C 3.54Å; K217-Q220 PolarHBondContact O-N 2.68Å; K217-L221 WeakPolarHBondContact O-CB 3.42Å; K217-L221 VanDerWaalsContact O-CG 3.28Å; K217-L221 WeakPolarHBondContact O-CG 3.27Å; K217-L221 PolarHBondContact O-N 2.64Å
218L75.1Confident73.2Confident88 Ų8896.7 Ų96.746%0.46150%0.502SS..Hα-helixtrans-65.3-37.7177.1-174.464.8000110.9D214 L221 H222D214-L218 WeakPolarHBondContact O-CB 3.31Å; D214-L218 PolarHBondContact O-N 2.86Å; L218-L221 PolarHBondContact O-N 3.24Å; L218-H222 VanDerWaalsContact O-CB 3.29Å; L218-H222 WeakPolarHBondContact O-CB 3.2Å; L218-H222 PolarHBondContact O-N 3.48Å; L218-H222 PolarHBondContact O-ND1 2.85Å
219G71.4Confident73.8Confident38 Ų3897.2 Ų97.239%0.39250%0.504SS..Hα-helixtrans-65.1-39.1171.400000113Q215 E216 K217 K223Q215-G219 WeakPolarHBondContact O-CA 3.4Å; Q215-G219 PolarHBondContact O-N 3.09Å; E216-G219 CarbonylContact O-C 3.58Å; E216-G219 PolarHBondContact O-N 2.8Å; K217-G219 VanDerWaalsContact C-N 3.31Å; G219-K223 WeakPolarHBondContact O-CB 3.16Å; G219-K223 PolarHBondContact O-N 3.39Å
220Q74.7Confident74.3Confident114 Ų11497.8 Ų97.853%0.53351%0.508SS..Hα-helixtrans-71-37.4174.9-73.4173.51500111.8E216 K217 K223 A224E216-Q220 WeakPolarHBondContact O-CB 3.32Å; E216-Q220 VanDerWaalsContact O-CG 3.24Å; E216-Q220 WeakPolarHBondContact O-CG 3.49Å; E216-Q220 PolarHBondContact O-N 2.93Å; E216-Q220 PolarHBondContact OE1-NE2 2.78Å; K217-Q220 CarbonylContact O-C 3.54Å; K217-Q220 PolarHBondContact O-N 2.68Å; Q220-K223 PolarHBondContact O-N 2.78Å; Q220-A224 VanDerWaalsContact O-CB 3.28Å; Q220-A224 WeakPolarHBondContact O-CB 3.27Å; Q220-A224 PolarHBondContact O-N 3.05Å
221L76Confident74.9Confident115 Ų115100.5 Ų100.560%0.60252%0.518SS*.Hα-helixtrans-68.2-51.9174.3-74.9169.2000111K217 L218 K223 A224 E225K217-L221 WeakPolarHBondContact O-CB 3.42Å; K217-L221 VanDerWaalsContact O-CG 3.28Å; K217-L221 WeakPolarHBondContact O-CG 3.27Å; K217-L221 PolarHBondContact O-N 2.64Å; L218-L221 PolarHBondContact O-N 3.24Å; L221-K223 PolarHBondContact O-N 2.81Å; L221-A224 PolarHBondContact O-N 3.23Å; L221-E225 VanDerWaalsContact O-CB 3.24Å; L221-E225 WeakPolarHBondContact O-CB 3.47Å; L221-E225 PolarHBondContact O-N 3.22Å
222H73.4Confident75.8Confident103 Ų10398.5 Ų98.548%0.47751%0.51SS..Hα-helixtrans-59.1-36.3173.1-69.4160.1000111.7L218 V226L218-H222 VanDerWaalsContact O-CB 3.29Å; L218-H222 WeakPolarHBondContact O-CB 3.2Å; L218-H222 PolarHBondContact O-N 3.48Å; L218-H222 PolarHBondContact O-ND1 2.85Å; H222-V226 VanDerWaalsContact O-CB 3.25Å; H222-V226 WeakPolarHBondContact O-CB 3.26Å; H222-V226 WeakPolarHBondContact O-CG2 3.33Å; H222-V226 PolarHBondContact O-N 3.5Å
223K81.6Confident76.4Confident122 Ų12298.9 Ų98.953%0.5351%0.509SS..Hα-helixtrans-66.2-48.6174.7179.3178.5170.3-175.70111.5G219 Q220 L221 E225 V226 E227G219-K223 WeakPolarHBondContact O-CB 3.16Å; G219-K223 PolarHBondContact O-N 3.39Å; Q220-K223 PolarHBondContact O-N 2.78Å; L221-K223 PolarHBondContact O-N 2.81Å; K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 2.83Å; K223-V226 PolarHBondContact O-N 2.78Å; K223-E227 VanDerWaalsContact CE-CD 3.41Å; K223-E227 WeakPolarHBondContact CE-OE1 3.21Å; K223-E227 HydrophobicContact CG-CG 4.36Å; K223-E227 IonicContact NZ-OE1 2.83Å; K223-E227 WeakPolarHBondContact O-CB 3.24Å; K223-E227 VanDerWaalsContact O-CG 3.3Å; K223-E227 WeakPolarHBondContact O-CG 3.31Å; K223-E227 PolarHBondContact O-N 3Å
224A79.3Confident77Confident53 Ų5397.6 Ų97.644%0.43851%0.505SS..Hα-helixtrans-64.9-33.3177.600000112.3Q220 L221 S228Q220-A224 VanDerWaalsContact O-CB 3.28Å; Q220-A224 WeakPolarHBondContact O-CB 3.27Å; Q220-A224 PolarHBondContact O-N 3.05Å; L221-A224 PolarHBondContact O-N 3.23Å; A224-S228 WeakPolarHBondContact O-CB 3.39Å; A224-S228 PolarHBondContact O-N 2.94Å
225E80.4Confident78Confident118 Ų11898.2 Ų98.255%0.55151%0.505SS*.Hα-helixtrans-71.8-40.1174.4-171168.1-14000111.4L221 K223 L229L221-E225 VanDerWaalsContact O-CB 3.24Å; L221-E225 WeakPolarHBondContact O-CB 3.47Å; L221-E225 PolarHBondContact O-N 3.22Å; K223-E225 VanDerWaalsContact C-N 3.29Å; K223-E225 PolarHBondContact O-N 2.83Å; E225-L229 HydrophobicContact CG-CD1 4.26Å; E225-L229 VanDerWaalsContact O-CB 3.24Å; E225-L229 WeakPolarHBondContact O-CB 3.32Å; E225-L229 WeakPolarHBondContact O-CG 3.17Å; E225-L229 PolarHBondContact O-N 3.09Å
226V79.7Confident79Confident94 Ų9496.1 Ų96.157%0.5750%0.498SS*.Hα-helixtrans-67.3-38.4171.5165.70000112H222 K223 L229 A230H222-V226 VanDerWaalsContact O-CB 3.25Å; H222-V226 WeakPolarHBondContact O-CB 3.26Å; H222-V226 WeakPolarHBondContact O-CG2 3.33Å; H222-V226 PolarHBondContact O-N 3.5Å; K223-V226 PolarHBondContact O-N 2.78Å; V226-L229 PolarHBondContact O-N 2.81Å; V226-A230 VanDerWaalsContact O-CB 3.23Å; V226-A230 WeakPolarHBondContact O-CB 3.39Å; V226-A230 PolarHBondContact O-N 3.38Å
227E81Confident79.5Confident99 Ų9996 Ų9646%0.46350%0.495SS..Hα-helixtrans-67.6-45.3175.6-75.2172159.900110.4K223 L229 A230 E231K223-E227 VanDerWaalsContact CE-CD 3.41Å; K223-E227 WeakPolarHBondContact CE-OE1 3.21Å; K223-E227 HydrophobicContact CG-CG 4.36Å; K223-E227 IonicContact NZ-OE1 2.83Å; K223-E227 WeakPolarHBondContact O-CB 3.24Å; K223-E227 VanDerWaalsContact O-CG 3.3Å; K223-E227 WeakPolarHBondContact O-CG 3.31Å; K223-E227 PolarHBondContact O-N 3Å; E227-L229 PolarHBondContact O-N 2.76Å; E227-A230 WeakPolarHBondContact O-CB 3.42Å; E227-A230 PolarHBondContact O-N 3.08Å; E227-A230 VanDerWaalsContact O-N 3.16Å; E227-E231 WeakPolarHBondContact O-CG 3.22Å; E227-E231 PolarHBondContact O-N 3.1Å
228S84.1Confident80.1Confident71 Ų7195.1 Ų95.150%0.49749%0.493SS..Hα-helixtrans-61.1-42.4172.2178.50000112.7A224 A230 E231 R232A224-S228 WeakPolarHBondContact O-CB 3.39Å; A224-S228 PolarHBondContact O-N 2.94Å; S228-A230 VanDerWaalsContact C-N 3.34Å; S228-E231 PolarHBondContact O-N 2.92Å; S228-R232 VanDerWaalsContact O-CB 3.26Å; S228-R232 WeakPolarHBondContact O-CB 3.48Å; S228-R232 PolarHBondContact O-N 2.8Å
229L81.7Confident80.5Confident105 Ų10594.5 Ų94.555%0.5549%0.491SS..Hα-helixtrans-67.2-33.9173.9-75168.8000112.1E225 V226 E227 V233E225-L229 HydrophobicContact CG-CD1 4.26Å; E225-L229 VanDerWaalsContact O-CB 3.24Å; E225-L229 WeakPolarHBondContact O-CB 3.32Å; E225-L229 WeakPolarHBondContact O-CG 3.17Å; E225-L229 PolarHBondContact O-N 3.09Å; V226-L229 PolarHBondContact O-N 2.81Å; E227-L229 PolarHBondContact O-N 2.76Å; L229-V233 VanDerWaalsContact O-CB 3.27Å; L229-V233 WeakPolarHBondContact O-CB 3.48Å; L229-V233 VanDerWaalsContact O-CG2 3.22Å; L229-V233 WeakPolarHBondContact O-CG2 3.48Å; L229-V233 PolarHBondContact O-N 2.64Å
230A77.1Confident81.1Confident54 Ų5499.8 Ų99.845%0.44650%0.503SS..Hα-helixtrans-69.3-43.1174.700000111.7V226 E227 S228 V233 E234V226-A230 VanDerWaalsContact O-CB 3.23Å; V226-A230 WeakPolarHBondContact O-CB 3.39Å; V226-A230 PolarHBondContact O-N 3.38Å; E227-A230 WeakPolarHBondContact O-CB 3.42Å; E227-A230 PolarHBondContact O-N 3.08Å; E227-A230 VanDerWaalsContact O-N 3.16Å; S228-A230 VanDerWaalsContact C-N 3.34Å; A230-V233 PolarHBondContact O-N 3.26Å; A230-E234 PolarHBondContact O-N 2.8Å
231E84.3Confident81.6Confident139 Ų139100.6 Ų100.665%0.6551%0.505SS*.Hα-helixtrans-59.6-48.7171.2-73-177.5161.300110.8E227 S228 V233 E234 E235E227-E231 WeakPolarHBondContact O-CG 3.22Å; E227-E231 PolarHBondContact O-N 3.1Å; S228-E231 PolarHBondContact O-N 2.92Å; E231-V233 VanDerWaalsContact C-N 3.29Å; E231-V233 PolarHBondContact O-N 2.74Å; E231-E234 CarbonylContact O-C 3.58Å; E231-E234 WeakPolarHBondContact O-CA 3.42Å; E231-E234 PolarHBondContact O-N 2.79Å; E231-E235 WeakPolarHBondContact O-CG 3.34Å; E231-E235 PolarHBondContact O-N 3.01Å
232R83.4Confident82.2Confident134 Ų134101.5 Ų101.551%0.50650%0.5SS..Hα-helixtrans-59.6-37.4176.2-162.176.9-174.4112.93.8112.6S228 E235 L236S228-R232 VanDerWaalsContact O-CB 3.26Å; S228-R232 WeakPolarHBondContact O-CB 3.48Å; S228-R232 PolarHBondContact O-N 2.8Å; R232-E235 WeakPolarHBondContact CD-OE2 3.46Å; R232-E235 IonicContact CZ-OE2 3.24Å; R232-E235 IonicContact NE-OE2 2.91Å; R232-E235 IonicContact NH1-OE2 2.7Å; R232-E235 PolarHBondContact NH1-OE2 3.06Å; R232-L236 WeakPolarHBondContact O-CB 3.48Å; R232-L236 WeakPolarHBondContact O-CD1 3.34Å; R232-L236 WeakPolarHBondContact O-CG 3.49Å; R232-L236 PolarHBondContact O-N 2.9Å
233V82Confident82.9Confident74 Ų74100.8 Ų100.845%0.44850%0.499SS..Hα-helixtrans-69.4-35.9173.9159.80000111.4L229 A230 E231 L236 K237L229-V233 VanDerWaalsContact O-CB 3.27Å; L229-V233 WeakPolarHBondContact O-CB 3.48Å; L229-V233 VanDerWaalsContact O-CG2 3.22Å; L229-V233 WeakPolarHBondContact O-CG2 3.48Å; L229-V233 PolarHBondContact O-N 2.64Å; A230-V233 PolarHBondContact O-N 3.26Å; E231-V233 VanDerWaalsContact C-N 3.29Å; E231-V233 PolarHBondContact O-N 2.74Å; V233-L236 PolarHBondContact O-N 3Å; V233-K237 VanDerWaalsContact O-CG 3.31Å; V233-K237 WeakPolarHBondContact O-CG 3.35Å; V233-K237 PolarHBondContact O-N 3.35Å
234E82.6Confident83Confident87 Ų8797.8 Ų97.841%0.40749%0.491SS..Hα-helixtrans-74.5-36.7176.7-155.261-134.800112.3A230 E231 K237 Q238A230-E234 PolarHBondContact O-N 2.8Å; E231-E234 CarbonylContact O-C 3.58Å; E231-E234 WeakPolarHBondContact O-CA 3.42Å; E231-E234 PolarHBondContact O-N 2.79Å; E234-K237 PolarHBondContact O-N 3.3Å; E234-K237 WeakPolarHBondContact OE1-CD 3.1Å; E234-K237 WeakPolarHBondContact OE2-CD 3.4Å; E234-K237 IonicContact OE2-NZ 3.61Å; E234-K237 PolarHBondContact OE2-NZ 3.32Å; E234-Q238 WeakPolarHBondContact O-CG 3.39Å; E234-Q238 PolarHBondContact O-N 2.88Å
235E85.8Confident83.4Confident92 Ų9298.9 Ų98.943%0.4349%0.489SS..Hα-helixtrans-56.2-50.7165.9-71.7-176.1140.600110.7E231 R232 K237 Q238 D239E231-E235 WeakPolarHBondContact O-CG 3.34Å; E231-E235 PolarHBondContact O-N 3.01Å; R232-E235 WeakPolarHBondContact CD-OE2 3.46Å; R232-E235 IonicContact CZ-OE2 3.24Å; R232-E235 IonicContact NE-OE2 2.91Å; R232-E235 IonicContact NH1-OE2 2.7Å; R232-E235 PolarHBondContact NH1-OE2 3.06Å; E235-K237 VanDerWaalsContact C-N 3.3Å; E235-K237 PolarHBondContact O-N 2.8Å; E235-Q238 CarbonylContact O-C 3.52Å; E235-Q238 WeakPolarHBondContact O-CB 3.25Å; E235-Q238 PolarHBondContact O-N 3.39Å; E235-D239 PolarHBondContact O-N 2.84Å
236L83.8Confident83.6Confident97 Ų9798.2 Ų98.251%0.50849%0.486SS..Hα-helixtrans-65.1-29.7178.9-73.2169.3000112.9R232 V233 K240R232-L236 WeakPolarHBondContact O-CB 3.48Å; R232-L236 WeakPolarHBondContact O-CD1 3.34Å; R232-L236 WeakPolarHBondContact O-CG 3.49Å; R232-L236 PolarHBondContact O-N 2.9Å; V233-L236 PolarHBondContact O-N 3Å; L236-K240 WeakPolarHBondContact O-CB 3.5Å; L236-K240 PolarHBondContact O-N 3.46Å
237K80.1Confident83.8Confident106 Ų106100.7 Ų100.746%0.46149%0.486SS..Hα-helixtrans-68.8-42.7168.6-73.6171-158159.30111.6V233 E234 E235 K240 K241V233-K237 VanDerWaalsContact O-CG 3.31Å; V233-K237 WeakPolarHBondContact O-CG 3.35Å; V233-K237 PolarHBondContact O-N 3.35Å; E234-K237 PolarHBondContact O-N 3.3Å; E234-K237 WeakPolarHBondContact OE1-CD 3.1Å; E234-K237 WeakPolarHBondContact OE2-CD 3.4Å; E234-K237 IonicContact OE2-NZ 3.61Å; E234-K237 PolarHBondContact OE2-NZ 3.32Å; E235-K237 VanDerWaalsContact C-N 3.3Å; E235-K237 PolarHBondContact O-N 2.8Å; K237-K240 PolarHBondContact O-N 2.78Å; K237-K241 WeakPolarHBondContact O-CB 3.26Å; K237-K241 PolarHBondContact O-N 3.48Å
238Q84.4Confident84Confident95 Ų95101.4 Ų101.444%0.44449%0.49SS..Hα-helixtrans-65.3-42.9177.6-73.7178.949.200111.6E234 E235 K241 R242E234-Q238 WeakPolarHBondContact O-CG 3.39Å; E234-Q238 PolarHBondContact O-N 2.88Å; E235-Q238 CarbonylContact O-C 3.52Å; E235-Q238 WeakPolarHBondContact O-CB 3.25Å; E235-Q238 PolarHBondContact O-N 3.39Å; Q238-K241 WeakPolarHBondContact O-CB 3.15Å; Q238-K241 PolarHBondContact O-N 2.63Å; Q238-R242 VanDerWaalsContact O-CG 3.27Å; Q238-R242 WeakPolarHBondContact O-CG 3.48Å; Q238-R242 PolarHBondContact O-N 2.88Å
239D83.1Confident84Confident75 Ų75100.1 Ų100.140%0.40148%0.483SS..Hα-helixtrans-70.1-39.1175.7-77.1-18.5000112E235 K241 R242 L243E235-D239 PolarHBondContact O-N 2.84Å; D239-K241 VanDerWaalsContact C-N 3.27Å; D239-K241 PolarHBondContact O-N 2.91Å; D239-R242 PolarHBondContact O-N 3.13Å; D239-R242 WeakPolarHBondContact OD1-CD 3.42Å; D239-R242 IonicContact OD1-CZ 3.81Å; D239-R242 IonicContact OD1-NE 2.72Å; D239-R242 IonicContact OD1-NH1 3.17Å; D239-R242 PolarHBondContact OD1-NH1 2.85Å; D239-L243 WeakPolarHBondContact O-CB 3.49Å; D239-L243 PolarHBondContact O-N 2.77Å
240K84.3Confident84.2Confident149 Ų14999.7 Ų99.765%0.64848%0.477SS*.Hα-helixtrans-57.6-42.2168.4178.5179.6176.1-178.20111.2L236 K237 L243 V244L236-K240 WeakPolarHBondContact O-CB 3.5Å; L236-K240 PolarHBondContact O-N 3.46Å; K237-K240 PolarHBondContact O-N 2.78Å; K240-L243 PolarHBondContact O-N 3.39Å; K240-V244 VanDerWaalsContact O-CG2 3.31Å; K240-V244 WeakPolarHBondContact O-CG2 3.28Å; K240-V244 PolarHBondContact O-N 2.88Å
241K86.4Confident84.4Confident131 Ų131102 Ų10257%0.5748%0.481SS*.Hα-helixtrans-65.4-52.1177.2-172.7-174.7172.4-175.70111.1K237 Q238 D239 L243 V244 D245K237-K241 WeakPolarHBondContact O-CB 3.26Å; K237-K241 PolarHBondContact O-N 3.48Å; Q238-K241 WeakPolarHBondContact O-CB 3.15Å; Q238-K241 PolarHBondContact O-N 2.63Å; D239-K241 VanDerWaalsContact C-N 3.27Å; D239-K241 PolarHBondContact O-N 2.91Å; K241-L243 PolarHBondContact O-N 3.27Å; K241-V244 CarbonylContact O-C 3.56Å; K241-V244 WeakPolarHBondContact O-CA 3.14Å; K241-V244 PolarHBondContact O-N 3.27Å; K241-D245 WeakPolarHBondContact O-CB 3.5Å; K241-D245 PolarHBondContact O-N 3.43Å
242R87.9Confident84.4Confident134 Ų13498.5 Ų98.551%0.50647%0.472SS..Hα-helixtrans-52.6-42.2175.2-70.6164.5-175.2156.52.8111.5Q238 D239 D245 E246Q238-R242 VanDerWaalsContact O-CG 3.27Å; Q238-R242 WeakPolarHBondContact O-CG 3.48Å; Q238-R242 PolarHBondContact O-N 2.88Å; D239-R242 PolarHBondContact O-N 3.13Å; D239-R242 WeakPolarHBondContact OD1-CD 3.42Å; D239-R242 IonicContact OD1-CZ 3.81Å; D239-R242 IonicContact OD1-NE 2.72Å; D239-R242 IonicContact OD1-NH1 3.17Å; D239-R242 PolarHBondContact OD1-NH1 2.85Å; R242-D245 PolarHBondContact O-N 2.8Å; R242-E246 VanDerWaalsContact O-CB 3.28Å; R242-E246 WeakPolarHBondContact O-CB 3.47Å; R242-E246 WeakPolarHBondContact O-CG 3.12Å; R242-E246 PolarHBondContact O-N 2.8Å
243L87Confident84.5Confident87 Ų8799.3 Ų99.346%0.45548%0.479SS..Hα-helixtrans-68.9-38.3179.1-171.563.9000112.3D239 K240 K241 Y247D239-L243 WeakPolarHBondContact O-CB 3.49Å; D239-L243 PolarHBondContact O-N 2.77Å; K240-L243 PolarHBondContact O-N 3.39Å; K241-L243 PolarHBondContact O-N 3.27Å; L243-Y247 HydrophobicContact CD1-CD2 3.99Å; L243-Y247 HydrophobicContact CD1-CE2 3.52Å; L243-Y247 HydrophobicContact CD2-CE2 4.23Å; L243-Y247 HydrophobicContact CG-CD2 3.85Å; L243-Y247 HydrophobicContact CG-CE2 3.65Å; L243-Y247 WeakPolarHBondContact O-CB 3.34Å; L243-Y247 WeakPolarHBondContact O-CD2 3.49Å; L243-Y247 PolarHBondContact O-N 3.45Å
244V84.9Confident84.3Confident60 Ų6097.7 Ų97.736%0.36447%0.473SS..Hα-helixtrans-65-52.6170.7167.50000110.6K240 K241 E246 Y247 E248K240-V244 VanDerWaalsContact O-CG2 3.31Å; K240-V244 WeakPolarHBondContact O-CG2 3.28Å; K240-V244 PolarHBondContact O-N 2.88Å; K241-V244 CarbonylContact O-C 3.56Å; K241-V244 WeakPolarHBondContact O-CA 3.14Å; K241-V244 PolarHBondContact O-N 3.27Å; V244-E246 PolarHBondContact O-N 2.72Å; V244-Y247 CarbonylContact O-C 3.52Å; V244-Y247 PolarHBondContact O-N 3.5Å; V244-E248 HydrophobicContact CG1-CG 4.25Å; V244-E248 WeakPolarHBondContact CG1-OE1 3.43Å; V244-E248 WeakPolarHBondContact O-CB 3.27Å; V244-E248 WeakPolarHBondContact O-CG 3.48Å; V244-E248 PolarHBondContact O-N 3.29Å
245D87Confident84Confident76 Ų7698.1 Ų98.141%0.40648%0.476SS..Hα-helixtrans-54.5-39.4177.1-61.1-16.3000110.7K241 R242 A249K241-D245 WeakPolarHBondContact O-CB 3.5Å; K241-D245 PolarHBondContact O-N 3.43Å; R242-D245 PolarHBondContact O-N 2.8Å; D245-A249 WeakPolarHBondContact O-CB 3.45Å; D245-A249 PolarHBondContact O-N 3.06Å
246E85.7Confident83.8Confident103 Ų10395 Ų9548%0.48147%0.466SS..Hα-helixtrans-68-43.2173.2-91.7-163.2-136.800113.8R242 V244 A249 K250R242-E246 VanDerWaalsContact O-CB 3.28Å; R242-E246 WeakPolarHBondContact O-CB 3.47Å; R242-E246 WeakPolarHBondContact O-CG 3.12Å; R242-E246 PolarHBondContact O-N 2.8Å; V244-E246 PolarHBondContact O-N 2.72Å; E246-A249 PolarHBondContact O-N 3.3Å; E246-K250 WeakPolarHBondContact O-CB 3.49Å; E246-K250 VanDerWaalsContact O-CD 3.26Å; E246-K250 WeakPolarHBondContact O-CD 3.25Å; E246-K250 WeakPolarHBondContact O-CG 3.46Å; E246-K250 PolarHBondContact O-N 2.77Å; E246-K250 WeakPolarHBondContact OE2-CE 3.45Å; E246-K250 IonicContact OE2-NZ 3.56Å; E246-K250 PolarHBondContact OE2-NZ 3.08Å
247Y83.3Confident83.8Confident146 Ų14695.9 Ų95.957%0.57347%0.465SS*.Hα-helixtrans-70.6-36.6178.2-83.2-58000111.9L243 V244 K250 L251L243-Y247 HydrophobicContact CD1-CD2 3.99Å; L243-Y247 HydrophobicContact CD1-CE2 3.52Å; L243-Y247 HydrophobicContact CD2-CE2 4.23Å; L243-Y247 HydrophobicContact CG-CD2 3.85Å; L243-Y247 HydrophobicContact CG-CE2 3.65Å; L243-Y247 WeakPolarHBondContact O-CB 3.34Å; L243-Y247 WeakPolarHBondContact O-CD2 3.49Å; L243-Y247 PolarHBondContact O-N 3.45Å; V244-Y247 CarbonylContact O-C 3.52Å; V244-Y247 PolarHBondContact O-N 3.5Å; Y247-K250 HydrophobicContact CD1-CD 4.15Å; Y247-K250 PolarHBondContact O-N 2.84Å; Y247-L251 VanDerWaalsContact O-CB 3.28Å; Y247-L251 WeakPolarHBondContact O-CB 3.28Å; Y247-L251 PolarHBondContact O-N 2.67Å
248E84.9Confident83.9Confident115 Ų11598 Ų9854%0.53747%0.472SS..Hα-helixtrans-63.3-46.4169.9-71.2-176.9-174.300110.5V244 K250 L251 S252V244-E248 HydrophobicContact CG1-CG 4.25Å; V244-E248 WeakPolarHBondContact CG1-OE1 3.43Å; V244-E248 WeakPolarHBondContact O-CB 3.27Å; V244-E248 WeakPolarHBondContact O-CG 3.48Å; V244-E248 PolarHBondContact O-N 3.29Å; E248-K250 VanDerWaalsContact C-N 3.28Å; E248-K250 PolarHBondContact O-N 3.16Å; E248-L251 CarbonylContact O-C 3.15Å; E248-L251 WeakPolarHBondContact O-CB 3.36Å; E248-L251 PolarHBondContact O-N 2.85Å; E248-L251 VanDerWaalsContact O-N 3.1Å; E248-S252 PolarHBondContact O-N 3.44Å; E248-S252 PolarHBondContact O-OG 2.84Å
249A83.9Confident83.8Confident43 Ų4399.6 Ų99.636%0.35548%0.479SS..Hα-helixtrans-62.4-32.4174.900000113.3D245 E246 K253D245-A249 WeakPolarHBondContact O-CB 3.45Å; D245-A249 PolarHBondContact O-N 3.06Å; E246-A249 PolarHBondContact O-N 3.3Å; A249-K253 WeakPolarHBondContact O-CB 3.18Å; A249-K253 VanDerWaalsContact O-CD 3.32Å; A249-K253 WeakPolarHBondContact O-CD 3.4Å; A249-K253 WeakPolarHBondContact O-CG 3.18Å; A249-K253 PolarHBondContact O-N 2.87Å
250K86.4Confident83.8Confident97 Ų97104.2 Ų104.242%0.42249%0.491SS..Hα-helixtrans-71.4-41.6171.9-70.7157.7-162.91650111E246 Y247 E248 K253 A254E246-K250 WeakPolarHBondContact O-CB 3.49Å; E246-K250 VanDerWaalsContact O-CD 3.26Å; E246-K250 WeakPolarHBondContact O-CD 3.25Å; E246-K250 WeakPolarHBondContact O-CG 3.46Å; E246-K250 PolarHBondContact O-N 2.77Å; E246-K250 WeakPolarHBondContact OE2-CE 3.45Å; E246-K250 IonicContact OE2-NZ 3.56Å; E246-K250 PolarHBondContact OE2-NZ 3.08Å; Y247-K250 HydrophobicContact CD1-CD 4.15Å; Y247-K250 PolarHBondContact O-N 2.84Å; E248-K250 VanDerWaalsContact C-N 3.28Å; E248-K250 PolarHBondContact O-N 3.16Å; K250-K253 PolarHBondContact O-N 2.79Å; K250-A254 PolarHBondContact O-N 3.37Å
251L81.4Confident83.4Confident102 Ų102102.1 Ų102.153%0.53448%0.483SS..Hα-helixtrans-64.3-48.1177.6-169.374.3000111.4Y247 E248 K253 A254 Q255Y247-L251 VanDerWaalsContact O-CB 3.28Å; Y247-L251 WeakPolarHBondContact O-CB 3.28Å; Y247-L251 PolarHBondContact O-N 2.67Å; E248-L251 CarbonylContact O-C 3.15Å; E248-L251 WeakPolarHBondContact O-CB 3.36Å; E248-L251 PolarHBondContact O-N 2.85Å; E248-L251 VanDerWaalsContact O-N 3.1Å; L251-K253 VanDerWaalsContact C-N 3.31Å; L251-K253 PolarHBondContact O-N 3.25Å; L251-A254 CarbonylContact O-C 3.56Å; L251-A254 WeakPolarHBondContact O-CB 3.38Å; L251-A254 PolarHBondContact O-N 3.38Å; L251-A254 VanDerWaalsContact O-N 3.12Å; L251-Q255 WeakPolarHBondContact O-CB 3.45Å; L251-Q255 WeakPolarHBondContact O-CG 3.46Å; L251-Q255 PolarHBondContact O-N 2.82Å
252S83.2Confident83Confident65 Ų65100.6 Ų100.646%0.45548%0.481SS..Hα-helixtrans-65.5-32.2176.7-59.10000112.6E248 A256E248-S252 PolarHBondContact O-N 3.44Å; E248-S252 PolarHBondContact O-OG 2.84Å; S252-A256 VanDerWaalsContact O-CB 3.22Å; S252-A256 WeakPolarHBondContact O-CB 3.5Å; S252-A256 PolarHBondContact O-N 3.35Å
253K86.3Confident82.7Confident152 Ų15298.5 Ų98.566%0.66148%0.477SS*.Hα-helixtrans-67-39.5170.4-77169-173.31720112A249 K250 L251 F257A249-K253 WeakPolarHBondContact O-CB 3.18Å; A249-K253 VanDerWaalsContact O-CD 3.32Å; A249-K253 WeakPolarHBondContact O-CD 3.4Å; A249-K253 WeakPolarHBondContact O-CG 3.18Å; A249-K253 PolarHBondContact O-N 2.87Å; K250-K253 PolarHBondContact O-N 2.79Å; L251-K253 VanDerWaalsContact C-N 3.31Å; L251-K253 PolarHBondContact O-N 3.25Å; K253-F257 WeakPolarHBondContact O-CB 3.11Å; K253-F257 PolarHBondContact O-N 2.72Å
254A78.9Confident82.4Confident39 Ų3996.4 Ų96.432%0.32247%0.472SS..Hα-helixtrans-68.6-43.2174.800000111.9K250 L251 F257 Y258K250-A254 PolarHBondContact O-N 3.37Å; L251-A254 CarbonylContact O-C 3.56Å; L251-A254 WeakPolarHBondContact O-CB 3.38Å; L251-A254 PolarHBondContact O-N 3.38Å; L251-A254 VanDerWaalsContact O-N 3.12Å; A254-F257 WeakPolarHBondContact O-CB 3.31Å; A254-F257 PolarHBondContact O-N 3.37Å; A254-F257 VanDerWaalsContact O-N 3.15Å; A254-Y258 HydrophobicContact CB-CE2 4.38Å; A254-Y258 WeakPolarHBondContact O-CD2 3.4Å; A254-Y258 PolarHBondContact O-N 3.18Å
255Q75.7Confident81.9Confident97 Ų9798.9 Ų98.945%0.45348%0.481SS..Hα-helixtrans-58.1-52.2173-73167.5-26.900110.6L251 F257 Y258 E259L251-Q255 WeakPolarHBondContact O-CB 3.45Å; L251-Q255 WeakPolarHBondContact O-CG 3.46Å; L251-Q255 PolarHBondContact O-N 2.82Å; Q255-F257 PolarHBondContact O-N 3Å; Q255-Y258 PolarHBondContact O-N 2.79Å; Q255-Y258 VanDerWaalsContact O-N 3.12Å; Q255-E259 WeakPolarHBondContact O-CB 3.44Å; Q255-E259 WeakPolarHBondContact O-CG 3.46Å; Q255-E259 PolarHBondContact O-N 3.09Å
256A81.4Confident81.6Confident27 Ų27101.3 Ų101.322%0.22349%0.488CS..Hα-helixtrans-65.6-18.1176.900000114S252 R260S252-A256 VanDerWaalsContact O-CB 3.22Å; S252-A256 WeakPolarHBondContact O-CB 3.5Å; S252-A256 PolarHBondContact O-N 3.35Å; A256-R260 VanDerWaalsContact O-CD 3.26Å; A256-R260 WeakPolarHBondContact O-CD 3.31Å; A256-R260 WeakPolarHBondContact O-CG 3.47Å; A256-R260 PolarHBondContact O-N 2.8Å
257F83.6Confident81.2Confident114 Ų114103.1 Ų103.150%0.549%0.49SS..Hα-helixtrans-77.4-51.8168.1178.8-93.2000110.6K253 A254 Q255 E259 R260 E261K253-F257 WeakPolarHBondContact O-CB 3.11Å; K253-F257 PolarHBondContact O-N 2.72Å; A254-F257 WeakPolarHBondContact O-CB 3.31Å; A254-F257 PolarHBondContact O-N 3.37Å; A254-F257 VanDerWaalsContact O-N 3.15Å; Q255-F257 PolarHBondContact O-N 3Å; F257-E259 VanDerWaalsContact C-N 3.32Å; F257-E259 PolarHBondContact O-N 3.19Å; F257-R260 PolarHBondContact O-N 3.4Å; F257-R260 VanDerWaalsContact O-N 3.11Å; F257-E261 HydrophobicContact CD1-CG 4.09Å; F257-E261 HydrophobicContact CE1-CG 3.63Å; F257-E261 HydrophobicContact CZ-CG 3.9Å; F257-E261 PolarHBondContact O-N 3.16Å
258Y81.2Confident80.6Confident152 Ų15299.8 Ų99.860%0.59649%0.485SS*.Hα-helixtrans-63.9-33178.3-69.4-55.7000113.3A254 Q255 E261 L262A254-Y258 HydrophobicContact CB-CE2 4.38Å; A254-Y258 WeakPolarHBondContact O-CD2 3.4Å; A254-Y258 PolarHBondContact O-N 3.18Å; Q255-Y258 PolarHBondContact O-N 2.79Å; Q255-Y258 VanDerWaalsContact O-N 3.12Å; Y258-E261 PolarHBondContact O-N 3.31Å; Y258-L262 VanDerWaalsContact O-CB 3.29Å; Y258-L262 WeakPolarHBondContact O-CB 3.16Å; Y258-L262 PolarHBondContact O-N 3.39Å
259E83Confident79.9Confident127 Ų127100.2 Ų100.259%0.59349%0.487SS*.Hα-helixtrans-65.9-40.4172.1-74.6179152.200111.6Q255 F257 L262 E263Q255-E259 WeakPolarHBondContact O-CB 3.44Å; Q255-E259 WeakPolarHBondContact O-CG 3.46Å; Q255-E259 PolarHBondContact O-N 3.09Å; F257-E259 VanDerWaalsContact C-N 3.32Å; F257-E259 PolarHBondContact O-N 3.19Å; E259-L262 PolarHBondContact O-N 3Å; E259-E263 WeakPolarHBondContact O-CG 3.13Å; E259-E263 PolarHBondContact O-N 3.23Å
260R82.8Confident79.6Confident173 Ų173103.7 Ų103.765%0.65350%0.496SS*.Hα-helixtrans-69.3-38.4174.9-74.1172.8-174.3134.9-0.5112.3A256 F257 E263 A264A256-R260 VanDerWaalsContact O-CD 3.26Å; A256-R260 WeakPolarHBondContact O-CD 3.31Å; A256-R260 WeakPolarHBondContact O-CG 3.47Å; A256-R260 PolarHBondContact O-N 2.8Å; F257-R260 PolarHBondContact O-N 3.4Å; F257-R260 VanDerWaalsContact O-N 3.11Å; R260-E263 PolarHBondContact O-N 3.23Å; R260-A264 VanDerWaalsContact O-CB 3.24Å; R260-A264 WeakPolarHBondContact O-CB 3.16Å; R260-A264 PolarHBondContact O-N 3.1Å
261E76.9Confident79.2Confident105 Ų105104.1 Ų104.149%0.49150%0.502SS..Hα-helixtrans-60.4-45169.4-76.3-94.5105.900111.1F257 Y258 A264 M265F257-E261 HydrophobicContact CD1-CG 4.09Å; F257-E261 HydrophobicContact CE1-CG 3.63Å; F257-E261 HydrophobicContact CZ-CG 3.9Å; F257-E261 PolarHBondContact O-N 3.16Å; Y258-E261 PolarHBondContact O-N 3.31Å; E261-A264 PolarHBondContact O-N 2.7Å; E261-M265 WeakPolarHBondContact O-CB 3.45Å; E261-M265 WeakPolarHBondContact O-CG 3.19Å; E261-M265 PolarHBondContact O-N 3.43Å
262L77.7Confident78.9Confident99 Ų99103.1 Ų103.152%0.51850%0.501SS..Hα-helixtrans-65.3-39.4175.7-99151.3000112.5Y258 E259 K266Y258-L262 VanDerWaalsContact O-CB 3.29Å; Y258-L262 WeakPolarHBondContact O-CB 3.16Å; Y258-L262 PolarHBondContact O-N 3.39Å; E259-L262 PolarHBondContact O-N 3Å; L262-K266 VanDerWaalsContact O-CB 3.31Å; L262-K266 WeakPolarHBondContact O-CB 3.26Å; L262-K266 WeakPolarHBondContact O-CD 3.46Å; L262-K266 WeakPolarHBondContact O-CG 3.49Å; L262-K266 PolarHBondContact O-N 3.21Å
263E82Confident78.3Confident90 Ų90102 Ų10242%0.42150%0.496SS..Hα-helixtrans-67.5-39.8172.2-74.7-156.8145.100112.3E259 R260 K266 R267E259-E263 WeakPolarHBondContact O-CG 3.13Å; E259-E263 PolarHBondContact O-N 3.23Å; R260-E263 PolarHBondContact O-N 3.23Å; E263-K266 PolarHBondContact O-N 3.31Å; E263-R267 VanDerWaalsContact CD-NH2 3.26Å; E263-R267 WeakPolarHBondContact O-CB 3.47Å; E263-R267 VanDerWaalsContact O-CG 3.24Å; E263-R267 WeakPolarHBondContact O-CG 3.2Å; E263-R267 PolarHBondContact O-N 3.5Å; E263-R267 IonicContact OE1-NH2 3.67Å; E263-R267 PolarHBondContact OE1-NH2 3.49Å; E263-R267 IonicContact OE2-CZ 3.85Å; E263-R267 IonicContact OE2-NH1 3.56Å; E263-R267 PolarHBondContact OE2-NH1 2.82Å; E263-R267 IonicContact OE2-NH2 3.52Å; E263-R267 PolarHBondContact OE2-NH2 3.49Å
264A80.3Confident78Confident43 Ų4398.4 Ų98.436%0.35548%0.484SS..Hα-helixtrans-64.4-44.2175.700000110.8R260 E261 R267 T268R260-A264 VanDerWaalsContact O-CB 3.24Å; R260-A264 WeakPolarHBondContact O-CB 3.16Å; R260-A264 PolarHBondContact O-N 3.1Å; E261-A264 PolarHBondContact O-N 2.7Å; A264-R267 PolarHBondContact O-N 2.75Å; A264-T268 WeakPolarHBondContact O-CB 3.42Å; A264-T268 PolarHBondContact O-N 2.79Å; A264-T268 PolarHBondContact O-OG1 2.83Å
265M73.7Confident77.7Confident111 Ų111101.5 Ų101.555%0.54750%0.495SS..Hα-helixtrans-62.7-41.8172.6-83.5-69.5-75.400112.1E261 T268 Q269E261-M265 WeakPolarHBondContact O-CB 3.45Å; E261-M265 WeakPolarHBondContact O-CG 3.19Å; E261-M265 PolarHBondContact O-N 3.43Å; M265-T268 PolarHBondContact O-N 3.48Å; M265-Q269 WeakPolarHBondContact O-CB 3.37Å; M265-Q269 WeakPolarHBondContact O-CG 3.22Å; M265-Q269 PolarHBondContact O-N 3.48Å
266K80.8Confident77.8Confident127 Ų127101.3 Ų101.355%0.55250%0.496SS*.Hα-helixtrans-63.1-42.4173.2-75.5164.7-174.6173.90112L262 E263 T268 Q269 Q270L262-K266 VanDerWaalsContact O-CB 3.31Å; L262-K266 WeakPolarHBondContact O-CB 3.26Å; L262-K266 WeakPolarHBondContact O-CD 3.46Å; L262-K266 WeakPolarHBondContact O-CG 3.49Å; L262-K266 PolarHBondContact O-N 3.21Å; E263-K266 PolarHBondContact O-N 3.31Å; K266-T268 VanDerWaalsContact C-N 3.34Å; K266-Q269 PolarHBondContact O-N 2.85Å; K266-Q270 WeakPolarHBondContact O-CB 3.41Å; K266-Q270 PolarHBondContact O-N 3.47Å
267R78.1Confident77.6Confident142 Ų142104.1 Ų104.154%0.53651%0.507SS..Hα-helixtrans-65.4-37174.9-72.4169.2-175124.412.2111.6E263 A264 Q270 L271E263-R267 VanDerWaalsContact CD-NH2 3.26Å; E263-R267 WeakPolarHBondContact O-CB 3.47Å; E263-R267 VanDerWaalsContact O-CG 3.24Å; E263-R267 WeakPolarHBondContact O-CG 3.2Å; E263-R267 PolarHBondContact O-N 3.5Å; E263-R267 IonicContact OE1-NH2 3.67Å; E263-R267 PolarHBondContact OE1-NH2 3.49Å; E263-R267 IonicContact OE2-CZ 3.85Å; E263-R267 IonicContact OE2-NH1 3.56Å; E263-R267 PolarHBondContact OE2-NH1 2.82Å; E263-R267 IonicContact OE2-NH2 3.52Å; E263-R267 PolarHBondContact OE2-NH2 3.49Å; A264-R267 PolarHBondContact O-N 2.75Å; R267-Q270 PolarHBondContact O-N 2.76Å; R267-L271 WeakPolarHBondContact O-CB 3.38Å; R267-L271 PolarHBondContact O-N 3.27Å
268T69.8Low77.3Confident76 Ų76100.7 Ų100.747%0.46650%0.5SS..Hα-helixtrans-71.7-38.1175.4-52.70000111.9A264 M265 K266 L271 T272A264-T268 WeakPolarHBondContact O-CB 3.42Å; A264-T268 PolarHBondContact O-N 2.79Å; A264-T268 PolarHBondContact O-OG1 2.83Å; M265-T268 PolarHBondContact O-N 3.48Å; K266-T268 VanDerWaalsContact C-N 3.34Å; T268-L271 PolarHBondContact O-N 2.84Å; T268-T272 WeakPolarHBondContact O-CB 2.79Å; T268-T272 WeakPolarHBondContact O-CG2 3.3Å; T268-T272 PolarHBondContact O-N 3.36Å; T268-T272 PolarHBondContact O-OG1 2.95Å
269Q71.9Confident76.9Confident124 Ų124101.2 Ų101.258%0.57950%0.501SS*.Hα-helixtrans-64.8-41.1170.5-80.1-174.9-18.700111.9M265 K266 T272 A273M265-Q269 WeakPolarHBondContact O-CB 3.37Å; M265-Q269 WeakPolarHBondContact O-CG 3.22Å; M265-Q269 PolarHBondContact O-N 3.48Å; K266-Q269 PolarHBondContact O-N 2.85Å; Q269-T272 WeakPolarHBondContact CA-OG1 3.26Å; Q269-T272 PolarHBondContact O-N 3.33Å; Q269-T272 PolarHBondContact O-OG1 2.79Å; Q269-A273 VanDerWaalsContact O-CB 3.25Å; Q269-A273 WeakPolarHBondContact O-CB 3.49Å; Q269-A273 PolarHBondContact O-N 3.29Å
270Q76.6Confident76.6Confident115 Ų115100.7 Ų100.754%0.53750%0.497SS..Hα-helixtrans-62.3-49.6173.9-170.462.650.200110.9K266 R267 T272 A273 D274K266-Q270 WeakPolarHBondContact O-CB 3.41Å; K266-Q270 PolarHBondContact O-N 3.47Å; R267-Q270 PolarHBondContact O-N 2.76Å; Q270-T272 PolarHBondContact O-N 3.23Å; Q270-A273 PolarHBondContact O-N 2.75Å; Q270-D274 PolarHBondContact NE2-OD2 2.98Å; Q270-D274 VanDerWaalsContact NE2-OD2 3.12Å; Q270-D274 WeakPolarHBondContact O-CB 3.34Å; Q270-D274 PolarHBondContact O-N 3.46Å
271L77.4Confident76.4Confident106 Ų10699.7 Ų99.756%0.55549%0.493SS*.Hα-helixtrans-60.6-39.2175.8-85.9162.2000113R267 T268 N275R267-L271 WeakPolarHBondContact O-CB 3.38Å; R267-L271 PolarHBondContact O-N 3.27Å; T268-L271 PolarHBondContact O-N 2.84Å; L271-N275 WeakPolarHBondContact O-CB 3.48Å; L271-N275 PolarHBondContact O-N 2.75Å; L271-N275 PolarHBondContact O-ND2 2.66Å; L271-N275 VanDerWaalsContact O-ND2 3.13Å
272T75.1Confident76.4Confident81 Ų8197.8 Ų97.850%0.49749%0.488SS..Hα-helixtrans-74.2-31.2176.246.70000112.7T268 Q269 Q270 L276T268-T272 WeakPolarHBondContact O-CB 2.79Å; T268-T272 WeakPolarHBondContact O-CG2 3.3Å; T268-T272 PolarHBondContact O-N 3.36Å; T268-T272 PolarHBondContact O-OG1 2.95Å; Q269-T272 WeakPolarHBondContact CA-OG1 3.26Å; Q269-T272 PolarHBondContact O-N 3.33Å; Q269-T272 PolarHBondContact O-OG1 2.79Å; Q270-T272 PolarHBondContact O-N 3.23Å; T272-L276 WeakPolarHBondContact O-CB 3.22Å; T272-L276 PolarHBondContact O-N 3.46Å
273A71.8Confident76.2Confident43 Ų4395.8 Ų95.836%0.35548%0.476SS..Hα-helixtrans-67.6-44.6170.500000111.7Q269 Q270 L276 L277Q269-A273 VanDerWaalsContact O-CB 3.25Å; Q269-A273 WeakPolarHBondContact O-CB 3.49Å; Q269-A273 PolarHBondContact O-N 3.29Å; Q270-A273 PolarHBondContact O-N 2.75Å; A273-L276 PolarHBondContact O-N 2.66Å; A273-L277 WeakPolarHBondContact O-CB 3.22Å; A273-L277 WeakPolarHBondContact O-CG 3.45Å; A273-L277 PolarHBondContact O-N 2.76Å
274D78.8Confident76Confident76 Ų7693.3 Ų93.341%0.40647%0.471SS..Hα-helixtrans-66.9-40.1177.2-71.5-38.2000111.5Q270 L277 A278Q270-D274 PolarHBondContact NE2-OD2 2.98Å; Q270-D274 VanDerWaalsContact NE2-OD2 3.12Å; Q270-D274 WeakPolarHBondContact O-CB 3.34Å; Q270-D274 PolarHBondContact O-N 3.46Å; D274-L277 PolarHBondContact O-N 3.46Å; D274-A278 PolarHBondContact O-N 2.78Å
275N73Confident76Confident103 Ų10396.4 Ų96.455%0.55148%0.478SS*.Hα-helixtrans-64.6-39170.6-76-28.4000112L271 L277 A278 W279L271-N275 WeakPolarHBondContact O-CB 3.48Å; L271-N275 PolarHBondContact O-N 2.75Å; L271-N275 PolarHBondContact O-ND2 2.66Å; L271-N275 VanDerWaalsContact O-ND2 3.13Å; N275-L277 VanDerWaalsContact C-N 3.34Å; N275-A278 WeakPolarHBondContact O-CB 3.28Å; N275-A278 PolarHBondContact O-N 2.75Å; N275-W279 WeakPolarHBondContact O-CB 3.23Å; N275-W279 PolarHBondContact O-N 3.25Å
276L77.3Confident76.1Confident94 Ų9495 Ų9549%0.49247%0.472SS..Hα-helixtrans-68.1-33.5175.1-177.464.6000111.8T272 A273 W279 K280T272-L276 WeakPolarHBondContact O-CB 3.22Å; T272-L276 PolarHBondContact O-N 3.46Å; A273-L276 PolarHBondContact O-N 2.66Å; L276-W279 PolarHBondContact O-N 2.75Å; L276-K280 WeakPolarHBondContact O-CB 3.27Å; L276-K280 VanDerWaalsContact O-CG 3.31Å; L276-K280 WeakPolarHBondContact O-CG 3.21Å; L276-K280 PolarHBondContact O-N 3.5Å
277L77.9Confident76.1Confident86 Ų8695.4 Ų95.445%0.4547%0.471SS..Hα-helixtrans-69.4-36.1171.6-73.7170.4000111.9A273 D274 N275 R281A273-L277 WeakPolarHBondContact O-CB 3.22Å; A273-L277 WeakPolarHBondContact O-CG 3.45Å; A273-L277 PolarHBondContact O-N 2.76Å; D274-L277 PolarHBondContact O-N 3.46Å; N275-L277 VanDerWaalsContact C-N 3.34Å; L277-R281 WeakPolarHBondContact O-CG 3.44Å; L277-R281 PolarHBondContact O-N 3.29Å
278A77.1Confident76.2Confident42 Ų4296.4 Ų96.435%0.34747%0.474SS..Hα-helixtrans-64.7-46.6168.900000111.3D274 N275 K280 R281 T282D274-A278 PolarHBondContact O-N 2.78Å; N275-A278 WeakPolarHBondContact O-CB 3.28Å; N275-A278 PolarHBondContact O-N 2.75Å; A278-K280 VanDerWaalsContact C-N 3.32Å; A278-K280 PolarHBondContact O-N 2.79Å; A278-R281 WeakPolarHBondContact O-CB 3.48Å; A278-R281 PolarHBondContact O-N 3.19Å; A278-T282 PolarHBondContact O-N 3.27Å; A278-T282 PolarHBondContact O-OG1 3.49Å
279W72.6Confident76.5Confident163 Ų16397.7 Ų97.762%0.61748%0.475SS*.Hα-helixtrans-61.7-38.8179.5-142.896.1000112.1N275 L276 R281 T282 E283N275-W279 WeakPolarHBondContact O-CB 3.23Å; N275-W279 PolarHBondContact O-N 3.25Å; L276-W279 PolarHBondContact O-N 2.75Å; W279-R281 VanDerWaalsContact C-N 3.31Å; W279-R281 PolarHBondContact O-N 3.39Å; W279-T282 WeakPolarHBondContact CA-OG1 3.42Å; W279-T282 PolarHBondContact O-N 3.31Å; W279-T282 PolarHBondContact O-OG1 3.26Å; W279-E283 HydrophobicContact CE3-CB 3.95Å; W279-E283 HydrophobicContact CE3-CG 4.36Å; W279-E283 HydrophobicContact CZ3-CB 3.95Å; W279-E283 HydrophobicContact CZ3-CG 3.92Å; W279-E283 WeakPolarHBondContact O-CB 3.25Å; W279-E283 PolarHBondContact O-N 3.13Å
280K77.3Confident76.6Confident116 Ų11698 Ų9850%0.50448%0.475SS..Hα-helixtrans-65.9-27.9173.2-78175.7177.51800113.7L276 A278 A284L276-K280 WeakPolarHBondContact O-CB 3.27Å; L276-K280 VanDerWaalsContact O-CG 3.31Å; L276-K280 WeakPolarHBondContact O-CG 3.21Å; L276-K280 PolarHBondContact O-N 3.5Å; A278-K280 VanDerWaalsContact C-N 3.32Å; A278-K280 PolarHBondContact O-N 2.79Å; K280-A284 WeakPolarHBondContact O-CB 3.45Å; K280-A284 PolarHBondContact O-N 3.28Å; K280-A284 VanDerWaalsContact O-N 3.12Å
281R79.3Confident76.7Confident152 Ų15298.8 Ų98.857%0.57448%0.479SS*.Hα-helixtrans-71.1-50.7171.6-67.9171.2-169.8117-1.5110.2L277 A278 W279 E283 A284 E285L277-R281 WeakPolarHBondContact O-CG 3.44Å; L277-R281 PolarHBondContact O-N 3.29Å; A278-R281 WeakPolarHBondContact O-CB 3.48Å; A278-R281 PolarHBondContact O-N 3.19Å; W279-R281 VanDerWaalsContact C-N 3.31Å; W279-R281 PolarHBondContact O-N 3.39Å; R281-E283 VanDerWaalsContact C-N 3.29Å; R281-E283 PolarHBondContact O-N 3.43Å; R281-A284 CarbonylContact O-C 3.59Å; R281-A284 PolarHBondContact O-N 3.21Å; R281-E285 WeakPolarHBondContact O-CG 3.19Å; R281-E285 PolarHBondContact O-N 3.49Å
282T77.2Confident76.6Confident64 Ų6498.4 Ų98.439%0.39348%0.481SS..Hα-helixtrans-63.6-33.6177.252.60000112.5A278 W279 E285 L286A278-T282 PolarHBondContact O-N 3.27Å; A278-T282 PolarHBondContact O-OG1 3.49Å; W279-T282 WeakPolarHBondContact CA-OG1 3.42Å; W279-T282 PolarHBondContact O-N 3.31Å; W279-T282 PolarHBondContact O-OG1 3.26Å; T282-E285 PolarHBondContact O-N 3.48Å; T282-L286 VanDerWaalsContact O-CB 3.3Å; T282-L286 WeakPolarHBondContact O-CB 3.35Å; T282-L286 VanDerWaalsContact O-CG 3.27Å; T282-L286 WeakPolarHBondContact O-CG 3.28Å; T282-L286 PolarHBondContact O-N 3.35Å
283E72.9Confident76.6Confident57 Ų5799.3 Ų99.327%0.26648%0.479SS..Hα-helixtrans-66.8-37.5173-168.1-162.4-156.800111.7W279 R281 R287W279-E283 HydrophobicContact CE3-CB 3.95Å; W279-E283 HydrophobicContact CE3-CG 4.36Å; W279-E283 HydrophobicContact CZ3-CB 3.95Å; W279-E283 HydrophobicContact CZ3-CG 3.92Å; W279-E283 WeakPolarHBondContact O-CB 3.25Å; W279-E283 PolarHBondContact O-N 3.13Å; R281-E283 VanDerWaalsContact C-N 3.29Å; R281-E283 PolarHBondContact O-N 3.43Å; E283-R287 VanDerWaalsContact CD-CZ 3.43Å; E283-R287 VanDerWaalsContact CD-NH2 3.32Å; E283-R287 VanDerWaalsContact O-CB 3.31Å; E283-R287 WeakPolarHBondContact O-CB 3.24Å; E283-R287 VanDerWaalsContact O-CG 3.3Å; E283-R287 WeakPolarHBondContact O-CG 3.24Å; E283-R287 PolarHBondContact O-N 3.36Å; E283-R287 IonicContact OE1-CZ 2.78Å; E283-R287 VanDerWaalsContact OE1-CZ 3.27Å; E283-R287 IonicContact OE1-NH1 2.71Å; E283-R287 PolarHBondContact OE1-NH1 3.46Å; E283-R287 IonicContact OE1-NH2 2.75Å; E283-R287 PolarHBondContact OE1-NH2 3.38Å; E283-R287 IonicContact OE2-CZ 2.61Å; E283-R287 IonicContact OE2-NH1 2.73Å; E283-R287 PolarHBondContact OE2-NH1 3.06Å; E283-R287 IonicContact OE2-NH2 2.69Å
284A77.6Confident76.7Confident38 Ų38102.4 Ų102.431%0.31449%0.486SS..Hα-helixtrans-74.7-23.417500000113.4K280 R281 R288K280-A284 WeakPolarHBondContact O-CB 3.45Å; K280-A284 PolarHBondContact O-N 3.28Å; K280-A284 VanDerWaalsContact O-N 3.12Å; R281-A284 CarbonylContact O-C 3.59Å; R281-A284 PolarHBondContact O-N 3.21Å; A284-R288 WeakPolarHBondContact O-CG 3.37Å; A284-R288 PolarHBondContact O-NH1 2.82Å
285E79.4Confident76.4Confident108 Ų108101.6 Ų101.651%0.50549%0.491SS..Hα-helixtrans-76.3-53.4170.5-73.1155.9-177.300109.9R281 T282 R287 R288 E289R281-E285 WeakPolarHBondContact O-CG 3.19Å; R281-E285 PolarHBondContact O-N 3.49Å; T282-E285 PolarHBondContact O-N 3.48Å; E285-R287 VanDerWaalsContact C-N 3.29Å; E285-R287 PolarHBondContact O-N 3.32Å; E285-R288 WeakPolarHBondContact O-CA 3.46Å; E285-R288 WeakPolarHBondContact O-CB 3.46Å; E285-R288 PolarHBondContact O-N 3.05Å; E285-E289 PolarHBondContact O-N 2.97Å; E285-E289 VanDerWaalsContact O-N 3.07Å
286L76.9Confident76.5Confident81 Ų8199.5 Ų99.542%0.42449%0.487SS..Hα-helixtrans-55.9-38.2173.6-74167.7000112.6T282 R288 E289 F290T282-L286 VanDerWaalsContact O-CB 3.3Å; T282-L286 WeakPolarHBondContact O-CB 3.35Å; T282-L286 VanDerWaalsContact O-CG 3.27Å; T282-L286 WeakPolarHBondContact O-CG 3.28Å; T282-L286 PolarHBondContact O-N 3.35Å; L286-R288 VanDerWaalsContact C-N 3.3Å; L286-R288 PolarHBondContact O-N 2.8Å; L286-E289 PolarHBondContact O-N 2.8Å; L286-F290 HydrophobicContact CB-CD2 4.5Å; L286-F290 WeakPolarHBondContact O-CB 3.41Å; L286-F290 VanDerWaalsContact O-CD2 3.31Å; L286-F290 WeakPolarHBondContact O-CD2 3.25Å; L286-F290 PolarHBondContact O-N 3.04Å
287R80.4Confident76.2Confident137 Ų13799.8 Ų99.852%0.51749%0.489SS..Hα-helixtrans-61.2-35.5174-85-174.6-179.2108.212.3113E283 E285 Q291E283-R287 VanDerWaalsContact CD-CZ 3.43Å; E283-R287 VanDerWaalsContact CD-NH2 3.32Å; E283-R287 VanDerWaalsContact O-CB 3.31Å; E283-R287 WeakPolarHBondContact O-CB 3.24Å; E283-R287 VanDerWaalsContact O-CG 3.3Å; E283-R287 WeakPolarHBondContact O-CG 3.24Å; E283-R287 PolarHBondContact O-N 3.36Å; E283-R287 IonicContact OE1-CZ 2.78Å; E283-R287 VanDerWaalsContact OE1-CZ 3.27Å; E283-R287 IonicContact OE1-NH1 2.71Å; E283-R287 PolarHBondContact OE1-NH1 3.46Å; E283-R287 IonicContact OE1-NH2 2.75Å; E283-R287 PolarHBondContact OE1-NH2 3.38Å; E283-R287 IonicContact OE2-CZ 2.61Å; E283-R287 IonicContact OE2-NH1 2.73Å; E283-R287 PolarHBondContact OE2-NH1 3.06Å; E283-R287 IonicContact OE2-NH2 2.69Å; E285-R287 VanDerWaalsContact C-N 3.29Å; E285-R287 PolarHBondContact O-N 3.32Å; R287-Q291 WeakPolarHBondContact O-CB 3.17Å; R287-Q291 VanDerWaalsContact O-CG 3.26Å; R287-Q291 WeakPolarHBondContact O-CG 3.14Å; R287-Q291 PolarHBondContact O-N 2.82Å
288R79.6Confident76Confident162 Ų162101.3 Ų101.361%0.61149%0.494SS*.Hα-helixtrans-70.8-41.3174.8-69.1179.4-178.2101-11.7111.1A284 E285 L286 Q291 T292A284-R288 WeakPolarHBondContact O-CG 3.37Å; A284-R288 PolarHBondContact O-NH1 2.82Å; E285-R288 WeakPolarHBondContact O-CA 3.46Å; E285-R288 WeakPolarHBondContact O-CB 3.46Å; E285-R288 PolarHBondContact O-N 3.05Å; L286-R288 VanDerWaalsContact C-N 3.3Å; L286-R288 PolarHBondContact O-N 2.8Å; R288-Q291 PolarHBondContact O-N 3.08Å; R288-T292 PolarHBondContact O-N 3Å
289E76.3Confident75.7Confident104 Ų104107.2 Ų107.249%0.48651%0.512SS..Hα-helixtrans-64.3-44.2175.6-64.7-175.6164.700111.8E285 L286 Q291 T292 Q293E285-E289 PolarHBondContact O-N 2.97Å; E285-E289 VanDerWaalsContact O-N 3.07Å; L286-E289 PolarHBondContact O-N 2.8Å; E289-Q291 VanDerWaalsContact C-N 3.33Å; E289-Q291 PolarHBondContact O-N 3.26Å; E289-T292 PolarHBondContact O-N 2.79Å; E289-T292 PolarHBondContact O-OG1 3.4Å; E289-Q293 WeakPolarHBondContact O-CB 3.04Å; E289-Q293 VanDerWaalsContact O-CG 3.32Å; E289-Q293 WeakPolarHBondContact O-CG 3.19Å; E289-Q293 PolarHBondContact O-N 2.82Å
290F74.5Confident75.7Confident131 Ų131102.6 Ų102.658%0.57550%0.501SS*.Hα-helixtrans-61.8-38.8173.6-88.6-68.4000112.2L286 T292 Q293 E294L286-F290 HydrophobicContact CB-CD2 4.5Å; L286-F290 WeakPolarHBondContact O-CB 3.41Å; L286-F290 VanDerWaalsContact O-CD2 3.31Å; L286-F290 WeakPolarHBondContact O-CD2 3.25Å; L286-F290 PolarHBondContact O-N 3.04Å; F290-T292 PolarHBondContact O-N 3.4Å; F290-Q293 PolarHBondContact O-N 3.3Å; F290-E294 VanDerWaalsContact O-CB 3.25Å; F290-E294 WeakPolarHBondContact O-CB 3.27Å; F290-E294 PolarHBondContact O-N 2.82Å
291Q78.1Confident75.3Confident131 Ų131100.7 Ų100.761%0.61250%0.496SS*.Hα-helixtrans-64.6-36.9174.6-77.7173.7-17.600112.8R287 R288 E289 A295R287-Q291 WeakPolarHBondContact O-CB 3.17Å; R287-Q291 VanDerWaalsContact O-CG 3.26Å; R287-Q291 WeakPolarHBondContact O-CG 3.14Å; R287-Q291 PolarHBondContact O-N 2.82Å; R288-Q291 PolarHBondContact O-N 3.08Å; E289-Q291 VanDerWaalsContact C-N 3.33Å; E289-Q291 PolarHBondContact O-N 3.26Å; Q291-A295 WeakPolarHBondContact O-CB 3.24Å; Q291-A295 PolarHBondContact O-N 2.83Å; Q291-A295 VanDerWaalsContact O-N 3.16Å
292T74.9Confident74.9Confident98 Ų9896 Ų9660%0.60150%0.495SS*.Hα-helixtrans-73.7-35174.959.60000112.5R288 E289 F290 A296R288-T292 PolarHBondContact O-N 3Å; E289-T292 PolarHBondContact O-N 2.79Å; E289-T292 PolarHBondContact O-OG1 3.4Å; F290-T292 PolarHBondContact O-N 3.4Å; T292-A296 PolarHBondContact O-N 3.09Å
293Q76.6Confident74.7Confident100 Ų100100 Ų10047%0.46751%0.507SS..Hα-helixtrans-69.2-41.2173.2-69.9179.329.200112.3E289 F290 A296 L297E289-Q293 WeakPolarHBondContact O-CB 3.04Å; E289-Q293 VanDerWaalsContact O-CG 3.32Å; E289-Q293 WeakPolarHBondContact O-CG 3.19Å; E289-Q293 PolarHBondContact O-N 2.82Å; F290-Q293 PolarHBondContact O-N 3.3Å; Q293-A296 WeakPolarHBondContact O-CB 3.26Å; Q293-A296 PolarHBondContact O-N 3.46Å; Q293-A296 VanDerWaalsContact O-N 3.12Å; Q293-L297 WeakPolarHBondContact O-CG 3.18Å; Q293-L297 PolarHBondContact O-N 2.68Å
294E72.6Confident74.5Confident107 Ų107102 Ų10250%0.552%0.519SS..Hα-helixtrans-64.2-42.8178.1-164.8-169.3160.100110.9F290 A296 L297 Q298F290-E294 VanDerWaalsContact O-CB 3.25Å; F290-E294 WeakPolarHBondContact O-CB 3.27Å; F290-E294 PolarHBondContact O-N 2.82Å; E294-A296 PolarHBondContact O-N 3.35Å; E294-L297 PolarHBondContact O-N 3.23Å; E294-L297 VanDerWaalsContact O-N 3.09Å; E294-Q298 HydrophobicContact CG-CG 4.3Å; E294-Q298 WeakPolarHBondContact O-CG 3.46Å; E294-Q298 PolarHBondContact O-N 2.65Å; E294-Q298 PolarHBondContact OE1-NE2 3.03Å
295A72.6Confident74.4Confident60 Ų60108.8 Ų108.850%0.49654%0.536SS..Hα-helixtrans-59-33.4173.200000112.7Q291Q291-A295 WeakPolarHBondContact O-CB 3.24Å; Q291-A295 PolarHBondContact O-N 2.83Å; Q291-A295 VanDerWaalsContact O-N 3.16Å
296A75.7Confident73.6Confident58 Ų58107.4 Ų107.448%0.47954%0.543SS..Hα-helixtrans-73.9-40172.800000112.6T292 Q293 E294 K299 T300T292-A296 PolarHBondContact O-N 3.09Å; Q293-A296 WeakPolarHBondContact O-CB 3.26Å; Q293-A296 PolarHBondContact O-N 3.46Å; Q293-A296 VanDerWaalsContact O-N 3.12Å; E294-A296 PolarHBondContact O-N 3.35Å; A296-K299 WeakPolarHBondContact O-CB 3.43Å; A296-K299 PolarHBondContact O-N 2.76Å; A296-T300 PolarHBondContact O-N 2.66Å
297L70.5Confident73.2Confident101 Ų101109.6 Ų109.653%0.52955%0.551SS.*Hα-helixtrans-72.8-36-179.6-72.2172.2000113.2Q293 E294 K299 T300 L301Q293-L297 WeakPolarHBondContact O-CG 3.18Å; Q293-L297 PolarHBondContact O-N 2.68Å; E294-L297 PolarHBondContact O-N 3.23Å; E294-L297 VanDerWaalsContact O-N 3.09Å; L297-K299 PolarHBondContact O-N 3.42Å; L297-T300 PolarHBondContact O-N 2.71Å; L297-T300 VanDerWaalsContact O-N 3.14Å; L297-T300 PolarHBondContact O-OG1 2.72Å; L297-L301 WeakPolarHBondContact O-CB 3.4Å; L297-L301 WeakPolarHBondContact O-CG 3.26Å; L297-L301 PolarHBondContact O-N 3.46Å
298Q74.8Confident72.5Confident118 Ų118109 Ų10955%0.55156%0.558SS**Hα-helixtrans-60.3-35.8171.2-69.7179.711.300110.7E294 T300 G302E294-Q298 HydrophobicContact CG-CG 4.3Å; E294-Q298 WeakPolarHBondContact O-CG 3.46Å; E294-Q298 PolarHBondContact O-N 2.65Å; E294-Q298 PolarHBondContact OE1-NE2 3.03Å; Q298-T300 PolarHBondContact O-N 2.79Å; Q298-G302 PolarHBondContact O-N 3Å; Q298-G302 VanDerWaalsContact O-N 3.08Å
299K71.2Confident72Confident166 Ų166104.4 Ų104.472%0.72256%0.555SS**Hα-helixtrans-72.8-19.1176.6-165.8174.8-177.6176.80114.1A296 L297A296-K299 WeakPolarHBondContact O-CB 3.43Å; A296-K299 PolarHBondContact O-N 2.76Å; L297-K299 PolarHBondContact O-N 3.42Å
300T72.4Confident71.3Confident65 Ų65107.6 Ų107.640%0.39956%0.562SS.*Hα-helixtrans-95.9-37.1172.257.50000112.6A296 L297 Q298 G302 K303 L304A296-T300 PolarHBondContact O-N 2.66Å; L297-T300 PolarHBondContact O-N 2.71Å; L297-T300 VanDerWaalsContact O-N 3.14Å; L297-T300 PolarHBondContact O-OG1 2.72Å; Q298-T300 PolarHBondContact O-N 2.79Å; T300-G302 PolarHBondContact O-N 2.79Å; T300-K303 WeakPolarHBondContact O-CA 3.21Å; T300-K303 WeakPolarHBondContact O-CB 3.39Å; T300-K303 PolarHBondContact O-N 3.34Å; T300-L304 PolarHBondContact O-N 3.12Å; T300-L304 VanDerWaalsContact O-N 3.11Å
301L68.1Low71.1Confident77 Ų77105 Ų10540%0.40356%0.557SS.*Hα-helixtrans-59.5-34.1170.9-79.1167.9000112.3L297 K303 L304 R305L297-L301 WeakPolarHBondContact O-CB 3.4Å; L297-L301 WeakPolarHBondContact O-CG 3.26Å; L297-L301 PolarHBondContact O-N 3.46Å; L301-K303 PolarHBondContact O-N 2.74Å; L301-L304 PolarHBondContact O-N 3.49Å; L301-R305 WeakPolarHBondContact O-CB 3.45Å; L301-R305 VanDerWaalsContact O-CG 3.3Å; L301-R305 WeakPolarHBondContact O-CG 3.18Å; L301-R305 PolarHBondContact O-N 3.45Å
302G71.3Confident70.5Confident53 Ų53102.9 Ų102.955%0.54655%0.553SS.*Hα-helixtrans-60.2-21.5170.800000114.5Q298 T300Q298-G302 PolarHBondContact O-N 3Å; Q298-G302 VanDerWaalsContact O-N 3.08Å; T300-G302 PolarHBondContact O-N 2.79Å
303K72.1Confident70.1Confident149 Ų149104.7 Ų104.765%0.64856%0.559SS**Hα-helixtrans-88-52.4172.7-56.3-176.9179.6-174.70111.1T300 L301 R305 A306T300-K303 WeakPolarHBondContact O-CA 3.21Å; T300-K303 WeakPolarHBondContact O-CB 3.39Å; T300-K303 PolarHBondContact O-N 3.34Å; L301-K303 PolarHBondContact O-N 2.74Å; K303-R305 PolarHBondContact O-N 2.59Å; K303-A306 WeakPolarHBondContact O-CB 3.16Å; K303-A306 PolarHBondContact O-N 3.4Å
304L69.6Low69.5Low97 Ų97106 Ų10651%0.50857%0.566SS.*Hα-helixtrans-60.7-30.5-176.1-69.9169.2000113.4T300 L301 A306 E307 L308T300-L304 PolarHBondContact O-N 3.12Å; T300-L304 VanDerWaalsContact O-N 3.11Å; L301-L304 PolarHBondContact O-N 3.49Å; L304-A306 PolarHBondContact O-N 3.01Å; L304-E307 PolarHBondContact O-N 3.18Å; L304-E307 VanDerWaalsContact O-N 3.1Å; L304-L308 PolarHBondContact O-N 3Å
305R75.8Confident69.1Low181 Ų181103.9 Ų103.968%0.68357%0.566SS**Hα-helixtrans-63.4-24.7174.1-76.7173.6177.7160.60.5113.6L301 K303L301-R305 WeakPolarHBondContact O-CB 3.45Å; L301-R305 VanDerWaalsContact O-CG 3.3Å; L301-R305 WeakPolarHBondContact O-CG 3.18Å; L301-R305 PolarHBondContact O-N 3.45Å; K303-R305 PolarHBondContact O-N 2.59Å
306A61.2Low69.2Low79 Ų79112 Ų11265%0.65358%0.584SS**Hα-helixtrans-78.8-22.8174.100000112.8K303 L304K303-A306 WeakPolarHBondContact O-CB 3.16Å; K303-A306 PolarHBondContact O-N 3.4Å; L304-A306 PolarHBondContact O-N 3.01Å
307E70.1Confident68.6Low127 Ų127117.6 Ų117.659%0.59360%0.6SS**Hα-helixtrans-90.3-39.6178.7-72.1175.6116.300112.7L304 A309 R310L304-E307 PolarHBondContact O-N 3.18Å; L304-E307 VanDerWaalsContact O-N 3.1Å; E307-A309 VanDerWaalsContact C-N 3.27Å; E307-A309 PolarHBondContact O-N 3.11Å; E307-R310 VanDerWaalsContact O-CB 3.27Å; E307-R310 WeakPolarHBondContact O-CB 3.33Å; E307-R310 PolarHBondContact O-N 3.11Å
308L63.9Low67.6Low125 Ų125118.7 Ų118.765%0.65461%0.606SS**Hα-helixtrans-60.5-36.5-176.6-165.577.7000112.7L304 R310 V311L304-L308 PolarHBondContact O-N 3Å; L308-R310 PolarHBondContact O-N 3.06Å; L308-R310 VanDerWaalsContact O-N 3.1Å; L308-V311 PolarHBondContact O-N 3.19Å; L308-V311 VanDerWaalsContact O-N 3.14Å
309A70.3Confident67.2Low66 Ų66123.1 Ų123.155%0.54562%0.618SS.*THydrogen-bonded Turntrans-61.2-15.6176.400000113.6E307E307-A309 VanDerWaalsContact C-N 3.27Å; E307-A309 PolarHBondContact O-N 3.11Å
310R61.6Low67.1Low170 Ų170124.6 Ų124.664%0.64263%0.628SS**THydrogen-bonded Turntrans-88.6-4.6178.9-149.3-163.866.266.81.9113.9E307 L308 E314E307-R310 VanDerWaalsContact O-CB 3.27Å; E307-R310 WeakPolarHBondContact O-CB 3.33Å; E307-R310 PolarHBondContact O-N 3.11Å; L308-R310 PolarHBondContact O-N 3.06Å; L308-R310 VanDerWaalsContact O-N 3.1Å; R310-E314 IonicContact NH1-OE1 3.86Å
311V70.1Confident65.9Low76 Ų76130.7 Ų130.746%0.46165%0.649SS.*THydrogen-bonded Turntrans-118.5-27.4-169.3-178.90000112.8L308 D313 E314L308-V311 PolarHBondContact O-N 3.19Å; L308-V311 VanDerWaalsContact O-N 3.14Å; V311-D313 PolarHBondContact O-N 3.3Å; V311-E314 PolarHBondContact O-N 2.78Å
312T66.1Low64.5Low88 Ų88131.3 Ų131.354%0.5466%0.66SS.*THydrogen-bonded Turntrans-62.7-26.3-177.539.80000114.3
313D65.9Low64.2Low136 Ų136137.2 Ų137.273%0.72767%0.672SS**THydrogen-bonded Turntrans-77.6-23.5-173.5-61.1-8.4000112.4V311V311-D313 PolarHBondContact O-N 3.3Å
314E63.7Low63.2Low128 Ų128140 Ų14060%0.59869%0.685SS**THydrogen-bonded Turntrans-81.6-21.1-176-61.7177170.100113.2R310 V311R310-E314 IonicContact NH1-OE1 3.86Å; V311-E314 PolarHBondContact O-N 2.78Å
315A64.8Low61.8Low62 Ų62143.5 Ų143.551%0.51270%0.703SS.*SBendtrans-94.1-9.1-16300000116.2
316R74.6Confident60.7Low229 Ų229144 Ų14486%0.86471%0.713SS**G310 helixtrans-78.7-24.6-166.8-165.3170.6-176.11580.8114.4N318R316-N318 VanDerWaalsContact C-N 3.34Å; R316-N318 PolarHBondContact O-N 2.73Å
317E62.1Low59.9Low176 Ų176145.2 Ų145.282%0.82272%0.723SS**G310 helixtrans-74-12.7-162.3-155.2171.9-171.100115.7
318N49.7Very low58.3Low124 Ų124144.1 Ų144.166%0.66374%0.736SS**G310 helixtrans-99.5-13.3-159.8-85.1-63.5000118.1R316R316-N318 VanDerWaalsContact C-N 3.34Å; R316-N318 PolarHBondContact O-N 2.73Å
319R65.8Low56.6Low211 Ų211146.6 Ų146.680%0.79675%0.749SS**  trans-87.3-19.3-158.2-77.2-167.3174.995.4-2118.6K321R319-K321 VanDerWaalsContact C-N 3.33Å; R319-K321 PolarHBondContact O-N 3.17Å; R319-K321 VanDerWaalsContact O-N 3.08Å
320E69Low55.5Low198 Ų198147.3 Ų147.393%0.92576%0.763SS**THydrogen-bonded Turntrans-78.74-155.6-59.5-173.2136.100117.5
321K47.9Very low54.4Low193 Ų193146 Ų14684%0.83977%0.774SS**THydrogen-bonded Turntrans-100.1-2.3-156.7-65.5174.9-178.6167.10117.9R319R319-K321 VanDerWaalsContact C-N 3.33Å; R319-K321 PolarHBondContact O-N 3.17Å; R319-K321 VanDerWaalsContact O-N 3.08Å
322S39.8Very low52.5Low90 Ų90146.1 Ų146.163%0.62978%0.783SS**  trans-100.9-28.5-149.3-1580000121.5
323H63.7Low50.7Low176 Ų176150.9 Ų150.982%0.81580%0.799SS**  trans-117.544.1-146.9-86.8-66.8000119.8
324K52.6Low49.5Very low208 Ų208147.6 Ų147.690%0.90480%0.798SS**  trans-108.220.3-172-73-172.1174.3-179.30119
325L39.8Very low48.2Very low171 Ų171147.3 Ų147.390%0.89581%0.81SS**  trans-123.96.1-156.1-77.6169.9000121.5
326Q51.6Low46.5Very low190 Ų190152.2 Ų152.289%0.88883%0.826SS**  trans-110.110.6-151.3-158.5165.4-12.500120.8
327A45.3Very low44.7Very low105 Ų105150.4 Ų150.487%0.86882%0.824SS**  trans-115.721.8-144.500000123
328A35.5Very low43.4Very low105 Ų105148.7 Ų148.787%0.86882%0.821SS**  trans-130.819.9-151.200000123.8
329L28.7Very low42.8Very low176 Ų176151 Ų15192%0.92183%0.832SS**  trans-115.9-19.4-159.4-160.960.1000121.5
330G46.5Very low41.5Very low82 Ų82147.8 Ų147.885%0.84584%0.836SS**  trans-96.917.4-14100000124.3
331T39.4Very low40.2Very low141 Ų141148.1 Ų148.187%0.86583%0.834SS**  trans-123.4106.6-164.654.50000117.3
332A30.2Very low39.6Very low79 Ų79147.8 Ų147.865%0.65384%0.836SS**  trans-161.8158.7167.100000114.2
333E28.8Very low39.8Very low188 Ų188150.7 Ų150.788%0.87984%0.843SS**  trans53.5134.9150.9-65.5145.3-141.100121.9
334G40Very low38.7Very low68 Ų68149.8 Ų149.870%0.70185%0.845SS**  cis111.3107.9-25.300000118.9
335S35.8Very low38.3Very low121 Ų121148 Ų14885%0.84684%0.839SS**  trans149.6177147.8-71.60000115.8
336I30Very low38.7Very low166 Ų166145.9 Ų145.985%0.85183%0.833SS**  trans90126.5168.6-54.5170.3000116.8
337K36.3Very low38.5Very low191 Ų191142.9 Ų142.983%0.8383%0.828SS**  trans-158.9-1.9-172.4-130.4175.8-179.1-1800121.7
338D35.4Very low38.7Very low140 Ų140146.5 Ų146.575%0.74983%0.827SS**  trans-126.569.3-140.9-47.5-80.1000119.7
339L37.1Very low39Very low173 Ų173149.1 Ų149.191%0.90683%0.826SS**  trans-147.287177-75.3177.4000116.8
340T37.2Very low39.6Very low142 Ų142146.3 Ų146.387%0.87182%0.821SS**  trans-15684.6179.9-41.60000114.7
341K41.9Very low39.5Very low206 Ų206151.5 Ų151.590%0.89682%0.824SS**  trans-163.321.6-175-133.3-158172.3-170.90125.9
342Q36.4Very low39.8Very low186 Ų186152.2 Ų152.287%0.86982%0.821SS**  trans-146.9106.3-174.6-66.1178-21.300115.2
343L43.4Very low41.1Very low150 Ų150156.7 Ų156.779%0.78583%0.832SS**  trans-164.2-28.2167.4-155.352000119.7E345L343-E345 PolarHBondContact O-N 2.65Å; L343-E345 VanDerWaalsContact O-N 3.13Å
344D40.5Very low42.1Very low158 Ų158156.4 Ų156.485%0.84583%0.83SS**  trans-80.76.1-153.3-57.6-57.9000118.1V346D344-V346 PolarHBondContact O-N 2.79Å
345E45.5Very low42.6Very low169 Ų169160.8 Ų160.879%0.7984%0.836SS**  trans-108.556.1-145.1-60.5168.585.800114.9L343L343-E345 PolarHBondContact O-N 2.65Å; L343-E345 VanDerWaalsContact O-N 3.13Å
346V46.6Very low43Very low127 Ų127166.8 Ų166.877%0.7784%0.84SS**  trans-132.3-78.4-165.9-159.10000120.1D344D344-V346 PolarHBondContact O-N 2.79Å
347T48.6Very low43.5Very low128 Ų128168.1 Ų168.179%0.78584%0.843SS**  trans-110.6130.4-14952.50000117.3
348Q48Very low44.2Very low180 Ų180168.1 Ų168.184%0.84184%0.843SS**  trans-160.19.3174.9-140175.1-5.900120
349N43.4Very low44.6Very low160 Ų160171.1 Ų171.186%0.85685%0.853SS**  trans-125.3100.7-159.3-59.2-39000116.8
350S40.2Very low45.3Very low117 Ų117167.8 Ų167.882%0.81885%0.85SS**  trans-162.510.7171.9-157.30000121.7I352S350-I352 PolarHBondContact O-N 3.32Å
351E44Very low45.9Very low192 Ų192168.9 Ų168.990%0.89785%0.845SS**  trans-90.418.7-156.4-59.2179.6125.300119.7
352I46.3Very low46.4Very low156 Ų156164.9 Ų164.980%0.884%0.841SS**  trans-98.1-4.6-149.4-74.9173.7000119.5S350S350-I352 PolarHBondContact O-N 3.32Å
353I57.6Low46.8Very low173 Ų173165 Ų16589%0.88784%0.842SS**  trans-108.660.5-161.3-41.7-176.6000115.4
354E49.1Very low46.7Very low181 Ų181165.8 Ų165.885%0.84685%0.846SS**  trans-105.8-25.5-171.4-165.7177.6-153.800116.9R356E354-R356 PolarHBondContact O-N 3.33Å
355I52.1Low47.4Very low160 Ų160167.1 Ų167.182%0.82185%0.847SS**  trans-88.5-2.7-139.1-69.4174000118.1
356R43.8Very low47.7Very low247 Ų247163.1 Ų163.193%0.93284%0.843SS**  trans-10915.5-146.5-122-177-166.1-178.25.1122.4E354E354-R356 PolarHBondContact O-N 3.33Å
357Q41Very low48Very low195 Ų195159.9 Ų159.991%0.91183%0.83SS**  trans-142.676.3-176.6-164.9173.84.900114.5
358K49.4Very low48Very low190 Ų190164 Ų16483%0.82683%0.831SS**  trans-150.225.6-175.4-144.5175.8-177177.90116.5
359E44.4Very low48.3Very low204 Ų204162.6 Ų162.695%0.95383%0.829SS**  trans-12440.5-168.5-60.2-178.9130.900113.6
360A51.9Low49Very low102 Ų102164.1 Ų164.184%0.84382%0.823SS**  trans-134.526.9-171.100000115.2
361E50.2Low49.5Very low165 Ų165164 Ų16477%0.77182%0.817SS**  trans-90.7-179.3175.4-62.2178.7150.100111.9
362C52Low49.7Very low122 Ų122163.2 Ų163.282%0.82481%0.813SS**  trans95.4-8.8149.8-59.70000124.7
363E44.8Very low49.9Very low189 Ų189163.5 Ų163.588%0.88381%0.811SS**SBendtrans-102.7-17.3-172.6-75-155.6154.100119.8
364L42.3Very low49.6Very low166 Ų166163 Ų16387%0.86981%0.805SS**SBendtrans-92.2-1.7-167.5-13478.3000117.2A366L364-A366 VanDerWaalsContact C-N 3.32Å; L364-A366 PolarHBondContact O-N 3.35Å
365E55Low49.5Very low187 Ų187158.6 Ų158.687%0.87480%0.799SS**THydrogen-bonded Turntrans-67.9-23.7-171.1-146.473.8-161.900114.1A367E365-A367 PolarHBondContact O-N 2.72Å
366A51.7Low49.6Very low85 Ų85156.2 Ų156.270%0.70279%0.792SS**THydrogen-bonded Turntrans-87.715.4-161.100000116.8L364L364-A366 VanDerWaalsContact C-N 3.32Å; L364-A366 PolarHBondContact O-N 3.35Å
367A52.8Low50.3Low59 Ų59152 Ų15249%0.48878%0.783SS.*SBendtrans-97.5-31.6-158.300000117.3E365E365-A367 PolarHBondContact O-N 2.72Å
368R48Very low51Low215 Ų215149.8 Ų149.881%0.81178%0.776SS**SBendtrans-119.9-3.7-157-81.6-175.4171.7167.6-0.7119.7R370 V371R368-R370 PolarHBondContact O-N 2.74Å; R368-V371 PolarHBondContact O-N 2.73Å
369D54.3Low50.9Low149 Ų149148.5 Ų148.580%0.79778%0.778SS**G310 helixtrans-62.1-9174.1-66.2-41.7000114.8V371D369-V371 VanDerWaalsContact C-N 3.29Å; D369-V371 PolarHBondContact O-N 3.35Å
370R57.1Low51.2Low193 Ų193145.7 Ų145.773%0.72877%0.768SS**G310 helixtrans-73-9.1-179.4-80.1176.1-91.1-166.8-10.6115.4R368R368-R370 PolarHBondContact O-N 2.74Å
371V51.4Low51.2Low115 Ų115149.6 Ų149.670%0.69777%0.766SS**G310 helixtrans-85.7-23.2-176.3-178.80000113R368 D369 Q373R368-V371 PolarHBondContact O-N 2.73Å; D369-V371 VanDerWaalsContact C-N 3.29Å; D369-V371 PolarHBondContact O-N 3.35Å; V371-Q373 PolarHBondContact O-N 2.82Å
372Q47.7Very low51.1Low174 Ų174146 Ų14681%0.81376%0.764SS**THydrogen-bonded Turntrans-78.6-12.6-168.5-15183.7-900114.9
373Q52.2Low51.1Low162 Ų162144.4 Ų144.476%0.75776%0.755SS**THydrogen-bonded Turntrans-101.5-8.1-165.6-71-172.8-1300116.4V371 A375V371-Q373 PolarHBondContact O-N 2.82Å; Q373-A375 VanDerWaalsContact C-N 3.31Å; Q373-A375 PolarHBondContact O-N 2.77Å
374Q49.7Very low51.4Low164 Ų164143 Ų14377%0.76675%0.748SS**THydrogen-bonded Turntrans-83.32.5-175-65.2-170.1-57.600115
375A48Very low51.9Low87 Ų87141.7 Ų141.772%0.71974%0.741SS**THydrogen-bonded Turntrans-83-8.4-171.300000115.6Q373Q373-A375 VanDerWaalsContact C-N 3.31Å; Q373-A375 PolarHBondContact O-N 2.77Å
376T54.3Low51.6Low110 Ų110137.7 Ų137.768%0.67573%0.733SS**SBendtrans-112-15.3-165.646.50000116.2I378T376-I378 PolarHBondContact O-N 3.35Å
377E58.3Low51.7Low158 Ų158137.7 Ų137.774%0.73873%0.729SS**G310 helixtrans-76.5-15.7-175.4-69.9-165.3122.200115.1L379 L380E377-L379 PolarHBondContact O-N 3.41Å; E377-L380 PolarHBondContact O-N 2.83Å
378I55.2Low51.9Low149 Ų149141.1 Ų141.176%0.76474%0.738SS**G310 helixtrans-64.9-24.6-173.9-67.2176000112.5T376 L380T376-I378 PolarHBondContact O-N 3.35Å; I378-L380 VanDerWaalsContact C-N 3.28Å; I378-L380 PolarHBondContact O-N 2.75Å
379L48.2Very low52.3Low164 Ų164137.9 Ų137.986%0.85973%0.732SS**G310 helixtrans-72.3-8.1-176.9-86.4163.8000115.5E377E377-L379 PolarHBondContact O-N 3.41Å
380L50.9Low52.4Low145 Ų145134.3 Ų134.376%0.75972%0.723SS**G310 helixtrans-102-0.8-168.5-104.3162.3000116.4E377 I378E377-L380 PolarHBondContact O-N 2.83Å; I378-L380 VanDerWaalsContact C-N 3.28Å; I378-L380 PolarHBondContact O-N 2.75Å
381K51.4Low52.4Low184 Ų184129.3 Ų129.380%0.871%0.714SS**G310 helixtrans-90.51.5-175.2-72.9-172.7175.7179.40116.2S383K381-S383 VanDerWaalsContact C-N 3.34Å; K381-S383 PolarHBondContact O-N 3.46Å
382A48.7Very low53Low88 Ų88129 Ų12973%0.72771%0.705SS**G310 helixtrans-78-9-175.200000115.5
383S50.8Low53.6Low90 Ų90126.5 Ų126.563%0.62970%0.695SS**G310 helixtrans-87.9-3.8-167.654.90000116.1K381K381-S383 VanDerWaalsContact C-N 3.34Å; K381-S383 PolarHBondContact O-N 3.46Å
384Q50.6Low54.1Low159 Ų159123.8 Ų123.874%0.74369%0.689SS**G310 helixtrans-91-1.2-169.9-69.2-175.1-25.800115.5S387Q384-S387 PolarHBondContact O-OG 2.71Å
385I53.1Low54.4Low139 Ų139122.7 Ų122.771%0.71369%0.685SS**G310 helixtrans-76.6-29-177.2-65.5175.9000112.4S387I385-S387 PolarHBondContact O-N 3.42Å
386S50.4Low55.3Low102 Ų102122 Ų12271%0.71367%0.667SS**G310 helixtrans-69.4-5.5-171.5-46.20000115.8
387S52.5Low55.8Low86 Ų86119.2 Ų119.260%0.60165%0.654SS**G310 helixtrans-85.3-22.2-177.1570000114.1Q384 I385 Q389Q384-S387 PolarHBondContact O-OG 2.71Å; I385-S387 PolarHBondContact O-N 3.42Å; S387-Q389 VanDerWaalsContact C-N 3.3Å; S387-Q389 PolarHBondContact O-N 2.76Å
388L57Low56.1Low130 Ų130114.8 Ų114.868%0.68165%0.645SS**G310 helixtrans-73.7-17.4-176.4-75.9166000114.1A390 T391L388-A390 VanDerWaalsContact C-N 3.28Å; L388-A390 PolarHBondContact O-N 2.92Å; L388-T391 PolarHBondContact O-OG1 3.04Å
389Q56.9Low56.4Low147 Ų147112.9 Ų112.969%0.68764%0.635SS**G310 helixtrans-73.3-19.5-178-160.6168.85.200113.1S387S387-Q389 VanDerWaalsContact C-N 3.3Å; S387-Q389 PolarHBondContact O-N 2.76Å
390A55.1Low57.4Low75 Ų75112 Ų11262%0.6262%0.62SS**G310 helixtrans-74.5-26.2-179.200000113.8L388L388-A390 VanDerWaalsContact C-N 3.28Å; L388-A390 PolarHBondContact O-N 2.92Å
391T57.6Low58.1Low88 Ų88110.7 Ų110.754%0.5461%0.614SS.*THydrogen-bonded Turntrans-86-11.7-17941.70000114.2L388 T394L388-T391 PolarHBondContact O-OG1 3.04Å; T391-T394 PolarHBondContact O-OG1 2.71Å
392Q65.4Low58.8Low109 Ų109108.5 Ų108.551%0.50961%0.61SS.*THydrogen-bonded Turntrans-76.2-45.5176.1-177.2-179.7-27.600111.5T394 Q395 E396Q392-T394 PolarHBondContact O-N 2.89Å; Q392-Q395 PolarHBondContact O-N 2.74Å; Q392-E396 PolarHBondContact NE2-OE1 2.82Å; Q392-E396 PolarHBondContact O-N 2.98Å
393M59.7Low59.6Low121 Ų121106.7 Ų106.760%0.59659%0.588SS**THydrogen-bonded Turntrans-57.6-24.8-174.9-66.5-64.9-64.200114.5
394T61.5Low60.4Low104 Ų104107.3 Ų107.364%0.63858%0.584SS**THydrogen-bonded Turntrans-84.7-21.5178.948.90000113.6T391 Q392T391-T394 PolarHBondContact O-OG1 2.71Å; Q392-T394 PolarHBondContact O-N 2.89Å
395Q57.6Low61.2Low142 Ų142105.1 Ų105.166%0.66457%0.574SS**Hα-helixtrans-79.9-30.8174.1-62.1-173.5-600111.5Q392 A397 A398Q392-Q395 PolarHBondContact O-N 2.74Å; Q395-A397 PolarHBondContact O-N 2.76Å; Q395-A397 VanDerWaalsContact O-N 3.15Å; Q395-A398 PolarHBondContact O-N 2.98Å
396E66.9Low61.8Low73 Ų73105.3 Ų105.334%0.34157%0.566SS.*Hα-helixtrans-68.3-7.3177.1-65.8177.6-176.700114.3Q392 R400Q392-E396 PolarHBondContact NE2-OE1 2.82Å; Q392-E396 PolarHBondContact O-N 2.98Å; E396-R400 VanDerWaalsContact O-CZ 3.31Å; E396-R400 PolarHBondContact O-NE 2.66Å; E396-R400 PolarHBondContact O-NH2 3.08Å
397A64.6Low62.6Low50 Ų50102.7 Ų102.741%0.41355%0.548SS..Hα-helixtrans-81-53.9174.200000111.6Q395 I399 R400Q395-A397 PolarHBondContact O-N 2.76Å; Q395-A397 VanDerWaalsContact O-N 3.15Å; A397-I399 PolarHBondContact O-N 2.75Å; A397-R400 PolarHBondContact O-N 3.42Å
398A63.8Low63.5Low66 Ų66107.1 Ų107.155%0.54555%0.551SS.*Hα-helixtrans-63.5-24.1-177.800000113.7Q395 R400Q395-A398 PolarHBondContact O-N 2.98Å; A398-R400 VanDerWaalsContact C-N 3.35Å
399I61.7Low63.8Low108 Ų108106.7 Ų106.755%0.55455%0.549SS*.Hα-helixtrans-66.9-34.4175-65.8171.9000111.6A397 D403A397-I399 PolarHBondContact O-N 2.75Å; I399-D403 PolarHBondContact O-N 2.73Å; I399-D403 VanDerWaalsContact O-N 3.13Å
400R69.4Low64.1Low147 Ų147105.1 Ų105.156%0.55554%0.54SS*.Hα-helixtrans-70.6-37.2-174.7-87.2171.8-86.4178-11113.6E396 A397 A398 D403 N404E396-R400 VanDerWaalsContact O-CZ 3.31Å; E396-R400 PolarHBondContact O-NE 2.66Å; E396-R400 PolarHBondContact O-NH2 3.08Å; A397-R400 PolarHBondContact O-N 3.42Å; A398-R400 VanDerWaalsContact C-N 3.35Å; R400-D403 WeakPolarHBondContact O-CB 3.14Å; R400-D403 PolarHBondContact O-N 2.74Å; R400-D403 VanDerWaalsContact O-N 3.12Å; R400-N404 PolarHBondContact O-N 2.71Å; R400-N404 VanDerWaalsContact O-N 3.12Å; R400-N404 PolarHBondContact O-ND2 2.84Å
401D64.6Low64.7Low117 Ų117106 Ų10663%0.62653%0.534SS*.Hα-helixtrans-72.5-31.2179.8-65.6-35000112.2D403D401-D403 VanDerWaalsContact C-N 3.32Å
402L66.1Low65.1Low137 Ų137109 Ų10972%0.71754%0.539SS*.Hα-helixtrans-69.4-28.6168.4-68172.6000112.5R406L402-R406 WeakPolarHBondContact O-CB 3.43Å; L402-R406 PolarHBondContact O-N 3.36Å; L402-R406 VanDerWaalsContact O-N 3.11Å
403D66.3Low65.1Low51 Ų51107.3 Ų107.327%0.27354%0.536SS..Hα-helixtrans-74-30.7177.2-147.9-17.1000112.9I399 R400 D401 R406 S407I399-D403 PolarHBondContact O-N 2.73Å; I399-D403 VanDerWaalsContact O-N 3.13Å; R400-D403 WeakPolarHBondContact O-CB 3.14Å; R400-D403 PolarHBondContact O-N 2.74Å; R400-D403 VanDerWaalsContact O-N 3.12Å; D401-D403 VanDerWaalsContact C-N 3.32Å; D403-R406 WeakPolarHBondContact O-CB 3.28Å; D403-R406 PolarHBondContact O-N 3.43Å; D403-R406 IonicContact OD1-CZ 2.72Å; D403-R406 IonicContact OD1-NE 3.75Å; D403-R406 PolarHBondContact OD1-NE 3.19Å; D403-R406 IonicContact OD1-NH2 3.98Å; D403-R406 PolarHBondContact OD1-NH2 3.41Å; D403-R406 IonicContact OD2-CZ 3.63Å; D403-R406 IonicContact OD2-NH2 3.13Å; D403-R406 PolarHBondContact OD2-NH2 2.68Å; D403-S407 WeakPolarHBondContact O-CB 3.39Å; D403-S407 PolarHBondContact O-N 3.44Å; D403-S407 PolarHBondContact O-OG 3.21Å
404N67.8Low65.5Low102 Ų102105.2 Ų105.255%0.54553%0.527SS..Hα-helixtrans-65.6-43.5175.6-71-38.9000112R400 S407 R408R400-N404 PolarHBondContact O-N 2.71Å; R400-N404 VanDerWaalsContact O-N 3.12Å; R400-N404 PolarHBondContact O-ND2 2.84Å; N404-S407 WeakPolarHBondContact O-CB 3.4Å; N404-S407 PolarHBondContact O-N 3.1Å; N404-R408 PolarHBondContact O-N 2.9Å; N404-R408 VanDerWaalsContact O-N 3.17Å
405E67.9Low66Low113 Ų113107.5 Ų107.553%0.52852%0.524SS..Hα-helixtrans-74.2-31.9176.4-141.961.7-146.600111.8S407 R408 L409E405-S407 VanDerWaalsContact C-N 3.3Å; E405-S407 PolarHBondContact O-N 2.9Å; E405-R408 PolarHBondContact O-N 2.82Å; E405-L409 PolarHBondContact O-N 2.92Å
406R64.8Low66.6Low144 Ų144107.3 Ų107.354%0.54353%0.525SS..Hα-helixtrans-57.6-42.6167.3-178.1175.476.1160.4-1.1111.6L402 D403 L409 K410L402-R406 WeakPolarHBondContact O-CB 3.43Å; L402-R406 PolarHBondContact O-N 3.36Å; L402-R406 VanDerWaalsContact O-N 3.11Å; D403-R406 WeakPolarHBondContact O-CB 3.28Å; D403-R406 PolarHBondContact O-N 3.43Å; D403-R406 IonicContact OD1-CZ 2.72Å; D403-R406 IonicContact OD1-NE 3.75Å; D403-R406 PolarHBondContact OD1-NE 3.19Å; D403-R406 IonicContact OD1-NH2 3.98Å; D403-R406 PolarHBondContact OD1-NH2 3.41Å; D403-R406 IonicContact OD2-CZ 3.63Å; D403-R406 IonicContact OD2-NH2 3.13Å; D403-R406 PolarHBondContact OD2-NH2 2.68Å; R406-L409 PolarHBondContact O-N 3.35Å; R406-K410 WeakPolarHBondContact O-CB 3.35Å; R406-K410 PolarHBondContact O-N 2.99Å
407S66.9Low66.5Low46 Ų46107.3 Ų107.332%0.32253%0.525SS..Hα-helixtrans-64.3-39.9178.9-61.10000111.8D403 N404 E405 L409 K410 D411D403-S407 WeakPolarHBondContact O-CB 3.39Å; D403-S407 PolarHBondContact O-N 3.44Å; D403-S407 PolarHBondContact O-OG 3.21Å; N404-S407 WeakPolarHBondContact O-CB 3.4Å; N404-S407 PolarHBondContact O-N 3.1Å; E405-S407 VanDerWaalsContact C-N 3.3Å; E405-S407 PolarHBondContact O-N 2.9Å; S407-L409 PolarHBondContact O-N 3.08Å; S407-K410 WeakPolarHBondContact O-CA 3.49Å; S407-K410 WeakPolarHBondContact O-CB 3.4Å; S407-K410 PolarHBondContact O-N 3.27Å; S407-K410 VanDerWaalsContact O-N 3.14Å; S407-D411 PolarHBondContact O-N 3.38Å
408R70.9Confident66.8Low180 Ų180110.3 Ų110.368%0.67953%0.531SS*.Hα-helixtrans-70.2-30.4-179.3-144.8176.9-162.3169.75.7114.2N404 E405N404-R408 PolarHBondContact O-N 2.9Å; N404-R408 VanDerWaalsContact O-N 3.17Å; E405-R408 PolarHBondContact O-N 2.82Å
409L63.7Low67.1Low120 Ų120113.8 Ų113.863%0.62854%0.536SS*.Hα-helixtrans-76.8-35.8168.7-71.6171.4000111.5E405 R406 S407 D411 K412 V413E405-L409 PolarHBondContact O-N 2.92Å; R406-L409 PolarHBondContact O-N 3.35Å; S407-L409 PolarHBondContact O-N 3.08Å; L409-D411 PolarHBondContact O-N 2.92Å; L409-K412 PolarHBondContact O-N 3.36Å; L409-K412 VanDerWaalsContact O-N 3.15Å; L409-V413 WeakPolarHBondContact O-CG2 3.45Å; L409-V413 PolarHBondContact O-N 3.39Å
410K62.9Low67.4Low114 Ų114114.8 Ų114.850%0.49653%0.532SS..Hα-helixtrans-52.8-47.9170-108.1-177.9174.9-173.10112R406 S407 K412 V413 L414R406-K410 WeakPolarHBondContact O-CB 3.35Å; R406-K410 PolarHBondContact O-N 2.99Å; S407-K410 WeakPolarHBondContact O-CA 3.49Å; S407-K410 WeakPolarHBondContact O-CB 3.4Å; S407-K410 PolarHBondContact O-N 3.27Å; S407-K410 VanDerWaalsContact O-N 3.14Å; K410-K412 PolarHBondContact O-N 3.2Å; K410-V413 CarbonylContact O-C 3.4Å; K410-V413 PolarHBondContact O-N 2.73Å; K410-V413 VanDerWaalsContact O-N 3.12Å; K410-L414 VanDerWaalsContact O-CB 3.26Å; K410-L414 WeakPolarHBondContact O-CB 3.47Å; K410-L414 WeakPolarHBondContact O-CG 3.39Å; K410-L414 PolarHBondContact O-N 3.32Å
411D69.1Low67.1Low93 Ų93112.9 Ų112.950%0.49753%0.53SS..Hα-helixtrans-66.4-9-178.8-65.9-14.4000115.3S407 L409 R415S407-D411 PolarHBondContact O-N 3.38Å; L409-D411 PolarHBondContact O-N 2.92Å; D411-R415 PolarHBondContact O-NE 2.86Å; D411-R415 VanDerWaalsContact O-NE 3.09Å; D411-R415 PolarHBondContact O-NH2 2.89Å; D411-R415 VanDerWaalsContact O-NH2 3.07Å
412K65.6Low67.4Low151 Ų151110 Ų11066%0.65752%0.523SS*.Hα-helixtrans-104.7-30.8174.5-160.9176.5-176.3-177.10112.1L409 K410 M416L409-K412 PolarHBondContact O-N 3.36Å; L409-K412 VanDerWaalsContact O-N 3.15Å; K410-K412 PolarHBondContact O-N 3.2Å; K412-M416 WeakPolarHBondContact O-CG 3.2Å
413V65.1Low67.5Low74 Ų74109.3 Ų109.345%0.44852%0.519SS..Hα-helixtrans-67.4-47.1165.8172.30000109.7L409 K410 R415 M416 E417L409-V413 WeakPolarHBondContact O-CG2 3.45Å; L409-V413 PolarHBondContact O-N 3.39Å; K410-V413 CarbonylContact O-C 3.4Å; K410-V413 PolarHBondContact O-N 2.73Å; K410-V413 VanDerWaalsContact O-N 3.12Å; V413-R415 VanDerWaalsContact C-N 3.32Å; V413-R415 PolarHBondContact O-N 2.78Å; V413-M416 CarbonylContact O-C 3.44Å; V413-M416 WeakPolarHBondContact O-CA 3.35Å; V413-M416 WeakPolarHBondContact O-CB 3.46Å; V413-M416 PolarHBondContact O-N 3.17Å; V413-E417 HydrophobicContact CG1-CG 3.83Å; V413-E417 WeakPolarHBondContact CG1-OE2 3.16Å; V413-E417 WeakPolarHBondContact O-CG 3.43Å; V413-E417 PolarHBondContact O-N 3.44Å
414L69.4Low67.5Low77 Ų77110.2 Ų110.240%0.40352%0.521SS..Hα-helixtrans-51.8-42.4179.5-86.2167.1000113.1K410 E417 E418K410-L414 VanDerWaalsContact O-CB 3.26Å; K410-L414 WeakPolarHBondContact O-CB 3.47Å; K410-L414 WeakPolarHBondContact O-CG 3.39Å; K410-L414 PolarHBondContact O-N 3.32Å; L414-E417 CarbonylContact O-C 3.55Å; L414-E417 WeakPolarHBondContact O-CA 3.1Å; L414-E417 PolarHBondContact O-N 3.39Å; L414-E418 WeakPolarHBondContact O-CB 3.39Å; L414-E418 VanDerWaalsContact O-CG 3.23Å; L414-E418 WeakPolarHBondContact O-CG 3.28Å; L414-E418 PolarHBondContact O-N 3.33Å
415R71.6Confident67.3Low153 Ų153108.6 Ų108.658%0.57752%0.518SS*.Hα-helixtrans-71.7-33.4176.7-83.8173.7-72.6169.3-6.8113.9D411 V413 E417 E418 E419D411-R415 PolarHBondContact O-NE 2.86Å; D411-R415 VanDerWaalsContact O-NE 3.09Å; D411-R415 PolarHBondContact O-NH2 2.89Å; D411-R415 VanDerWaalsContact O-NH2 3.07Å; V413-R415 VanDerWaalsContact C-N 3.32Å; V413-R415 PolarHBondContact O-N 2.78Å; R415-E417 VanDerWaalsContact C-N 3.28Å; R415-E418 VanDerWaalsContact CG-OE2 3.24Å; R415-E418 WeakPolarHBondContact CG-OE2 3.06Å; R415-E418 PolarHBondContact O-N 2.84Å; R415-E419 PolarHBondContact O-N 3.46Å; R415-E419 VanDerWaalsContact O-N 3.08Å
416M69Low67.4Low137 Ų137109.3 Ų109.368%0.67552%0.521SS*.Hα-helixtrans-70.6-29.9170.2-62.2-90.2-68.600111K412 V413 R420K412-M416 WeakPolarHBondContact O-CG 3.2Å; V413-M416 CarbonylContact O-C 3.44Å; V413-M416 WeakPolarHBondContact O-CA 3.35Å; V413-M416 WeakPolarHBondContact O-CB 3.46Å; V413-M416 PolarHBondContact O-N 3.17Å; M416-R420 WeakPolarHBondContact O-CB 3.3Å; M416-R420 PolarHBondContact O-N 2.76Å
417E64.8Low67.4Low73 Ų73105 Ų10534%0.34151%0.513SS..Hα-helixtrans-78.2-31.1173.3-68.4-164.6124.800112.2V413 L414 R415 R420 E421V413-E417 HydrophobicContact CG1-CG 3.83Å; V413-E417 WeakPolarHBondContact CG1-OE2 3.16Å; V413-E417 WeakPolarHBondContact O-CG 3.43Å; V413-E417 PolarHBondContact O-N 3.44Å; L414-E417 CarbonylContact O-C 3.55Å; L414-E417 WeakPolarHBondContact O-CA 3.1Å; L414-E417 PolarHBondContact O-N 3.39Å; R415-E417 VanDerWaalsContact C-N 3.28Å; E417-R420 CarbonylContact O-C 3.6Å; E417-R420 PolarHBondContact O-N 3.45Å; E417-R420 IonicContact OE1-NH1 3.29Å; E417-R420 PolarHBondContact OE1-NH1 2.71Å; E417-E421 WeakPolarHBondContact O-CA 3.34Å; E417-E421 WeakPolarHBondContact O-CB 3.49Å; E417-E421 WeakPolarHBondContact O-CG 3.29Å; E417-E421 PolarHBondContact O-N 2.85Å
418E72.2Confident67.1Low114 Ų114106.7 Ų106.753%0.53352%0.515SS..Hα-helixtrans-70-43.1173.5-77.9165.4165.800111L414 R415 E421 A422L414-E418 WeakPolarHBondContact O-CB 3.39Å; L414-E418 VanDerWaalsContact O-CG 3.23Å; L414-E418 WeakPolarHBondContact O-CG 3.28Å; L414-E418 PolarHBondContact O-N 3.33Å; R415-E418 VanDerWaalsContact CG-OE2 3.24Å; R415-E418 WeakPolarHBondContact CG-OE2 3.06Å; R415-E418 PolarHBondContact O-N 2.84Å; E418-E421 CarbonylContact O-C 3.58Å; E418-E421 PolarHBondContact O-N 2.8Å; E418-A422 WeakPolarHBondContact O-CB 3.4Å; E418-A422 PolarHBondContact O-N 3.39Å
419E68.6Low67.1Low139 Ų139100.5 Ų100.565%0.6550%0.502SS*.Hα-helixtrans-67.9-40.2172.7-71.2-178.2174.100111.4R415 E421 A422 L423R415-E419 PolarHBondContact O-N 3.46Å; R415-E419 VanDerWaalsContact O-N 3.08Å; E419-E421 VanDerWaalsContact C-N 3.34Å; E419-A422 PolarHBondContact O-N 2.79Å; E419-L423 PolarHBondContact O-N 2.73Å; E419-L423 VanDerWaalsContact O-N 3.12Å
420R69.4Low67.3Low128 Ų12899.5 Ų99.548%0.48350%0.497SS..Hα-helixtrans-65.2-34.9171.6179.5-177.5134.5-127.3-14111.8M416 E417 Q424M416-R420 WeakPolarHBondContact O-CB 3.3Å; M416-R420 PolarHBondContact O-N 2.76Å; E417-R420 CarbonylContact O-C 3.6Å; E417-R420 PolarHBondContact O-N 3.45Å; E417-R420 IonicContact OE1-NH1 3.29Å; E417-R420 PolarHBondContact OE1-NH1 2.71Å; R420-Q424 WeakPolarHBondContact O-CA 3.03Å; R420-Q424 WeakPolarHBondContact O-CB 3.19Å; R420-Q424 PolarHBondContact O-N 3.43Å
421E62.3Low67.6Low107 Ų10799.4 Ų99.450%0.550%0.498SS..Hα-helixtrans-81.4-22.6177.4-79.4-164.5150.600112.1E417 E418 E419 S425E417-E421 WeakPolarHBondContact O-CA 3.34Å; E417-E421 WeakPolarHBondContact O-CB 3.49Å; E417-E421 WeakPolarHBondContact O-CG 3.29Å; E417-E421 PolarHBondContact O-N 2.85Å; E418-E421 CarbonylContact O-C 3.58Å; E418-E421 PolarHBondContact O-N 2.8Å; E419-E421 VanDerWaalsContact C-N 3.34Å; E421-S425 WeakPolarHBondContact O-CA 2.99Å; E421-S425 WeakPolarHBondContact O-CB 3.49Å; E421-S425 PolarHBondContact O-N 2.76Å; E421-S425 PolarHBondContact O-OG 2.77Å
422A72.1Confident67.6Low58 Ų5899.8 Ų99.848%0.47950%0.497SS..Hα-helixtrans-66-48.9165.900000110.1E418 E419 S425 Q426E418-A422 WeakPolarHBondContact O-CB 3.4Å; E418-A422 PolarHBondContact O-N 3.39Å; E419-A422 PolarHBondContact O-N 2.79Å; A422-S425 PolarHBondContact O-N 3.37Å; A422-S425 PolarHBondContact O-OG 3.35Å; A422-S425 VanDerWaalsContact O-OG 3.11Å; A422-Q426 WeakPolarHBondContact O-CB 3.45Å; A422-Q426 PolarHBondContact O-N 2.84Å
423L67.4Low67.9Low122 Ų122101.2 Ų101.264%0.63950%0.499SS*.Hα-helixtrans-70.1-39.3176.3-68.5170.5000112.4E419 Q426 S427E419-L423 PolarHBondContact O-N 2.73Å; E419-L423 VanDerWaalsContact O-N 3.12Å; L423-Q426 PolarHBondContact O-N 3.35Å; L423-S427 WeakPolarHBondContact O-CB 3.45Å; L423-S427 PolarHBondContact O-N 3.14Å
424Q65.2Low67.8Low70 Ų70103.1 Ų103.133%0.32750%0.502SS..Hα-helixtrans-77.6-19.4177.4-167.5171.511.400111.9R420 K428R420-Q424 WeakPolarHBondContact O-CA 3.03Å; R420-Q424 WeakPolarHBondContact O-CB 3.19Å; R420-Q424 PolarHBondContact O-N 3.43Å; Q424-K428 HydrophobicContact CG-CD 4.27Å; Q424-K428 HydrophobicContact CG-CG 4.36Å; Q424-K428 WeakPolarHBondContact O-CA 3.33Å; Q424-K428 WeakPolarHBondContact O-CB 3.44Å; Q424-K428 WeakPolarHBondContact O-CD 3.26Å; Q424-K428 WeakPolarHBondContact O-CG 3.21Å; Q424-K428 PolarHBondContact O-N 3.1Å
425S65.4Low67.8Low67 Ų67105.1 Ų105.147%0.46951%0.508SS..Hα-helixtrans-83.9-29.8167.263.90000112.2E421 A422 A429E421-S425 WeakPolarHBondContact O-CA 2.99Å; E421-S425 WeakPolarHBondContact O-CB 3.49Å; E421-S425 PolarHBondContact O-N 2.76Å; E421-S425 PolarHBondContact O-OG 2.77Å; A422-S425 PolarHBondContact O-N 3.37Å; A422-S425 PolarHBondContact O-OG 3.35Å; A422-S425 VanDerWaalsContact O-OG 3.11Å; S425-A429 WeakPolarHBondContact O-CA 3.19Å; S425-A429 WeakPolarHBondContact O-CB 3.43Å; S425-A429 PolarHBondContact O-N 2.78Å
426Q68.3Low67.7Low129 Ų129103.4 Ų103.460%0.60351%0.506SS*.Hα-helixtrans-67.1-42.6167.4-166.1173.331.700111A422 L423 A429 L430A422-Q426 WeakPolarHBondContact O-CB 3.45Å; A422-Q426 PolarHBondContact O-N 2.84Å; L423-Q426 PolarHBondContact O-N 3.35Å; Q426-A429 PolarHBondContact O-N 3.29Å; Q426-L430 PolarHBondContact O-N 2.75Å
427S66.3Low67.6Low54 Ų54102.7 Ų102.738%0.37850%0.501SS..Hα-helixtrans-63-52.3170.3-1610000110.9L423 A429 L430 E431L423-S427 WeakPolarHBondContact O-CB 3.45Å; L423-S427 PolarHBondContact O-N 3.14Å; S427-A429 VanDerWaalsContact C-N 3.27Å; S427-A429 PolarHBondContact O-N 3.4Å; S427-L430 PolarHBondContact O-N 2.67Å; S427-E431 WeakPolarHBondContact O-CB 3.44Å; S427-E431 WeakPolarHBondContact O-CG 3.21Å; S427-E431 PolarHBondContact O-N 3.5Å
428K59.1Low67.9Low80 Ų80103.5 Ų103.535%0.34851%0.507SS..Hα-helixtrans-62.2-27.1176.4-76.8166.2-179.8171.50112.9Q424 E431 E432Q424-K428 HydrophobicContact CG-CD 4.27Å; Q424-K428 HydrophobicContact CG-CG 4.36Å; Q424-K428 WeakPolarHBondContact O-CA 3.33Å; Q424-K428 WeakPolarHBondContact O-CB 3.44Å; Q424-K428 WeakPolarHBondContact O-CD 3.26Å; Q424-K428 WeakPolarHBondContact O-CG 3.21Å; Q424-K428 PolarHBondContact O-N 3.1Å; K428-E431 CarbonylContact O-C 3.57Å; K428-E432 VanDerWaalsContact O-CA 3.31Å; K428-E432 WeakPolarHBondContact O-CA 3.14Å; K428-E432 WeakPolarHBondContact O-CB 3.2Å; K428-E432 WeakPolarHBondContact O-CG 3.29Å; K428-E432 PolarHBondContact O-N 2.68Å
429A70.8Confident67.5Low51 Ų51102.6 Ų102.642%0.42150%0.503SS..Hα-helixtrans-78.7-30.4177.300000112.3S425 Q426 S427 R433S425-A429 WeakPolarHBondContact O-CA 3.19Å; S425-A429 WeakPolarHBondContact O-CB 3.43Å; S425-A429 PolarHBondContact O-N 2.78Å; Q426-A429 PolarHBondContact O-N 3.29Å; S427-A429 VanDerWaalsContact C-N 3.27Å; S427-A429 PolarHBondContact O-N 3.4Å; A429-R433 WeakPolarHBondContact O-CB 3.17Å; A429-R433 PolarHBondContact O-N 3.28Å
430L68.8Low67.8Low98 Ų9898.9 Ų98.951%0.51349%0.492SS..Hα-helixtrans-75.6-44.4169.3-72.1170.1000110.9Q426 S427 E432 R433 H434Q426-L430 PolarHBondContact O-N 2.75Å; S427-L430 PolarHBondContact O-N 2.67Å; L430-E432 VanDerWaalsContact C-N 3.32Å; L430-E432 PolarHBondContact O-N 2.74Å; L430-R433 PolarHBondContact O-N 2.84Å; L430-H434 WeakPolarHBondContact O-CB 3.21Å; L430-H434 VanDerWaalsContact O-CG 3.27Å; L430-H434 PolarHBondContact O-N 2.73Å
431E68.7Low67.8Low112 Ų11298 Ų9852%0.52350%0.496SS..Hα-helixtrans-62.8-35.2170.8-71.4175.3163.700111.6S427 K428 H434 K435S427-E431 WeakPolarHBondContact O-CB 3.44Å; S427-E431 WeakPolarHBondContact O-CG 3.21Å; S427-E431 PolarHBondContact O-N 3.5Å; K428-E431 CarbonylContact O-C 3.57Å; E431-H434 CarbonylContact O-C 3.59Å; E431-K435 VanDerWaalsContact O-CA 3.3Å; E431-K435 WeakPolarHBondContact O-CA 3.18Å; E431-K435 WeakPolarHBondContact O-CB 3.27Å; E431-K435 PolarHBondContact O-N 2.69Å
432E68.8Low68.2Low102 Ų10298.1 Ų98.148%0.47750%0.497SS..Hα-helixtrans-77.9-28.5175.8-80.3171.8-166.800111.6K428 L430 Q436K428-E432 VanDerWaalsContact O-CA 3.31Å; K428-E432 WeakPolarHBondContact O-CA 3.14Å; K428-E432 WeakPolarHBondContact O-CB 3.2Å; K428-E432 WeakPolarHBondContact O-CG 3.29Å; K428-E432 PolarHBondContact O-N 2.68Å; L430-E432 VanDerWaalsContact C-N 3.32Å; L430-E432 PolarHBondContact O-N 2.74Å; E432-Q436 WeakPolarHBondContact O-CA 3.48Å; E432-Q436 WeakPolarHBondContact O-CB 3.49Å; E432-Q436 WeakPolarHBondContact O-CG 3.49Å; E432-Q436 PolarHBondContact O-N 3.14Å
433R72.1Confident68.2Low181 Ų181100.9 Ų100.968%0.68350%0.498SS*.Hα-helixtrans-66.7-50.6165.3-91.1-177164.6162.5-2.6111A429 L430 K435 Q436 Q437A429-R433 WeakPolarHBondContact O-CB 3.17Å; A429-R433 PolarHBondContact O-N 3.28Å; L430-R433 PolarHBondContact O-N 2.84Å; R433-K435 VanDerWaalsContact C-N 3.26Å; R433-K435 PolarHBondContact O-N 3.12Å; R433-Q436 PolarHBondContact O-N 3.05Å; R433-Q437 WeakPolarHBondContact O-CB 3.16Å; R433-Q437 PolarHBondContact O-N 3.44Å
434H63.8Low68.6Low113 Ų11398.6 Ų98.652%0.52349%0.489SS..Hα-helixtrans-63.9-32.6177.3-66.1172.2000111.8L430 E431 I438L430-H434 WeakPolarHBondContact O-CB 3.21Å; L430-H434 VanDerWaalsContact O-CG 3.27Å; L430-H434 PolarHBondContact O-N 2.73Å; E431-H434 CarbonylContact O-C 3.59Å; H434-I438 WeakPolarHBondContact O-CA 3.46Å; H434-I438 WeakPolarHBondContact O-CB 3.44Å; H434-I438 WeakPolarHBondContact O-CD1 3.43Å; H434-I438 WeakPolarHBondContact O-CG1 3.43Å; H434-I438 PolarHBondContact O-N 2.98Å
435K68.9Low69Low120 Ų120101 Ų10152%0.52250%0.504SS..Hα-helixtrans-86.3-22.4177.7-174.7179.3178.7-176.90112.8E431 R433 Q439E431-K435 VanDerWaalsContact O-CA 3.3Å; E431-K435 WeakPolarHBondContact O-CA 3.18Å; E431-K435 WeakPolarHBondContact O-CB 3.27Å; E431-K435 PolarHBondContact O-N 2.69Å; R433-K435 VanDerWaalsContact C-N 3.26Å; R433-K435 PolarHBondContact O-N 3.12Å; K435-Q439 HydrophobicContact CG-CG 4.05Å; K435-Q439 VanDerWaalsContact O-CA 3.31Å; K435-Q439 WeakPolarHBondContact O-CA 3.49Å; K435-Q439 WeakPolarHBondContact O-CB 3.45Å; K435-Q439 WeakPolarHBondContact O-CG 3.29Å; K435-Q439 PolarHBondContact O-N 2.98Å; K435-Q439 PolarHBondContact O-OE1 3.35Å
436Q68.8Low69.2Low117 Ų117103.5 Ų103.555%0.54751%0.508SS..Hα-helixtrans-78.2-27.8165.4-74.9165.11800110.9E432 R433 S440E432-Q436 WeakPolarHBondContact O-CA 3.48Å; E432-Q436 WeakPolarHBondContact O-CB 3.49Å; E432-Q436 WeakPolarHBondContact O-CG 3.49Å; E432-Q436 PolarHBondContact O-N 3.14Å; R433-Q436 PolarHBondContact O-N 3.05Å; Q436-S440 WeakPolarHBondContact O-CB 3.23Å; Q436-S440 PolarHBondContact O-N 2.82Å; Q436-S440 PolarHBondContact O-OG 2.91Å; Q436-S440 VanDerWaalsContact O-OG 3.1Å
437Q68.5Low69.5Low122 Ų122101.9 Ų101.957%0.5750%0.5SS*.Hα-helixtrans-81.2-37.3174.1-167.7167.61.600111.8R433 S440 L441R433-Q437 WeakPolarHBondContact O-CB 3.16Å; R433-Q437 PolarHBondContact O-N 3.44Å; Q437-S440 WeakPolarHBondContact CA-OG 3.02Å; Q437-S440 PolarHBondContact O-OG 2.91Å; Q437-S440 VanDerWaalsContact O-OG 3.07Å; Q437-L441 WeakPolarHBondContact O-CB 3.09Å; Q437-L441 WeakPolarHBondContact O-CD1 3.11Å; Q437-L441 VanDerWaalsContact O-CG 3.24Å; Q437-L441 WeakPolarHBondContact O-CG 3.43Å; Q437-L441 PolarHBondContact O-N 2.87Å
438I70.9Confident69.8Low89 Ų89104.7 Ų104.746%0.45651%0.508SS..Hα-helixtrans-70.9-44.7167.5-72.3164.7000109.3H434 S440 L441 E442H434-I438 WeakPolarHBondContact O-CA 3.46Å; H434-I438 WeakPolarHBondContact O-CB 3.44Å; H434-I438 WeakPolarHBondContact O-CD1 3.43Å; H434-I438 WeakPolarHBondContact O-CG1 3.43Å; H434-I438 PolarHBondContact O-N 2.98Å; I438-S440 VanDerWaalsContact C-N 3.32Å; I438-S440 PolarHBondContact O-N 3.34Å; I438-L441 CarbonylContact O-C 3.49Å; I438-L441 PolarHBondContact O-N 2.92Å; I438-E442 VanDerWaalsContact CG2-CD 3.42Å; I438-E442 HydrophobicContact CG2-CG 3.84Å; I438-E442 WeakPolarHBondContact O-CA 3.18Å; I438-E442 WeakPolarHBondContact O-CB 3.48Å; I438-E442 VanDerWaalsContact O-CG 3.23Å; I438-E442 WeakPolarHBondContact O-CG 3.41Å; I438-E442 PolarHBondContact O-N 3.23Å
439Q64.3Low70.4Confident95 Ų95106.5 Ų106.544%0.44452%0.515SS..Hα-helixtrans-69.2-24.3174.9-73.4173.2-28.300113.1K435 K443K435-Q439 HydrophobicContact CG-CG 4.05Å; K435-Q439 VanDerWaalsContact O-CA 3.31Å; K435-Q439 WeakPolarHBondContact O-CA 3.49Å; K435-Q439 WeakPolarHBondContact O-CB 3.45Å; K435-Q439 WeakPolarHBondContact O-CG 3.29Å; K435-Q439 PolarHBondContact O-N 2.98Å; K435-Q439 PolarHBondContact O-OE1 3.35Å; Q439-K443 WeakPolarHBondContact O-CA 3.48Å; Q439-K443 WeakPolarHBondContact O-CB 3.49Å; Q439-K443 PolarHBondContact O-N 3.41Å
440S74.3Confident70.2Confident61 Ų61105.4 Ų105.443%0.42750%0.504SS..Hα-helixtrans-74.8-40.2170.867.30000111Q436 Q437 I438 K443 T444Q436-S440 WeakPolarHBondContact O-CB 3.23Å; Q436-S440 PolarHBondContact O-N 2.82Å; Q436-S440 PolarHBondContact O-OG 2.91Å; Q436-S440 VanDerWaalsContact O-OG 3.1Å; Q437-S440 WeakPolarHBondContact CA-OG 3.02Å; Q437-S440 PolarHBondContact O-OG 2.91Å; Q437-S440 VanDerWaalsContact O-OG 3.07Å; I438-S440 VanDerWaalsContact C-N 3.32Å; I438-S440 PolarHBondContact O-N 3.34Å; S440-K443 PolarHBondContact O-N 3.4Å; S440-T444 WeakPolarHBondContact O-CG2 3.31Å; S440-T444 PolarHBondContact O-N 2.79Å; S440-T444 PolarHBondContact O-OG1 3.14Å; S440-T444 VanDerWaalsContact O-OG1 3.12Å
441L69.9Low70.4Confident110 Ų110102.8 Ų102.858%0.57649%0.493SS*.Hα-helixtrans-70.3-37.3173.8-71.2170.3000113.2Q437 I438 T444 L445Q437-L441 WeakPolarHBondContact O-CB 3.09Å; Q437-L441 WeakPolarHBondContact O-CD1 3.11Å; Q437-L441 VanDerWaalsContact O-CG 3.24Å; Q437-L441 WeakPolarHBondContact O-CG 3.43Å; Q437-L441 PolarHBondContact O-N 2.87Å; I438-L441 CarbonylContact O-C 3.49Å; I438-L441 PolarHBondContact O-N 2.92Å; L441-T444 WeakPolarHBondContact CA-OG1 3.48Å; L441-T444 PolarHBondContact O-OG1 3.33Å; L441-T444 VanDerWaalsContact O-OG1 3.11Å; L441-L445 WeakPolarHBondContact O-CA 3.39Å; L441-L445 WeakPolarHBondContact O-CB 3.05Å; L441-L445 PolarHBondContact O-N 2.84Å
442E69.8Low70.5Confident110 Ų110102.6 Ų102.651%0.51449%0.492SS..Hα-helixtrans-71.2-35.7171.7-74.1175.6155.500110.1I438 L445 H446I438-E442 VanDerWaalsContact CG2-CD 3.42Å; I438-E442 HydrophobicContact CG2-CG 3.84Å; I438-E442 WeakPolarHBondContact O-CA 3.18Å; I438-E442 WeakPolarHBondContact O-CB 3.48Å; I438-E442 VanDerWaalsContact O-CG 3.23Å; I438-E442 WeakPolarHBondContact O-CG 3.41Å; I438-E442 PolarHBondContact O-N 3.23Å; E442-L445 CarbonylContact O-C 3.5Å; E442-L445 PolarHBondContact O-N 3.38Å; E442-H446 WeakPolarHBondContact O-CA 3.27Å; E442-H446 WeakPolarHBondContact O-CB 3.34Å; E442-H446 PolarHBondContact O-N 3.38Å
443K73.1Confident70.7Confident116 Ų116100.6 Ų100.650%0.50448%0.483SS..Hα-helixtrans-71.7-40174.8-178.1175176.6-63.30111Q439 S440 H446 E447Q439-K443 WeakPolarHBondContact O-CA 3.48Å; Q439-K443 WeakPolarHBondContact O-CB 3.49Å; Q439-K443 PolarHBondContact O-N 3.41Å; S440-K443 PolarHBondContact O-N 3.4Å; K443-H446 CarbonylContact O-C 3.46Å; K443-H446 PolarHBondContact O-N 2.72Å; K443-E447 WeakPolarHBondContact CE-OE1 3.04Å; K443-E447 HydrophobicContact CG-CG 4.32Å; K443-E447 IonicContact NZ-OE1 3.46Å; K443-E447 PolarHBondContact NZ-OE1 2.82Å; K443-E447 IonicContact NZ-OE2 2.78Å; K443-E447 PolarHBondContact NZ-OE2 2.82Å; K443-E447 WeakPolarHBondContact O-CA 3.09Å; K443-E447 WeakPolarHBondContact O-CB 3.26Å; K443-E447 WeakPolarHBondContact O-CG 3.47Å; K443-E447 PolarHBondContact O-N 3.36Å
444T73.9Confident70.8Confident74 Ų7498.3 Ų98.345%0.45448%0.478SS..Hα-helixtrans-68.3-39.5170.454.70000111.4S440 L441 H446 E447 E448S440-T444 WeakPolarHBondContact O-CG2 3.31Å; S440-T444 PolarHBondContact O-N 2.79Å; S440-T444 PolarHBondContact O-OG1 3.14Å; S440-T444 VanDerWaalsContact O-OG1 3.12Å; L441-T444 WeakPolarHBondContact CA-OG1 3.48Å; L441-T444 PolarHBondContact O-OG1 3.33Å; L441-T444 VanDerWaalsContact O-OG1 3.11Å; T444-H446 VanDerWaalsContact C-N 3.3Å; T444-H446 PolarHBondContact O-N 2.97Å; T444-E447 PolarHBondContact O-N 2.95Å; T444-E448 WeakPolarHBondContact O-CB 3.26Å; T444-E448 WeakPolarHBondContact O-CG 3.13Å; T444-E448 PolarHBondContact O-N 2.73Å
445L74.1Confident71.4Confident121 Ų12197.2 Ų97.263%0.63448%0.476SS*.Hα-helixtrans-68.7-26.7175-176.364.3000112.6L441 E442 K449L441-L445 WeakPolarHBondContact O-CA 3.39Å; L441-L445 WeakPolarHBondContact O-CB 3.05Å; L441-L445 PolarHBondContact O-N 2.84Å; E442-L445 CarbonylContact O-C 3.5Å; E442-L445 PolarHBondContact O-N 3.38Å; L445-K449 WeakPolarHBondContact O-CA 3.15Å; L445-K449 WeakPolarHBondContact O-CB 3.26Å; L445-K449 PolarHBondContact O-N 3.11Å
446H71.2Confident71.4Confident118 Ų11896.8 Ų96.855%0.54648%0.477SS..Hα-helixtrans-90.3-23.1175.4-166.487.4000111.8E442 K443 T444 T450E442-H446 WeakPolarHBondContact O-CA 3.27Å; E442-H446 WeakPolarHBondContact O-CB 3.34Å; E442-H446 PolarHBondContact O-N 3.38Å; K443-H446 CarbonylContact O-C 3.46Å; K443-H446 PolarHBondContact O-N 2.72Å; T444-H446 VanDerWaalsContact C-N 3.3Å; T444-H446 PolarHBondContact O-N 2.97Å; H446-T450 WeakPolarHBondContact O-CA 3.4Å; H446-T450 WeakPolarHBondContact O-CB 3.41Å; H446-T450 WeakPolarHBondContact O-CG2 3.47Å; H446-T450 PolarHBondContact O-N 2.78Å; H446-T450 PolarHBondContact O-OG1 3.07Å
447E74.6Confident71.7Confident96 Ų9697.7 Ų97.745%0.44948%0.476SS..Hα-helixtrans-75.7-40.9167-76.2170.6157.200110K443 T444 S451K443-E447 WeakPolarHBondContact CE-OE1 3.04Å; K443-E447 HydrophobicContact CG-CG 4.32Å; K443-E447 IonicContact NZ-OE1 3.46Å; K443-E447 PolarHBondContact NZ-OE1 2.82Å; K443-E447 IonicContact NZ-OE2 2.78Å; K443-E447 PolarHBondContact NZ-OE2 2.82Å; K443-E447 WeakPolarHBondContact O-CA 3.09Å; K443-E447 WeakPolarHBondContact O-CB 3.26Å; K443-E447 WeakPolarHBondContact O-CG 3.47Å; K443-E447 PolarHBondContact O-N 3.36Å; T444-E447 PolarHBondContact O-N 2.95Å; E447-S451 VanDerWaalsContact O-CB 3.27Å; E447-S451 WeakPolarHBondContact O-CB 3.11Å; E447-S451 PolarHBondContact O-N 2.85Å; E447-S451 PolarHBondContact O-OG 2.77Å
448E71.9Confident72Confident113 Ų11395.3 Ų95.353%0.52847%0.472SS..Hα-helixtrans-64.9-45.4167.3-74.3-94143.200111.4T444 S451 H452T444-E448 WeakPolarHBondContact O-CB 3.26Å; T444-E448 WeakPolarHBondContact O-CG 3.13Å; T444-E448 PolarHBondContact O-N 2.73Å; E448-S451 WeakPolarHBondContact CA-OG 3.27Å; E448-S451 PolarHBondContact O-N 3.25Å; E448-S451 PolarHBondContact O-OG 3.46Å; E448-H452 VanDerWaalsContact O-CB 3.32Å; E448-H452 WeakPolarHBondContact O-CB 3.09Å; E448-H452 PolarHBondContact O-N 2.79Å; E448-H452 PolarHBondContact O-ND1 2.71Å; E448-H452 IonicContact OE2-CE1 2.73Å
449K71.7Confident72.2Confident117 Ų11794.3 Ų94.351%0.50947%0.47SS..Hα-helixtrans-71.2-33177.6178.6172.9169.6174.50111.6L445 E453L445-K449 WeakPolarHBondContact O-CA 3.15Å; L445-K449 WeakPolarHBondContact O-CB 3.26Å; L445-K449 PolarHBondContact O-N 3.11Å; K449-E453 WeakPolarHBondContact CE-OE1 3.19Å; K449-E453 HydrophobicContact CG-CG 4.24Å; K449-E453 IonicContact NZ-OE1 3.94Å; K449-E453 WeakPolarHBondContact O-CA 3.11Å; K449-E453 WeakPolarHBondContact O-CB 3.36Å; K449-E453 WeakPolarHBondContact O-CG 3.24Å; K449-E453 PolarHBondContact O-N 2.89Å
450T66.9Low72.7Confident29 Ų2994.8 Ų94.818%0.17847%0.472CS..Hα-helixtrans-83.4-16.1172.4630000113.4H446 K454H446-T450 WeakPolarHBondContact O-CA 3.4Å; H446-T450 WeakPolarHBondContact O-CB 3.41Å; H446-T450 WeakPolarHBondContact O-CG2 3.47Å; H446-T450 PolarHBondContact O-N 2.78Å; H446-T450 PolarHBondContact O-OG1 3.07Å; T450-K454 WeakPolarHBondContact O-CB 3.47Å; T450-K454 WeakPolarHBondContact O-CD 3.2Å; T450-K454 WeakPolarHBondContact O-CG 3.43Å; T450-K454 PolarHBondContact O-N 2.67Å
451S73Confident72.6Confident42 Ų4294.1 Ų94.129%0.29447%0.47SS..Hα-helixtrans-72.5-57.5162.275.80000108.6E447 E448 E453 K454 D455E447-S451 VanDerWaalsContact O-CB 3.27Å; E447-S451 WeakPolarHBondContact O-CB 3.11Å; E447-S451 PolarHBondContact O-N 2.85Å; E447-S451 PolarHBondContact O-OG 2.77Å; E448-S451 WeakPolarHBondContact CA-OG 3.27Å; E448-S451 PolarHBondContact O-N 3.25Å; E448-S451 PolarHBondContact O-OG 3.46Å; S451-E453 VanDerWaalsContact C-N 3.28Å; S451-E453 PolarHBondContact O-N 2.79Å; S451-K454 CarbonylContact O-C 3.58Å; S451-K454 WeakPolarHBondContact O-CA 3.19Å; S451-K454 WeakPolarHBondContact O-CB 3.43Å; S451-K454 PolarHBondContact O-N 2.84Å; S451-D455 VanDerWaalsContact C-OD2 3.29Å; S451-D455 WeakPolarHBondContact O-CB 3.44Å; S451-D455 PolarHBondContact O-N 2.79Å; S451-D455 VanDerWaalsContact O-OD2 3.07Å
452H70.8Confident72.9Confident108 Ų10893.8 Ų93.850%0.547%0.466SS..Hα-helixtrans-57.2-35.9176.3-72.985.3000113E448 M456E448-H452 VanDerWaalsContact O-CB 3.32Å; E448-H452 WeakPolarHBondContact O-CB 3.09Å; E448-H452 PolarHBondContact O-N 2.79Å; E448-H452 PolarHBondContact O-ND1 2.71Å; E448-H452 IonicContact OE2-CE1 2.73Å; H452-M456 WeakPolarHBondContact O-CB 3.48Å; H452-M456 WeakPolarHBondContact O-CG 3.4Å; H452-M456 PolarHBondContact O-N 3.35Å
453E71.8Confident73.2Confident61 Ų6195.9 Ų95.929%0.28547%0.47SS..Hα-helixtrans-74.4-29.1171.3-76.7-178.3-162.800112.9K449 S451 R457K449-E453 WeakPolarHBondContact CE-OE1 3.19Å; K449-E453 HydrophobicContact CG-CG 4.24Å; K449-E453 IonicContact NZ-OE1 3.94Å; K449-E453 WeakPolarHBondContact O-CA 3.11Å; K449-E453 WeakPolarHBondContact O-CB 3.36Å; K449-E453 WeakPolarHBondContact O-CG 3.24Å; K449-E453 PolarHBondContact O-N 2.89Å; S451-E453 VanDerWaalsContact C-N 3.28Å; S451-E453 PolarHBondContact O-N 2.79Å; E453-R457 WeakPolarHBondContact O-CB 3.11Å; E453-R457 WeakPolarHBondContact O-CD 3.4Å; E453-R457 WeakPolarHBondContact O-CG 3.45Å; E453-R457 PolarHBondContact O-N 3.08Å; E453-R457 IonicContact OE2-CZ 2.72Å; E453-R457 IonicContact OE2-NH1 3.01Å; E453-R457 PolarHBondContact OE2-NH1 3.22Å; E453-R457 IonicContact OE2-NH2 3.68Å; E453-R457 PolarHBondContact OE2-NH2 3.49Å
454K75Confident73.4Confident132 Ų13297.1 Ų97.157%0.57448%0.478SS*.Hα-helixtrans-74.3-34.4170.6-79.8165.6-166158.30111.6T450 S451 R457 S458T450-K454 WeakPolarHBondContact O-CB 3.47Å; T450-K454 WeakPolarHBondContact O-CD 3.2Å; T450-K454 WeakPolarHBondContact O-CG 3.43Å; T450-K454 PolarHBondContact O-N 2.67Å; S451-K454 CarbonylContact O-C 3.58Å; S451-K454 WeakPolarHBondContact O-CA 3.19Å; S451-K454 WeakPolarHBondContact O-CB 3.43Å; S451-K454 PolarHBondContact O-N 2.84Å; K454-R457 CarbonylContact O-C 3.57Å; K454-R457 PolarHBondContact O-N 2.73Å; K454-S458 WeakPolarHBondContact O-CA 3.29Å; K454-S458 WeakPolarHBondContact O-CB 3.23Å; K454-S458 PolarHBondContact O-N 2.74Å
455D75.1Confident73.5Confident91 Ų9199 Ų9949%0.48748%0.482SS..Hα-helixtrans-76.7-40.9179.6-61.3-33.4000109.3S451 S458 V459S451-D455 VanDerWaalsContact C-OD2 3.29Å; S451-D455 WeakPolarHBondContact O-CB 3.44Å; S451-D455 PolarHBondContact O-N 2.79Å; S451-D455 VanDerWaalsContact O-OD2 3.07Å; D455-S458 PolarHBondContact O-N 3.18Å; D455-V459 VanDerWaalsContact O-CB 3.31Å; D455-V459 WeakPolarHBondContact O-CB 3.22Å; D455-V459 VanDerWaalsContact O-CG2 3.26Å; D455-V459 WeakPolarHBondContact O-CG2 3.41Å; D455-V459 PolarHBondContact O-N 2.66Å
456M69.9Low73.5Confident111 Ų11197.2 Ų97.255%0.54747%0.47SS..Hα-helixtrans-66.8-38.8168.1-71.6-64.1-62.800112H452 S458 Q460H452-M456 WeakPolarHBondContact O-CB 3.48Å; H452-M456 WeakPolarHBondContact O-CG 3.4Å; H452-M456 PolarHBondContact O-N 3.35Å; M456-S458 VanDerWaalsContact C-N 3.32Å; M456-Q460 WeakPolarHBondContact O-CB 3.27Å; M456-Q460 WeakPolarHBondContact O-CG 3.23Å; M456-Q460 PolarHBondContact O-N 2.99Å
457R75.1Confident73.5Confident136 Ų13693.6 Ų93.651%0.51346%0.46SS..Hα-helixtrans-69.7-27.6171-75.5169.5-170.3122.610.6112.7E453 K454 A461E453-R457 WeakPolarHBondContact O-CB 3.11Å; E453-R457 WeakPolarHBondContact O-CD 3.4Å; E453-R457 WeakPolarHBondContact O-CG 3.45Å; E453-R457 PolarHBondContact O-N 3.08Å; E453-R457 IonicContact OE2-CZ 2.72Å; E453-R457 IonicContact OE2-NH1 3.01Å; E453-R457 PolarHBondContact OE2-NH1 3.22Å; E453-R457 IonicContact OE2-NH2 3.68Å; E453-R457 PolarHBondContact OE2-NH2 3.49Å; K454-R457 CarbonylContact O-C 3.57Å; K454-R457 PolarHBondContact O-N 2.73Å; R457-A461 WeakPolarHBondContact O-CA 3.23Å; R457-A461 WeakPolarHBondContact O-CB 3.44Å; R457-A461 PolarHBondContact O-N 3.06Å
458S75.7Confident73.6Confident72 Ų7291.7 Ų91.750%0.50346%0.457SS..Hα-helixtrans-76.1-41.5176.7-179.40000110.3K454 D455 M456 A461 H462K454-S458 WeakPolarHBondContact O-CA 3.29Å; K454-S458 WeakPolarHBondContact O-CB 3.23Å; K454-S458 PolarHBondContact O-N 2.74Å; D455-S458 PolarHBondContact O-N 3.18Å; M456-S458 VanDerWaalsContact C-N 3.32Å; S458-A461 PolarHBondContact O-N 2.79Å; S458-H462 WeakPolarHBondContact O-CB 3.38Å; S458-H462 PolarHBondContact O-N 3.39Å
459V75Confident73.8Confident67 Ų6791.7 Ų91.741%0.40646%0.458SS..Hα-helixtrans-70.1-38.3172.4169.20000111D455 H462 Y463D455-V459 VanDerWaalsContact O-CB 3.31Å; D455-V459 WeakPolarHBondContact O-CB 3.22Å; D455-V459 VanDerWaalsContact O-CG2 3.26Å; D455-V459 WeakPolarHBondContact O-CG2 3.41Å; D455-V459 PolarHBondContact O-N 2.66Å; V459-H462 PolarHBondContact O-N 2.9Å; V459-Y463 HydrophobicContact CG1-CD2 3.65Å; V459-Y463 HydrophobicContact CG1-CE2 3.39Å; V459-Y463 WeakPolarHBondContact O-CB 3.44Å; V459-Y463 WeakPolarHBondContact O-CD2 3.41Å; V459-Y463 PolarHBondContact O-N 3.45Å
460Q73.6Confident73.8Confident105 Ų10591.4 Ų91.449%0.49146%0.459SS..Hα-helixtrans-65-46.2170.3-77.1170.6-25.300111.1M456 H462 Y463 E464M456-Q460 WeakPolarHBondContact O-CB 3.27Å; M456-Q460 WeakPolarHBondContact O-CG 3.23Å; M456-Q460 PolarHBondContact O-N 2.99Å; Q460-H462 VanDerWaalsContact C-N 3.33Å; Q460-H462 PolarHBondContact O-N 3.46Å; Q460-Y463 CarbonylContact O-C 3.56Å; Q460-Y463 PolarHBondContact O-N 2.97Å; Q460-E464 WeakPolarHBondContact O-CB 3.23Å; Q460-E464 VanDerWaalsContact O-CG 3.31Å; Q460-E464 WeakPolarHBondContact O-CG 3.24Å; Q460-E464 PolarHBondContact O-N 3.48Å
461A73.4Confident74.2Confident47 Ų4796.7 Ų96.739%0.38848%0.48SS..Hα-helixtrans-63-38.817500000111.6R457 S458 E464 E465R457-A461 WeakPolarHBondContact O-CA 3.23Å; R457-A461 WeakPolarHBondContact O-CB 3.44Å; R457-A461 PolarHBondContact O-N 3.06Å; S458-A461 PolarHBondContact O-N 2.79Å; A461-E464 CarbonylContact O-C 3.47Å; A461-E464 PolarHBondContact O-N 3.43Å; A461-E465 WeakPolarHBondContact O-CA 3.31Å; A461-E465 WeakPolarHBondContact O-CB 3.48Å; A461-E465 PolarHBondContact O-N 3.15Å
462H75.6Confident74.4Confident104 Ų10498.2 Ų98.248%0.48149%0.485SS..Hα-helixtrans-65.8-41.2174.7-167-75000111S458 V459 Q460 E465 E466S458-H462 WeakPolarHBondContact O-CB 3.38Å; S458-H462 PolarHBondContact O-N 3.39Å; V459-H462 PolarHBondContact O-N 2.9Å; Q460-H462 VanDerWaalsContact C-N 3.33Å; Q460-H462 PolarHBondContact O-N 3.46Å; H462-E465 PolarHBondContact O-N 3.08Å; H462-E466 IonicContact CE1-OE1 2.68Å; H462-E466 PolarHBondContact CE1-OE1 3.24Å; H462-E466 IonicContact CE1-OE2 2.6Å; H462-E466 PolarHBondContact CE1-OE2 2.83Å; H462-E466 IonicContact ND1-OE1 3.61Å; H462-E466 IonicContact ND1-OE2 2.7Å; H462-E466 PolarHBondContact ND1-OE2 3.5Å; H462-E466 VanDerWaalsContact O-CB 3.24Å; H462-E466 WeakPolarHBondContact O-CB 3.27Å; H462-E466 VanDerWaalsContact O-CG 3.28Å; H462-E466 WeakPolarHBondContact O-CG 3.14Å; H462-E466 PolarHBondContact O-N 3.35Å
463Y75.1Confident74.6Confident153 Ų15395.8 Ų95.860%0.648%0.48SS*.Hα-helixtrans-72.4-28.8173.7-73.1-44.1000113.3V459 Q460 E466 A467V459-Y463 HydrophobicContact CG1-CD2 3.65Å; V459-Y463 HydrophobicContact CG1-CE2 3.39Å; V459-Y463 WeakPolarHBondContact O-CB 3.44Å; V459-Y463 WeakPolarHBondContact O-CD2 3.41Å; V459-Y463 PolarHBondContact O-N 3.45Å; Q460-Y463 CarbonylContact O-C 3.56Å; Q460-Y463 PolarHBondContact O-N 2.97Å; Y463-E466 WeakPolarHBondContact CD1-OE2 3.33Å; Y463-A467 WeakPolarHBondContact O-CA 3.43Å; Y463-A467 WeakPolarHBondContact O-CB 3.41Å; Y463-A467 PolarHBondContact O-N 2.89Å
464E77.3Confident74.7Confident142 Ų14298.1 Ų98.166%0.66449%0.491SS*.Hα-helixtrans-76.3-31.5171.9-75.2178174.300111.6Q460 A461 S468Q460-E464 WeakPolarHBondContact O-CB 3.23Å; Q460-E464 VanDerWaalsContact O-CG 3.31Å; Q460-E464 WeakPolarHBondContact O-CG 3.24Å; Q460-E464 PolarHBondContact O-N 3.48Å; A461-E464 CarbonylContact O-C 3.47Å; A461-E464 PolarHBondContact O-N 3.43Å; E464-S468 WeakPolarHBondContact O-CB 3.35Å; E464-S468 PolarHBondContact O-N 3.36Å; E464-S468 PolarHBondContact O-OG 2.79Å
465E76.9Confident74.8Confident115 Ų11594.3 Ų94.354%0.53748%0.484SS..Hα-helixtrans-77.9-39.6175.4-172161.7-142.700110.8A461 H462 S468 Q469A461-E465 WeakPolarHBondContact O-CA 3.31Å; A461-E465 WeakPolarHBondContact O-CB 3.48Å; A461-E465 PolarHBondContact O-N 3.15Å; H462-E465 PolarHBondContact O-N 3.08Å; E465-S468 VanDerWaalsContact CA-OG 3.3Å; E465-S468 WeakPolarHBondContact CA-OG 3.17Å; E465-S468 PolarHBondContact O-OG 2.78Å; E465-Q469 WeakPolarHBondContact O-CB 3.49Å; E465-Q469 WeakPolarHBondContact O-CG 3.47Å; E465-Q469 PolarHBondContact O-N 3.2Å
466E73.8Confident75.2Confident83 Ų8397.1 Ų97.139%0.38849%0.487SS..Hα-helixtrans-66.9-43.8167.2-75.8178125.800111.3H462 Y463 S468 Q469 M470H462-E466 IonicContact CE1-OE1 2.68Å; H462-E466 PolarHBondContact CE1-OE1 3.24Å; H462-E466 IonicContact CE1-OE2 2.6Å; H462-E466 PolarHBondContact CE1-OE2 2.83Å; H462-E466 IonicContact ND1-OE1 3.61Å; H462-E466 IonicContact ND1-OE2 2.7Å; H462-E466 PolarHBondContact ND1-OE2 3.5Å; H462-E466 VanDerWaalsContact O-CB 3.24Å; H462-E466 WeakPolarHBondContact O-CB 3.27Å; H462-E466 VanDerWaalsContact O-CG 3.28Å; H462-E466 WeakPolarHBondContact O-CG 3.14Å; H462-E466 PolarHBondContact O-N 3.35Å; Y463-E466 WeakPolarHBondContact CD1-OE2 3.33Å; E466-S468 VanDerWaalsContact C-N 3.33Å; E466-S468 PolarHBondContact O-N 3.47Å; E466-Q469 PolarHBondContact O-N 3.32Å; E466-M470 VanDerWaalsContact O-CB 3.26Å; E466-M470 WeakPolarHBondContact O-CB 3.15Å; E466-M470 WeakPolarHBondContact O-CG 3.19Å; E466-M470 PolarHBondContact O-N 2.83Å
467A72.4Confident75.6Confident42 Ų4294.3 Ų94.335%0.34748%0.482SS..Hα-helixtrans-68.8-31.4177.200000112.3Y463 K471Y463-A467 WeakPolarHBondContact O-CA 3.43Å; Y463-A467 WeakPolarHBondContact O-CB 3.41Å; Y463-A467 PolarHBondContact O-N 2.89Å; A467-K471 WeakPolarHBondContact O-CB 3.29Å; A467-K471 WeakPolarHBondContact O-CD 3.23Å; A467-K471 WeakPolarHBondContact O-CG 3.04Å; A467-K471 PolarHBondContact O-N 3.12Å
468S76.6Confident75.6Confident55 Ų5593.8 Ų93.839%0.38549%0.489SS..Hα-helixtrans-76.4-39.2171.456.10000111.6E464 E465 E466 M470 K471 D472E464-S468 WeakPolarHBondContact O-CB 3.35Å; E464-S468 PolarHBondContact O-N 3.36Å; E464-S468 PolarHBondContact O-OG 2.79Å; E465-S468 VanDerWaalsContact CA-OG 3.3Å; E465-S468 WeakPolarHBondContact CA-OG 3.17Å; E465-S468 PolarHBondContact O-OG 2.78Å; E466-S468 VanDerWaalsContact C-N 3.33Å; E466-S468 PolarHBondContact O-N 3.47Å; S468-M470 VanDerWaalsContact C-N 3.31Å; S468-M470 PolarHBondContact O-N 2.89Å; S468-K471 CarbonylContact O-C 3.46Å; S468-K471 PolarHBondContact O-N 2.84Å; S468-D472 VanDerWaalsContact O-CB 3.22Å; S468-D472 WeakPolarHBondContact O-CB 3.17Å; S468-D472 PolarHBondContact O-N 3.3Å
469Q74.3Confident75.9Confident114 Ų11495.2 Ų95.253%0.53349%0.487SS..Hα-helixtrans-62.6-34.4170.4-75.5176.239.500112.7E465 E466 S473E465-Q469 WeakPolarHBondContact O-CB 3.49Å; E465-Q469 WeakPolarHBondContact O-CG 3.47Å; E465-Q469 PolarHBondContact O-N 3.2Å; E466-Q469 PolarHBondContact O-N 3.32Å; Q469-S473 WeakPolarHBondContact O-CB 3.31Å; Q469-S473 PolarHBondContact O-N 3.17Å; Q469-S473 PolarHBondContact O-OG 3.37Å
470M72.8Confident76.2Confident111 Ų11197 Ų9755%0.54749%0.491SS..Hα-helixtrans-72.2-41172.8-74.4-63.4-69.100111.7E466 S468 D472 S473 Q474E466-M470 VanDerWaalsContact O-CB 3.26Å; E466-M470 WeakPolarHBondContact O-CB 3.15Å; E466-M470 WeakPolarHBondContact O-CG 3.19Å; E466-M470 PolarHBondContact O-N 2.83Å; S468-M470 VanDerWaalsContact C-N 3.31Å; S468-M470 PolarHBondContact O-N 2.89Å; M470-D472 VanDerWaalsContact C-N 3.34Å; M470-S473 WeakPolarHBondContact CA-OG 3.5Å; M470-S473 PolarHBondContact O-OG 2.74Å; M470-Q474 VanDerWaalsContact O-CB 3.27Å; M470-Q474 WeakPolarHBondContact O-CB 3.12Å; M470-Q474 WeakPolarHBondContact O-CG 3.1Å; M470-Q474 PolarHBondContact O-N 3.47Å
471K75.1Confident76.4Confident140 Ų14096.3 Ų96.361%0.60949%0.494SS*.Hα-helixtrans-64.3-38.3170.7-76165.4-175.7171.50111.9A467 S468 A475A467-K471 WeakPolarHBondContact O-CB 3.29Å; A467-K471 WeakPolarHBondContact O-CD 3.23Å; A467-K471 WeakPolarHBondContact O-CG 3.04Å; A467-K471 PolarHBondContact O-N 3.12Å; S468-K471 CarbonylContact O-C 3.46Å; S468-K471 PolarHBondContact O-N 2.84Å; K471-A475 WeakPolarHBondContact O-CB 3.17Å; K471-A475 PolarHBondContact O-N 2.86Å
472D77.4Confident76.4Confident73 Ų7396.8 Ų96.839%0.3950%0.498SS..Hα-helixtrans-70.5-42.3178.7-104.442.2000111.5S468 M470 A475 R476S468-D472 VanDerWaalsContact O-CB 3.22Å; S468-D472 WeakPolarHBondContact O-CB 3.17Å; S468-D472 PolarHBondContact O-N 3.3Å; M470-D472 VanDerWaalsContact C-N 3.34Å; D472-A475 PolarHBondContact O-N 2.84Å; D472-R476 VanDerWaalsContact O-CB 3.24Å; D472-R476 WeakPolarHBondContact O-CB 3.05Å; D472-R476 WeakPolarHBondContact O-CD 3.22Å; D472-R476 WeakPolarHBondContact O-CG 3.44Å; D472-R476 PolarHBondContact O-N 2.79Å; D472-R476 IonicContact OD2-CZ 2.79Å; D472-R476 IonicContact OD2-NE 3.49Å; D472-R476 IonicContact OD2-NH2 3.21Å; D472-R476 PolarHBondContact OD2-NH2 3.21Å
473S75.8Confident76.7Confident58 Ų5896.3 Ų96.341%0.40649%0.494SS..Hα-helixtrans-69.7-36.2175.152.90000111.6Q469 M470 A477Q469-S473 WeakPolarHBondContact O-CB 3.31Å; Q469-S473 PolarHBondContact O-N 3.17Å; Q469-S473 PolarHBondContact O-OG 3.37Å; M470-S473 WeakPolarHBondContact CA-OG 3.5Å; M470-S473 PolarHBondContact O-OG 2.74Å; S473-A477 WeakPolarHBondContact O-CB 3.13Å; S473-A477 PolarHBondContact O-N 3.02Å
474Q72.6Confident76.9Confident110 Ų11094.7 Ų94.751%0.51449%0.49SS..Hα-helixtrans-65-42.9169-72.6170.59.200112.1M470 A477 L478M470-Q474 VanDerWaalsContact O-CB 3.27Å; M470-Q474 WeakPolarHBondContact O-CB 3.12Å; M470-Q474 WeakPolarHBondContact O-CG 3.1Å; M470-Q474 PolarHBondContact O-N 3.47Å; Q474-A477 PolarHBondContact O-N 2.84Å; Q474-L478 WeakPolarHBondContact O-CB 3.4Å; Q474-L478 VanDerWaalsContact O-CG 3.29Å; Q474-L478 WeakPolarHBondContact O-CG 3.29Å; Q474-L478 PolarHBondContact O-N 2.78Å
475A77.7Confident76.8Confident51 Ų5193.6 Ų93.642%0.42149%0.485SS..Hα-helixtrans-66.2-42.4177.400000111.5K471 D472 L478 E479K471-A475 WeakPolarHBondContact O-CB 3.17Å; K471-A475 PolarHBondContact O-N 2.86Å; D472-A475 PolarHBondContact O-N 2.84Å; A475-L478 PolarHBondContact O-N 2.78Å; A475-E479 VanDerWaalsContact O-CB 3.25Å; A475-E479 WeakPolarHBondContact O-CB 3.36Å; A475-E479 PolarHBondContact O-N 2.84Å
476R82.7Confident77Confident150 Ų15095 Ų9557%0.56649%0.485SS*.Hα-helixtrans-66.2-36.3173.6-69.2165.9-153.2-173.77.7111.7D472 E479 E480D472-R476 VanDerWaalsContact O-CB 3.24Å; D472-R476 WeakPolarHBondContact O-CB 3.05Å; D472-R476 WeakPolarHBondContact O-CD 3.22Å; D472-R476 WeakPolarHBondContact O-CG 3.44Å; D472-R476 PolarHBondContact O-N 2.79Å; D472-R476 IonicContact OD2-CZ 2.79Å; D472-R476 IonicContact OD2-NE 3.49Å; D472-R476 IonicContact OD2-NH2 3.21Å; D472-R476 PolarHBondContact OD2-NH2 3.21Å; R476-E479 PolarHBondContact O-N 3.23Å; R476-E480 VanDerWaalsContact O-CB 3.31Å; R476-E480 WeakPolarHBondContact O-CB 3.35Å; R476-E480 PolarHBondContact O-N 2.66Å
477A78.2Confident77.7Confident52 Ų5294.1 Ų94.143%0.4349%0.486SS..Hα-helixtrans-67.1-42.5173.300000111.7S473 Q474 E480 V481S473-A477 WeakPolarHBondContact O-CB 3.13Å; S473-A477 PolarHBondContact O-N 3.02Å; Q474-A477 PolarHBondContact O-N 2.84Å; A477-E480 PolarHBondContact O-N 2.79Å; A477-V481 WeakPolarHBondContact O-CB 3.42Å; A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.05Å; A477-V481 PolarHBondContact O-N 3.35Å
478L75.8Confident78.1Confident126 Ų12695.8 Ų95.866%0.6649%0.492SS*.Hα-helixtrans-65.1-39.2172.7-73169.3000111.7Q474 A475 V481 A482Q474-L478 WeakPolarHBondContact O-CB 3.4Å; Q474-L478 VanDerWaalsContact O-CG 3.29Å; Q474-L478 WeakPolarHBondContact O-CG 3.29Å; Q474-L478 PolarHBondContact O-N 2.78Å; A475-L478 PolarHBondContact O-N 2.78Å; L478-V481 PolarHBondContact O-N 2.82Å; L478-A482 VanDerWaalsContact O-CB 3.26Å; L478-A482 WeakPolarHBondContact O-CB 3.28Å; L478-A482 PolarHBondContact O-N 3.39Å
479E81.1Confident78.1Confident101 Ų10197.1 Ų97.147%0.47249%0.494SS..Hα-helixtrans-70.2-35.6176.2-158.6-154175.500111.2A475 R476 A482 K483A475-E479 VanDerWaalsContact O-CB 3.25Å; A475-E479 WeakPolarHBondContact O-CB 3.36Å; A475-E479 PolarHBondContact O-N 2.84Å; R476-E479 PolarHBondContact O-N 3.23Å; E479-A482 PolarHBondContact O-N 2.7Å; E479-K483 VanDerWaalsContact CD-CE 3.44Å; E479-K483 HydrophobicContact CG-CD 4.33Å; E479-K483 WeakPolarHBondContact O-CB 3.34Å; E479-K483 WeakPolarHBondContact O-CD 3.47Å; E479-K483 WeakPolarHBondContact O-CG 3.23Å; E479-K483 PolarHBondContact O-N 2.66Å; E479-K483 WeakPolarHBondContact OE1-CE 3.34Å; E479-K483 IonicContact OE1-NZ 2.71Å; E479-K483 PolarHBondContact OE1-NZ 3.45Å; E479-K483 IonicContact OE2-NZ 3.88Å; E479-K483 PolarHBondContact OE2-NZ 2.81Å
480E81.6Confident78.5Confident104 Ų10495.6 Ų95.649%0.48649%0.487SS..Hα-helixtrans-65.5-42.1170-91.9-162.8-146.900111.9R476 A477 K483 K484R476-E480 VanDerWaalsContact O-CB 3.31Å; R476-E480 WeakPolarHBondContact O-CB 3.35Å; R476-E480 PolarHBondContact O-N 2.66Å; A477-E480 PolarHBondContact O-N 2.79Å; E480-K483 PolarHBondContact O-N 2.82Å; E480-K484 VanDerWaalsContact O-CB 3.31Å; E480-K484 WeakPolarHBondContact O-CB 3.34Å; E480-K484 VanDerWaalsContact O-CD 3.31Å; E480-K484 WeakPolarHBondContact O-CD 3.4Å; E480-K484 WeakPolarHBondContact O-CG 3.46Å; E480-K484 PolarHBondContact O-N 3.25Å; E480-K484 WeakPolarHBondContact OE2-CE 3.42Å; E480-K484 IonicContact OE2-NZ 3.58Å; E480-K484 PolarHBondContact OE2-NZ 2.72Å
481V78.1Confident78.9Confident92 Ų9294.6 Ų94.656%0.55848%0.484SS*.Hα-helixtrans-66.2-40.4174.9168.70000110.4A477 L478 K484 H485A477-V481 WeakPolarHBondContact O-CB 3.42Å; A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.05Å; A477-V481 PolarHBondContact O-N 3.35Å; L478-V481 PolarHBondContact O-N 2.82Å; V481-K484 PolarHBondContact O-N 2.66Å; V481-H485 VanDerWaalsContact O-CB 3.29Å; V481-H485 WeakPolarHBondContact O-CB 3.44Å; V481-H485 PolarHBondContact O-N 2.7Å
482A73.8Confident79.2Confident56 Ų5691.9 Ų91.946%0.46348%0.479SS..Hα-helixtrans-66.6-39.9174.100000112.1L478 E479 H485 R486L478-A482 VanDerWaalsContact O-CB 3.26Å; L478-A482 WeakPolarHBondContact O-CB 3.28Å; L478-A482 PolarHBondContact O-N 3.39Å; E479-A482 PolarHBondContact O-N 2.7Å; A482-H485 PolarHBondContact O-N 2.78Å; A482-R486 VanDerWaalsContact O-CB 3.27Å; A482-R486 WeakPolarHBondContact O-CB 3.41Å; A482-R486 PolarHBondContact O-N 3.38Å
483K81.1Confident79.3Confident94 Ų9493.4 Ų93.441%0.40949%0.487SS..Hα-helixtrans-64.2-44.2172.7-78.6163.7178163.10111.2E479 E480 R486 V487E479-K483 VanDerWaalsContact CD-CE 3.44Å; E479-K483 HydrophobicContact CG-CD 4.33Å; E479-K483 WeakPolarHBondContact O-CB 3.34Å; E479-K483 WeakPolarHBondContact O-CD 3.47Å; E479-K483 WeakPolarHBondContact O-CG 3.23Å; E479-K483 PolarHBondContact O-N 2.66Å; E479-K483 WeakPolarHBondContact OE1-CE 3.34Å; E479-K483 IonicContact OE1-NZ 2.71Å; E479-K483 PolarHBondContact OE1-NZ 3.45Å; E479-K483 IonicContact OE2-NZ 3.88Å; E479-K483 PolarHBondContact OE2-NZ 2.81Å; E480-K483 PolarHBondContact O-N 2.82Å; K483-R486 PolarHBondContact O-N 2.9Å; K483-V487 WeakPolarHBondContact O-CB 3.43Å; K483-V487 VanDerWaalsContact O-CG2 3.27Å; K483-V487 WeakPolarHBondContact O-CG2 3.24Å; K483-V487 PolarHBondContact O-N 2.96Å
484K80.6Confident79.7Confident119 Ų11993.1 Ų93.152%0.51748%0.483SS..Hα-helixtrans-62-44.5174.2-72.7159.5-165.9164.10110.7E480 V481 V487 T488E480-K484 VanDerWaalsContact O-CB 3.31Å; E480-K484 WeakPolarHBondContact O-CB 3.34Å; E480-K484 VanDerWaalsContact O-CD 3.31Å; E480-K484 WeakPolarHBondContact O-CD 3.4Å; E480-K484 WeakPolarHBondContact O-CG 3.46Å; E480-K484 PolarHBondContact O-N 3.25Å; E480-K484 WeakPolarHBondContact OE2-CE 3.42Å; E480-K484 IonicContact OE2-NZ 3.58Å; E480-K484 PolarHBondContact OE2-NZ 2.72Å; V481-K484 PolarHBondContact O-N 2.66Å; K484-V487 PolarHBondContact O-N 3.15Å; K484-T488 WeakPolarHBondContact O-CG2 3.36Å; K484-T488 PolarHBondContact O-N 3.39Å; K484-T488 PolarHBondContact O-OG1 2.84Å
485H74.9Confident80.2Confident119 Ų11991.2 Ų91.255%0.55148%0.479SS*.Hα-helixtrans-63.7-45.6176.6-174.252.8000111.9V481 A482 V487 T488 L489V481-H485 VanDerWaalsContact O-CB 3.29Å; V481-H485 WeakPolarHBondContact O-CB 3.44Å; V481-H485 PolarHBondContact O-N 2.7Å; A482-H485 PolarHBondContact O-N 2.78Å; H485-V487 PolarHBondContact O-N 3.41Å; H485-T488 VanDerWaalsContact CA-OG1 3.31Å; H485-T488 WeakPolarHBondContact CA-OG1 3.48Å; H485-T488 CarbonylContact O-C 3.58Å; H485-T488 PolarHBondContact O-N 2.92Å; H485-T488 VanDerWaalsContact O-N 3.16Å; H485-T488 PolarHBondContact O-OG1 3.16Å; H485-L489 PolarHBondContact O-N 2.68Å
486R81.5Confident80.3Confident144 Ų14491.5 Ų91.554%0.54348%0.481SS..Hα-helixtrans-61.3-43.8175.5-159.5-171.877.9-157.2-0.9111.6A482 K483 T488 L489 E490A482-R486 VanDerWaalsContact O-CB 3.27Å; A482-R486 WeakPolarHBondContact O-CB 3.41Å; A482-R486 PolarHBondContact O-N 3.38Å; K483-R486 PolarHBondContact O-N 2.9Å; R486-T488 PolarHBondContact O-N 3.43Å; R486-L489 CarbonylContact O-C 3.53Å; R486-L489 WeakPolarHBondContact O-CB 3.38Å; R486-L489 PolarHBondContact O-N 3.17Å; R486-L489 VanDerWaalsContact O-N 3.11Å; R486-E490 WeakPolarHBondContact CD-OE1 3.43Å; R486-E490 WeakPolarHBondContact CG-OE1 3.39Å; R486-E490 IonicContact CZ-OE1 3.16Å; R486-E490 IonicContact NE-OE1 3.56Å; R486-E490 PolarHBondContact NE-OE1 2.69Å; R486-E490 IonicContact NH2-OE1 2.82Å; R486-E490 WeakPolarHBondContact O-CB 3.24Å; R486-E490 VanDerWaalsContact O-CG 3.26Å; R486-E490 WeakPolarHBondContact O-CG 3.41Å; R486-E490 PolarHBondContact O-N 3.47Å
487V87.1Confident80.2Confident66 Ų6689.3 Ų89.340%0.448%0.477SS..Hα-helixtrans-65-36.1174.3168.10000111.6K483 K484 H485 L489 N491K483-V487 WeakPolarHBondContact O-CB 3.43Å; K483-V487 VanDerWaalsContact O-CG2 3.27Å; K483-V487 WeakPolarHBondContact O-CG2 3.24Å; K483-V487 PolarHBondContact O-N 2.96Å; K484-V487 PolarHBondContact O-N 3.15Å; H485-V487 PolarHBondContact O-N 3.41Å; V487-L489 VanDerWaalsContact C-N 3.34Å; V487-N491 VanDerWaalsContact O-CB 3.24Å; V487-N491 WeakPolarHBondContact O-CB 3.27Å; V487-N491 PolarHBondContact O-N 3.07Å; V487-N491 PolarHBondContact O-ND2 2.92Å
488T80.5Confident80.5Confident76 Ų7693.3 Ų93.347%0.46649%0.485SS..Hα-helixtrans-66.9-35.5170.7520000112.4K484 H485 R486 N491 T492K484-T488 WeakPolarHBondContact O-CG2 3.36Å; K484-T488 PolarHBondContact O-N 3.39Å; K484-T488 PolarHBondContact O-OG1 2.84Å; H485-T488 VanDerWaalsContact CA-OG1 3.31Å; H485-T488 WeakPolarHBondContact CA-OG1 3.48Å; H485-T488 CarbonylContact O-C 3.58Å; H485-T488 PolarHBondContact O-N 2.92Å; H485-T488 VanDerWaalsContact O-N 3.16Å; H485-T488 PolarHBondContact O-OG1 3.16Å; R486-T488 PolarHBondContact O-N 3.43Å; T488-N491 PolarHBondContact O-N 3.35Å; T488-T492 WeakPolarHBondContact O-CG2 3.09Å; T488-T492 PolarHBondContact O-N 3.09Å; T488-T492 PolarHBondContact O-OG1 3.46Å; T488-T492 VanDerWaalsContact O-OG1 3.12Å
489L77.8Confident80.9Confident84 Ų8491 Ų9144%0.4447%0.473SS..Hα-helixtrans-69-45.9176-140.782.8000111.5H485 R486 V487 N491 T492 L493H485-L489 PolarHBondContact O-N 2.68Å; R486-L489 CarbonylContact O-C 3.53Å; R486-L489 WeakPolarHBondContact O-CB 3.38Å; R486-L489 PolarHBondContact O-N 3.17Å; R486-L489 VanDerWaalsContact O-N 3.11Å; V487-L489 VanDerWaalsContact C-N 3.34Å; L489-N491 VanDerWaalsContact C-N 3.3Å; L489-N491 PolarHBondContact O-N 2.86Å; L489-T492 WeakPolarHBondContact CA-OG1 3.2Å; L489-T492 PolarHBondContact O-N 3.48Å; L489-T492 PolarHBondContact O-OG1 3.08Å; L489-T492 VanDerWaalsContact O-OG1 3.07Å; L489-L493 VanDerWaalsContact O-CB 3.26Å; L489-L493 WeakPolarHBondContact O-CB 3.35Å; L489-L493 WeakPolarHBondContact O-CG 3.3Å; L489-L493 PolarHBondContact O-N 2.83Å
490E81.6Confident81.1Confident81 Ų8191.2 Ų91.238%0.37947%0.473SS..Hα-helixtrans-59.8-39.8173.5-71.6162.6-175.500110.8R486 T494R486-E490 WeakPolarHBondContact CD-OE1 3.43Å; R486-E490 WeakPolarHBondContact CG-OE1 3.39Å; R486-E490 IonicContact CZ-OE1 3.16Å; R486-E490 IonicContact NE-OE1 3.56Å; R486-E490 PolarHBondContact NE-OE1 2.69Å; R486-E490 IonicContact NH2-OE1 2.82Å; R486-E490 WeakPolarHBondContact O-CB 3.24Å; R486-E490 VanDerWaalsContact O-CG 3.26Å; R486-E490 WeakPolarHBondContact O-CG 3.41Å; R486-E490 PolarHBondContact O-N 3.47Å; E490-T494 WeakPolarHBondContact O-CB 3.27Å; E490-T494 VanDerWaalsContact O-CG2 3.27Å; E490-T494 WeakPolarHBondContact O-CG2 3.23Å; E490-T494 PolarHBondContact O-N 3.18Å; E490-T494 PolarHBondContact O-OG1 2.99Å
491N81.9Confident81.2Confident91 Ų9190.2 Ų90.249%0.48747%0.471SS..Hα-helixtrans-67.9-45174.2-76.7-35.8000112.4V487 T488 L489 T494 T495V487-N491 VanDerWaalsContact O-CB 3.24Å; V487-N491 WeakPolarHBondContact O-CB 3.27Å; V487-N491 PolarHBondContact O-N 3.07Å; V487-N491 PolarHBondContact O-ND2 2.92Å; T488-N491 PolarHBondContact O-N 3.35Å; L489-N491 VanDerWaalsContact C-N 3.3Å; L489-N491 PolarHBondContact O-N 2.86Å; N491-T494 PolarHBondContact O-N 3.27Å; N491-T494 PolarHBondContact O-OG1 2.89Å; N491-T495 WeakPolarHBondContact O-CG2 3.49Å; N491-T495 PolarHBondContact O-N 3.35Å; N491-T495 PolarHBondContact O-OG1 2.84Å; N491-T495 VanDerWaalsContact O-OG1 3.07Å
492T81.8Confident81.7Confident83 Ų8391.9 Ų91.951%0.50947%0.467SS..Hα-helixtrans-68.4-38.2178.651.90000112.4T488 L489 T495 A496T488-T492 WeakPolarHBondContact O-CG2 3.09Å; T488-T492 PolarHBondContact O-N 3.09Å; T488-T492 PolarHBondContact O-OG1 3.46Å; T488-T492 VanDerWaalsContact O-OG1 3.12Å; L489-T492 WeakPolarHBondContact CA-OG1 3.2Å; L489-T492 PolarHBondContact O-N 3.48Å; L489-T492 PolarHBondContact O-OG1 3.08Å; L489-T492 VanDerWaalsContact O-OG1 3.07Å; T492-T495 WeakPolarHBondContact CA-OG1 3.22Å; T492-T495 PolarHBondContact O-N 3.33Å; T492-T495 PolarHBondContact O-OG1 2.89Å; T492-A496 VanDerWaalsContact O-CB 3.32Å; T492-A496 WeakPolarHBondContact O-CB 3.17Å; T492-A496 PolarHBondContact O-N 3.2Å
493L79.1Confident82.2Confident104 Ų10493.6 Ų93.655%0.54547%0.468SS..Hα-helixtrans-63.4-48.4172.6-71.9169.5000110.9L489 T495 A496 E497L489-L493 VanDerWaalsContact O-CB 3.26Å; L489-L493 WeakPolarHBondContact O-CB 3.35Å; L489-L493 WeakPolarHBondContact O-CG 3.3Å; L489-L493 PolarHBondContact O-N 2.83Å; L493-T495 VanDerWaalsContact C-N 3.32Å; L493-T495 PolarHBondContact O-N 2.91Å; L493-A496 CarbonylContact O-C 3.56Å; L493-A496 PolarHBondContact O-N 2.88Å; L493-A496 VanDerWaalsContact O-N 3.16Å; L493-E497 WeakPolarHBondContact O-CG 3.19Å; L493-E497 PolarHBondContact O-N 2.79Å
494T83.8Confident82.1Confident52 Ų5293 Ų9332%0.31947%0.468SS..Hα-helixtrans-71.3-22178.857.90000113.7E490 N491 K498E490-T494 WeakPolarHBondContact O-CB 3.27Å; E490-T494 VanDerWaalsContact O-CG2 3.27Å; E490-T494 WeakPolarHBondContact O-CG2 3.23Å; E490-T494 PolarHBondContact O-N 3.18Å; E490-T494 PolarHBondContact O-OG1 2.99Å; N491-T494 PolarHBondContact O-N 3.27Å; N491-T494 PolarHBondContact O-OG1 2.89Å; T494-K498 WeakPolarHBondContact O-CB 3.22Å; T494-K498 WeakPolarHBondContact O-CD 3.42Å; T494-K498 WeakPolarHBondContact O-CG 3.35Å; T494-K498 PolarHBondContact O-N 3.03Å; T494-K498 VanDerWaalsContact O-N 3.16Å
495T83.3Confident82.3Confident71 Ų7189.7 Ų89.744%0.43646%0.463SS..Hα-helixtrans-73.5-43.6165.449.30000111.7N491 T492 L493 E497 K498 D499N491-T495 WeakPolarHBondContact O-CG2 3.49Å; N491-T495 PolarHBondContact O-N 3.35Å; N491-T495 PolarHBondContact O-OG1 2.84Å; N491-T495 VanDerWaalsContact O-OG1 3.07Å; T492-T495 WeakPolarHBondContact CA-OG1 3.22Å; T492-T495 PolarHBondContact O-N 3.33Å; T492-T495 PolarHBondContact O-OG1 2.89Å; L493-T495 VanDerWaalsContact C-N 3.32Å; L493-T495 PolarHBondContact O-N 2.91Å; T495-E497 VanDerWaalsContact C-N 3.32Å; T495-E497 PolarHBondContact O-N 3.06Å; T495-K498 WeakPolarHBondContact O-CB 3.43Å; T495-K498 PolarHBondContact O-N 3.29Å; T495-K498 VanDerWaalsContact O-N 3.13Å; T495-D499 PolarHBondContact O-N 3.01Å
496A79.3Confident82.8Confident57 Ų5787.5 Ų87.547%0.47145%0.453SS..Hα-helixtrans-63.2-37.4176.700000112.2T492 L493 K500T492-A496 VanDerWaalsContact O-CB 3.32Å; T492-A496 WeakPolarHBondContact O-CB 3.17Å; T492-A496 PolarHBondContact O-N 3.2Å; L493-A496 CarbonylContact O-C 3.56Å; L493-A496 PolarHBondContact O-N 2.88Å; L493-A496 VanDerWaalsContact O-N 3.16Å; A496-K500 WeakPolarHBondContact O-CB 3.26Å; A496-K500 PolarHBondContact O-N 2.81Å
497E81.5Confident82.8Confident104 Ų10484.5 Ų84.549%0.48645%0.448SS..Hα-helixtrans-66.7-40171.5-74.9-166118.600112.4L493 T495 N501L493-E497 WeakPolarHBondContact O-CG 3.19Å; L493-E497 PolarHBondContact O-N 2.79Å; T495-E497 VanDerWaalsContact C-N 3.32Å; T495-E497 PolarHBondContact O-N 3.06Å; E497-N501 WeakPolarHBondContact O-CB 3.39Å; E497-N501 PolarHBondContact O-N 2.72Å; E497-N501 PolarHBondContact O-ND2 2.83Å; E497-N501 PolarHBondContact O-OD1 2.77Å
498K85.1Confident82.5Confident135 Ų13587.6 Ų87.659%0.58746%0.458SS*.Hα-helixtrans-62.2-47174.2-76.7161.8-166.2155.60110.9T494 T495 N501 R502T494-K498 WeakPolarHBondContact O-CB 3.22Å; T494-K498 WeakPolarHBondContact O-CD 3.42Å; T494-K498 WeakPolarHBondContact O-CG 3.35Å; T494-K498 PolarHBondContact O-N 3.03Å; T494-K498 VanDerWaalsContact O-N 3.16Å; T495-K498 WeakPolarHBondContact O-CB 3.43Å; T495-K498 PolarHBondContact O-N 3.29Å; T495-K498 VanDerWaalsContact O-N 3.13Å; K498-N501 PolarHBondContact O-N 2.81Å; K498-R502 VanDerWaalsContact O-CB 3.31Å; K498-R502 WeakPolarHBondContact O-CB 3.46Å; K498-R502 PolarHBondContact O-N 3.46Å
499D82.6Confident82.8Confident77 Ų7789.3 Ų89.341%0.41246%0.461SS..Hα-helixtrans-68.5-38.8178.4-77-44.4000112.4T495 R502 L503T495-D499 PolarHBondContact O-N 3.01Å; D499-R502 WeakPolarHBondContact O-CB 3.09Å; D499-R502 PolarHBondContact O-N 2.79Å; D499-R502 IonicContact OD1-NH1 2.68Å; D499-R502 PolarHBondContact OD1-NH1 2.87Å; D499-L503 WeakPolarHBondContact O-CB 3.18Å; D499-L503 WeakPolarHBondContact O-CG 3.34Å; D499-L503 PolarHBondContact O-N 3.05Å
500K86.6Confident82.9Confident106 Ų10690.5 Ų90.546%0.46146%0.464SS..Hα-helixtrans-59.4-46.8170.8-174.4-147.271.8-176.80111.2A496 R502 L503 L504A496-K500 WeakPolarHBondContact O-CB 3.26Å; A496-K500 PolarHBondContact O-N 2.81Å; K500-R502 VanDerWaalsContact C-N 3.31Å; K500-R502 PolarHBondContact O-N 2.69Å; K500-L503 PolarHBondContact O-N 2.68Å; K500-L504 HydrophobicContact CD-CD1 4.42Å; K500-L504 HydrophobicContact CG-CD1 4.31Å; K500-L504 WeakPolarHBondContact O-CB 3.25Å; K500-L504 VanDerWaalsContact O-CG 3.3Å; K500-L504 WeakPolarHBondContact O-CG 3.49Å; K500-L504 PolarHBondContact O-N 3.01Å
501N82.8Confident82.9Confident83 Ų8393.1 Ų93.144%0.44447%0.474SS..Hα-helixtrans-68.6-30.6177.8-66.4-11.7000111.7E497 K498 A505E497-N501 WeakPolarHBondContact O-CB 3.39Å; E497-N501 PolarHBondContact O-N 2.72Å; E497-N501 PolarHBondContact O-ND2 2.83Å; E497-N501 PolarHBondContact O-OD1 2.77Å; K498-N501 PolarHBondContact O-N 2.81Å; N501-A505 WeakPolarHBondContact O-CB 3.39Å; N501-A505 PolarHBondContact O-N 2.78Å
502R89.9Confident83.1Confident127 Ų12792.8 Ų92.848%0.47947%0.47SS..Hα-helixtrans-67.9-45.1173.3-151.2-166.288.2-134.4-1.8111.3K498 D499 K500 A505 E506K498-R502 VanDerWaalsContact O-CB 3.31Å; K498-R502 WeakPolarHBondContact O-CB 3.46Å; K498-R502 PolarHBondContact O-N 3.46Å; D499-R502 WeakPolarHBondContact O-CB 3.09Å; D499-R502 PolarHBondContact O-N 2.79Å; D499-R502 IonicContact OD1-NH1 2.68Å; D499-R502 PolarHBondContact OD1-NH1 2.87Å; K500-R502 VanDerWaalsContact C-N 3.31Å; K500-R502 PolarHBondContact O-N 2.69Å; R502-A505 PolarHBondContact O-N 3.43Å; R502-E506 IonicContact CZ-OE1 2.67Å; R502-E506 VanDerWaalsContact CZ-OE1 3.24Å; R502-E506 IonicContact NE-OE1 4Å; R502-E506 PolarHBondContact NE-OE1 3.33Å; R502-E506 IonicContact NH2-OE1 3.62Å; R502-E506 PolarHBondContact NH2-OE1 2.87Å; R502-E506 IonicContact NH2-OE2 3.77Å; R502-E506 WeakPolarHBondContact O-CB 3.28Å; R502-E506 VanDerWaalsContact O-CG 3.29Å; R502-E506 WeakPolarHBondContact O-CG 3.43Å; R502-E506 PolarHBondContact O-N 3.15Å
503L83.4Confident83.4Confident93 Ų9394.5 Ų94.549%0.48747%0.47SS..Hα-helixtrans-65.2-37.9175.1-72.6167.7000112D499 K500 E506 L507D499-L503 WeakPolarHBondContact O-CB 3.18Å; D499-L503 WeakPolarHBondContact O-CG 3.34Å; D499-L503 PolarHBondContact O-N 3.05Å; K500-L503 PolarHBondContact O-N 2.68Å; L503-E506 PolarHBondContact O-N 3.48Å; L503-L507 WeakPolarHBondContact O-CB 3.36Å; L503-L507 WeakPolarHBondContact O-CG 3.46Å; L503-L507 PolarHBondContact O-N 3.04Å
504L80.1Confident83.4Confident80 Ų8094.9 Ų94.942%0.41947%0.469SS..Hα-helixtrans-63.1-46.5171.4-73.8168.1000111.3K500 E506 L507 E508K500-L504 HydrophobicContact CD-CD1 4.42Å; K500-L504 HydrophobicContact CG-CD1 4.31Å; K500-L504 WeakPolarHBondContact O-CB 3.25Å; K500-L504 VanDerWaalsContact O-CG 3.3Å; K500-L504 WeakPolarHBondContact O-CG 3.49Å; K500-L504 PolarHBondContact O-N 3.01Å; L504-E506 VanDerWaalsContact C-N 3.33Å; L504-E506 PolarHBondContact O-N 3.07Å; L504-L507 PolarHBondContact O-N 2.93Å; L504-E508 WeakPolarHBondContact O-CB 3.35Å; L504-E508 WeakPolarHBondContact O-CG 3.39Å; L504-E508 PolarHBondContact O-N 2.7Å
505A83.4Confident83.7Confident50 Ų5097.7 Ų97.741%0.41347%0.474SS..Hα-helixtrans-66.3-32175.900000113.2N501 R502 Q509N501-A505 WeakPolarHBondContact O-CB 3.39Å; N501-A505 PolarHBondContact O-N 2.78Å; R502-A505 PolarHBondContact O-N 3.43Å; A505-Q509 VanDerWaalsContact O-CB 3.26Å; A505-Q509 WeakPolarHBondContact O-CB 3.44Å; A505-Q509 PolarHBondContact O-N 2.63Å
506E85.7Confident83.8Confident73 Ų7398.4 Ų98.434%0.34148%0.475SS..Hα-helixtrans-67.4-40.2172-77.1169.6-158.700111.4R502 L503 L504 Q510R502-E506 IonicContact CZ-OE1 2.67Å; R502-E506 VanDerWaalsContact CZ-OE1 3.24Å; R502-E506 IonicContact NE-OE1 4Å; R502-E506 PolarHBondContact NE-OE1 3.33Å; R502-E506 IonicContact NH2-OE1 3.62Å; R502-E506 PolarHBondContact NH2-OE1 2.87Å; R502-E506 IonicContact NH2-OE2 3.77Å; R502-E506 WeakPolarHBondContact O-CB 3.28Å; R502-E506 VanDerWaalsContact O-CG 3.29Å; R502-E506 WeakPolarHBondContact O-CG 3.43Å; R502-E506 PolarHBondContact O-N 3.15Å; L503-E506 PolarHBondContact O-N 3.48Å; L504-E506 VanDerWaalsContact C-N 3.33Å; L504-E506 PolarHBondContact O-N 3.07Å; E506-Q510 WeakPolarHBondContact O-CG 3.34Å; E506-Q510 PolarHBondContact O-N 3.19Å
507L81.3Confident84.2Confident82 Ų8297.8 Ų97.843%0.42947%0.467SS..Hα-helixtrans-68.2-46.9173.4-79.5164000112.2L503 L504 Q509 Q510 F511L503-L507 WeakPolarHBondContact O-CB 3.36Å; L503-L507 WeakPolarHBondContact O-CG 3.46Å; L503-L507 PolarHBondContact O-N 3.04Å; L504-L507 PolarHBondContact O-N 2.93Å; L507-Q509 VanDerWaalsContact C-N 3.27Å; L507-Q509 PolarHBondContact O-N 2.86Å; L507-Q510 WeakPolarHBondContact O-CA 3.39Å; L507-Q510 WeakPolarHBondContact O-CB 3.31Å; L507-Q510 PolarHBondContact O-N 3.35Å; L507-F511 HydrophobicContact CB-CE2 4.42Å; L507-F511 WeakPolarHBondContact O-CD2 3.22Å; L507-F511 PolarHBondContact O-N 2.96Å
508E80.9Confident84.1Confident131 Ų13197.9 Ų97.961%0.61247%0.47SS*.Hα-helixtrans-57.5-41174.1-74.1171.5174.800110.9L504 F511 E512L504-E508 WeakPolarHBondContact O-CB 3.35Å; L504-E508 WeakPolarHBondContact O-CG 3.39Å; L504-E508 PolarHBondContact O-N 2.7Å; E508-F511 PolarHBondContact O-N 3.08Å; E508-E512 VanDerWaalsContact O-CB 3.27Å; E508-E512 WeakPolarHBondContact O-CB 3.39Å; E508-E512 PolarHBondContact O-N 3.43Å
509Q87.5Confident83.9Confident111 Ų11194.8 Ų94.852%0.51946%0.458SS..Hα-helixtrans-68.6-31.6174.6-166.7-170.893.900112.9A505 L507 K513A505-Q509 VanDerWaalsContact O-CB 3.26Å; A505-Q509 WeakPolarHBondContact O-CB 3.44Å; A505-Q509 PolarHBondContact O-N 2.63Å; L507-Q509 VanDerWaalsContact C-N 3.27Å; L507-Q509 PolarHBondContact O-N 2.86Å; Q509-K513 HydrophobicContact CG-CD 4.4Å; Q509-K513 WeakPolarHBondContact O-CB 3.35Å; Q509-K513 WeakPolarHBondContact O-CD 3.36Å; Q509-K513 VanDerWaalsContact O-CG 3.23Å; Q509-K513 WeakPolarHBondContact O-CG 3.23Å; Q509-K513 PolarHBondContact O-N 3.49Å; Q509-K513 VanDerWaalsContact O-N 3.07Å
510Q79.9Confident84.1Confident109 Ų10997.5 Ų97.551%0.50947%0.468SS..Hα-helixtrans-68.1-50.5172.7-75.7174.330.100110.8E506 L507 E512 K513 E514E506-Q510 WeakPolarHBondContact O-CG 3.34Å; E506-Q510 PolarHBondContact O-N 3.19Å; L507-Q510 WeakPolarHBondContact O-CA 3.39Å; L507-Q510 WeakPolarHBondContact O-CB 3.31Å; L507-Q510 PolarHBondContact O-N 3.35Å; Q510-E512 VanDerWaalsContact C-N 3.29Å; Q510-E512 PolarHBondContact O-N 3.22Å; Q510-K513 WeakPolarHBondContact O-CB 3.46Å; Q510-K513 PolarHBondContact O-N 2.98Å; Q510-K513 VanDerWaalsContact O-N 3.15Å; Q510-E514 WeakPolarHBondContact O-CG 3.27Å; Q510-E514 PolarHBondContact O-N 2.84Å
511F82.1Confident84Confident136 Ų13697.8 Ų97.860%0.59647%0.471SS*.Hα-helixtrans-58.4-39.5175.3-71.1-56.3000112.4L507 E508 E514 R515L507-F511 HydrophobicContact CB-CE2 4.42Å; L507-F511 WeakPolarHBondContact O-CD2 3.22Å; L507-F511 PolarHBondContact O-N 2.96Å; E508-F511 PolarHBondContact O-N 3.08Å; F511-E514 PolarHBondContact O-N 3.3Å; F511-R515 VanDerWaalsContact O-CB 3.22Å; F511-R515 WeakPolarHBondContact O-CB 3.23Å; F511-R515 PolarHBondContact O-N 2.86Å
512E85.9Confident84.2Confident84 Ų84100 Ų10039%0.39348%0.477SS..Hα-helixtrans-70.8-33.1178.5-16965.4-179.800112.2E508 Q510 R515 L516E508-E512 VanDerWaalsContact O-CB 3.27Å; E508-E512 WeakPolarHBondContact O-CB 3.39Å; E508-E512 PolarHBondContact O-N 3.43Å; Q510-E512 VanDerWaalsContact C-N 3.29Å; Q510-E512 PolarHBondContact O-N 3.22Å; E512-R515 IonicContact OE1-CZ 2.7Å; E512-R515 IonicContact OE1-NE 3.63Å; E512-R515 PolarHBondContact OE1-NE 3.29Å; E512-R515 IonicContact OE1-NH2 2.75Å; E512-R515 PolarHBondContact OE1-NH2 2.98Å; E512-R515 IonicContact OE2-CZ 3.1Å; E512-R515 IonicContact OE2-NE 3.95Å; E512-R515 PolarHBondContact OE2-NE 2.78Å; E512-R515 IonicContact OE2-NH2 3.34Å; E512-L516 HydrophobicContact CG-CD1 4.41Å; E512-L516 WeakPolarHBondContact O-CB 2.95Å; E512-L516 WeakPolarHBondContact O-CD1 3.36Å; E512-L516 WeakPolarHBondContact O-CG 3.19Å; E512-L516 PolarHBondContact O-N 2.92Å
513K86.5Confident83.9Confident120 Ų12097.5 Ų97.552%0.52248%0.476SS..Hα-helixtrans-66.8-44.1170.2-77.2164.7176165.80112Q509 Q510 L516 S517Q509-K513 HydrophobicContact CG-CD 4.4Å; Q509-K513 WeakPolarHBondContact O-CB 3.35Å; Q509-K513 WeakPolarHBondContact O-CD 3.36Å; Q509-K513 VanDerWaalsContact O-CG 3.23Å; Q509-K513 WeakPolarHBondContact O-CG 3.23Å; Q509-K513 PolarHBondContact O-N 3.49Å; Q509-K513 VanDerWaalsContact O-N 3.07Å; Q510-K513 WeakPolarHBondContact O-CB 3.46Å; Q510-K513 PolarHBondContact O-N 2.98Å; Q510-K513 VanDerWaalsContact O-N 3.15Å; K513-L516 PolarHBondContact O-N 3.01Å; K513-S517 PolarHBondContact O-N 3.37Å; K513-S517 PolarHBondContact O-OG 3Å
514E80.8Confident84Confident112 Ų11297.7 Ų97.752%0.52348%0.477SS..Hα-helixtrans-62.4-47.7175.9-72-177.4168.700110.4Q510 F511 L516 S517 L518Q510-E514 WeakPolarHBondContact O-CG 3.27Å; Q510-E514 PolarHBondContact O-N 2.84Å; F511-E514 PolarHBondContact O-N 3.3Å; E514-L516 PolarHBondContact O-N 3.23Å; E514-S517 PolarHBondContact O-N 2.76Å; E514-S517 VanDerWaalsContact O-N 3.16Å; E514-S517 PolarHBondContact O-OG 2.88Å; E514-L518 WeakPolarHBondContact O-CG 3.14Å; E514-L518 PolarHBondContact O-N 3.47Å
515R89.7Confident84.1Confident111 Ų11198.7 Ų98.742%0.41948%0.482SS..Hα-helixtrans-55.3-48175.3-166.7-17575.374.4-3.6111.8F511 E512 L518 E519F511-R515 VanDerWaalsContact O-CB 3.22Å; F511-R515 WeakPolarHBondContact O-CB 3.23Å; F511-R515 PolarHBondContact O-N 2.86Å; E512-R515 IonicContact OE1-CZ 2.7Å; E512-R515 IonicContact OE1-NE 3.63Å; E512-R515 PolarHBondContact OE1-NE 3.29Å; E512-R515 IonicContact OE1-NH2 2.75Å; E512-R515 PolarHBondContact OE1-NH2 2.98Å; E512-R515 IonicContact OE2-CZ 3.1Å; E512-R515 IonicContact OE2-NE 3.95Å; E512-R515 PolarHBondContact OE2-NE 2.78Å; E512-R515 IonicContact OE2-NH2 3.34Å; R515-L518 PolarHBondContact O-N 2.86Å; R515-E519 IonicContact NH1-OE2 2.84Å; R515-E519 PolarHBondContact NH1-OE2 2.7Å; R515-E519 WeakPolarHBondContact O-CB 3.13Å; R515-E519 PolarHBondContact O-N 3.1Å
516L85.6Confident84Confident85 Ų8599 Ų9945%0.44548%0.481SS..Hα-helixtrans-61.8-44.6176.6-75167.7000111.8E512 K513 E514 L518 E519 E520E512-L516 HydrophobicContact CG-CD1 4.41Å; E512-L516 WeakPolarHBondContact O-CB 2.95Å; E512-L516 WeakPolarHBondContact O-CD1 3.36Å; E512-L516 WeakPolarHBondContact O-CG 3.19Å; E512-L516 PolarHBondContact O-N 2.92Å; K513-L516 PolarHBondContact O-N 3.01Å; E514-L516 PolarHBondContact O-N 3.23Å; L516-L518 VanDerWaalsContact C-N 3.32Å; L516-L518 PolarHBondContact O-N 3.39Å; L516-E519 WeakPolarHBondContact O-CB 3.49Å; L516-E519 PolarHBondContact O-N 2.73Å; L516-E519 VanDerWaalsContact O-N 3.15Å; L516-E520 WeakPolarHBondContact O-CG 3.27Å; L516-E520 PolarHBondContact O-N 3.42Å
517S86Confident83.9Confident44 Ų44101.2 Ų101.231%0.30849%0.492SS..Hα-helixtrans-66.5-31178.471.90000113.6K513 E514 Q521K513-S517 PolarHBondContact O-N 3.37Å; K513-S517 PolarHBondContact O-OG 3Å; E514-S517 PolarHBondContact O-N 2.76Å; E514-S517 VanDerWaalsContact O-N 3.16Å; E514-S517 PolarHBondContact O-OG 2.88Å; S517-Q521 VanDerWaalsContact O-CG 3.26Å; S517-Q521 WeakPolarHBondContact O-CG 3.45Å; S517-Q521 PolarHBondContact O-N 3.21Å
518L79.5Confident84Confident107 Ų107102 Ų10256%0.5649%0.493SS*.Hα-helixtrans-72.3-36.3171.8-70.2169.7000111.7E514 R515 L516 Q521 K522E514-L518 WeakPolarHBondContact O-CG 3.14Å; E514-L518 PolarHBondContact O-N 3.47Å; R515-L518 PolarHBondContact O-N 2.86Å; L516-L518 VanDerWaalsContact C-N 3.32Å; L516-L518 PolarHBondContact O-N 3.39Å; L518-Q521 PolarHBondContact O-N 2.75Å; L518-K522 WeakPolarHBondContact O-CB 3.5Å; L518-K522 PolarHBondContact O-N 2.67Å
519E82.6Confident83.9Confident70 Ų70100.8 Ų100.833%0.32749%0.49SS..Hα-helixtrans-68.1-36.1173.7-150.482-112.500111.6R515 L516 K522 T523R515-E519 IonicContact NH1-OE2 2.84Å; R515-E519 PolarHBondContact NH1-OE2 2.7Å; R515-E519 WeakPolarHBondContact O-CB 3.13Å; R515-E519 PolarHBondContact O-N 3.1Å; L516-E519 WeakPolarHBondContact O-CB 3.49Å; L516-E519 PolarHBondContact O-N 2.73Å; L516-E519 VanDerWaalsContact O-N 3.15Å; E519-K522 WeakPolarHBondContact OE1-CD 3.12Å; E519-K522 WeakPolarHBondContact OE1-CE 3.1Å; E519-K522 IonicContact OE1-NZ 3.67Å; E519-K522 PolarHBondContact OE1-NZ 2.8Å; E519-T523 WeakPolarHBondContact O-CB 3.12Å; E519-T523 WeakPolarHBondContact O-CG2 3.48Å; E519-T523 PolarHBondContact O-N 3.36Å; E519-T523 PolarHBondContact O-OG1 2.73Å
520E86.2Confident83.8Confident134 Ų13498.7 Ų98.763%0.62648%0.482SS*.Hα-helixtrans-65.3-45.6171.2-74.9176.417000111.7L516 K522 T523 L524L516-E520 WeakPolarHBondContact O-CG 3.27Å; L516-E520 PolarHBondContact O-N 3.42Å; E520-K522 PolarHBondContact O-N 3.2Å; E520-T523 WeakPolarHBondContact CA-OG1 3.46Å; E520-T523 PolarHBondContact O-N 2.79Å; E520-T523 PolarHBondContact O-OG1 2.92Å; E520-T523 VanDerWaalsContact O-OG1 3.06Å; E520-L524 WeakPolarHBondContact O-CB 3.5Å; E520-L524 PolarHBondContact O-N 3.42Å
521Q83.5Confident84Confident112 Ų11299.5 Ų99.552%0.52349%0.486SS..Hα-helixtrans-62.9-42.6175-73.4170.23400111.9S517 L518 L524 L525S517-Q521 VanDerWaalsContact O-CG 3.26Å; S517-Q521 WeakPolarHBondContact O-CG 3.45Å; S517-Q521 PolarHBondContact O-N 3.21Å; L518-Q521 PolarHBondContact O-N 2.75Å; Q521-L524 PolarHBondContact O-N 3.37Å; Q521-L525 WeakPolarHBondContact O-CB 3.34Å; Q521-L525 WeakPolarHBondContact O-CG 3.05Å; Q521-L525 PolarHBondContact O-N 2.94Å
522K87.8Confident84Confident128 Ų12898.3 Ų98.356%0.55748%0.484SS*.Hα-helixtrans-63.7-41176.4172.1-176.9161.7-162.10112.7L518 E519 E520 S526L518-K522 WeakPolarHBondContact O-CB 3.5Å; L518-K522 PolarHBondContact O-N 2.67Å; E519-K522 WeakPolarHBondContact OE1-CD 3.12Å; E519-K522 WeakPolarHBondContact OE1-CE 3.1Å; E519-K522 IonicContact OE1-NZ 3.67Å; E519-K522 PolarHBondContact OE1-NZ 2.8Å; E520-K522 PolarHBondContact O-N 3.2Å; K522-S526 PolarHBondContact O-N 2.79Å
523T82.8Confident83.9Confident75 Ų75101.3 Ų101.346%0.4649%0.491SS..Hα-helixtrans-71.2-38.1177.444.90000111.9E519 E520 S526 Q527E519-T523 WeakPolarHBondContact O-CB 3.12Å; E519-T523 WeakPolarHBondContact O-CG2 3.48Å; E519-T523 PolarHBondContact O-N 3.36Å; E519-T523 PolarHBondContact O-OG1 2.73Å; E520-T523 WeakPolarHBondContact CA-OG1 3.46Å; E520-T523 PolarHBondContact O-N 2.79Å; E520-T523 PolarHBondContact O-OG1 2.92Å; E520-T523 VanDerWaalsContact O-OG1 3.06Å; T523-S526 PolarHBondContact O-N 3.22Å; T523-Q527 WeakPolarHBondContact O-CG 3.12Å; T523-Q527 PolarHBondContact O-N 3.44Å
524L86.7Confident83.7Confident97 Ų97102.5 Ų102.551%0.50850%0.499SS..Hα-helixtrans-61.2-43.6172.2-170.871.3000112.1E520 Q521 Q527 Q528E520-L524 WeakPolarHBondContact O-CB 3.5Å; E520-L524 PolarHBondContact O-N 3.42Å; Q521-L524 PolarHBondContact O-N 3.37Å; L524-Q527 PolarHBondContact O-N 2.81Å; L524-Q528 WeakPolarHBondContact O-CG 3.5Å; L524-Q528 PolarHBondContact O-N 2.86Å
525L81.6Confident83.8Confident102 Ų102102.1 Ų102.153%0.53450%0.497SS..Hα-helixtrans-65.5-35.3174.6-74.7167.9000112.7Q521 L529Q521-L525 WeakPolarHBondContact O-CB 3.34Å; Q521-L525 WeakPolarHBondContact O-CG 3.05Å; Q521-L525 PolarHBondContact O-N 2.94Å; L525-L529 WeakPolarHBondContact O-CG 3.39Å; L525-L529 PolarHBondContact O-N 2.85Å; L525-L529 VanDerWaalsContact O-N 3.12Å
526S81Confident83.2Confident56 Ų56102.1 Ų102.139%0.39251%0.505SS..Hα-helixtrans-66.2-43.8173.4-161.40000111.4K522 T523 Q528 L529 D530K522-S526 PolarHBondContact O-N 2.79Å; T523-S526 PolarHBondContact O-N 3.22Å; S526-Q528 VanDerWaalsContact C-N 3.35Å; S526-Q528 PolarHBondContact O-N 2.71Å; S526-L529 PolarHBondContact O-N 3.03Å; S526-L529 VanDerWaalsContact O-N 3.14Å; S526-D530 PolarHBondContact O-N 3.42Å; S526-D530 PolarHBondContact OG-OD2 3.45Å
527Q83.1Confident83Confident120 Ų120101.5 Ų101.556%0.56151%0.505SS*.Hα-helixtrans-58.4-45.9176.1-75.5176.1-18.700111.4T523 L524 L529 D530 E531T523-Q527 WeakPolarHBondContact O-CG 3.12Å; T523-Q527 PolarHBondContact O-N 3.44Å; L524-Q527 PolarHBondContact O-N 2.81Å; Q527-L529 VanDerWaalsContact C-N 3.31Å; Q527-L529 PolarHBondContact O-N 3.35Å; Q527-D530 PolarHBondContact O-N 3.04Å; Q527-D530 VanDerWaalsContact O-N 3.14Å; Q527-E531 WeakPolarHBondContact O-CB 3.08Å; Q527-E531 WeakPolarHBondContact O-CG 3.04Å; Q527-E531 PolarHBondContact O-N 3.39Å
528Q83.8Confident82.7Confident97 Ų97102 Ų10245%0.45351%0.508SS..Hα-helixtrans-61-36.4175.8-70.9175-2.600113.2L524 S526 M532L524-Q528 WeakPolarHBondContact O-CG 3.5Å; L524-Q528 PolarHBondContact O-N 2.86Å; S526-Q528 VanDerWaalsContact C-N 3.35Å; S526-Q528 PolarHBondContact O-N 2.71Å; Q528-M532 WeakPolarHBondContact O-CB 3.4Å; Q528-M532 VanDerWaalsContact O-CG 3.22Å; Q528-M532 WeakPolarHBondContact O-CG 3.4Å; Q528-M532 PolarHBondContact O-N 2.86Å
529L80.4Confident82.9Confident106 Ų106102.6 Ų102.656%0.55551%0.506SS*.Hα-helixtrans-69.8-36.4174.7-74.7170.4000112.5L525 S526 Q527 R533L525-L529 WeakPolarHBondContact O-CG 3.39Å; L525-L529 PolarHBondContact O-N 2.85Å; L525-L529 VanDerWaalsContact O-N 3.12Å; S526-L529 PolarHBondContact O-N 3.03Å; S526-L529 VanDerWaalsContact O-N 3.14Å; Q527-L529 VanDerWaalsContact C-N 3.31Å; Q527-L529 PolarHBondContact O-N 3.35Å; L529-R533 WeakPolarHBondContact O-CD 3.38Å; L529-R533 VanDerWaalsContact O-CG 3.23Å; L529-R533 WeakPolarHBondContact O-CG 3.44Å; L529-R533 PolarHBondContact O-N 2.98Å; L529-R533 VanDerWaalsContact O-N 3.1Å
530D83.6Confident82.8Confident67 Ų67104.5 Ų104.536%0.35852%0.518SS..Hα-helixtrans-78.2-37.6-179.7-68.8-42.2000112.3S526 Q527 M532 R533 E534S526-D530 PolarHBondContact O-N 3.42Å; S526-D530 PolarHBondContact OG-OD2 3.45Å; Q527-D530 PolarHBondContact O-N 3.04Å; Q527-D530 VanDerWaalsContact O-N 3.14Å; D530-M532 VanDerWaalsContact C-N 3.34Å; D530-M532 PolarHBondContact O-N 3.48Å; D530-R533 WeakPolarHBondContact O-CB 3.5Å; D530-R533 PolarHBondContact O-N 2.89Å; D530-R533 VanDerWaalsContact O-N 3.08Å; D530-R533 VanDerWaalsContact OD1-CD 3.29Å; D530-R533 WeakPolarHBondContact OD1-CD 3.46Å; D530-R533 IonicContact OD1-CZ 2.68Å; D530-R533 IonicContact OD1-NE 2.64Å; D530-R533 IonicContact OD1-NH1 3.97Å; D530-R533 PolarHBondContact OD1-NH1 3.02Å; D530-E534 PolarHBondContact O-N 2.7Å
531E85.7Confident82.6Confident126 Ų126105.3 Ų105.359%0.58952%0.516SS*.Hα-helixtrans-56.7-46.2167.5-73.4176158.900111.3Q527 R533 E534 E535Q527-E531 WeakPolarHBondContact O-CB 3.08Å; Q527-E531 WeakPolarHBondContact O-CG 3.04Å; Q527-E531 PolarHBondContact O-N 3.39Å; E531-R533 VanDerWaalsContact C-N 3.28Å; E531-R533 PolarHBondContact O-N 3.34Å; E531-E534 PolarHBondContact O-N 2.82Å; E531-E535 PolarHBondContact O-N 3.45Å
532M80.8Confident82.3Confident111 Ų111102.7 Ų102.755%0.54751%0.513SS..Hα-helixtrans-63.4-31.2175.2-76-69.3-66.100112.9Q528 D530 L536Q528-M532 WeakPolarHBondContact O-CB 3.4Å; Q528-M532 VanDerWaalsContact O-CG 3.22Å; Q528-M532 WeakPolarHBondContact O-CG 3.4Å; Q528-M532 PolarHBondContact O-N 2.86Å; D530-M532 VanDerWaalsContact C-N 3.34Å; D530-M532 PolarHBondContact O-N 3.48Å; M532-L536 WeakPolarHBondContact O-CB 3.48Å; M532-L536 WeakPolarHBondContact O-CD1 3.35Å; M532-L536 VanDerWaalsContact O-CG 3.27Å; M532-L536 WeakPolarHBondContact O-CG 3.41Å; M532-L536 PolarHBondContact O-N 2.88Å; M532-L536 VanDerWaalsContact O-N 3.12Å
533R84.3Confident81.8Confident147 Ų14799.1 Ų99.156%0.55551%0.507SS*.Hα-helixtrans-72.3-38.9173.5-73.6159.1170.2172.9-1.2111.9L529 D530 E531 L536 T537L529-R533 WeakPolarHBondContact O-CD 3.38Å; L529-R533 VanDerWaalsContact O-CG 3.23Å; L529-R533 WeakPolarHBondContact O-CG 3.44Å; L529-R533 PolarHBondContact O-N 2.98Å; L529-R533 VanDerWaalsContact O-N 3.1Å; D530-R533 WeakPolarHBondContact O-CB 3.5Å; D530-R533 PolarHBondContact O-N 2.89Å; D530-R533 VanDerWaalsContact O-N 3.08Å; D530-R533 VanDerWaalsContact OD1-CD 3.29Å; D530-R533 WeakPolarHBondContact OD1-CD 3.46Å; D530-R533 IonicContact OD1-CZ 2.68Å; D530-R533 IonicContact OD1-NE 2.64Å; D530-R533 IonicContact OD1-NH1 3.97Å; D530-R533 PolarHBondContact OD1-NH1 3.02Å; E531-R533 VanDerWaalsContact C-N 3.28Å; E531-R533 PolarHBondContact O-N 3.34Å; R533-L536 PolarHBondContact O-N 3.28Å; R533-T537 WeakPolarHBondContact O-CB 3.39Å; R533-T537 WeakPolarHBondContact O-CG2 3.48Å; R533-T537 PolarHBondContact O-N 3.46Å; R533-T537 PolarHBondContact O-OG1 3.32Å
534E83.2Confident81.5Confident145 Ų145100.4 Ų100.468%0.67851%0.511SS*.Hα-helixtrans-68.2-38.9174.8-67.7-155.3146.100112D530 E531 L536 T537 S538D530-E534 PolarHBondContact O-N 2.7Å; E531-E534 PolarHBondContact O-N 2.82Å; E534-L536 PolarHBondContact O-N 3.27Å; E534-T537 WeakPolarHBondContact CA-OG1 3.21Å; E534-T537 PolarHBondContact O-OG1 2.92Å; E534-S538 VanDerWaalsContact O-CB 3.29Å; E534-S538 WeakPolarHBondContact O-CB 3.22Å; E534-S538 PolarHBondContact O-N 2.85Å; E534-S538 PolarHBondContact O-OG 3.27Å
535E82Confident81.2Confident104 Ų104101.6 Ų101.649%0.48651%0.514SS..Hα-helixtrans-60.4-43.2170.8-87.4-147.2-173.500112.5E531 S538 K539E531-E535 PolarHBondContact O-N 3.45Å; E535-S538 WeakPolarHBondContact CA-OG 3.2Å; E535-S538 PolarHBondContact O-OG 2.84Å; E535-K539 WeakPolarHBondContact O-CB 3.41Å; E535-K539 WeakPolarHBondContact O-CD 3.48Å; E535-K539 WeakPolarHBondContact O-CE 3.46Å; E535-K539 WeakPolarHBondContact O-CG 3.48Å; E535-K539 PolarHBondContact O-N 3Å; E535-K539 IonicContact OE2-NZ 3.74Å; E535-K539 PolarHBondContact OE2-NZ 3.43Å
536L77.9Confident80.9Confident111 Ų111100.7 Ų100.758%0.58151%0.507SS*.Hα-helixtrans-71.4-40179.8-73.2168.8000112.3M532 R533 E534 L540M532-L536 WeakPolarHBondContact O-CB 3.48Å; M532-L536 WeakPolarHBondContact O-CD1 3.35Å; M532-L536 VanDerWaalsContact O-CG 3.27Å; M532-L536 WeakPolarHBondContact O-CG 3.41Å; M532-L536 PolarHBondContact O-N 2.88Å; M532-L536 VanDerWaalsContact O-N 3.12Å; R533-L536 PolarHBondContact O-N 3.28Å; E534-L536 PolarHBondContact O-N 3.27Å; L536-L540 WeakPolarHBondContact O-CB 3.36Å; L536-L540 PolarHBondContact O-N 2.81Å
537T81.2Confident80.7Confident72 Ų72101.6 Ų101.644%0.44251%0.51SS..Hα-helixtrans-74.9-29179.452.60000113.4R533 E534 R541R533-T537 WeakPolarHBondContact O-CB 3.39Å; R533-T537 WeakPolarHBondContact O-CG2 3.48Å; R533-T537 PolarHBondContact O-N 3.46Å; R533-T537 PolarHBondContact O-OG1 3.32Å; E534-T537 WeakPolarHBondContact CA-OG1 3.21Å; E534-T537 PolarHBondContact O-OG1 2.92Å; T537-R541 WeakPolarHBondContact O-CB 3.35Å; T537-R541 PolarHBondContact O-N 3.44Å
538S80.3Confident80.3Confident54 Ų5499.3 Ų99.338%0.37851%0.507SS..Hα-helixtrans-69.6-42.6170.354.20000112.1E534 E535 L540 R541 A542E534-S538 VanDerWaalsContact O-CB 3.29Å; E534-S538 WeakPolarHBondContact O-CB 3.22Å; E534-S538 PolarHBondContact O-N 2.85Å; E534-S538 PolarHBondContact O-OG 3.27Å; E535-S538 WeakPolarHBondContact CA-OG 3.2Å; E535-S538 PolarHBondContact O-OG 2.84Å; S538-L540 VanDerWaalsContact C-N 3.34Å; S538-L540 PolarHBondContact O-N 3.5Å; S538-R541 WeakPolarHBondContact O-CB 3.43Å; S538-R541 PolarHBondContact O-N 2.93Å; S538-A542 PolarHBondContact O-N 3.37Å
539K82.1Confident80.1Confident120 Ų120100.8 Ų100.852%0.52251%0.509SS..Hα-helixtrans-60.5-40.4172.6-70163.3-163.2168.60112.2E535 A543E535-K539 WeakPolarHBondContact O-CB 3.41Å; E535-K539 WeakPolarHBondContact O-CD 3.48Å; E535-K539 WeakPolarHBondContact O-CE 3.46Å; E535-K539 WeakPolarHBondContact O-CG 3.48Å; E535-K539 PolarHBondContact O-N 3Å; E535-K539 IonicContact OE2-NZ 3.74Å; E535-K539 PolarHBondContact OE2-NZ 3.43Å; K539-A543 PolarHBondContact O-N 2.76Å
540L81.1Confident79.6Confident110 Ų110100 Ų10058%0.57651%0.505SS*.Hα-helixtrans-64.4-38.5174.7-174.269.5000112.5L536 S538 A543 N544L536-L540 WeakPolarHBondContact O-CB 3.36Å; L536-L540 PolarHBondContact O-N 2.81Å; S538-L540 VanDerWaalsContact C-N 3.34Å; S538-L540 PolarHBondContact O-N 3.5Å; L540-A543 PolarHBondContact O-N 2.71Å; L540-N544 PolarHBondContact O-N 2.84Å
541R81.3Confident79Confident152 Ų152101.7 Ų101.757%0.57451%0.511SS*.Hα-helixtrans-63.2-48.5179.9-164.5-175.9-54.1160.27.9111.9T537 S538 A543 N544 E545T537-R541 WeakPolarHBondContact O-CB 3.35Å; T537-R541 PolarHBondContact O-N 3.44Å; S538-R541 WeakPolarHBondContact O-CB 3.43Å; S538-R541 PolarHBondContact O-N 2.93Å; R541-A543 VanDerWaalsContact C-N 3.26Å; R541-A543 PolarHBondContact O-N 3.37Å; R541-N544 PolarHBondContact O-N 2.96Å; R541-N544 VanDerWaalsContact O-N 3.11Å; R541-E545 WeakPolarHBondContact CG-OE1 3.44Å; R541-E545 PolarHBondContact O-N 3Å; R541-E545 VanDerWaalsContact O-N 3.11Å
542A78.4Confident78.1Confident57 Ų57102.5 Ų102.547%0.47151%0.514SS..Hα-helixtrans-59-35.717800000112.8S538 E546S538-A542 PolarHBondContact O-N 3.37Å; A542-E546 PolarHBondContact O-N 2.74Å
543A75.9Confident77.4Confident53 Ų53103 Ų10344%0.43852%0.515SS..Hα-helixtrans-66.8-39.2175.800000112.9K539 L540 R541 V547K539-A543 PolarHBondContact O-N 2.76Å; L540-A543 PolarHBondContact O-N 2.71Å; R541-A543 VanDerWaalsContact C-N 3.26Å; R541-A543 PolarHBondContact O-N 3.37Å; A543-V547 WeakPolarHBondContact O-CG2 3.41Å; A543-V547 PolarHBondContact O-N 3.22Å
544N76.6Confident76.3Confident102 Ų102100.7 Ų100.755%0.54552%0.517SS..Hα-helixtrans-70.6-33.2177.4-83.4-11.3000113.1L540 R541 V547 S548L540-N544 PolarHBondContact O-N 2.84Å; R541-N544 PolarHBondContact O-N 2.96Å; R541-N544 VanDerWaalsContact O-N 3.11Å; N544-V547 PolarHBondContact O-N 2.78Å; N544-S548 WeakPolarHBondContact O-CB 3.33Å; N544-S548 PolarHBondContact O-N 2.9Å; N544-S548 PolarHBondContact O-OG 2.73Å
545E80.2Confident75.2Confident122 Ų122101.1 Ų101.157%0.5751%0.513SS*.Hα-helixtrans-64.4-41.5175.9-71.8167.2-173.100111R541 S548 R549R541-E545 WeakPolarHBondContact CG-OE1 3.44Å; R541-E545 PolarHBondContact O-N 3Å; R541-E545 VanDerWaalsContact O-N 3.11Å; E545-S548 WeakPolarHBondContact O-CB 3.27Å; E545-S548 PolarHBondContact O-N 3.39Å; E545-R549 PolarHBondContact O-N 2.76Å; E545-R549 VanDerWaalsContact O-N 3.13Å
546E77.3Confident73.8Confident83 Ų83104 Ų10439%0.38852%0.524SS..Hα-helixtrans-67-40.8175.817960.7-174.400113.1A542 S548 R549 L550A542-E546 PolarHBondContact O-N 2.74Å; E546-S548 VanDerWaalsContact C-N 3.26Å; E546-S548 PolarHBondContact O-N 3.48Å; E546-R549 VanDerWaalsContact CD-NH2 3.31Å; E546-R549 WeakPolarHBondContact O-CB 3.24Å; E546-R549 PolarHBondContact O-N 2.85Å; E546-R549 IonicContact OE1-CZ 3.52Å; E546-R549 IonicContact OE1-NE 3.42Å; E546-R549 IonicContact OE1-NH2 3.28Å; E546-R549 PolarHBondContact OE1-NH2 3.3Å; E546-R549 IonicContact OE2-CZ 2.68Å; E546-R549 IonicContact OE2-NE 2.64Å; E546-R549 PolarHBondContact OE2-NE 3.33Å; E546-R549 IonicContact OE2-NH2 3.48Å; E546-R549 PolarHBondContact OE2-NH2 2.79Å; E546-R549 VanDerWaalsContact OE2-NH2 3.1Å; E546-L550 PolarHBondContact O-N 2.93Å
547V75.6Confident72.7Confident74 Ų74101.5 Ų101.545%0.44853%0.525SS..Hα-helixtrans-61.1-38.2173.3171.20000111.3A543 N544 R549 L550 Q551A543-V547 WeakPolarHBondContact O-CG2 3.41Å; A543-V547 PolarHBondContact O-N 3.22Å; N544-V547 PolarHBondContact O-N 2.78Å; V547-R549 VanDerWaalsContact C-N 3.34Å; V547-R549 PolarHBondContact O-N 3.24Å; V547-L550 PolarHBondContact O-N 3.03Å; V547-Q551 WeakPolarHBondContact O-CG 3.2Å; V547-Q551 PolarHBondContact O-N 2.73Å
548S75Confident71.1Confident72 Ų72105.2 Ų105.250%0.50354%0.537SS..Hα-helixtrans-66.6-35.5179.1-57.30000112.3N544 E545 E546 Q551N544-S548 WeakPolarHBondContact O-CB 3.33Å; N544-S548 PolarHBondContact O-N 2.9Å; N544-S548 PolarHBondContact O-OG 2.73Å; E545-S548 WeakPolarHBondContact O-CB 3.27Å; E545-S548 PolarHBondContact O-N 3.39Å; E546-S548 VanDerWaalsContact C-N 3.26Å; E546-S548 PolarHBondContact O-N 3.48Å; S548-Q551 PolarHBondContact O-N 3.44Å
549R79.7Confident69.4Low129 Ų129110.5 Ų110.549%0.48756%0.556SS.*Hα-helixtrans-60.2-50.5175.6-171.5170.573.598.7-3.4111.7E545 E546 V547 Q551 Q552E545-R549 PolarHBondContact O-N 2.76Å; E545-R549 VanDerWaalsContact O-N 3.13Å; E546-R549 VanDerWaalsContact CD-NH2 3.31Å; E546-R549 WeakPolarHBondContact O-CB 3.24Å; E546-R549 PolarHBondContact O-N 2.85Å; E546-R549 IonicContact OE1-CZ 3.52Å; E546-R549 IonicContact OE1-NE 3.42Å; E546-R549 IonicContact OE1-NH2 3.28Å; E546-R549 PolarHBondContact OE1-NH2 3.3Å; E546-R549 IonicContact OE2-CZ 2.68Å; E546-R549 IonicContact OE2-NE 2.64Å; E546-R549 PolarHBondContact OE2-NE 3.33Å; E546-R549 IonicContact OE2-NH2 3.48Å; E546-R549 PolarHBondContact OE2-NH2 2.79Å; E546-R549 VanDerWaalsContact OE2-NH2 3.1Å; V547-R549 VanDerWaalsContact C-N 3.34Å; V547-R549 PolarHBondContact O-N 3.24Å; R549-Q551 VanDerWaalsContact C-N 3.31Å; R549-Q551 PolarHBondContact O-N 3.13Å; R549-Q552 WeakPolarHBondContact O-CB 3.11Å; R549-Q552 PolarHBondContact O-N 2.89Å
550L70.4Confident67.6Low88 Ų88111.5 Ų111.546%0.46157%0.567SS.*Hα-helixtrans-61.9-36.9-179.5-64.7169.9000112.5E546 V547 Q552 E553E546-L550 PolarHBondContact O-N 2.93Å; V547-L550 PolarHBondContact O-N 3.03Å; L550-Q552 PolarHBondContact O-N 3.44Å; L550-E553 PolarHBondContact O-N 3.06Å
551Q69.8Low65.8Low104 Ų104116 Ų11649%0.48658%0.582SS.*Hα-helixtrans-68.7-11.8176.1-69.8-174.716.500114.6V547 S548 R549 R555V547-Q551 WeakPolarHBondContact O-CG 3.2Å; V547-Q551 PolarHBondContact O-N 2.73Å; S548-Q551 PolarHBondContact O-N 3.44Å; R549-Q551 VanDerWaalsContact C-N 3.31Å; R549-Q551 PolarHBondContact O-N 3.13Å; Q551-R555 PolarHBondContact O-NE 3.44Å
552Q68.3Low64.5Low142 Ų142112.2 Ų112.266%0.66459%0.591SS**Hα-helixtrans-95.6-23.8179.4-157.1172.731.900112.5R549 L550R549-Q552 WeakPolarHBondContact O-CB 3.11Å; R549-Q552 PolarHBondContact O-N 2.89Å; L550-Q552 PolarHBondContact O-N 3.44Å
553E66.1Low63.1Low122 Ų122114.4 Ų114.457%0.5761%0.609SS**Hα-helixtrans-74-39.6174.7-64.4-174.6158.200111.7L550 R555 K556L550-E553 PolarHBondContact O-N 3.06Å; E553-R555 PolarHBondContact O-N 2.94Å; E553-K556 PolarHBondContact O-N 3.03Å
554V59.9Low61.9Low99 Ų99115.5 Ų115.560%0.662%0.618SS**Hα-helixtrans-58.2-44.7179.3176.60000112.4K556 G557V554-K556 PolarHBondContact O-N 3.12Å; V554-K556 VanDerWaalsContact O-N 3.16Å; V554-G557 PolarHBondContact O-N 3.34Å
555R60.3Low60.6Low154 Ų154117 Ų11758%0.58162%0.622SS**G310 helixtrans-65.4-20.3-174.8-59179.4-149.6-145.21.9113.6Q551 E553 G557Q551-R555 PolarHBondContact O-NE 3.44Å; E553-R555 PolarHBondContact O-N 2.94Å; R555-G557 VanDerWaalsContact C-N 3.28Å; R555-G557 PolarHBondContact O-N 2.94Å
556K52.5Low59.5Low164 Ų164114.7 Ų114.771%0.71363%0.631SS**G310 helixtrans-76.3-12.2174.5-75.6-174.1172.4-1790113.7E553 V554E553-K556 PolarHBondContact O-N 3.03Å; V554-K556 PolarHBondContact O-N 3.12Å; V554-K556 VanDerWaalsContact O-N 3.16Å
557G55Low58.3Low59 Ų59118.9 Ų118.961%0.60865%0.65SS**G310 helixtrans-85-6.917700000114.5V554 R555V554-G557 PolarHBondContact O-N 3.34Å; R555-G557 VanDerWaalsContact C-N 3.28Å; R555-G557 PolarHBondContact O-N 2.94Å
558E48.1Very low57.3Low149 Ų149118.4 Ų118.470%0.69664%0.644SS**SBendtrans-100.3-5.7-168.1-60-176.5126.200113.7
559E43.5Very low56.3Low166 Ų166118.3 Ų118.378%0.77664%0.644SS**SBendtrans-89.9-11-170.8-59.9-172.9133.400114.9
560D43.8Very low55.2Low141 Ų141117.1 Ų117.175%0.75465%0.651SS**SBendtrans-87.7-1.7-163.3-88-24.8000117.4
561F44.9Very low54.5Low203 Ų203118.6 Ų118.689%0.8966%0.659SS**  trans-11031.2-167.8-87.1-83.6000116.9A563F561-A563 PolarHBondContact O-N 3.49Å
562G53.6Low53.8Low74 Ų74117.6 Ų117.676%0.76365%0.653SS**  trans-83.634.4-17300000118.8
563A48.7Very low53.4Low103 Ų103117.5 Ų117.585%0.85165%0.653SS**  trans-120.527.4-163.500000117.5F561F561-A563 PolarHBondContact O-N 3.49Å
564A50.8Low53.2Low76 Ų76114.3 Ų114.363%0.62865%0.647SS**  trans-129.610.8-174.300000116.4G566A564-G566 VanDerWaalsContact C-N 3.34Å; A564-G566 PolarHBondContact O-N 3.42Å
565E49.3Very low53.3Low133 Ų133114.3 Ų114.362%0.62164%0.64SS**G310 helixtrans-69.2-20.3-167.6-65.8-158.793.700116.4Q567 I568 K572E565-Q567 VanDerWaalsContact C-N 3.31Å; E565-Q567 PolarHBondContact O-N 3.46Å; E565-I568 WeakPolarHBondContact O-CB 3.35Å; E565-I568 PolarHBondContact O-N 3.48Å; E565-K572 IonicContact OE1-NZ 2.62Å
566G57.3Low53.6Low73 Ų73110.6 Ų110.675%0.75363%0.632SS**G310 helixtrans-64.7-24.2-167.900000116.4A564A564-G566 VanDerWaalsContact C-N 3.34Å; A564-G566 PolarHBondContact O-N 3.42Å
567Q52.5Low54.5Low171 Ų171109.7 Ų109.780%0.79963%0.628SS**G310 helixtrans-100.50.9175.5-70.2-176.9-15.700113E565E565-Q567 VanDerWaalsContact C-N 3.31Å; E565-Q567 PolarHBondContact O-N 3.46Å
568I53.8Low55.1Low64 Ų64112.4 Ų112.433%0.32863%0.628SS.*THydrogen-bonded Turntrans-84.9-20.3-175.8-59.1-175.7000111.4E565 T570 L571 K572E565-I568 WeakPolarHBondContact O-CB 3.35Å; E565-I568 PolarHBondContact O-N 3.48Å; I568-T570 PolarHBondContact O-N 3.22Å; I568-L571 PolarHBondContact O-N 2.95Å; I568-K572 HydrophobicContact CG2-CD 3.98Å; I568-K572 HydrophobicContact CG2-CG 3.99Å; I568-K572 WeakPolarHBondContact O-CB 3.39Å; I568-K572 WeakPolarHBondContact O-CG 3.36Å; I568-K572 PolarHBondContact O-N 3.24Å
569S53.5Low56Low70 Ų70107.6 Ų107.649%0.4961%0.607SS.*Hα-helixtrans-65.6-40.6-175.959.10000114.8K572 E573S569-K572 WeakPolarHBondContact O-CB 2.93Å; S569-K572 PolarHBondContact O-N 3.16Å; S569-E573 PolarHBondContact O-N 3.11Å
570T56.9Low57.5Low105 Ų105106.5 Ų106.564%0.64460%0.602SS**Hα-helixtrans-79.8-21.2178.451.80000113I568I568-T570 PolarHBondContact O-N 3.22Å
571L56.3Low59Low119 Ų119106.4 Ų106.462%0.62360%0.597SS**Hα-helixtrans-76.1-35.4164.3-77.6169.5000111.3I568 A574 Q575I568-L571 PolarHBondContact O-N 2.95Å; L571-A574 PolarHBondContact O-N 2.9Å; L571-Q575 WeakPolarHBondContact O-CB 3.41Å; L571-Q575 PolarHBondContact O-N 2.92Å
572K54.8Low60.3Low83 Ų83100.5 Ų100.536%0.36157%0.574SS.*Hα-helixtrans-54.8-52.9173.1-87.1166.8176.3170.40110.6E565 I568 S569 A574 Q575 D576E565-K572 IonicContact OE1-NZ 2.62Å; I568-K572 HydrophobicContact CG2-CD 3.98Å; I568-K572 HydrophobicContact CG2-CG 3.99Å; I568-K572 WeakPolarHBondContact O-CB 3.39Å; I568-K572 WeakPolarHBondContact O-CG 3.36Å; I568-K572 PolarHBondContact O-N 3.24Å; S569-K572 WeakPolarHBondContact O-CB 2.93Å; S569-K572 PolarHBondContact O-N 3.16Å; K572-A574 PolarHBondContact O-N 2.87Å; K572-Q575 CarbonylContact O-C 3.51Å; K572-Q575 WeakPolarHBondContact O-CA 3.27Å; K572-Q575 WeakPolarHBondContact O-CB 2.9Å; K572-Q575 PolarHBondContact O-N 3.35Å; K572-D576 VanDerWaalsContact C-OD2 3.25Å; K572-D576 VanDerWaalsContact O-CB 3.28Å; K572-D576 WeakPolarHBondContact O-CB 3.41Å; K572-D576 PolarHBondContact O-N 2.84Å; K572-D576 VanDerWaalsContact O-OD2 3.08Å
573E60.5Low61.4Low140 Ų14099.4 Ų99.465%0.65455%0.551SS**Hα-helixtrans-58.7-24.4-178.9-67.2-179-177.900115.6S569S569-E573 PolarHBondContact O-N 3.11Å
574A61.6Low62.7Low55 Ų5596.4 Ų96.446%0.45553%0.526SS..Hα-helixtrans-88.7-38.4172.300000112.4L571 K572 D576 L578L571-A574 PolarHBondContact O-N 2.9Å; K572-A574 PolarHBondContact O-N 2.87Å; A574-D576 VanDerWaalsContact C-N 3.25Å; A574-D576 PolarHBondContact O-N 3.12Å; A574-L578 PolarHBondContact O-N 3.3Å
575Q61Low63.8Low98 Ų9896.4 Ų96.446%0.45852%0.518SS..Hα-helixtrans-63.9-29.3171.5-177.2-176.110.300111.7L571 K572 L578 L579L571-Q575 WeakPolarHBondContact O-CB 3.41Å; L571-Q575 PolarHBondContact O-N 2.92Å; K572-Q575 CarbonylContact O-C 3.51Å; K572-Q575 WeakPolarHBondContact O-CA 3.27Å; K572-Q575 WeakPolarHBondContact O-CB 2.9Å; K572-Q575 PolarHBondContact O-N 3.35Å; Q575-L578 CarbonylContact O-C 3.55Å; Q575-L578 PolarHBondContact O-N 2.85Å; Q575-L579 HydrophobicContact CG-CD1 3.92Å; Q575-L579 HydrophobicContact CG-CG 4.24Å; Q575-L579 WeakPolarHBondContact O-CA 2.88Å; Q575-L579 WeakPolarHBondContact O-CB 3.37Å; Q575-L579 WeakPolarHBondContact O-CG 3.45Å; Q575-L579 PolarHBondContact O-N 3.27Å
576D66.5Low65.3Low77 Ų7794.5 Ų94.541%0.41251%0.505SS..Hα-helixtrans-72.7-38.1-176.6-71.8-28.8000110.4K572 A574 L579 E580K572-D576 VanDerWaalsContact C-OD2 3.25Å; K572-D576 VanDerWaalsContact O-CB 3.28Å; K572-D576 WeakPolarHBondContact O-CB 3.41Å; K572-D576 PolarHBondContact O-N 2.84Å; K572-D576 VanDerWaalsContact O-OD2 3.08Å; A574-D576 VanDerWaalsContact C-N 3.25Å; A574-D576 PolarHBondContact O-N 3.12Å; D576-L579 CarbonylContact O-C 3.55Å; D576-L579 WeakPolarHBondContact O-CB 3.04Å; D576-L579 PolarHBondContact O-N 2.86Å; D576-E580 WeakPolarHBondContact O-CG 3.49Å; D576-E580 PolarHBondContact O-N 3.48Å
577K71.8Confident66.1Low145 Ų14592.6 Ų92.663%0.6348%0.483SS*.Hα-helixtrans-71.6-39.2172.4-68.4172.8-176.5167.20111.9L579 E580 E581K577-L579 PolarHBondContact O-N 3.33Å; K577-E580 PolarHBondContact O-N 3.43Å; K577-E581 PolarHBondContact O-N 3.15Å; K577-E581 VanDerWaalsContact O-N 3.09Å
578L67.1Low67.4Low116 Ų11692.3 Ų92.361%0.60748%0.475SS*.Hα-helixtrans-68.1-25.8169.9-72.5170.1000111.9A574 Q575 L582A574-L578 PolarHBondContact O-N 3.3Å; Q575-L578 CarbonylContact O-C 3.55Å; Q575-L578 PolarHBondContact O-N 2.85Å; L578-L582 WeakPolarHBondContact O-CA 3.18Å; L578-L582 WeakPolarHBondContact O-CB 3.22Å; L578-L582 PolarHBondContact O-N 3.37Å
579L67.9Low68.5Low48 Ų4894.8 Ų94.825%0.25149%0.488SS..Hα-helixtrans-76.8-34.8171.3-83.7166.1000111.1Q575 D576 K577 L582 D583Q575-L579 HydrophobicContact CG-CD1 3.92Å; Q575-L579 HydrophobicContact CG-CG 4.24Å; Q575-L579 WeakPolarHBondContact O-CA 2.88Å; Q575-L579 WeakPolarHBondContact O-CB 3.37Å; Q575-L579 WeakPolarHBondContact O-CG 3.45Å; Q575-L579 PolarHBondContact O-N 3.27Å; D576-L579 CarbonylContact O-C 3.55Å; D576-L579 WeakPolarHBondContact O-CB 3.04Å; D576-L579 PolarHBondContact O-N 2.86Å; K577-L579 PolarHBondContact O-N 3.33Å; L579-L582 HydrophobicContact CD2-CD2 4.43Å; L579-L582 CarbonylContact O-C 3.51Å; L579-L582 PolarHBondContact O-N 3.38Å; L579-D583 WeakPolarHBondContact O-CA 3.48Å; L579-D583 WeakPolarHBondContact O-CB 3.38Å; L579-D583 PolarHBondContact O-N 2.93Å
580E74.8Confident69.6Low143 Ų14397.3 Ų97.367%0.66849%0.486SS*.Hα-helixtrans-62.9-43.1171.2-76.1-179.9144.900110.7D576 K577 A584D576-E580 WeakPolarHBondContact O-CG 3.49Å; D576-E580 PolarHBondContact O-N 3.48Å; K577-E580 PolarHBondContact O-N 3.43Å; E580-A584 WeakPolarHBondContact O-CB 3.2Å; E580-A584 PolarHBondContact O-N 3.21Å
581E74.3Confident70.7Confident138 Ų13898.2 Ų98.265%0.64548%0.483SS*.Hα-helixtrans-70.4-39.2173.8-67.7-172.4165.700112.7K577 T585K577-E581 PolarHBondContact O-N 3.15Å; K577-E581 VanDerWaalsContact O-N 3.09Å; E581-T585 WeakPolarHBondContact O-CB 3.34Å; E581-T585 WeakPolarHBondContact O-CG2 3.48Å; E581-T585 PolarHBondContact O-N 2.64Å; E581-T585 PolarHBondContact O-OG1 2.76Å
582L73.4Confident71.6Confident79 Ų7996.3 Ų96.341%0.41448%0.477SS..Hα-helixtrans-71.3-32.9177.2-174.662.9000112.2L578 L579 T585 R586L578-L582 WeakPolarHBondContact O-CA 3.18Å; L578-L582 WeakPolarHBondContact O-CB 3.22Å; L578-L582 PolarHBondContact O-N 3.37Å; L579-L582 HydrophobicContact CD2-CD2 4.43Å; L579-L582 CarbonylContact O-C 3.51Å; L579-L582 PolarHBondContact O-N 3.38Å; L582-T585 VanDerWaalsContact CA-OG1 3.3Å; L582-T585 WeakPolarHBondContact CA-OG1 3.4Å; L582-T585 PolarHBondContact O-OG1 2.78Å; L582-R586 VanDerWaalsContact O-CB 3.27Å; L582-R586 WeakPolarHBondContact O-CB 3.35Å; L582-R586 VanDerWaalsContact O-CD 3.26Å; L582-R586 WeakPolarHBondContact O-CD 3.5Å; L582-R586 WeakPolarHBondContact O-CG 3.46Å; L582-R586 PolarHBondContact O-N 3.41Å
583D75.8Confident72.6Confident51 Ų5195.1 Ų95.127%0.27348%0.479SS..Hα-helixtrans-86.9-21.3175.2-83.8-61.5000113.1L579 R586 A587 R590L579-D583 WeakPolarHBondContact O-CA 3.48Å; L579-D583 WeakPolarHBondContact O-CB 3.38Å; L579-D583 PolarHBondContact O-N 2.93Å; D583-R586 WeakPolarHBondContact OD1-CD 3.33Å; D583-R586 IonicContact OD1-NE 2.69Å; D583-R586 IonicContact OD1-NH1 3.66Å; D583-R586 PolarHBondContact OD1-NH1 3.4Å; D583-R586 IonicContact OD2-NH1 3.2Å; D583-R586 PolarHBondContact OD2-NH1 3.3Å; D583-A587 WeakPolarHBondContact O-CA 3.23Å; D583-A587 WeakPolarHBondContact O-CB 3.44Å; D583-A587 PolarHBondContact O-N 2.98Å; D583-R590 IonicContact OD1-CZ 2.67Å; D583-R590 IonicContact OD1-NH1 3.67Å; D583-R590 PolarHBondContact OD1-NH1 2.87Å; D583-R590 IonicContact OD1-NH2 2.64Å; D583-R590 PolarHBondContact OD1-NH2 3.13Å
584A77.1Confident73.6Confident41 Ų4193.6 Ų93.634%0.33948%0.475SS..Hα-helixtrans-69.3-39.2161.900000111.5E580 A587 R588E580-A584 WeakPolarHBondContact O-CB 3.2Å; E580-A584 PolarHBondContact O-N 3.21Å; A584-A587 PolarHBondContact O-N 2.8Å; A584-R588 WeakPolarHBondContact O-CG 3.4Å; A584-R588 PolarHBondContact O-N 2.85Å
585T74.2Confident74.7Confident75 Ų7596.1 Ų96.146%0.4648%0.481SS..Hα-helixtrans-74.9-36.9173.749.70000112.3E581 L582 A587 R588 L589E581-T585 WeakPolarHBondContact O-CB 3.34Å; E581-T585 WeakPolarHBondContact O-CG2 3.48Å; E581-T585 PolarHBondContact O-N 2.64Å; E581-T585 PolarHBondContact O-OG1 2.76Å; L582-T585 VanDerWaalsContact CA-OG1 3.3Å; L582-T585 WeakPolarHBondContact CA-OG1 3.4Å; L582-T585 PolarHBondContact O-OG1 2.78Å; T585-A587 VanDerWaalsContact C-N 3.33Å; T585-R588 PolarHBondContact O-N 3.39Å; T585-L589 WeakPolarHBondContact O-CB 3.47Å; T585-L589 PolarHBondContact O-N 3.11Å
586R79.3Confident75.5Confident93 Ų9396.6 Ų96.635%0.35149%0.486SS..Hα-helixtrans-67.6-29.1167.3-67.1155.4172.1167.9-1.1112.1L582 D583 L589 R590L582-R586 VanDerWaalsContact O-CB 3.27Å; L582-R586 WeakPolarHBondContact O-CB 3.35Å; L582-R586 VanDerWaalsContact O-CD 3.26Å; L582-R586 WeakPolarHBondContact O-CD 3.5Å; L582-R586 WeakPolarHBondContact O-CG 3.46Å; L582-R586 PolarHBondContact O-N 3.41Å; D583-R586 WeakPolarHBondContact OD1-CD 3.33Å; D583-R586 IonicContact OD1-NE 2.69Å; D583-R586 IonicContact OD1-NH1 3.66Å; D583-R586 PolarHBondContact OD1-NH1 3.4Å; D583-R586 IonicContact OD2-NH1 3.2Å; D583-R586 PolarHBondContact OD2-NH1 3.3Å; R586-L589 PolarHBondContact O-N 3.46Å; R586-R590 VanDerWaalsContact O-CB 3.26Å; R586-R590 WeakPolarHBondContact O-CB 3.46Å; R586-R590 WeakPolarHBondContact O-CD 3.39Å; R586-R590 WeakPolarHBondContact O-CG 3.5Å; R586-R590 PolarHBondContact O-N 2.84Å
587A75.4Confident76.3Confident34 Ų3496.8 Ų96.828%0.28149%0.49SS..Hα-helixtrans-66.1-49.4173.200000109.8D583 A584 T585 L589 R590 E591D583-A587 WeakPolarHBondContact O-CA 3.23Å; D583-A587 WeakPolarHBondContact O-CB 3.44Å; D583-A587 PolarHBondContact O-N 2.98Å; A584-A587 PolarHBondContact O-N 2.8Å; T585-A587 VanDerWaalsContact C-N 3.33Å; A587-L589 VanDerWaalsContact C-N 3.29Å; A587-L589 PolarHBondContact O-N 2.87Å; A587-R590 CarbonylContact O-C 3.51Å; A587-R590 WeakPolarHBondContact O-CB 3.46Å; A587-R590 PolarHBondContact O-N 2.73Å; A587-R590 VanDerWaalsContact O-N 3.14Å; A587-E591 WeakPolarHBondContact O-CB 3.45Å; A587-E591 VanDerWaalsContact O-CG 3.31Å; A587-E591 WeakPolarHBondContact O-CG 3.34Å; A587-E591 PolarHBondContact O-N 3.16Å
588R79.6Confident76.6Confident165 Ų16592.2 Ų92.262%0.62348%0.479SS*.Hα-helixtrans-59.6-38.3171.6-65.5176-149.9167.68.5112.3A584 T585 E591 T592A584-R588 WeakPolarHBondContact O-CG 3.4Å; A584-R588 PolarHBondContact O-N 2.85Å; T585-R588 PolarHBondContact O-N 3.39Å; R588-E591 PolarHBondContact O-N 2.73Å; R588-T592 WeakPolarHBondContact O-CG2 3.33Å; R588-T592 PolarHBondContact O-N 3.35Å; R588-T592 PolarHBondContact O-OG1 3.03Å
589L75.9Confident77.2Confident115 Ų11591 Ų9160%0.60247%0.473SS*.Hα-helixtrans-65.5-43.3175-168.666.4000111.4T585 R586 A587 T592 S593T585-L589 WeakPolarHBondContact O-CB 3.47Å; T585-L589 PolarHBondContact O-N 3.11Å; R586-L589 PolarHBondContact O-N 3.46Å; A587-L589 VanDerWaalsContact C-N 3.29Å; A587-L589 PolarHBondContact O-N 2.87Å; L589-T592 WeakPolarHBondContact CA-OG1 3.45Å; L589-T592 PolarHBondContact O-N 2.83Å; L589-T592 PolarHBondContact O-OG1 2.77Å; L589-S593 WeakPolarHBondContact O-CB 3.47Å; L589-S593 PolarHBondContact O-N 2.66Å
590R78Confident77.8Confident123 Ų12394 Ų9446%0.46449%0.486SS..Hα-helixtrans-62.9-39.1172.7-71.9162.7-168.6128.8-2.9111D583 R586 A587 S593 N594D583-R590 IonicContact OD1-CZ 2.67Å; D583-R590 IonicContact OD1-NH1 3.67Å; D583-R590 PolarHBondContact OD1-NH1 2.87Å; D583-R590 IonicContact OD1-NH2 2.64Å; D583-R590 PolarHBondContact OD1-NH2 3.13Å; R586-R590 VanDerWaalsContact O-CB 3.26Å; R586-R590 WeakPolarHBondContact O-CB 3.46Å; R586-R590 WeakPolarHBondContact O-CD 3.39Å; R586-R590 WeakPolarHBondContact O-CG 3.5Å; R586-R590 PolarHBondContact O-N 2.84Å; A587-R590 CarbonylContact O-C 3.51Å; A587-R590 WeakPolarHBondContact O-CB 3.46Å; A587-R590 PolarHBondContact O-N 2.73Å; A587-R590 VanDerWaalsContact O-N 3.14Å; R590-S593 PolarHBondContact O-N 2.92Å; R590-N594 WeakPolarHBondContact O-CB 3.35Å; R590-N594 PolarHBondContact O-N 2.78Å; R590-N594 PolarHBondContact O-ND2 2.79Å; R590-N594 PolarHBondContact O-OD1 2.72Å
591E78.6Confident78.3Confident124 Ų12488.7 Ų88.758%0.57947%0.469SS*.Hα-helixtrans-64.1-48.2174.2-72.9164.1174.500111.1A587 R588 S593 N594 L595A587-E591 WeakPolarHBondContact O-CB 3.45Å; A587-E591 VanDerWaalsContact O-CG 3.31Å; A587-E591 WeakPolarHBondContact O-CG 3.34Å; A587-E591 PolarHBondContact O-N 3.16Å; R588-E591 PolarHBondContact O-N 2.73Å; E591-S593 VanDerWaalsContact C-N 3.31Å; E591-S593 PolarHBondContact O-N 3.01Å; E591-N594 PolarHBondContact O-N 2.72Å; E591-L595 WeakPolarHBondContact O-CB 3.46Å; E591-L595 PolarHBondContact O-N 2.89Å
592T75.6Confident78.7Confident79 Ų7987.7 Ų87.749%0.48546%0.464SS..Hα-helixtrans-65.3-33.4174.757.60000112.7R588 L589 L596R588-T592 WeakPolarHBondContact O-CG2 3.33Å; R588-T592 PolarHBondContact O-N 3.35Å; R588-T592 PolarHBondContact O-OG1 3.03Å; L589-T592 WeakPolarHBondContact CA-OG1 3.45Å; L589-T592 PolarHBondContact O-N 2.83Å; L589-T592 PolarHBondContact O-OG1 2.77Å; T592-L596 WeakPolarHBondContact O-CB 3.18Å; T592-L596 PolarHBondContact O-N 3.29Å
593S76.6Confident79.1Confident58 Ų5888.8 Ų88.841%0.40647%0.47SS..Hα-helixtrans-72.8-38.2175.8-169.90000112L589 R590 E591 L596 T597L589-S593 WeakPolarHBondContact O-CB 3.47Å; L589-S593 PolarHBondContact O-N 2.66Å; R590-S593 PolarHBondContact O-N 2.92Å; E591-S593 VanDerWaalsContact C-N 3.31Å; E591-S593 PolarHBondContact O-N 3.01Å; S593-L596 WeakPolarHBondContact O-CB 3.44Å; S593-L596 PolarHBondContact O-N 3.26Å; S593-T597 WeakPolarHBondContact O-CB 3.29Å; S593-T597 PolarHBondContact O-N 2.83Å; S593-T597 PolarHBondContact O-OG1 3.05Å
594N81.2Confident79.4Confident108 Ų10890.6 Ų90.658%0.57848%0.476SS*.Hα-helixtrans-68.6-37.5173.8-71.1-10.4000110.4R590 E591 T597 A598R590-N594 WeakPolarHBondContact O-CB 3.35Å; R590-N594 PolarHBondContact O-N 2.78Å; R590-N594 PolarHBondContact O-ND2 2.79Å; R590-N594 PolarHBondContact O-OD1 2.72Å; E591-N594 PolarHBondContact O-N 2.72Å; N594-T597 PolarHBondContact O-N 3.05Å; N594-A598 VanDerWaalsContact O-CB 3.27Å; N594-A598 WeakPolarHBondContact O-CB 3.48Å; N594-A598 PolarHBondContact O-N 3.21Å
595L84.2Confident79.7Confident109 Ų10991.7 Ų91.757%0.57148%0.479SS*.Hα-helixtrans-66.4-40.4171.3-172.666.6000111.3E591 A598 L599E591-L595 WeakPolarHBondContact O-CB 3.46Å; E591-L595 PolarHBondContact O-N 2.89Å; L595-A598 PolarHBondContact O-N 2.91Å; L595-L599 HydrophobicContact CG-CD1 4.16Å; L595-L599 WeakPolarHBondContact O-CB 3.16Å; L595-L599 VanDerWaalsContact O-CG 3.23Å; L595-L599 WeakPolarHBondContact O-CG 3.11Å; L595-L599 PolarHBondContact O-N 2.77Å
596L78.4Confident80Confident107 Ų10792.4 Ų92.456%0.5648%0.477SS*.Hα-helixtrans-62.3-42.8171.9-113163.1000111.8T592 S593 L599 Q600T592-L596 WeakPolarHBondContact O-CB 3.18Å; T592-L596 PolarHBondContact O-N 3.29Å; S593-L596 WeakPolarHBondContact O-CB 3.44Å; S593-L596 PolarHBondContact O-N 3.26Å; L596-L599 PolarHBondContact O-N 2.8Å; L596-Q600 WeakPolarHBondContact O-CB 3.11Å; L596-Q600 WeakPolarHBondContact O-CG 3.36Å; L596-Q600 PolarHBondContact O-N 3.05Å
597T82.4Confident80.2Confident82 Ų8293.9 Ų93.950%0.50349%0.486SS..Hα-helixtrans-66.8-38.7176.9-55.70000111.2S593 N594 Q600 G601S593-T597 WeakPolarHBondContact O-CB 3.29Å; S593-T597 PolarHBondContact O-N 2.83Å; S593-T597 PolarHBondContact O-OG1 3.05Å; N594-T597 PolarHBondContact O-N 3.05Å; T597-Q600 PolarHBondContact O-N 3.07Å; T597-G601 PolarHBondContact O-N 3.02Å
598A79.3Confident80.6Confident48 Ų4899 Ų9940%0.39750%0.498SS..Hα-helixtrans-65-46.9173.300000111.1N594 L595 Q600 G601 E602N594-A598 VanDerWaalsContact O-CB 3.27Å; N594-A598 WeakPolarHBondContact O-CB 3.48Å; N594-A598 PolarHBondContact O-N 3.21Å; L595-A598 PolarHBondContact O-N 2.91Å; A598-Q600 VanDerWaalsContact C-N 3.31Å; A598-Q600 PolarHBondContact O-N 3.18Å; A598-G601 CarbonylContact O-C 3.55Å; A598-G601 WeakPolarHBondContact O-CA 3.22Å; A598-G601 PolarHBondContact O-N 3.49Å; A598-E602 WeakPolarHBondContact O-CG 3.16Å; A598-E602 PolarHBondContact O-N 3.5Å
599L79.6Confident80.6Confident92 Ų9295.4 Ų95.448%0.48249%0.489SS..Hα-helixtrans-65-31.7175.2-71.2168.2000112.5L595 L596 L603L595-L599 HydrophobicContact CG-CD1 4.16Å; L595-L599 WeakPolarHBondContact O-CB 3.16Å; L595-L599 VanDerWaalsContact O-CG 3.23Å; L595-L599 WeakPolarHBondContact O-CG 3.11Å; L595-L599 PolarHBondContact O-N 2.77Å; L596-L599 PolarHBondContact O-N 2.8Å; L599-L603 VanDerWaalsContact O-CB 3.24Å; L599-L603 WeakPolarHBondContact O-CB 3.19Å; L599-L603 PolarHBondContact O-N 3.35Å
600Q81.3Confident80.8Confident111 Ų11195.4 Ų95.452%0.51949%0.485SS..Hα-helixtrans-68.5-40.5168.8-77.4-178.5-89.600111.5L596 T597 A598 L603 E604L596-Q600 WeakPolarHBondContact O-CB 3.11Å; L596-Q600 WeakPolarHBondContact O-CG 3.36Å; L596-Q600 PolarHBondContact O-N 3.05Å; T597-Q600 PolarHBondContact O-N 3.07Å; A598-Q600 VanDerWaalsContact C-N 3.31Å; A598-Q600 PolarHBondContact O-N 3.18Å; Q600-L603 PolarHBondContact O-N 2.72Å; Q600-E604 WeakPolarHBondContact O-CB 3.19Å; Q600-E604 WeakPolarHBondContact O-CG 3.49Å; Q600-E604 PolarHBondContact O-N 3.48Å
601G83.7Confident81.1Confident30 Ų3095.3 Ų95.331%0.30949%0.49SS..Hα-helixtrans-64.7-37.9173.400000113.2T597 A598 T605T597-G601 PolarHBondContact O-N 3.02Å; A598-G601 CarbonylContact O-C 3.55Å; A598-G601 WeakPolarHBondContact O-CA 3.22Å; A598-G601 PolarHBondContact O-N 3.49Å; G601-T605 WeakPolarHBondContact O-CB 3.01Å; G601-T605 WeakPolarHBondContact O-CG2 3.35Å; G601-T605 PolarHBondContact O-N 2.88Å; G601-T605 PolarHBondContact O-OG1 3.13Å
602E83.4Confident81.5Confident117 Ų11791.8 Ų91.855%0.54748%0.482SS..Hα-helixtrans-67-43.7171.4-73.3179-177.700111.1A598 E604 T605 Q606A598-E602 WeakPolarHBondContact O-CG 3.16Å; A598-E602 PolarHBondContact O-N 3.5Å; E602-E604 PolarHBondContact O-N 2.72Å; E602-T605 WeakPolarHBondContact CA-OG1 3.29Å; E602-T605 PolarHBondContact O-N 3.03Å; E602-T605 PolarHBondContact O-OG1 3Å; E602-T605 VanDerWaalsContact O-OG1 3.12Å; E602-Q606 WeakPolarHBondContact O-CB 3.49Å; E602-Q606 VanDerWaalsContact O-CG 3.28Å; E602-Q606 WeakPolarHBondContact O-CG 3.18Å; E602-Q606 PolarHBondContact O-N 2.98Å
603L81.1Confident81.9Confident102 Ų10293.5 Ų93.553%0.53448%0.483SS..Hα-helixtrans-64-38.9174.7-17664.3000112.2L599 Q600 K607L599-L603 VanDerWaalsContact O-CB 3.24Å; L599-L603 WeakPolarHBondContact O-CB 3.19Å; L599-L603 PolarHBondContact O-N 3.35Å; Q600-L603 PolarHBondContact O-N 2.72Å; L603-K607 WeakPolarHBondContact O-CB 2.98Å; L603-K607 VanDerWaalsContact O-CG 3.28Å; L603-K607 WeakPolarHBondContact O-CG 3.4Å; L603-K607 PolarHBondContact O-N 2.83Å
604E82.8Confident82.4Confident89 Ų8995.4 Ų95.442%0.41649%0.488SS..Hα-helixtrans-69.6-40.4174.4-80.2-168.9-168.300112.7Q600 E602 K607 R608Q600-E604 WeakPolarHBondContact O-CB 3.19Å; Q600-E604 WeakPolarHBondContact O-CG 3.49Å; Q600-E604 PolarHBondContact O-N 3.48Å; E602-E604 PolarHBondContact O-N 2.72Å; E604-K607 PolarHBondContact O-N 2.83Å; E604-R608 WeakPolarHBondContact O-CB 3.32Å; E604-R608 VanDerWaalsContact O-CG 3.31Å; E604-R608 WeakPolarHBondContact O-CG 3.43Å; E604-R608 PolarHBondContact O-N 2.74Å; E604-R608 IonicContact OE2-CZ 2.69Å; E604-R608 IonicContact OE2-NH1 3.52Å; E604-R608 PolarHBondContact OE2-NH1 3.29Å; E604-R608 IonicContact OE2-NH2 2.63Å; E604-R608 PolarHBondContact OE2-NH2 3.12Å
605T83.6Confident82.8Confident65 Ų6594.6 Ų94.640%0.39948%0.482SS..Hα-helixtrans-70.8-35.1177480000111.5G601 E602 R608 Q609G601-T605 WeakPolarHBondContact O-CB 3.01Å; G601-T605 WeakPolarHBondContact O-CG2 3.35Å; G601-T605 PolarHBondContact O-N 2.88Å; G601-T605 PolarHBondContact O-OG1 3.13Å; E602-T605 WeakPolarHBondContact CA-OG1 3.29Å; E602-T605 PolarHBondContact O-N 3.03Å; E602-T605 PolarHBondContact O-OG1 3Å; E602-T605 VanDerWaalsContact O-OG1 3.12Å; T605-R608 PolarHBondContact O-N 2.75Å; T605-Q609 WeakPolarHBondContact O-CB 3.17Å; T605-Q609 VanDerWaalsContact O-CG 3.22Å; T605-Q609 WeakPolarHBondContact O-CG 3.16Å; T605-Q609 PolarHBondContact O-N 3.38Å
606Q79.9Confident82.9Confident90 Ų9092.4 Ų92.442%0.42147%0.474SS..Hα-helixtrans-62.8-45167.5-72.2-61.7-26.700111.6E602 R608 Q609 H610E602-Q606 WeakPolarHBondContact O-CB 3.49Å; E602-Q606 VanDerWaalsContact O-CG 3.28Å; E602-Q606 WeakPolarHBondContact O-CG 3.18Å; E602-Q606 PolarHBondContact O-N 2.98Å; Q606-R608 PolarHBondContact O-N 3.37Å; Q606-Q609 PolarHBondContact O-N 3.49Å; Q606-H610 WeakPolarHBondContact O-CB 3.37Å; Q606-H610 PolarHBondContact O-CD2 3.07Å; Q606-H610 PolarHBondContact O-N 3.45Å
607K83.2Confident82.9Confident123 Ų12390.6 Ų90.654%0.53547%0.467SS..Hα-helixtrans-56.8-51173.2-79.4174.3179.3-177.60111.8L603 E604 Q609 H610 E611L603-K607 WeakPolarHBondContact O-CB 2.98Å; L603-K607 VanDerWaalsContact O-CG 3.28Å; L603-K607 WeakPolarHBondContact O-CG 3.4Å; L603-K607 PolarHBondContact O-N 2.83Å; E604-K607 PolarHBondContact O-N 2.83Å; K607-Q609 VanDerWaalsContact C-N 3.3Å; K607-Q609 PolarHBondContact O-N 3.07Å; K607-H610 CarbonylContact O-C 3.58Å; K607-H610 PolarHBondContact O-N 2.85Å; K607-H610 VanDerWaalsContact O-N 3.08Å; K607-E611 WeakPolarHBondContact O-CG 3.46Å; K607-E611 PolarHBondContact O-N 2.83Å
608R83.6Confident82.9Confident141 Ų14193 Ų9353%0.53247%0.471SS..Hα-helixtrans-60.4-37177.1-70.9172.9-175.7116.912112.3E604 T605 Q606 A612E604-R608 WeakPolarHBondContact O-CB 3.32Å; E604-R608 VanDerWaalsContact O-CG 3.31Å; E604-R608 WeakPolarHBondContact O-CG 3.43Å; E604-R608 PolarHBondContact O-N 2.74Å; E604-R608 IonicContact OE2-CZ 2.69Å; E604-R608 IonicContact OE2-NH1 3.52Å; E604-R608 PolarHBondContact OE2-NH1 3.29Å; E604-R608 IonicContact OE2-NH2 2.63Å; E604-R608 PolarHBondContact OE2-NH2 3.12Å; T605-R608 PolarHBondContact O-N 2.75Å; Q606-R608 PolarHBondContact O-N 3.37Å; R608-A612 VanDerWaalsContact O-CB 3.24Å; R608-A612 WeakPolarHBondContact O-CB 3.09Å; R608-A612 PolarHBondContact O-N 3.38Å
609Q80Confident83.1Confident91 Ų9196 Ų9643%0.42548%0.476SS..Hα-helixtrans-69-36.4173.7-75.817730.100112.7T605 Q606 K607 K613T605-Q609 WeakPolarHBondContact O-CB 3.17Å; T605-Q609 VanDerWaalsContact O-CG 3.22Å; T605-Q609 WeakPolarHBondContact O-CG 3.16Å; T605-Q609 PolarHBondContact O-N 3.38Å; Q606-Q609 PolarHBondContact O-N 3.49Å; K607-Q609 VanDerWaalsContact C-N 3.3Å; K607-Q609 PolarHBondContact O-N 3.07Å; Q609-K613 WeakPolarHBondContact O-CB 3.4Å; Q609-K613 WeakPolarHBondContact O-CD 3.27Å; Q609-K613 VanDerWaalsContact O-CG 3.22Å; Q609-K613 WeakPolarHBondContact O-CG 3.26Å; Q609-K613 PolarHBondContact O-N 3.16Å; Q609-K613 VanDerWaalsContact O-N 3.08Å
610H80.3Confident83.3Confident115 Ų11596.6 Ų96.653%0.53248%0.477SS..Hα-helixtrans-70.4-43.6174-81.6-70000111.6Q606 K607 K613 L614Q606-H610 WeakPolarHBondContact O-CB 3.37Å; Q606-H610 PolarHBondContact O-CD2 3.07Å; Q606-H610 PolarHBondContact O-N 3.45Å; K607-H610 CarbonylContact O-C 3.58Å; K607-H610 PolarHBondContact O-N 2.85Å; K607-H610 VanDerWaalsContact O-N 3.08Å; H610-K613 PolarHBondContact O-N 2.88Å; H610-L614 VanDerWaalsContact O-CB 3.25Å; H610-L614 WeakPolarHBondContact O-CB 3.47Å; H610-L614 PolarHBondContact O-N 2.8Å
611E85.4Confident83.3Confident121 Ų12196.1 Ų96.157%0.56548%0.475SS*.Hα-helixtrans-60.2-45.8173.4-72.6175.4136.500111.3K607 K613 L614 I615K607-E611 WeakPolarHBondContact O-CG 3.46Å; K607-E611 PolarHBondContact O-N 2.83Å; E611-K613 PolarHBondContact O-N 3.07Å; E611-L614 CarbonylContact O-C 3.58Å; E611-L614 PolarHBondContact O-N 2.84Å; E611-L614 VanDerWaalsContact O-N 3.09Å; E611-I615 WeakPolarHBondContact O-CG1 3.47Å; E611-I615 PolarHBondContact O-N 3.07Å
612A85.1Confident83.6Confident49 Ų49100.8 Ų100.841%0.40549%0.486SS..Hα-helixtrans-58.3-47.3175.100000112.2R608 L614 I615 T616R608-A612 VanDerWaalsContact O-CB 3.24Å; R608-A612 WeakPolarHBondContact O-CB 3.09Å; R608-A612 PolarHBondContact O-N 3.38Å; A612-L614 VanDerWaalsContact C-N 3.26Å; A612-L614 PolarHBondContact O-N 2.9Å; A612-I615 PolarHBondContact O-N 3.46Å; A612-T616 PolarHBondContact O-N 3.27Å
613K85.7Confident83.8Confident116 Ų116101.5 Ų101.550%0.50449%0.49SS..Hα-helixtrans-62.7-31.9174.8-71.6164.3-174.4167.20112.7Q609 H610 E611 T616 T617Q609-K613 WeakPolarHBondContact O-CB 3.4Å; Q609-K613 WeakPolarHBondContact O-CD 3.27Å; Q609-K613 VanDerWaalsContact O-CG 3.22Å; Q609-K613 WeakPolarHBondContact O-CG 3.26Å; Q609-K613 PolarHBondContact O-N 3.16Å; Q609-K613 VanDerWaalsContact O-N 3.08Å; H610-K613 PolarHBondContact O-N 2.88Å; E611-K613 PolarHBondContact O-N 3.07Å; K613-T616 PolarHBondContact O-OG1 3.35Å; K613-T617 WeakPolarHBondContact O-CB 3.5Å; K613-T617 WeakPolarHBondContact O-CG2 3.43Å; K613-T617 PolarHBondContact O-N 2.73Å; K613-T617 PolarHBondContact O-OG1 2.9Å
614L87.1Confident84Confident97 Ų97101.5 Ų101.551%0.50849%0.485SS..Hα-helixtrans-79.6-22178.8-155.5145.7000112H610 E611 A612 T617 K618H610-L614 VanDerWaalsContact O-CB 3.25Å; H610-L614 WeakPolarHBondContact O-CB 3.47Å; H610-L614 PolarHBondContact O-N 2.8Å; E611-L614 CarbonylContact O-C 3.58Å; E611-L614 PolarHBondContact O-N 2.84Å; E611-L614 VanDerWaalsContact O-N 3.09Å; A612-L614 VanDerWaalsContact C-N 3.26Å; A612-L614 PolarHBondContact O-N 2.9Å; L614-T617 WeakPolarHBondContact CA-OG1 3.46Å; L614-K618 HydrophobicContact CD2-CD 4.17Å; L614-K618 WeakPolarHBondContact O-CB 3.18Å; L614-K618 WeakPolarHBondContact O-CD 3.32Å; L614-K618 WeakPolarHBondContact O-CG 3.35Å; L614-K618 PolarHBondContact O-N 3.19Å
615I88.3Confident83.8Confident91 Ų91103.3 Ų103.347%0.46750%0.495SS..Hα-helixtrans-76.4-53.7167.4-68.7162.4000109.8E611 A612 T617 K618 E619E611-I615 WeakPolarHBondContact O-CG1 3.47Å; E611-I615 PolarHBondContact O-N 3.07Å; A612-I615 PolarHBondContact O-N 3.46Å; I615-T617 VanDerWaalsContact C-N 3.32Å; I615-T617 PolarHBondContact O-N 3.43Å; I615-K618 CarbonylContact O-C 3.51Å; I615-K618 WeakPolarHBondContact O-CA 3.42Å; I615-K618 WeakPolarHBondContact O-CB 3.49Å; I615-K618 PolarHBondContact O-N 3.27Å; I615-E619 HydrophobicContact CG2-CG 4.34Å; I615-E619 WeakPolarHBondContact O-CG 3.3Å; I615-E619 PolarHBondContact O-N 2.89Å
616T85.9Confident83.9Confident63 Ų63103.6 Ų103.639%0.38749%0.494SS..Hα-helixtrans-61.3-39.5-177.761.40000112.4A612 K613 K618 E619 E620A612-T616 PolarHBondContact O-N 3.27Å; K613-T616 PolarHBondContact O-OG1 3.35Å; T616-K618 VanDerWaalsContact C-N 3.35Å; T616-K618 PolarHBondContact O-N 2.83Å; T616-E619 PolarHBondContact O-N 2.9Å; T616-E620 WeakPolarHBondContact O-CB 3.48Å; T616-E620 WeakPolarHBondContact O-CG 3.47Å; T616-E620 PolarHBondContact O-N 2.97Å
617T79Confident84.2Confident69 Ų69105.4 Ų105.442%0.42350%0.501SS..Hα-helixtrans-66.7-33.1174.4480000113K613 L614 I615 E621K613-T617 WeakPolarHBondContact O-CB 3.5Å; K613-T617 WeakPolarHBondContact O-CG2 3.43Å; K613-T617 PolarHBondContact O-N 2.73Å; K613-T617 PolarHBondContact O-OG1 2.9Å; L614-T617 WeakPolarHBondContact CA-OG1 3.46Å; I615-T617 VanDerWaalsContact C-N 3.32Å; I615-T617 PolarHBondContact O-N 3.43Å; T617-E621 WeakPolarHBondContact O-CG 3.21Å; T617-E621 PolarHBondContact O-N 2.83Å
618K82.4Confident84.1Confident134 Ų134105.6 Ų105.658%0.58351%0.505SS*.Hα-helixtrans-68.8-36.6170.9-79.5174.2178.8173.90112.3L614 I615 T616 K622L614-K618 HydrophobicContact CD2-CD 4.17Å; L614-K618 WeakPolarHBondContact O-CB 3.18Å; L614-K618 WeakPolarHBondContact O-CD 3.32Å; L614-K618 WeakPolarHBondContact O-CG 3.35Å; L614-K618 PolarHBondContact O-N 3.19Å; I615-K618 CarbonylContact O-C 3.51Å; I615-K618 WeakPolarHBondContact O-CA 3.42Å; I615-K618 WeakPolarHBondContact O-CB 3.49Å; I615-K618 PolarHBondContact O-N 3.27Å; T616-K618 VanDerWaalsContact C-N 3.35Å; T616-K618 PolarHBondContact O-N 2.83Å; K618-K622 WeakPolarHBondContact O-CB 3.35Å; K618-K622 PolarHBondContact O-N 2.86Å
619E84.3Confident84.1Confident109 Ų109101.2 Ų101.251%0.50950%0.499SS..Hα-helixtrans-69.4-39.6176.1-69.2170.9154.100111.4I615 T616 K622 H623I615-E619 HydrophobicContact CG2-CG 4.34Å; I615-E619 WeakPolarHBondContact O-CG 3.3Å; I615-E619 PolarHBondContact O-N 2.89Å; T616-E619 PolarHBondContact O-N 2.9Å; E619-K622 PolarHBondContact O-N 3.14Å; E619-H623 WeakPolarHBondContact O-CB 3.35Å; E619-H623 PolarHBondContact O-N 3.42Å
620E83.4Confident84.4Confident105 Ų105101.6 Ų101.649%0.49150%0.503SS..Hα-helixtrans-63.6-47.2172.5-75.1172.4-156.800112.6T616 H623 K624T616-E620 WeakPolarHBondContact O-CB 3.48Å; T616-E620 WeakPolarHBondContact O-CG 3.47Å; T616-E620 PolarHBondContact O-N 2.97Å; E620-H623 PolarHBondContact O-N 2.67Å; E620-K624 WeakPolarHBondContact O-CG 3.5Å; E620-K624 PolarHBondContact O-N 3.34Å
621E80.8Confident84.6Confident102 Ų10299.8 Ų99.848%0.47750%0.495SS..Hα-helixtrans-66.1-38.5175-69.7-51.4134.900111.8T617 H623 K624 M625T617-E621 WeakPolarHBondContact O-CG 3.21Å; T617-E621 PolarHBondContact O-N 2.83Å; E621-H623 PolarHBondContact O-N 3.46Å; E621-K624 PolarHBondContact O-N 2.8Å; E621-K624 IonicContact OE1-NZ 3.36Å; E621-K624 PolarHBondContact OE1-NZ 3.34Å; E621-M625 WeakPolarHBondContact O-CG 3.46Å; E621-M625 PolarHBondContact O-N 2.77Å
622K90.1Very high84.5Confident127 Ų12798.6 Ų98.655%0.55249%0.492SS*.Hα-helixtrans-59.3-48.3172.7-169.8-159.5167.9-165.80110.6K618 E619 K624 M625 D626K618-K622 WeakPolarHBondContact O-CB 3.35Å; K618-K622 PolarHBondContact O-N 2.86Å; E619-K622 PolarHBondContact O-N 3.14Å; K622-K624 VanDerWaalsContact C-N 3.28Å; K622-K624 PolarHBondContact O-N 2.81Å; K622-M625 CarbonylContact O-C 3.55Å; K622-M625 WeakPolarHBondContact O-CB 3.36Å; K622-M625 PolarHBondContact O-N 3.4Å; K622-M625 VanDerWaalsContact O-N 3.08Å; K622-D626 WeakPolarHBondContact CE-OD2 3.47Å; K622-D626 IonicContact NZ-OD2 2.8Å; K622-D626 WeakPolarHBondContact O-CB 3.4Å; K622-D626 PolarHBondContact O-N 2.82Å
623H87.2Confident84.3Confident133 Ų133102.1 Ų102.162%0.61650%0.5SS*.Hα-helixtrans-64.1-29.2177.5-81.2-17.8000113.8E619 E620 E621 D626 K627E619-H623 WeakPolarHBondContact O-CB 3.35Å; E619-H623 PolarHBondContact O-N 3.42Å; E620-H623 PolarHBondContact O-N 2.67Å; E621-H623 PolarHBondContact O-N 3.46Å; H623-D626 IonicContact ND1-OD2 3.43Å; H623-D626 PolarHBondContact ND1-OD2 2.99Å; H623-K627 WeakPolarHBondContact O-CB 3.02Å; H623-K627 PolarHBondContact O-N 3.05Å
624K85.9Confident84.2Confident102 Ų102101.8 Ų101.844%0.44350%0.503SS..Hα-helixtrans-67-43.3169.8-68.4165.2-158.6170.30111.4E620 E621 K622 K627 M628E620-K624 WeakPolarHBondContact O-CG 3.5Å; E620-K624 PolarHBondContact O-N 3.34Å; E621-K624 PolarHBondContact O-N 2.8Å; E621-K624 IonicContact OE1-NZ 3.36Å; E621-K624 PolarHBondContact OE1-NZ 3.34Å; K622-K624 VanDerWaalsContact C-N 3.28Å; K622-K624 PolarHBondContact O-N 2.81Å; K624-K627 PolarHBondContact O-N 3.22Å; K624-M628 WeakPolarHBondContact O-CB 3.5Å; K624-M628 PolarHBondContact O-N 2.64Å
625M79.4Confident84.2Confident127 Ų127102.7 Ų102.763%0.62650%0.503SS*.Hα-helixtrans-66.7-47.7176.6-68.7-62.2-64.600112.2E621 K622 K627 M628 A629E621-M625 WeakPolarHBondContact O-CG 3.46Å; E621-M625 PolarHBondContact O-N 2.77Å; K622-M625 CarbonylContact O-C 3.55Å; K622-M625 WeakPolarHBondContact O-CB 3.36Å; K622-M625 PolarHBondContact O-N 3.4Å; K622-M625 VanDerWaalsContact O-N 3.08Å; M625-K627 VanDerWaalsContact C-N 3.26Å; M625-K627 PolarHBondContact O-N 3.13Å; M625-M628 PolarHBondContact O-N 2.97Å; M625-A629 WeakPolarHBondContact O-CB 3.5Å; M625-A629 PolarHBondContact O-N 3.37Å
626D84.6Confident83.9Confident70 Ų70107.5 Ų107.537%0.37452%0.515SS..Hα-helixtrans-55.7-43.3174.7-64.3-23.7000110.1K622 H623 A629 L630K622-D626 WeakPolarHBondContact CE-OD2 3.47Å; K622-D626 IonicContact NZ-OD2 2.8Å; K622-D626 WeakPolarHBondContact O-CB 3.4Å; K622-D626 PolarHBondContact O-N 2.82Å; H623-D626 IonicContact ND1-OD2 3.43Å; H623-D626 PolarHBondContact ND1-OD2 2.99Å; D626-A629 PolarHBondContact O-N 2.65Å; D626-L630 PolarHBondContact O-N 2.78Å
627K86.7Confident83.7Confident129 Ų129108.5 Ų108.556%0.56152%0.522SS*.Hα-helixtrans-68.7-42177.1-171.1-174.2179.3-147.30112.8H623 K624 M625 A629 L630 E631H623-K627 WeakPolarHBondContact O-CB 3.02Å; H623-K627 PolarHBondContact O-N 3.05Å; K624-K627 PolarHBondContact O-N 3.22Å; M625-K627 VanDerWaalsContact C-N 3.26Å; M625-K627 PolarHBondContact O-N 3.13Å; K627-A629 VanDerWaalsContact C-N 3.33Å; K627-L630 PolarHBondContact O-N 2.72Å; K627-E631 WeakPolarHBondContact CE-OE1 3.11Å; K627-E631 IonicContact NZ-OE1 3.86Å; K627-E631 PolarHBondContact NZ-OE1 2.81Å; K627-E631 WeakPolarHBondContact O-CB 3.44Å; K627-E631 WeakPolarHBondContact O-CG 3.13Å; K627-E631 PolarHBondContact O-N 2.75Å
628M81.4Confident83.8Confident127 Ų127108.4 Ų108.463%0.62652%0.517SS*.Hα-helixtrans-64-38175.2-85.3-168.6164.400112K624 M625 E631 L632K624-M628 WeakPolarHBondContact O-CB 3.5Å; K624-M628 PolarHBondContact O-N 2.64Å; M625-M628 PolarHBondContact O-N 2.97Å; M628-E631 PolarHBondContact O-N 2.74Å; M628-L632 WeakPolarHBondContact O-CB 3.49Å; M628-L632 VanDerWaalsContact O-CG 3.3Å; M628-L632 WeakPolarHBondContact O-CG 3.3Å; M628-L632 PolarHBondContact O-N 3.22Å
629A83.1Confident83.8Confident48 Ų48105.3 Ų105.340%0.39751%0.509SS..Hα-helixtrans-60.7-50.3172.600000110.8M625 D626 K627 E631 L632 E633M625-A629 WeakPolarHBondContact O-CB 3.5Å; M625-A629 PolarHBondContact O-N 3.37Å; D626-A629 PolarHBondContact O-N 2.65Å; K627-A629 VanDerWaalsContact C-N 3.33Å; A629-E631 VanDerWaalsContact C-N 3.35Å; A629-E631 PolarHBondContact O-N 3.49Å; A629-L632 WeakPolarHBondContact O-CB 3.47Å; A629-L632 PolarHBondContact O-N 2.86Å; A629-E633 WeakPolarHBondContact O-CG 3.38Å; A629-E633 PolarHBondContact O-N 2.98Å
630L86Confident83.5Confident100 Ų100105.7 Ų105.752%0.52451%0.514SS..Hα-helixtrans-61.4-40.3177.8-153.585.6000112.6D626 K627 L632 E633 L634D626-L630 PolarHBondContact O-N 2.78Å; K627-L630 PolarHBondContact O-N 2.72Å; L630-L632 VanDerWaalsContact C-N 3.28Å; L630-L632 PolarHBondContact O-N 3.42Å; L630-E633 PolarHBondContact O-N 2.84Å; L630-L634 HydrophobicContact CD2-CD1 4.47Å; L630-L634 HydrophobicContact CG-CD1 4.43Å; L630-L634 WeakPolarHBondContact O-CB 3.11Å; L630-L634 WeakPolarHBondContact O-CD1 3.33Å; L630-L634 VanDerWaalsContact O-CG 3.25Å; L630-L634 WeakPolarHBondContact O-CG 3.11Å; L630-L634 PolarHBondContact O-N 3.44Å
631E84.4Confident83.7Confident77 Ų77107.5 Ų107.536%0.3652%0.516SS..Hα-helixtrans-67.4-25.1174.9-79.6-171-149.300113.3K627 M628 A629 K635K627-E631 WeakPolarHBondContact CE-OE1 3.11Å; K627-E631 IonicContact NZ-OE1 3.86Å; K627-E631 PolarHBondContact NZ-OE1 2.81Å; K627-E631 WeakPolarHBondContact O-CB 3.44Å; K627-E631 WeakPolarHBondContact O-CG 3.13Å; K627-E631 PolarHBondContact O-N 2.75Å; M628-E631 PolarHBondContact O-N 2.74Å; A629-E631 VanDerWaalsContact C-N 3.35Å; A629-E631 PolarHBondContact O-N 3.49Å; E631-K635 WeakPolarHBondContact O-CD 3.47Å; E631-K635 VanDerWaalsContact O-CE 3.29Å; E631-K635 WeakPolarHBondContact O-CE 3.29Å; E631-K635 WeakPolarHBondContact O-CG 3.44Å; E631-K635 PolarHBondContact O-N 3.29Å; E631-K635 PolarHBondContact O-NZ 2.85Å; E631-K635 IonicContact OE2-NZ 3.59Å
632L83Confident83.8Confident96 Ų96106.9 Ų106.950%0.50351%0.513SS..Hα-helixtrans-80.2-46.9172-74.4167.3000110.7M628 A629 L630 L634 K635 W636M628-L632 WeakPolarHBondContact O-CB 3.49Å; M628-L632 VanDerWaalsContact O-CG 3.3Å; M628-L632 WeakPolarHBondContact O-CG 3.3Å; M628-L632 PolarHBondContact O-N 3.22Å; A629-L632 WeakPolarHBondContact O-CB 3.47Å; A629-L632 PolarHBondContact O-N 2.86Å; L630-L632 VanDerWaalsContact C-N 3.28Å; L630-L632 PolarHBondContact O-N 3.42Å; L632-L634 VanDerWaalsContact C-N 3.3Å; L632-L634 PolarHBondContact O-N 3.31Å; L632-K635 PolarHBondContact O-N 2.92Å; L632-W636 VanDerWaalsContact O-CD1 3.31Å; L632-W636 PolarHBondContact O-N 2.87Å
633E81.2Confident83.5Confident123 Ų123104.9 Ų104.958%0.57551%0.506SS*.Hα-helixtrans-56.5-42.1175.2-72.6-178.5161.200111.9A629 L630 K635 W636 T637A629-E633 WeakPolarHBondContact O-CG 3.38Å; A629-E633 PolarHBondContact O-N 2.98Å; L630-E633 PolarHBondContact O-N 2.84Å; E633-K635 VanDerWaalsContact C-N 3.35Å; E633-K635 PolarHBondContact O-N 3.25Å; E633-W636 PolarHBondContact O-N 2.9Å; E633-T637 WeakPolarHBondContact O-CB 3.47Å; E633-T637 WeakPolarHBondContact O-CG2 2.93Å; E633-T637 PolarHBondContact O-N 3.11Å; E633-T637 PolarHBondContact O-OG1 2.77Å
634L84.6Confident83.2Confident108 Ų108100.9 Ų100.957%0.56549%0.492SS*.Hα-helixtrans-64.3-35.4174.6-74.4167.5000113L630 L632 T637 E638L630-L634 HydrophobicContact CD2-CD1 4.47Å; L630-L634 HydrophobicContact CG-CD1 4.43Å; L630-L634 WeakPolarHBondContact O-CB 3.11Å; L630-L634 WeakPolarHBondContact O-CD1 3.33Å; L630-L634 VanDerWaalsContact O-CG 3.25Å; L630-L634 WeakPolarHBondContact O-CG 3.11Å; L630-L634 PolarHBondContact O-N 3.44Å; L632-L634 VanDerWaalsContact C-N 3.3Å; L632-L634 PolarHBondContact O-N 3.31Å; L634-T637 WeakPolarHBondContact CA-OG1 3.12Å; L634-T637 PolarHBondContact O-OG1 2.79Å; L634-E638 VanDerWaalsContact O-CB 3.28Å; L634-E638 WeakPolarHBondContact O-CB 3.29Å; L634-E638 PolarHBondContact O-N 3.02Å; L634-E638 VanDerWaalsContact O-N 3.12Å
635K86.7Confident83.1Confident117 Ų117100.9 Ų100.951%0.50949%0.492SS..Hα-helixtrans-72.5-43.2175.7-72.4163.1-164.2148.30111.4E631 L632 E633 E638 T639E631-K635 WeakPolarHBondContact O-CD 3.47Å; E631-K635 VanDerWaalsContact O-CE 3.29Å; E631-K635 WeakPolarHBondContact O-CE 3.29Å; E631-K635 WeakPolarHBondContact O-CG 3.44Å; E631-K635 PolarHBondContact O-N 3.29Å; E631-K635 PolarHBondContact O-NZ 2.85Å; E631-K635 IonicContact OE2-NZ 3.59Å; L632-K635 PolarHBondContact O-N 2.92Å; E633-K635 VanDerWaalsContact C-N 3.35Å; E633-K635 PolarHBondContact O-N 3.25Å; K635-E638 PolarHBondContact O-N 3.47Å; K635-T639 WeakPolarHBondContact O-CG2 3.37Å; K635-T639 PolarHBondContact O-N 2.82Å; K635-T639 PolarHBondContact O-OG1 3.46Å
636W81.4Confident83.3Confident191 Ų19199.2 Ų99.272%0.72348%0.481SS*.Hα-helixtrans-67.8-39.9177.7-85.491000112.7L632 E633 T639 L640L632-W636 VanDerWaalsContact O-CD1 3.31Å; L632-W636 PolarHBondContact O-N 2.87Å; E633-W636 PolarHBondContact O-N 2.9Å; W636-T639 WeakPolarHBondContact CA-OG1 3.31Å; W636-T639 PolarHBondContact O-OG1 2.71Å; W636-T639 VanDerWaalsContact O-OG1 3.12Å; W636-L640 WeakPolarHBondContact O-CB 3.49Å; W636-L640 PolarHBondContact O-N 3.08Å
637T81.4Confident83.2Confident85 Ų85101 Ų10152%0.52149%0.491SS..Hα-helixtrans-69.3-38175.2490000111.9E633 L634 R641E633-T637 WeakPolarHBondContact O-CB 3.47Å; E633-T637 WeakPolarHBondContact O-CG2 2.93Å; E633-T637 PolarHBondContact O-N 3.11Å; E633-T637 PolarHBondContact O-OG1 2.77Å; L634-T637 WeakPolarHBondContact CA-OG1 3.12Å; L634-T637 PolarHBondContact O-OG1 2.79Å; T637-R641 WeakPolarHBondContact O-CB 3.37Å; T637-R641 PolarHBondContact O-N 3Å
638E82Confident83.1Confident67 Ų67103.4 Ų103.431%0.31350%0.496SS..Hα-helixtrans-70-40.8175.4179.756.5-160.800112.5L634 K635 R641 Q642L634-E638 VanDerWaalsContact O-CB 3.28Å; L634-E638 WeakPolarHBondContact O-CB 3.29Å; L634-E638 PolarHBondContact O-N 3.02Å; L634-E638 VanDerWaalsContact O-N 3.12Å; K635-E638 PolarHBondContact O-N 3.47Å; E638-R641 VanDerWaalsContact CD-NH2 3.29Å; E638-R641 PolarHBondContact O-N 2.86Å; E638-R641 IonicContact OE1-CZ 3.37Å; E638-R641 IonicContact OE1-NE 3.96Å; E638-R641 IonicContact OE1-NH2 3.1Å; E638-R641 PolarHBondContact OE1-NH2 3.28Å; E638-R641 IonicContact OE2-CZ 3.35Å; E638-R641 VanDerWaalsContact OE2-CZ 3.29Å; E638-R641 IonicContact OE2-NE 2.59Å; E638-R641 PolarHBondContact OE2-NE 3.26Å; E638-R641 IonicContact OE2-NH2 3.83Å; E638-R641 PolarHBondContact OE2-NH2 3.29Å; E638-Q642 VanDerWaalsContact O-CG 3.31Å; E638-Q642 WeakPolarHBondContact O-CG 3.42Å; E638-Q642 PolarHBondContact O-N 3.32Å; E638-Q642 PolarHBondContact OE1-NE2 3.4Å
639T81.4Confident83.2Confident69 Ų69100.1 Ų100.142%0.42348%0.479SS..Hα-helixtrans-65.1-43.8173.250.10000111.5K635 W636 R641 Q642 E643K635-T639 WeakPolarHBondContact O-CG2 3.37Å; K635-T639 PolarHBondContact O-N 2.82Å; K635-T639 PolarHBondContact O-OG1 3.46Å; W636-T639 WeakPolarHBondContact CA-OG1 3.31Å; W636-T639 PolarHBondContact O-OG1 2.71Å; W636-T639 VanDerWaalsContact O-OG1 3.12Å; T639-R641 VanDerWaalsContact C-N 3.27Å; T639-R641 PolarHBondContact O-N 2.98Å; T639-Q642 PolarHBondContact O-N 2.99Å; T639-E643 PolarHBondContact O-N 2.86Å
640L79.7Confident83.2Confident117 Ų117102.2 Ų102.261%0.61348%0.481SS*.Hα-helixtrans-60.9-37.2174.6-167.173.1000111.6W636 Q642 C644W636-L640 WeakPolarHBondContact O-CB 3.49Å; W636-L640 PolarHBondContact O-N 3.08Å; L640-Q642 VanDerWaalsContact C-N 3.35Å; L640-C644 WeakPolarHBondContact O-CB 3.2Å; L640-C644 PolarHBondContact O-N 2.83Å; L640-C644 PolarHBondContact O-SG 2.82Å
641R87Confident83Confident143 Ų143102.8 Ų102.854%0.5448%0.484SS..Hα-helixtrans-66.9-34.2174.2-166.6-174.773.185.86112.2T637 E638 T639 K645T637-R641 WeakPolarHBondContact O-CB 3.37Å; T637-R641 PolarHBondContact O-N 3Å; E638-R641 VanDerWaalsContact CD-NH2 3.29Å; E638-R641 PolarHBondContact O-N 2.86Å; E638-R641 IonicContact OE1-CZ 3.37Å; E638-R641 IonicContact OE1-NE 3.96Å; E638-R641 IonicContact OE1-NH2 3.1Å; E638-R641 PolarHBondContact OE1-NH2 3.28Å; E638-R641 IonicContact OE2-CZ 3.35Å; E638-R641 VanDerWaalsContact OE2-CZ 3.29Å; E638-R641 IonicContact OE2-NE 2.59Å; E638-R641 PolarHBondContact OE2-NE 3.26Å; E638-R641 IonicContact OE2-NH2 3.83Å; E638-R641 PolarHBondContact OE2-NH2 3.29Å; T639-R641 VanDerWaalsContact C-N 3.27Å; T639-R641 PolarHBondContact O-N 2.98Å; R641-K645 WeakPolarHBondContact O-CB 3.5Å; R641-K645 PolarHBondContact O-N 2.76Å
642Q81.9Confident83Confident89 Ų89105.4 Ų105.442%0.41649%0.49SS..Hα-helixtrans-73.3-44.1176.2-73175.918.900112.2E638 T639 L640 K645 K646E638-Q642 VanDerWaalsContact O-CG 3.31Å; E638-Q642 WeakPolarHBondContact O-CG 3.42Å; E638-Q642 PolarHBondContact O-N 3.32Å; E638-Q642 PolarHBondContact OE1-NE2 3.4Å; T639-Q642 PolarHBondContact O-N 2.99Å; L640-Q642 VanDerWaalsContact C-N 3.35Å; Q642-K645 WeakPolarHBondContact O-CA 3.19Å; Q642-K645 WeakPolarHBondContact O-CB 3.12Å; Q642-K645 PolarHBondContact O-N 2.87Å; Q642-K646 PolarHBondContact O-N 3.5Å
643E85.1Confident83Confident85 Ų85106.7 Ų106.740%0.39749%0.494SS..Hα-helixtrans-64.8-41.9172.8-58.1-47.512600111.2T639 K645 K646 L647T639-E643 PolarHBondContact O-N 2.86Å; E643-K645 PolarHBondContact O-N 3.32Å; E643-K645 VanDerWaalsContact O-N 3.16Å; E643-K646 PolarHBondContact O-N 2.83Å; E643-K646 IonicContact OE1-NZ 2.82Å; E643-K646 PolarHBondContact OE1-NZ 2.92Å; E643-K646 WeakPolarHBondContact OE2-CD 3.2Å; E643-K646 IonicContact OE2-NZ 4Å; E643-K646 PolarHBondContact OE2-NZ 2.89Å; E643-L647 WeakPolarHBondContact O-CG 3.44Å; E643-L647 PolarHBondContact O-N 3.25Å
644C80.3Confident82.9Confident49 Ų49106.5 Ų106.533%0.33149%0.493SS..Hα-helixtrans-61.8-19.6170.1-71.60000113.7L640 R648L640-C644 WeakPolarHBondContact O-CB 3.2Å; L640-C644 PolarHBondContact O-N 2.83Å; L640-C644 PolarHBondContact O-SG 2.82Å; C644-R648 WeakPolarHBondContact O-CD 3.42Å; C644-R648 WeakPolarHBondContact O-CG 3.22Å; C644-R648 PolarHBondContact O-NE 3.43Å
645K82.9Confident82.9Confident101 Ų101107.2 Ų107.244%0.43949%0.493SS..Hα-helixtrans-83.4-46.3174.4-174.3-177173.1-73.90110.4R641 Q642 E643 R648 E649R641-K645 WeakPolarHBondContact O-CB 3.5Å; R641-K645 PolarHBondContact O-N 2.76Å; Q642-K645 WeakPolarHBondContact O-CA 3.19Å; Q642-K645 WeakPolarHBondContact O-CB 3.12Å; Q642-K645 PolarHBondContact O-N 2.87Å; E643-K645 PolarHBondContact O-N 3.32Å; E643-K645 VanDerWaalsContact O-N 3.16Å; K645-R648 CarbonylContact O-C 3.56Å; K645-R648 PolarHBondContact O-N 2.99Å; K645-E649 WeakPolarHBondContact CE-OE1 3.42Å; K645-E649 IonicContact NZ-OE1 2.72Å; K645-E649 PolarHBondContact NZ-OE1 2.89Å; K645-E649 IonicContact NZ-OE2 2.65Å; K645-E649 PolarHBondContact NZ-OE2 3.47Å; K645-E649 WeakPolarHBondContact O-CG 3.25Å; K645-E649 PolarHBondContact O-N 2.69Å
646K84.9Confident82.6Confident92 Ų92105.8 Ų105.840%0.449%0.488SS..Hα-helixtrans-55.5-53.3173.8-68.9176.3-172.91610111.8Q642 E643 R648 E649 E650Q642-K646 PolarHBondContact O-N 3.5Å; E643-K646 PolarHBondContact O-N 2.83Å; E643-K646 IonicContact OE1-NZ 2.82Å; E643-K646 PolarHBondContact OE1-NZ 2.92Å; E643-K646 WeakPolarHBondContact OE2-CD 3.2Å; E643-K646 IonicContact OE2-NZ 4Å; E643-K646 PolarHBondContact OE2-NZ 2.89Å; K646-R648 PolarHBondContact O-N 3.48Å; K646-R648 VanDerWaalsContact O-N 3.07Å; K646-E649 CarbonylContact O-C 3.51Å; K646-E649 WeakPolarHBondContact O-CA 3.34Å; K646-E649 WeakPolarHBondContact O-CB 3.43Å; K646-E649 PolarHBondContact O-N 3.32Å; K646-E650 WeakPolarHBondContact O-CB 3.39Å; K646-E650 WeakPolarHBondContact O-CG 3.11Å; K646-E650 PolarHBondContact O-N 2.95Å
647L82.3Confident82.6Confident109 Ų109103.3 Ų103.357%0.57149%0.485SS*.Hα-helixtrans-59-27179.4-69.8166.1000113E643 E650 L651E643-L647 WeakPolarHBondContact O-CG 3.44Å; E643-L647 PolarHBondContact O-N 3.25Å; L647-E650 WeakPolarHBondContact CA-OE2 3.13Å; L647-L651 WeakPolarHBondContact O-CB 2.97Å; L647-L651 PolarHBondContact O-N 2.93Å
648R84.3Confident82.5Confident178 Ų178106.1 Ų106.167%0.67249%0.492SS*.Hα-helixtrans-86.2-13.1174.1-71.7175.1-171.2168.63.1113.8C644 K645 K646 R652C644-R648 WeakPolarHBondContact O-CD 3.42Å; C644-R648 WeakPolarHBondContact O-CG 3.22Å; C644-R648 PolarHBondContact O-NE 3.43Å; K645-R648 CarbonylContact O-C 3.56Å; K645-R648 PolarHBondContact O-N 2.99Å; K646-R648 PolarHBondContact O-N 3.48Å; K646-R648 VanDerWaalsContact O-N 3.07Å; R648-R652 WeakPolarHBondContact O-CB 3.19Å; R648-R652 PolarHBondContact O-NH2 2.61Å
649E82.7Confident82.7Confident59 Ų59107.2 Ų107.228%0.27650%0.496SS..Hα-helixtrans-92.4-49.7174.5-74.6173.9151.800109.1K645 K646 L651 R652 E653K645-E649 WeakPolarHBondContact CE-OE1 3.42Å; K645-E649 IonicContact NZ-OE1 2.72Å; K645-E649 PolarHBondContact NZ-OE1 2.89Å; K645-E649 IonicContact NZ-OE2 2.65Å; K645-E649 PolarHBondContact NZ-OE2 3.47Å; K645-E649 WeakPolarHBondContact O-CG 3.25Å; K645-E649 PolarHBondContact O-N 2.69Å; K646-E649 CarbonylContact O-C 3.51Å; K646-E649 WeakPolarHBondContact O-CA 3.34Å; K646-E649 WeakPolarHBondContact O-CB 3.43Å; K646-E649 PolarHBondContact O-N 3.32Å; E649-L651 PolarHBondContact O-N 3.34Å; E649-R652 CarbonylContact O-C 3.6Å; E649-R652 WeakPolarHBondContact O-CA 3.32Å; E649-R652 WeakPolarHBondContact O-CB 3.41Å; E649-R652 PolarHBondContact O-N 3.15Å; E649-E653 WeakPolarHBondContact O-CG 3.48Å; E649-E653 PolarHBondContact O-N 2.84Å
650E83.3Confident82.8Confident91 Ų91107.7 Ų107.743%0.42550%0.499SS..Hα-helixtrans-50.6-56.8169.3-68.3157-178.700111.5K646 L647 R652 E653 E654K646-E650 WeakPolarHBondContact O-CB 3.39Å; K646-E650 WeakPolarHBondContact O-CG 3.11Å; K646-E650 PolarHBondContact O-N 2.95Å; L647-E650 WeakPolarHBondContact CA-OE2 3.13Å; E650-R652 PolarHBondContact O-N 3.43Å; E650-E653 PolarHBondContact O-N 2.82Å; E650-E654 WeakPolarHBondContact O-CG 3.24Å; E650-E654 PolarHBondContact O-N 3.05Å
651L81.6Confident83.1Confident113 Ų113104.4 Ų104.459%0.59249%0.488SS*.Hα-helixtrans-61.8-19.8177.9-174.165.8000113.8L647 E649 H655L647-L651 WeakPolarHBondContact O-CB 2.97Å; L647-L651 PolarHBondContact O-N 2.93Å; E649-L651 PolarHBondContact O-N 3.34Å; L651-H655 WeakPolarHBondContact O-CB 3.43Å; L651-H655 PolarHBondContact O-N 3.38Å
652R86Confident82.8Confident131 Ų131100.3 Ų100.349%0.49449%0.485SS..Hα-helixtrans-89-33.1176.5-162.7-166.6-42.411712.6111.7R648 E649 E650 E656R648-R652 WeakPolarHBondContact O-CB 3.19Å; R648-R652 PolarHBondContact O-NH2 2.61Å; E649-R652 CarbonylContact O-C 3.6Å; E649-R652 WeakPolarHBondContact O-CA 3.32Å; E649-R652 WeakPolarHBondContact O-CB 3.41Å; E649-R652 PolarHBondContact O-N 3.15Å; E650-R652 PolarHBondContact O-N 3.43Å; R652-E656 WeakPolarHBondContact O-CB 3.21Å; R652-E656 WeakPolarHBondContact O-CG 3.42Å; R652-E656 PolarHBondContact O-N 2.79Å
653E82.4Confident82.7Confident124 Ų124100.8 Ų100.858%0.57949%0.49SS*.Hα-helixtrans-68.2-47.4171.5-72.8172176.900109.1E649 E650 H655 E656 E657E649-E653 WeakPolarHBondContact O-CG 3.48Å; E649-E653 PolarHBondContact O-N 2.84Å; E650-E653 PolarHBondContact O-N 2.82Å; E653-H655 PolarHBondContact O-N 3.4Å; E653-E656 CarbonylContact O-C 3.57Å; E653-E656 PolarHBondContact O-N 2.79Å; E653-E656 VanDerWaalsContact O-N 3.13Å; E653-E657 WeakPolarHBondContact O-CB 3.44Å; E653-E657 WeakPolarHBondContact O-CG 3.22Å; E653-E657 PolarHBondContact O-N 3.49Å
654E79.7Confident82.7Confident118 Ų11899.5 Ų99.555%0.55149%0.494SS*.Hα-helixtrans-52.7-49.6169.7-71.2-178.8147.800112.1E650 E656 E657 E658E650-E654 WeakPolarHBondContact O-CG 3.24Å; E650-E654 PolarHBondContact O-N 3.05Å; E654-E656 VanDerWaalsContact C-N 3.34Å; E654-E656 PolarHBondContact O-N 3.42Å; E654-E657 PolarHBondContact O-N 2.7Å; E654-E658 WeakPolarHBondContact O-CG 3.43Å; E654-E658 PolarHBondContact O-N 3.39Å
655H83.3Confident82.8Confident123 Ų123103.6 Ų103.657%0.56951%0.508SS*.Hα-helixtrans-68-30.2-179.7-166.6-31.8000112.8L651 E653 K659L651-H655 WeakPolarHBondContact O-CB 3.43Å; L651-H655 PolarHBondContact O-N 3.38Å; E653-H655 PolarHBondContact O-N 3.4Å; H655-K659 WeakPolarHBondContact O-CB 3.42Å; H655-K659 PolarHBondContact O-N 3.01Å
656E80.4Confident82.7Confident88 Ų88103.6 Ų103.641%0.41151%0.513SS..Hα-helixtrans-77.5-31172.1-77.5-66157.900112.5R652 E653 E654 K659 T660R652-E656 WeakPolarHBondContact O-CB 3.21Å; R652-E656 WeakPolarHBondContact O-CG 3.42Å; R652-E656 PolarHBondContact O-N 2.79Å; E653-E656 CarbonylContact O-C 3.57Å; E653-E656 PolarHBondContact O-N 2.79Å; E653-E656 VanDerWaalsContact O-N 3.13Å; E654-E656 VanDerWaalsContact C-N 3.34Å; E654-E656 PolarHBondContact O-N 3.42Å; E656-K659 IonicContact OE1-NZ 2.98Å; E656-K659 PolarHBondContact OE1-NZ 3.47Å; E656-K659 IonicContact OE2-NZ 3.49Å; E656-K659 PolarHBondContact OE2-NZ 3.1Å; E656-T660 WeakPolarHBondContact O-CB 3.39Å; E656-T660 VanDerWaalsContact O-CG2 3.31Å; E656-T660 WeakPolarHBondContact O-CG2 3.45Å; E656-T660 PolarHBondContact O-N 3.15Å; E656-T660 PolarHBondContact O-OG1 3.14Å
657E83.1Confident82.5Confident138 Ų138102 Ų10265%0.64552%0.517SS*.Hα-helixtrans-68.6-46.5171.3-74.2-169.6172.800111.4E653 E654 K659 T660 A661E653-E657 WeakPolarHBondContact O-CB 3.44Å; E653-E657 WeakPolarHBondContact O-CG 3.22Å; E653-E657 PolarHBondContact O-N 3.49Å; E654-E657 PolarHBondContact O-N 2.7Å; E657-K659 VanDerWaalsContact C-N 3.33Å; E657-K659 PolarHBondContact O-N 3.16Å; E657-T660 WeakPolarHBondContact CA-OG1 3.48Å; E657-T660 PolarHBondContact O-N 3.4Å; E657-T660 PolarHBondContact O-OG1 2.73Å; E657-A661 WeakPolarHBondContact O-CB 3.34Å; E657-A661 PolarHBondContact O-N 3.48Å
658E79.1Confident82.7Confident144 Ų144102.2 Ų102.267%0.67352%0.515SS*.Hα-helixtrans-58.9-43.9171.6-74.4-167.7154.100111.6E654 A661 A662E654-E658 WeakPolarHBondContact O-CG 3.43Å; E654-E658 PolarHBondContact O-N 3.39Å; E658-A661 PolarHBondContact O-N 2.85Å; E658-A662 VanDerWaalsContact O-CB 3.24Å; E658-A662 WeakPolarHBondContact O-CB 3.07Å; E658-A662 PolarHBondContact O-N 3.08Å
659K84.9Confident82.4Confident90 Ų9096.2 Ų96.239%0.39150%0.5SS..Hα-helixtrans-65.6-41.3178.4169.8165.8157.2-95.40112.2H655 E656 E657 L663H655-K659 WeakPolarHBondContact O-CB 3.42Å; H655-K659 PolarHBondContact O-N 3.01Å; E656-K659 IonicContact OE1-NZ 2.98Å; E656-K659 PolarHBondContact OE1-NZ 3.47Å; E656-K659 IonicContact OE2-NZ 3.49Å; E656-K659 PolarHBondContact OE2-NZ 3.1Å; E657-K659 VanDerWaalsContact C-N 3.33Å; E657-K659 PolarHBondContact O-N 3.16Å; K659-L663 HydrophobicContact CG-CD1 4.18Å; K659-L663 WeakPolarHBondContact O-CB 3.44Å; K659-L663 WeakPolarHBondContact O-CD1 3.28Å; K659-L663 WeakPolarHBondContact O-CG 3.31Å; K659-L663 PolarHBondContact O-N 3.09Å
660T84.7Confident82.4Confident80 Ų8098.8 Ų98.849%0.49151%0.51SS..Hα-helixtrans-73.5-35.8176.550.20000112E656 E657 L663 A664E656-T660 WeakPolarHBondContact O-CB 3.39Å; E656-T660 VanDerWaalsContact O-CG2 3.31Å; E656-T660 WeakPolarHBondContact O-CG2 3.45Å; E656-T660 PolarHBondContact O-N 3.15Å; E656-T660 PolarHBondContact O-OG1 3.14Å; E657-T660 WeakPolarHBondContact CA-OG1 3.48Å; E657-T660 PolarHBondContact O-N 3.4Å; E657-T660 PolarHBondContact O-OG1 2.73Å; T660-L663 PolarHBondContact O-N 2.87Å; T660-A664 VanDerWaalsContact O-CB 3.27Å; T660-A664 WeakPolarHBondContact O-CB 3.48Å; T660-A664 PolarHBondContact O-N 3.33Å
661A84.3Confident82.4Confident47 Ų47100 Ų10039%0.38852%0.516SS..Hα-helixtrans-63.8-44.6171.700000112E657 E658 A664 Q665E657-A661 WeakPolarHBondContact O-CB 3.34Å; E657-A661 PolarHBondContact O-N 3.48Å; E658-A661 PolarHBondContact O-N 2.85Å; A661-A664 PolarHBondContact O-N 2.7Å; A661-Q665 WeakPolarHBondContact O-CG 3.35Å; A661-Q665 PolarHBondContact O-N 2.83Å
662A81.1Confident82.4Confident57 Ų57100 Ų10047%0.47151%0.513SS..Hα-helixtrans-64.4-40.4175.600000112.1E658 L666E658-A662 VanDerWaalsContact O-CB 3.24Å; E658-A662 WeakPolarHBondContact O-CB 3.07Å; E658-A662 PolarHBondContact O-N 3.08Å; A662-L666 VanDerWaalsContact O-CB 3.3Å; A662-L666 WeakPolarHBondContact O-CB 3.15Å; A662-L666 PolarHBondContact O-N 3.18Å
663L81.4Confident82Confident100 Ų10099.3 Ų99.352%0.52452%0.515SS..Hα-helixtrans-65.9-37.4173.2-74.2168.8000112.1K659 T660 L666 A667K659-L663 HydrophobicContact CG-CD1 4.18Å; K659-L663 WeakPolarHBondContact O-CB 3.44Å; K659-L663 WeakPolarHBondContact O-CD1 3.28Å; K659-L663 WeakPolarHBondContact O-CG 3.31Å; K659-L663 PolarHBondContact O-N 3.09Å; T660-L663 PolarHBondContact O-N 2.87Å; L663-L666 PolarHBondContact O-N 2.87Å; L663-A667 VanDerWaalsContact O-CB 3.3Å; L663-A667 WeakPolarHBondContact O-CB 3.46Å; L663-A667 PolarHBondContact O-N 3.33Å
664A83.6Confident81.8Confident58 Ų5898.4 Ų98.448%0.47951%0.511SS..Hα-helixtrans-67.6-43.7175.600000112T660 A661 A667 Q668T660-A664 VanDerWaalsContact O-CB 3.27Å; T660-A664 WeakPolarHBondContact O-CB 3.48Å; T660-A664 PolarHBondContact O-N 3.33Å; A661-A664 PolarHBondContact O-N 2.7Å; A664-A667 PolarHBondContact O-N 2.91Å; A664-Q668 WeakPolarHBondContact O-CB 3.36Å; A664-Q668 PolarHBondContact O-N 2.71Å
665Q82.6Confident81.9Confident135 Ų13595.6 Ų95.663%0.63150%0.5SS*.Hα-helixtrans-63-41.3173.4-73.3-178.55.400111.9A661 Q668 S669A661-Q665 WeakPolarHBondContact O-CG 3.35Å; A661-Q665 PolarHBondContact O-N 2.83Å; Q665-Q668 PolarHBondContact O-N 3.44Å; Q665-S669 WeakPolarHBondContact O-CB 3.48Å; Q665-S669 PolarHBondContact O-N 2.79Å
666L81Confident81.9Confident101 Ų10193 Ų9353%0.52950%0.495SS..Hα-helixtrans-64.2-41.3175.5-174.266.8000111.5A662 L663 K670A662-L666 VanDerWaalsContact O-CB 3.3Å; A662-L666 WeakPolarHBondContact O-CB 3.15Å; A662-L666 PolarHBondContact O-N 3.18Å; L663-L666 PolarHBondContact O-N 2.87Å; L666-K670 WeakPolarHBondContact O-CB 3.4Å; L666-K670 WeakPolarHBondContact O-CG 3.35Å; L666-K670 PolarHBondContact O-N 3.31Å
667A80.2Confident81.9Confident59 Ų5990.8 Ų90.849%0.48849%0.492SS..Hα-helixtrans-64.8-44.717500000111.9L663 A664 S669 K670 E671L663-A667 VanDerWaalsContact O-CB 3.3Å; L663-A667 WeakPolarHBondContact O-CB 3.46Å; L663-A667 PolarHBondContact O-N 3.33Å; A664-A667 PolarHBondContact O-N 2.91Å; A667-S669 PolarHBondContact O-N 3.38Å; A667-K670 PolarHBondContact O-N 3.29Å; A667-E671 WeakPolarHBondContact O-CB 3.32Å; A667-E671 PolarHBondContact O-N 2.83Å
668Q86.3Confident81.9Confident113 Ų11391.2 Ų91.253%0.52849%0.488SS..Hα-helixtrans-62.4-42.4176.5-173.3179.723.300111.7A664 Q665 E671 Q672A664-Q668 WeakPolarHBondContact O-CB 3.36Å; A664-Q668 PolarHBondContact O-N 2.71Å; Q665-Q668 PolarHBondContact O-N 3.44Å; Q668-E671 PolarHBondContact O-N 3.35Å; Q668-Q672 WeakPolarHBondContact O-CB 3.15Å; Q668-Q672 WeakPolarHBondContact O-CG 3.35Å; Q668-Q672 PolarHBondContact O-N 2.9Å
669S79.8Confident82.2Confident52 Ų5288.8 Ų88.836%0.36448%0.477SS..Hα-helixtrans-62.2-47174.4-174.10000111.2Q665 A667 E671 Q672 E673Q665-S669 WeakPolarHBondContact O-CB 3.48Å; Q665-S669 PolarHBondContact O-N 2.79Å; A667-S669 PolarHBondContact O-N 3.38Å; S669-E671 VanDerWaalsContact C-N 3.3Å; S669-E671 PolarHBondContact O-N 3.29Å; S669-Q672 PolarHBondContact O-N 2.81Å; S669-E673 WeakPolarHBondContact O-CG 3.49Å; S669-E673 PolarHBondContact O-N 2.95Å
670K81.9Confident81.8Confident113 Ų11386.7 Ų86.749%0.49147%0.473SS..Hα-helixtrans-61.2-35.5174.8-71-107.1176179.40113L666 A667 Q674L666-K670 WeakPolarHBondContact O-CB 3.4Å; L666-K670 WeakPolarHBondContact O-CG 3.35Å; L666-K670 PolarHBondContact O-N 3.31Å; A667-K670 PolarHBondContact O-N 3.29Å; K670-Q674 WeakPolarHBondContact O-CB 3.18Å; K670-Q674 VanDerWaalsContact O-CG 3.3Å; K670-Q674 WeakPolarHBondContact O-CG 3.16Å; K670-Q674 PolarHBondContact O-N 3.07Å
671E82.2Confident81.8Confident115 Ų11591 Ų9154%0.53748%0.48SS..Hα-helixtrans-71.6-40175.2-179.1165.5-152.600111.5A667 Q668 S669 Q674 N675A667-E671 WeakPolarHBondContact O-CB 3.32Å; A667-E671 PolarHBondContact O-N 2.83Å; Q668-E671 PolarHBondContact O-N 3.35Å; S669-E671 VanDerWaalsContact C-N 3.3Å; S669-E671 PolarHBondContact O-N 3.29Å; E671-Q674 PolarHBondContact O-N 2.61Å; E671-N675 WeakPolarHBondContact CG-ND2 3.37Å; E671-N675 VanDerWaalsContact O-CB 3.25Å; E671-N675 WeakPolarHBondContact O-CB 3.32Å; E671-N675 PolarHBondContact O-N 2.9Å; E671-N675 PolarHBondContact O-ND2 2.84Å
672Q81.8Confident81.6Confident114 Ų11493.5 Ų93.553%0.53348%0.484SS..Hα-helixtrans-64.9-40.4172.5-73.8176.8-3.300112.1Q668 S669 S676Q668-Q672 WeakPolarHBondContact O-CB 3.15Å; Q668-Q672 WeakPolarHBondContact O-CG 3.35Å; Q668-Q672 PolarHBondContact O-N 2.9Å; S669-Q672 PolarHBondContact O-N 2.81Å; Q672-S676 VanDerWaalsContact O-CB 3.22Å; Q672-S676 WeakPolarHBondContact O-CB 3.35Å; Q672-S676 PolarHBondContact O-N 2.95Å; Q672-S676 PolarHBondContact O-OG 2.8Å
673E78.4Confident81.7Confident116 Ų11697.3 Ų97.354%0.54249%0.486SS..Hα-helixtrans-62.1-48171.6-74.8177.9169.100111.3S669 N675 S676 A677S669-E673 WeakPolarHBondContact O-CG 3.49Å; S669-E673 PolarHBondContact O-N 2.95Å; E673-N675 PolarHBondContact O-N 2.95Å; E673-S676 PolarHBondContact O-N 3.35Å; E673-A677 VanDerWaalsContact O-CB 3.26Å; E673-A677 WeakPolarHBondContact O-CB 3.3Å; E673-A677 PolarHBondContact O-N 2.86Å
674Q77.2Confident81.7Confident106 Ų10697.7 Ų97.750%0.49548%0.484SS..Hα-helixtrans-64.1-39.9177.5-79.4-174.732.400112.4K670 E671 A677 R678K670-Q674 WeakPolarHBondContact O-CB 3.18Å; K670-Q674 VanDerWaalsContact O-CG 3.3Å; K670-Q674 WeakPolarHBondContact O-CG 3.16Å; K670-Q674 PolarHBondContact O-N 3.07Å; E671-Q674 PolarHBondContact O-N 2.61Å; Q674-A677 PolarHBondContact O-N 2.88Å; Q674-R678 VanDerWaalsContact O-CB 3.31Å; Q674-R678 WeakPolarHBondContact O-CB 3.26Å; Q674-R678 WeakPolarHBondContact O-CD 3.2Å; Q674-R678 WeakPolarHBondContact O-CG 3.27Å; Q674-R678 PolarHBondContact O-N 2.88Å
675N83.1Confident81.6Confident58 Ų5898.2 Ų98.231%0.3148%0.481SS..Hα-helixtrans-72.5-39.8178.4-70.4-23.1000111.1E671 E673 A677 R678 E679E671-N675 WeakPolarHBondContact CG-ND2 3.37Å; E671-N675 VanDerWaalsContact O-CB 3.25Å; E671-N675 WeakPolarHBondContact O-CB 3.32Å; E671-N675 PolarHBondContact O-N 2.9Å; E671-N675 PolarHBondContact O-ND2 2.84Å; E673-N675 PolarHBondContact O-N 2.95Å; N675-A677 VanDerWaalsContact C-N 3.33Å; N675-A677 PolarHBondContact O-N 3.49Å; N675-R678 PolarHBondContact O-N 3.36Å; N675-R678 PolarHBondContact OD1-NH1 3.46Å; N675-E679 WeakPolarHBondContact O-CB 3.26Å; N675-E679 WeakPolarHBondContact O-CG 3.45Å; N675-E679 PolarHBondContact O-N 3.36Å
676S82.1Confident81.7Confident69 Ų6995.3 Ų95.348%0.48347%0.47SS..Hα-helixtrans-60.8-41.6171-58.50000111.8Q672 E673 S680Q672-S676 VanDerWaalsContact O-CB 3.22Å; Q672-S676 WeakPolarHBondContact O-CB 3.35Å; Q672-S676 PolarHBondContact O-N 2.95Å; Q672-S676 PolarHBondContact O-OG 2.8Å; E673-S676 PolarHBondContact O-N 3.35Å; S676-S680 WeakPolarHBondContact O-CB 3.47Å; S676-S680 PolarHBondContact O-N 3.33Å
677A81.3Confident81.8Confident41 Ų4194.3 Ų94.334%0.33947%0.465SS..Hα-helixtrans-65.3-47.6174.800000111.4E673 Q674 N675 E679 S680 W681E673-A677 VanDerWaalsContact O-CB 3.26Å; E673-A677 WeakPolarHBondContact O-CB 3.3Å; E673-A677 PolarHBondContact O-N 2.86Å; Q674-A677 PolarHBondContact O-N 2.88Å; N675-A677 VanDerWaalsContact C-N 3.33Å; N675-A677 PolarHBondContact O-N 3.49Å; A677-E679 PolarHBondContact O-N 2.75Å; A677-S680 PolarHBondContact O-N 2.81Å; A677-S680 VanDerWaalsContact O-N 3.13Å; A677-S680 PolarHBondContact O-OG 3Å; A677-W681 PolarHBondContact O-N 3.23Å
678R83.9Confident81.9Confident147 Ų14796.1 Ų96.156%0.55547%0.466SS*.Hα-helixtrans-56.8-46.7174.7-77.4165-179.91650.2111.3Q674 N675 S680 W681 Q682Q674-R678 VanDerWaalsContact O-CB 3.31Å; Q674-R678 WeakPolarHBondContact O-CB 3.26Å; Q674-R678 WeakPolarHBondContact O-CD 3.2Å; Q674-R678 WeakPolarHBondContact O-CG 3.27Å; Q674-R678 PolarHBondContact O-N 2.88Å; N675-R678 PolarHBondContact O-N 3.36Å; N675-R678 PolarHBondContact OD1-NH1 3.46Å; R678-S680 PolarHBondContact O-N 3.3Å; R678-W681 CarbonylContact O-C 3.58Å; R678-W681 PolarHBondContact O-N 3.02Å; R678-Q682 VanDerWaalsContact O-CB 3.29Å; R678-Q682 WeakPolarHBondContact O-CB 3.49Å; R678-Q682 PolarHBondContact O-N 2.78Å
679E84.7Confident81.5Confident94 Ų9495.4 Ų95.444%0.43947%0.465SS..Hα-helixtrans-64.5-37.7175.1-71.2-179-162.500112.3N675 A677 W681 Q682 R683N675-E679 WeakPolarHBondContact O-CB 3.26Å; N675-E679 WeakPolarHBondContact O-CG 3.45Å; N675-E679 PolarHBondContact O-N 3.36Å; A677-E679 PolarHBondContact O-N 2.75Å; E679-W681 VanDerWaalsContact C-N 3.28Å; E679-W681 PolarHBondContact O-N 3.43Å; E679-Q682 PolarHBondContact O-N 2.88Å; E679-R683 VanDerWaalsContact CB-NH1 3.31Å; E679-R683 WeakPolarHBondContact O-CB 3.35Å; E679-R683 VanDerWaalsContact O-CG 3.24Å; E679-R683 WeakPolarHBondContact O-CG 3.19Å; E679-R683 PolarHBondContact O-N 3.33Å; E679-R683 IonicContact OE2-CZ 2.98Å; E679-R683 VanDerWaalsContact OE2-CZ 3.24Å; E679-R683 IonicContact OE2-NH1 2.68Å; E679-R683 PolarHBondContact OE2-NH1 2.81Å; E679-R683 IonicContact OE2-NH2 3.65Å; E679-R683 PolarHBondContact OE2-NH2 3.36Å
680S76.7Confident81.6Confident45 Ų4598.8 Ų98.832%0.31548%0.475SS..Hα-helixtrans-67.4-30.9176.781.70000112.6S676 A677 R678 K684S676-S680 WeakPolarHBondContact O-CB 3.47Å; S676-S680 PolarHBondContact O-N 3.33Å; A677-S680 PolarHBondContact O-N 2.81Å; A677-S680 VanDerWaalsContact O-N 3.13Å; A677-S680 PolarHBondContact O-OG 3Å; R678-S680 PolarHBondContact O-N 3.3Å; S680-K684 WeakPolarHBondContact O-CD 3.49Å; S680-K684 WeakPolarHBondContact O-CG 3.46Å; S680-K684 PolarHBondContact O-N 3.5Å
681W83.2Confident81.5Confident170 Ų17098.4 Ų98.464%0.64448%0.475SS*.Hα-helixtrans-79.6-37172.3-77.9115.2000112.2A677 R678 E679 K684 V685A677-W681 PolarHBondContact O-N 3.23Å; R678-W681 CarbonylContact O-C 3.58Å; R678-W681 PolarHBondContact O-N 3.02Å; E679-W681 VanDerWaalsContact C-N 3.28Å; E679-W681 PolarHBondContact O-N 3.43Å; W681-K684 HydrophobicContact CE3-CD 4.32Å; W681-K684 HydrophobicContact CZ3-CD 4.43Å; W681-K684 CarbonylContact O-C 3.42Å; W681-K684 PolarHBondContact O-N 3.45Å; W681-V685 WeakPolarHBondContact O-CB 3.47Å; W681-V685 WeakPolarHBondContact O-CG2 3.32Å; W681-V685 PolarHBondContact O-N 3.47Å
682Q81.9Confident81.3Confident101 Ų10196.7 Ų96.747%0.47247%0.469SS..Hα-helixtrans-63.4-48.7174.6-173.26052.400109.8R678 E679 K684 V685 D686R678-Q682 VanDerWaalsContact O-CB 3.29Å; R678-Q682 WeakPolarHBondContact O-CB 3.49Å; R678-Q682 PolarHBondContact O-N 2.78Å; E679-Q682 PolarHBondContact O-N 2.88Å; Q682-K684 VanDerWaalsContact C-N 3.32Å; Q682-K684 PolarHBondContact O-N 3.08Å; Q682-V685 CarbonylContact O-C 3.58Å; Q682-V685 WeakPolarHBondContact O-CA 3.06Å; Q682-V685 WeakPolarHBondContact O-CB 3.42Å; Q682-V685 PolarHBondContact O-N 2.99Å; Q682-D686 PolarHBondContact NE2-OD1 3.43Å; Q682-D686 WeakPolarHBondContact O-CB 3.28Å; Q682-D686 PolarHBondContact O-N 2.79Å
683R82.9Confident81.1Confident136 Ų13694 Ų9451%0.51346%0.463SS..Hα-helixtrans-53.1-47.7171.4-72.8170.8-172.8113.812.4111.2E679 V685 D686 D687E679-R683 VanDerWaalsContact CB-NH1 3.31Å; E679-R683 WeakPolarHBondContact O-CB 3.35Å; E679-R683 VanDerWaalsContact O-CG 3.24Å; E679-R683 WeakPolarHBondContact O-CG 3.19Å; E679-R683 PolarHBondContact O-N 3.33Å; E679-R683 IonicContact OE2-CZ 2.98Å; E679-R683 VanDerWaalsContact OE2-CZ 3.24Å; E679-R683 IonicContact OE2-NH1 2.68Å; E679-R683 PolarHBondContact OE2-NH1 2.81Å; E679-R683 IonicContact OE2-NH2 3.65Å; E679-R683 PolarHBondContact OE2-NH2 3.36Å; R683-V685 VanDerWaalsContact C-N 3.34Å; R683-V685 PolarHBondContact O-N 3.48Å; R683-D686 CarbonylContact O-C 3.54Å; R683-D686 PolarHBondContact O-N 2.73Å; R683-D686 VanDerWaalsContact O-N 3.15Å; R683-D687 WeakPolarHBondContact O-CB 3.48Å; R683-D687 PolarHBondContact O-N 2.84Å; R683-D687 VanDerWaalsContact O-OD2 3.11Å
684K81.8Confident81.1Confident108 Ų10893.1 Ų93.147%0.4746%0.461SS..Hα-helixtrans-65.2-31.7175.7-76.7167.9-178.5164.30114.2S680 W681 Q682 L688S680-K684 WeakPolarHBondContact O-CD 3.49Å; S680-K684 WeakPolarHBondContact O-CG 3.46Å; S680-K684 PolarHBondContact O-N 3.5Å; W681-K684 HydrophobicContact CE3-CD 4.32Å; W681-K684 HydrophobicContact CZ3-CD 4.43Å; W681-K684 CarbonylContact O-C 3.42Å; W681-K684 PolarHBondContact O-N 3.45Å; Q682-K684 VanDerWaalsContact C-N 3.32Å; Q682-K684 PolarHBondContact O-N 3.08Å; K684-L688 VanDerWaalsContact O-CB 3.24Å; K684-L688 WeakPolarHBondContact O-CB 3.13Å; K684-L688 WeakPolarHBondContact O-CD1 3.35Å; K684-L688 WeakPolarHBondContact O-CG 3.39Å; K684-L688 PolarHBondContact O-N 2.91Å
685V81.6Confident81Confident69 Ų6993.4 Ų93.442%0.41847%0.466SS..Hα-helixtrans-70.3-40.7172.51650000110.1W681 Q682 R683 L688 L689W681-V685 WeakPolarHBondContact O-CB 3.47Å; W681-V685 WeakPolarHBondContact O-CG2 3.32Å; W681-V685 PolarHBondContact O-N 3.47Å; Q682-V685 CarbonylContact O-C 3.58Å; Q682-V685 WeakPolarHBondContact O-CA 3.06Å; Q682-V685 WeakPolarHBondContact O-CB 3.42Å; Q682-V685 PolarHBondContact O-N 2.99Å; R683-V685 VanDerWaalsContact C-N 3.34Å; R683-V685 PolarHBondContact O-N 3.48Å; V685-L688 PolarHBondContact O-N 2.76Å; V685-L689 HydrophobicContact CG1-CD1 3.81Å; V685-L689 HydrophobicContact CG1-CG 4.34Å; V685-L689 VanDerWaalsContact O-CB 3.3Å; V685-L689 WeakPolarHBondContact O-CB 3.4Å; V685-L689 WeakPolarHBondContact O-CG 3.22Å; V685-L689 PolarHBondContact O-N 3.26Å
686D84.2Confident80.7Confident74 Ų7497.2 Ų97.240%0.39648%0.479SS..Hα-helixtrans-68.3-44.7177.2-59.4-27.5000110.7Q682 R683 L688 L689 E690Q682-D686 PolarHBondContact NE2-OD1 3.43Å; Q682-D686 WeakPolarHBondContact O-CB 3.28Å; Q682-D686 PolarHBondContact O-N 2.79Å; R683-D686 CarbonylContact O-C 3.54Å; R683-D686 PolarHBondContact O-N 2.73Å; R683-D686 VanDerWaalsContact O-N 3.15Å; D686-L688 VanDerWaalsContact C-N 3.29Å; D686-L688 PolarHBondContact O-N 3.28Å; D686-L689 CarbonylContact O-C 3.53Å; D686-L689 PolarHBondContact O-N 3.5Å; D686-L689 VanDerWaalsContact O-N 3.15Å; D686-E690 WeakPolarHBondContact O-CB 3.4Å; D686-E690 PolarHBondContact O-N 3.28Å
687D83.4Confident80.3Confident80 Ų80100 Ų10043%0.42849%0.485SS..Hα-helixtrans-57.8-40.1172.1-62.7-32.5000111.3R683 Q691R683-D687 WeakPolarHBondContact O-CB 3.48Å; R683-D687 PolarHBondContact O-N 2.84Å; R683-D687 VanDerWaalsContact O-OD2 3.11Å; D687-Q691 WeakPolarHBondContact O-CB 3.3Å; D687-Q691 VanDerWaalsContact O-CG 3.22Å; D687-Q691 WeakPolarHBondContact O-CG 3.45Å; D687-Q691 PolarHBondContact O-N 3.5Å; D687-Q691 PolarHBondContact O-NE2 3.46Å
688L80.8Confident80Confident97 Ų97100.5 Ų100.551%0.50849%0.486SS..Hα-helixtrans-75.6-34.4176.6-76.1170.4000111.8K684 V685 D686 I692K684-L688 VanDerWaalsContact O-CB 3.24Å; K684-L688 WeakPolarHBondContact O-CB 3.13Å; K684-L688 WeakPolarHBondContact O-CD1 3.35Å; K684-L688 WeakPolarHBondContact O-CG 3.39Å; K684-L688 PolarHBondContact O-N 2.91Å; V685-L688 PolarHBondContact O-N 2.76Å; D686-L688 VanDerWaalsContact C-N 3.29Å; D686-L688 PolarHBondContact O-N 3.28Å; L688-I692 VanDerWaalsContact O-CB 3.24Å; L688-I692 WeakPolarHBondContact O-CB 3.45Å; L688-I692 WeakPolarHBondContact O-CD1 3.15Å; L688-I692 WeakPolarHBondContact O-CG1 3.13Å; L688-I692 PolarHBondContact O-N 3.11Å
689L79.5Confident79.6Confident98 Ų9899 Ų9951%0.51349%0.488SS..Hα-helixtrans-69.7-33.7173.1-76.3169.7000111.6V685 D686 I692 S693V685-L689 HydrophobicContact CG1-CD1 3.81Å; V685-L689 HydrophobicContact CG1-CG 4.34Å; V685-L689 VanDerWaalsContact O-CB 3.3Å; V685-L689 WeakPolarHBondContact O-CB 3.4Å; V685-L689 WeakPolarHBondContact O-CG 3.22Å; V685-L689 PolarHBondContact O-N 3.26Å; D686-L689 CarbonylContact O-C 3.53Å; D686-L689 PolarHBondContact O-N 3.5Å; D686-L689 VanDerWaalsContact O-N 3.15Å; L689-I692 CarbonylContact O-C 3.58Å; L689-I692 PolarHBondContact O-N 3.13Å; L689-S693 WeakPolarHBondContact O-CB 3.42Å; L689-S693 PolarHBondContact O-N 3.23Å
690E80.5Confident79.4Confident123 Ų123101.2 Ų101.258%0.57550%0.499SS*.Hα-helixtrans-75.4-39173.3-171.3167.2-125.500111.3D686 I692 S693 L694D686-E690 WeakPolarHBondContact O-CB 3.4Å; D686-E690 PolarHBondContact O-N 3.28Å; E690-I692 VanDerWaalsContact C-N 3.3Å; E690-I692 PolarHBondContact O-N 2.8Å; E690-S693 WeakPolarHBondContact CA-OG 3.2Å; E690-S693 PolarHBondContact O-N 2.84Å; E690-S693 PolarHBondContact O-OG 2.87Å; E690-L694 HydrophobicContact CG-CD1 4.15Å; E690-L694 VanDerWaalsContact O-CB 3.29Å; E690-L694 WeakPolarHBondContact O-CB 3.24Å; E690-L694 WeakPolarHBondContact O-CG 3.46Å; E690-L694 PolarHBondContact O-N 3.01Å
691Q81.3Confident79.4Confident106 Ų106103.8 Ų103.850%0.49551%0.507SS..Hα-helixtrans-61.8-38.1167.1-77.9166.973.900111.9D687 L695D687-Q691 WeakPolarHBondContact O-CB 3.3Å; D687-Q691 VanDerWaalsContact O-CG 3.22Å; D687-Q691 WeakPolarHBondContact O-CG 3.45Å; D687-Q691 PolarHBondContact O-N 3.5Å; D687-Q691 PolarHBondContact O-NE2 3.46Å; Q691-L695 WeakPolarHBondContact O-CB 3.45Å; Q691-L695 WeakPolarHBondContact O-CD1 3.38Å; Q691-L695 WeakPolarHBondContact O-CG 3.44Å; Q691-L695 PolarHBondContact O-N 3.3Å
692I76.8Confident79Confident79 Ų79101.5 Ų101.541%0.40550%0.503SS..Hα-helixtrans-70.4-32.5173.6-73.9163.9000111.3L688 L689 E690 K696L688-I692 VanDerWaalsContact O-CB 3.24Å; L688-I692 WeakPolarHBondContact O-CB 3.45Å; L688-I692 WeakPolarHBondContact O-CD1 3.15Å; L688-I692 WeakPolarHBondContact O-CG1 3.13Å; L688-I692 PolarHBondContact O-N 3.11Å; L689-I692 CarbonylContact O-C 3.58Å; L689-I692 PolarHBondContact O-N 3.13Å; E690-I692 VanDerWaalsContact C-N 3.3Å; E690-I692 PolarHBondContact O-N 2.8Å; I692-K696 HydrophobicContact CG2-CD 4.03Å; I692-K696 HydrophobicContact CG2-CG 4.46Å; I692-K696 VanDerWaalsContact O-CB 3.23Å; I692-K696 WeakPolarHBondContact O-CB 3.47Å; I692-K696 WeakPolarHBondContact O-CG 3.4Å; I692-K696 PolarHBondContact O-N 2.97Å
693S77.1Confident78.7Confident58 Ų58101.6 Ų101.641%0.40651%0.506SS..Hα-helixtrans-74.3-41.1176.480.80000111.2L689 E690 K696 Q697L689-S693 WeakPolarHBondContact O-CB 3.42Å; L689-S693 PolarHBondContact O-N 3.23Å; E690-S693 WeakPolarHBondContact CA-OG 3.2Å; E690-S693 PolarHBondContact O-N 2.84Å; E690-S693 PolarHBondContact O-OG 2.87Å; S693-K696 PolarHBondContact O-N 3.45Å; S693-Q697 VanDerWaalsContact O-CB 3.23Å; S693-Q697 WeakPolarHBondContact O-CB 3.47Å; S693-Q697 PolarHBondContact O-N 3.34Å
694L79.3Confident78.4Confident96 Ų9698 Ų9850%0.50350%0.502SS..Hα-helixtrans-65.3-40.2171.1-75.7164.2000111.8E690 S698E690-L694 HydrophobicContact CG-CD1 4.15Å; E690-L694 VanDerWaalsContact O-CB 3.29Å; E690-L694 WeakPolarHBondContact O-CB 3.24Å; E690-L694 WeakPolarHBondContact O-CG 3.46Å; E690-L694 PolarHBondContact O-N 3.01Å; L694-S698 WeakPolarHBondContact O-CB 3.44Å; L694-S698 PolarHBondContact O-N 2.94Å
695L75.9Confident78Confident113 Ų11397.6 Ų97.659%0.59250%0.502SS*.Hα-helixtrans-66.8-40.6172.5-80.5166.8000111.3Q691 S698 L699Q691-L695 WeakPolarHBondContact O-CB 3.45Å; Q691-L695 WeakPolarHBondContact O-CD1 3.38Å; Q691-L695 WeakPolarHBondContact O-CG 3.44Å; Q691-L695 PolarHBondContact O-N 3.3Å; L695-S698 PolarHBondContact O-N 2.84Å; L695-L699 WeakPolarHBondContact O-CB 3.42Å; L695-L699 PolarHBondContact O-N 2.84Å
696K75.1Confident77.4Confident138 Ų13897.5 Ų97.560%0.650%0.504SS*.Hα-helixtrans-64.4-46173.2-80.1169.7-179.1175.50111.7I692 S693 S698 L699 E700I692-K696 HydrophobicContact CG2-CD 4.03Å; I692-K696 HydrophobicContact CG2-CG 4.46Å; I692-K696 VanDerWaalsContact O-CB 3.23Å; I692-K696 WeakPolarHBondContact O-CB 3.47Å; I692-K696 WeakPolarHBondContact O-CG 3.4Å; I692-K696 PolarHBondContact O-N 2.97Å; S693-K696 PolarHBondContact O-N 3.45Å; K696-S698 VanDerWaalsContact C-N 3.31Å; K696-S698 PolarHBondContact O-N 3.03Å; K696-L699 CarbonylContact O-C 3.58Å; K696-L699 PolarHBondContact O-N 3.36Å; K696-E700 WeakPolarHBondContact O-CB 3.38Å; K696-E700 PolarHBondContact O-N 2.92Å
697Q75.3Confident77Confident127 Ų12798.8 Ų98.859%0.59351%0.508SS*.Hα-helixtrans-66.6-34.1178-170.618022.600111.3S693 M701S693-Q697 VanDerWaalsContact O-CB 3.23Å; S693-Q697 WeakPolarHBondContact O-CB 3.47Å; S693-Q697 PolarHBondContact O-N 3.34Å; Q697-M701 WeakPolarHBondContact O-CA 3.47Å; Q697-M701 WeakPolarHBondContact O-CB 3.27Å; Q697-M701 PolarHBondContact O-N 2.76Å
698S73.3Confident76.5Confident52 Ų5297.3 Ų97.336%0.36450%0.504SS..Hα-helixtrans-69.6-42.4171-174.70000111.4L694 L695 K696 E700 M701 Q702L694-S698 WeakPolarHBondContact O-CB 3.44Å; L694-S698 PolarHBondContact O-N 2.94Å; L695-S698 PolarHBondContact O-N 2.84Å; K696-S698 VanDerWaalsContact C-N 3.31Å; K696-S698 PolarHBondContact O-N 3.03Å; S698-E700 VanDerWaalsContact C-N 3.34Å; S698-E700 PolarHBondContact O-N 3.33Å; S698-M701 PolarHBondContact O-N 3.41Å; S698-Q702 WeakPolarHBondContact O-CB 3.41Å; S698-Q702 WeakPolarHBondContact O-CG 3.4Å; S698-Q702 PolarHBondContact O-N 3.36Å
699L76.7Confident76.2Confident116 Ų11695.8 Ų95.861%0.60750%0.501SS*.Hα-helixtrans-65.2-38.1174.1-132.584.4000111.6L695 K696 Q702 L703L695-L699 WeakPolarHBondContact O-CB 3.42Å; L695-L699 PolarHBondContact O-N 2.84Å; K696-L699 CarbonylContact O-C 3.58Å; K696-L699 PolarHBondContact O-N 3.36Å; L699-Q702 CarbonylContact O-C 3.57Å; L699-Q702 PolarHBondContact O-N 2.86Å; L699-L703 WeakPolarHBondContact O-CA 3.44Å; L699-L703 WeakPolarHBondContact O-CB 3.24Å; L699-L703 PolarHBondContact O-N 2.83Å
700E80.6Confident76Confident140 Ų14095.5 Ų95.565%0.65450%0.5SS*.Hα-helixtrans-79.4-29.1-179.5-171.1164.6-135.600111.2K696 S698 S704K696-E700 WeakPolarHBondContact O-CB 3.38Å; K696-E700 PolarHBondContact O-N 2.92Å; S698-E700 VanDerWaalsContact C-N 3.34Å; S698-E700 PolarHBondContact O-N 3.33Å; E700-S704 WeakPolarHBondContact O-CB 3.27Å; E700-S704 PolarHBondContact O-N 2.64Å; E700-S704 PolarHBondContact O-OG 3.13Å
701M75.4Confident75.7Confident98 Ų9895 Ų9548%0.48350%0.497SS..Hα-helixtrans-71.1-39.8165.3-175.6169.262.100111.2Q697 S698 S704 Q705Q697-M701 WeakPolarHBondContact O-CA 3.47Å; Q697-M701 WeakPolarHBondContact O-CB 3.27Å; Q697-M701 PolarHBondContact O-N 2.76Å; S698-M701 PolarHBondContact O-N 3.41Å; M701-S704 WeakPolarHBondContact CA-OG 3.07Å; M701-S704 PolarHBondContact O-OG 2.75Å; M701-Q705 HydrophobicContact CG-CG 4.36Å; M701-Q705 WeakPolarHBondContact O-CA 3.24Å; M701-Q705 WeakPolarHBondContact O-CB 3.41Å; M701-Q705 WeakPolarHBondContact O-CG 3.31Å; M701-Q705 PolarHBondContact O-N 3.43Å
702Q76.1Confident75.3Confident122 Ų12295.8 Ų95.857%0.5750%0.501SS*.Hα-helixtrans-73-28.4172.4-76.6-164.1-7.800112.7S698 L699 S706S698-Q702 WeakPolarHBondContact O-CB 3.41Å; S698-Q702 WeakPolarHBondContact O-CG 3.4Å; S698-Q702 PolarHBondContact O-N 3.36Å; L699-Q702 CarbonylContact O-C 3.57Å; L699-Q702 PolarHBondContact O-N 2.86Å; Q702-S706 WeakPolarHBondContact O-CA 3.27Å; Q702-S706 WeakPolarHBondContact O-CB 3.41Å; Q702-S706 PolarHBondContact O-N 3.4Å; Q702-S706 PolarHBondContact O-OG 3.32Å
703L74.9Confident75.1Confident103 Ų10395.4 Ų95.454%0.53950%0.5SS..Hα-helixtrans-79.9-36.4176.3-165.3143.6000110.3L699 S706 Q707L699-L703 WeakPolarHBondContact O-CA 3.44Å; L699-L703 WeakPolarHBondContact O-CB 3.24Å; L699-L703 PolarHBondContact O-N 2.83Å; L703-S706 WeakPolarHBondContact CA-OG 3.49Å; L703-S706 PolarHBondContact O-OG 2.68Å; L703-Q707 WeakPolarHBondContact O-CA 3.22Å; L703-Q707 WeakPolarHBondContact O-CB 3.27Å; L703-Q707 PolarHBondContact O-N 3.29Å
704S76.4Confident74.9Confident60 Ų6098.2 Ų98.242%0.4251%0.506SS..Hα-helixtrans-74.6-3116959.20000113E700 M701 S708E700-S704 WeakPolarHBondContact O-CB 3.27Å; E700-S704 PolarHBondContact O-N 2.64Å; E700-S704 PolarHBondContact O-OG 3.13Å; M701-S704 WeakPolarHBondContact CA-OG 3.07Å; M701-S704 PolarHBondContact O-OG 2.75Å; S704-S708 WeakPolarHBondContact O-CA 3.44Å; S704-S708 WeakPolarHBondContact O-CB 3.48Å; S704-S708 PolarHBondContact O-N 3Å; S704-S708 PolarHBondContact O-OG 3.29Å
705Q73.6Confident74.7Confident101 Ų10198.6 Ų98.647%0.47251%0.505SS..Hα-helixtrans-73.1-38.4170.7-78.3172.61.300112M701 S708 S709M701-Q705 HydrophobicContact CG-CG 4.36Å; M701-Q705 WeakPolarHBondContact O-CA 3.24Å; M701-Q705 WeakPolarHBondContact O-CB 3.41Å; M701-Q705 WeakPolarHBondContact O-CG 3.31Å; M701-Q705 PolarHBondContact O-N 3.43Å; Q705-S708 WeakPolarHBondContact CA-OG 3.34Å; Q705-S708 PolarHBondContact O-OG 2.93Å; Q705-S708 VanDerWaalsContact O-OG 3.08Å; Q705-S709 WeakPolarHBondContact O-CA 3.44Å; Q705-S709 WeakPolarHBondContact O-CB 3.29Å; Q705-S709 PolarHBondContact O-N 3.33Å; Q705-S709 PolarHBondContact O-OG 3.08Å
706S68.5Low74.5Confident67 Ų6798 Ų9847%0.46950%0.499SS..Hα-helixtrans-76.3-28.7173.7610000111.6Q702 L703 S709 L710Q702-S706 WeakPolarHBondContact O-CA 3.27Å; Q702-S706 WeakPolarHBondContact O-CB 3.41Å; Q702-S706 PolarHBondContact O-N 3.4Å; Q702-S706 PolarHBondContact O-OG 3.32Å; L703-S706 WeakPolarHBondContact CA-OG 3.49Å; L703-S706 PolarHBondContact O-OG 2.68Å; S706-S709 CarbonylContact O-C 3.54Å; S706-L710 WeakPolarHBondContact O-CA 3.27Å; S706-L710 WeakPolarHBondContact O-CB 3.31Å; S706-L710 PolarHBondContact O-N 2.8Å
707Q76.7Confident74.2Confident100 Ų10096.7 Ų96.747%0.46749%0.494SS..Hα-helixtrans-75.1-34169.5-174.417722.300111.8L703 L710 Q711L703-Q707 WeakPolarHBondContact O-CA 3.22Å; L703-Q707 WeakPolarHBondContact O-CB 3.27Å; L703-Q707 PolarHBondContact O-N 3.29Å; Q707-L710 CarbonylContact O-C 3.57Å; Q707-L710 PolarHBondContact O-N 2.72Å; Q707-Q711 VanDerWaalsContact O-CB 3.25Å; Q707-Q711 WeakPolarHBondContact O-CB 3.35Å; Q707-Q711 WeakPolarHBondContact O-CG 3.3Å; Q707-Q711 PolarHBondContact O-N 2.74Å
708S72.2Confident74Confident49 Ų4992.3 Ų92.334%0.34348%0.478SS..Hα-helixtrans-73.6-34.3171.475.30000111S704 Q705 Q711 Q712S704-S708 WeakPolarHBondContact O-CA 3.44Å; S704-S708 WeakPolarHBondContact O-CB 3.48Å; S704-S708 PolarHBondContact O-N 3Å; S704-S708 PolarHBondContact O-OG 3.29Å; Q705-S708 WeakPolarHBondContact CA-OG 3.34Å; Q705-S708 PolarHBondContact O-OG 2.93Å; Q705-S708 VanDerWaalsContact O-OG 3.08Å; S708-Q711 PolarHBondContact O-N 3.15Å; S708-Q712 WeakPolarHBondContact O-CB 3.3Å; S708-Q712 VanDerWaalsContact O-CG 3.22Å; S708-Q712 WeakPolarHBondContact O-CG 3.36Å; S708-Q712 PolarHBondContact O-N 3.38Å
709S74.9Confident73.9Confident65 Ų6594.5 Ų94.546%0.45548%0.482SS..Hα-helixtrans-69.7-35.4169.8-58.80000111Q705 S706 L713Q705-S709 WeakPolarHBondContact O-CA 3.44Å; Q705-S709 WeakPolarHBondContact O-CB 3.29Å; Q705-S709 PolarHBondContact O-N 3.33Å; Q705-S709 PolarHBondContact O-OG 3.08Å; S706-S709 CarbonylContact O-C 3.54Å; S709-L713 WeakPolarHBondContact O-CA 3.31Å; S709-L713 WeakPolarHBondContact O-CB 3.34Å; S709-L713 PolarHBondContact O-N 2.75Å
710L76.3Confident73.6Confident92 Ų9293.7 Ų93.748%0.48248%0.475SS..Hα-helixtrans-73.5-31.9173.5-166.791.2000111S706 Q707 Q714S706-L710 WeakPolarHBondContact O-CA 3.27Å; S706-L710 WeakPolarHBondContact O-CB 3.31Å; S706-L710 PolarHBondContact O-N 2.8Å; Q707-L710 CarbonylContact O-C 3.57Å; Q707-L710 PolarHBondContact O-N 2.72Å; L710-Q714 HydrophobicContact CG-CG 4.46Å; L710-Q714 WeakPolarHBondContact O-CA 3.39Å; L710-Q714 WeakPolarHBondContact O-CB 3.47Å; L710-Q714 WeakPolarHBondContact O-CG 3.38Å; L710-Q714 PolarHBondContact O-N 3.38Å
711Q72.8Confident73.1Confident113 Ų11395.1 Ų95.153%0.52847%0.474SS..Hα-helixtrans-75.2-37.9172.3-78.3173.11.500111.2Q707 S708 H715Q707-Q711 VanDerWaalsContact O-CB 3.25Å; Q707-Q711 WeakPolarHBondContact O-CB 3.35Å; Q707-Q711 WeakPolarHBondContact O-CG 3.3Å; Q707-Q711 PolarHBondContact O-N 2.74Å; S708-Q711 PolarHBondContact O-N 3.15Å; Q711-H715 WeakPolarHBondContact O-CA 3.39Å; Q711-H715 WeakPolarHBondContact O-CB 3.34Å; Q711-H715 PolarHBondContact O-N 3.34Å
712Q72.9Confident72.9Confident123 Ų12396.2 Ų96.258%0.57548%0.478SS*.Hα-helixtrans-67.7-36.7170.5-78.4175.3-16.500111.1S708 H715 Q716S708-Q712 WeakPolarHBondContact O-CB 3.3Å; S708-Q712 VanDerWaalsContact O-CG 3.22Å; S708-Q712 WeakPolarHBondContact O-CG 3.36Å; S708-Q712 PolarHBondContact O-N 3.38Å; Q712-H715 CarbonylContact O-C 3.49Å; Q712-H715 PolarHBondContact O-N 2.79Å; Q712-Q716 WeakPolarHBondContact O-CA 3.47Å; Q712-Q716 WeakPolarHBondContact O-CB 3.2Å; Q712-Q716 WeakPolarHBondContact O-CG 3.31Å; Q712-Q716 PolarHBondContact O-N 3.15Å
713L73.9Confident72.7Confident71 Ų7195.4 Ų95.437%0.37247%0.474SS..Hα-helixtrans-80-27.7176.3-171.166.2000111.9S709 F717S709-L713 WeakPolarHBondContact O-CA 3.31Å; S709-L713 WeakPolarHBondContact O-CB 3.34Å; S709-L713 PolarHBondContact O-N 2.75Å; L713-F717 HydrophobicContact CD1-CD2 4.36Å; L713-F717 HydrophobicContact CD1-CE1 4.32Å; L713-F717 HydrophobicContact CD1-CE2 3.95Å; L713-F717 HydrophobicContact CD1-CZ 3.93Å; L713-F717 HydrophobicContact CD2-CE2 3.87Å; L713-F717 HydrophobicContact CD2-CZ 4.36Å; L713-F717 HydrophobicContact CG-CD2 3.87Å; L713-F717 HydrophobicContact CG-CE2 3.57Å; L713-F717 HydrophobicContact CG-CZ 4.07Å; L713-F717 WeakPolarHBondContact O-CA 3.43Å; L713-F717 WeakPolarHBondContact O-CB 3.43Å; L713-F717 WeakPolarHBondContact O-CD2 3.36Å; L713-F717 WeakPolarHBondContact O-CG 3.27Å; L713-F717 PolarHBondContact O-N 2.8Å
714Q72.3Confident72.6Confident116 Ų11694.7 Ų94.754%0.54247%0.47SS..Hα-helixtrans-75.8-29.4167.1-80.4176.5-7.200111.4L710 F717 S718L710-Q714 HydrophobicContact CG-CG 4.46Å; L710-Q714 WeakPolarHBondContact O-CA 3.39Å; L710-Q714 WeakPolarHBondContact O-CB 3.47Å; L710-Q714 WeakPolarHBondContact O-CG 3.38Å; L710-Q714 PolarHBondContact O-N 3.38Å; Q714-F717 CarbonylContact O-C 3.54Å; Q714-S718 WeakPolarHBondContact O-CA 3.27Å; Q714-S718 WeakPolarHBondContact O-CB 3.41Å; Q714-S718 PolarHBondContact O-N 3Å; Q714-S718 PolarHBondContact O-OG 3.27Å
715H74.1Confident72.5Confident105 Ų10599.9 Ų99.949%0.48648%0.481SS..Hα-helixtrans-78.3-35.9172.7-167.744.5000110.9Q711 Q712 S718 Q719Q711-H715 WeakPolarHBondContact O-CA 3.39Å; Q711-H715 WeakPolarHBondContact O-CB 3.34Å; Q711-H715 PolarHBondContact O-N 3.34Å; Q712-H715 CarbonylContact O-C 3.49Å; Q712-H715 PolarHBondContact O-N 2.79Å; H715-S718 WeakPolarHBondContact CA-OG 3.29Å; H715-S718 PolarHBondContact ND1-OG 3.03Å; H715-S718 PolarHBondContact O-N 2.99Å; H715-S718 PolarHBondContact O-OG 2.85Å; H715-Q719 PolarHBondContact CD2-NE2 3.08Å; H715-Q719 PolarHBondContact NE2-NE2 3.48Å; H715-Q719 WeakPolarHBondContact O-CA 3.41Å; H715-Q719 WeakPolarHBondContact O-CB 3.22Å; H715-Q719 WeakPolarHBondContact O-CG 3.35Å; H715-Q719 PolarHBondContact O-N 3.37Å
716Q72.4Confident72.4Confident100 Ų100100.5 Ų100.547%0.46749%0.485SS..Hα-helixtrans-68.8-39.2168-75.9165.3-14.400110.2Q712 S718 Q719 E720Q712-Q716 WeakPolarHBondContact O-CA 3.47Å; Q712-Q716 WeakPolarHBondContact O-CB 3.2Å; Q712-Q716 WeakPolarHBondContact O-CG 3.31Å; Q712-Q716 PolarHBondContact O-N 3.15Å; Q716-S718 VanDerWaalsContact C-N 3.33Å; Q716-S718 PolarHBondContact O-N 2.86Å; Q716-Q719 CarbonylContact O-C 3.59Å; Q716-E720 WeakPolarHBondContact O-CA 3.45Å; Q716-E720 WeakPolarHBondContact O-CB 3.29Å; Q716-E720 WeakPolarHBondContact O-CG 3.27Å; Q716-E720 PolarHBondContact O-N 3.24Å
717F68.3Low72.5Confident110 Ų110100.5 Ų100.548%0.48248%0.478SS..Hα-helixtrans-75.6-16.3171.1-71-36.3000113.4L713 Q714 E720 R721L713-F717 HydrophobicContact CD1-CD2 4.36Å; L713-F717 HydrophobicContact CD1-CE1 4.32Å; L713-F717 HydrophobicContact CD1-CE2 3.95Å; L713-F717 HydrophobicContact CD1-CZ 3.93Å; L713-F717 HydrophobicContact CD2-CE2 3.87Å; L713-F717 HydrophobicContact CD2-CZ 4.36Å; L713-F717 HydrophobicContact CG-CD2 3.87Å; L713-F717 HydrophobicContact CG-CE2 3.57Å; L713-F717 HydrophobicContact CG-CZ 4.07Å; L713-F717 WeakPolarHBondContact O-CA 3.43Å; L713-F717 WeakPolarHBondContact O-CB 3.43Å; L713-F717 WeakPolarHBondContact O-CD2 3.36Å; L713-F717 WeakPolarHBondContact O-CG 3.27Å; L713-F717 PolarHBondContact O-N 2.8Å; Q714-F717 CarbonylContact O-C 3.54Å; F717-E720 WeakPolarHBondContact CD1-OE2 3.48Å; F717-R721 WeakPolarHBondContact O-CB 3.25Å; F717-R721 WeakPolarHBondContact O-CD 3.31Å; F717-R721 WeakPolarHBondContact O-CG 3.26Å; F717-R721 PolarHBondContact O-N 3.35Å
718S71.5Confident72.2Confident36 Ų36101 Ų10125%0.25248%0.483SS..Hα-helixtrans-83-44.916979.50000110Q714 H715 Q716 E720 R721 E722Q714-S718 WeakPolarHBondContact O-CA 3.27Å; Q714-S718 WeakPolarHBondContact O-CB 3.41Å; Q714-S718 PolarHBondContact O-N 3Å; Q714-S718 PolarHBondContact O-OG 3.27Å; H715-S718 WeakPolarHBondContact CA-OG 3.29Å; H715-S718 PolarHBondContact ND1-OG 3.03Å; H715-S718 PolarHBondContact O-N 2.99Å; H715-S718 PolarHBondContact O-OG 2.85Å; Q716-S718 VanDerWaalsContact C-N 3.33Å; Q716-S718 PolarHBondContact O-N 2.86Å; S718-E720 VanDerWaalsContact C-N 3.33Å; S718-R721 CarbonylContact O-C 3.56Å; S718-R721 PolarHBondContact O-N 2.78Å; S718-R721 VanDerWaalsContact O-N 3.16Å; S718-E722 VanDerWaalsContact O-CB 3.27Å; S718-E722 WeakPolarHBondContact O-CB 3.42Å; S718-E722 WeakPolarHBondContact O-CG 3.37Å; S718-E722 PolarHBondContact O-N 3.22Å
719Q70.9Confident72.2Confident98 Ų98103.2 Ų103.246%0.45849%0.491SS..Hα-helixtrans-64.1-35171.7-73.6174.9-7.800111.5H715 Q716 H723H715-Q719 PolarHBondContact CD2-NE2 3.08Å; H715-Q719 PolarHBondContact NE2-NE2 3.48Å; H715-Q719 WeakPolarHBondContact O-CA 3.41Å; H715-Q719 WeakPolarHBondContact O-CB 3.22Å; H715-Q719 WeakPolarHBondContact O-CG 3.35Å; H715-Q719 PolarHBondContact O-N 3.37Å; Q716-Q719 CarbonylContact O-C 3.59Å; Q719-H723 WeakPolarHBondContact O-CA 3.37Å; Q719-H723 WeakPolarHBondContact O-CB 3.26Å; Q719-H723 PolarHBondContact O-N 3.42Å
720E70.9Confident72.1Confident98 Ų98105.3 Ų105.346%0.45849%0.494SS..Hα-helixtrans-79.9-28.1171-75.7179.5176.300110.7Q716 F717 S718 E722 L724Q716-E720 WeakPolarHBondContact O-CA 3.45Å; Q716-E720 WeakPolarHBondContact O-CB 3.29Å; Q716-E720 WeakPolarHBondContact O-CG 3.27Å; Q716-E720 PolarHBondContact O-N 3.24Å; F717-E720 WeakPolarHBondContact CD1-OE2 3.48Å; S718-E720 VanDerWaalsContact C-N 3.33Å; E720-E722 VanDerWaalsContact C-N 3.33Å; E720-L724 VanDerWaalsContact O-CA 3.26Å; E720-L724 WeakPolarHBondContact O-CA 3.14Å; E720-L724 WeakPolarHBondContact O-CB 3.39Å; E720-L724 WeakPolarHBondContact O-CD1 3.14Å; E720-L724 WeakPolarHBondContact O-CG 3.19Å; E720-L724 PolarHBondContact O-N 2.86Å
721R70Confident71.9Confident170 Ų170104.9 Ų104.964%0.64249%0.491SS*.Hα-helixtrans-75.1-23.2167.9-84.6173.251.5-151.2-13.4113.2F717 S718 R725F717-R721 WeakPolarHBondContact O-CB 3.25Å; F717-R721 WeakPolarHBondContact O-CD 3.31Å; F717-R721 WeakPolarHBondContact O-CG 3.26Å; F717-R721 PolarHBondContact O-N 3.35Å; S718-R721 CarbonylContact O-C 3.56Å; S718-R721 PolarHBondContact O-N 2.78Å; S718-R721 VanDerWaalsContact O-N 3.16Å; R721-R725 WeakPolarHBondContact O-CB 3.44Å; R721-R725 WeakPolarHBondContact O-CG 3.44Å; R721-R725 PolarHBondContact O-N 2.75Å
722E70.4Confident71.8Confident122 Ų122104.5 Ų104.557%0.5749%0.49SS*.Hα-helixtrans-90.6-32.6175.3-73.5-177.8137.100111S718 E720 R725 M726S718-E722 VanDerWaalsContact O-CB 3.27Å; S718-E722 WeakPolarHBondContact O-CB 3.42Å; S718-E722 WeakPolarHBondContact O-CG 3.37Å; S718-E722 PolarHBondContact O-N 3.22Å; E720-E722 VanDerWaalsContact C-N 3.33Å; E722-R725 PolarHBondContact O-N 3.44Å; E722-M726 VanDerWaalsContact O-CB 3.23Å; E722-M726 WeakPolarHBondContact O-CB 3.3Å; E722-M726 WeakPolarHBondContact O-CG 3.46Å; E722-M726 PolarHBondContact O-N 2.89Å
723H73.1Confident71.6Confident105 Ų105101.1 Ų101.149%0.48648%0.477SS..Hα-helixtrans-79.8-30.3170-17051.6000111.4Q719 Q727Q719-H723 WeakPolarHBondContact O-CA 3.37Å; Q719-H723 WeakPolarHBondContact O-CB 3.26Å; Q719-H723 PolarHBondContact O-N 3.42Å; H723-Q727 PolarHBondContact CD2-NE2 3.29Å; H723-Q727 VanDerWaalsContact CD2-NE2 3.28Å; H723-Q727 PolarHBondContact NE2-NE2 2.89Å; H723-Q727 WeakPolarHBondContact O-CA 3.4Å; H723-Q727 WeakPolarHBondContact O-CB 3.3Å; H723-Q727 WeakPolarHBondContact O-CG 3.34Å; H723-Q727 PolarHBondContact O-N 3.37Å
724L71.7Confident71.4Confident87 Ų87101.4 Ų101.446%0.45548%0.477SS..Hα-helixtrans-81.1-17.3164.3-64.5165.5000111.9E720 L728E720-L724 VanDerWaalsContact O-CA 3.26Å; E720-L724 WeakPolarHBondContact O-CA 3.14Å; E720-L724 WeakPolarHBondContact O-CB 3.39Å; E720-L724 WeakPolarHBondContact O-CD1 3.14Å; E720-L724 WeakPolarHBondContact O-CG 3.19Å; E720-L724 PolarHBondContact O-N 2.86Å; L724-L728 WeakPolarHBondContact O-CA 3.38Å; L724-L728 WeakPolarHBondContact O-CB 3.26Å; L724-L728 VanDerWaalsContact O-CD1 3.31Å; L724-L728 WeakPolarHBondContact O-CD1 3.17Å; L724-L728 WeakPolarHBondContact O-CG 3.47Å; L724-L728 PolarHBondContact O-N 3.38Å
725R75.6Confident71.3Confident169 Ų169101.5 Ų101.564%0.63848%0.477SS*.Hα-helixtrans-78.1-42.6164.4-94.8178160.1-178.5-7.2111.5R721 E722 L728 D729R721-R725 WeakPolarHBondContact O-CB 3.44Å; R721-R725 WeakPolarHBondContact O-CG 3.44Å; R721-R725 PolarHBondContact O-N 2.75Å; E722-R725 PolarHBondContact O-N 3.44Å; R725-L728 CarbonylContact O-C 3.38Å; R725-L728 PolarHBondContact O-N 3.32Å; R725-L728 VanDerWaalsContact O-N 3.17Å; R725-D729 WeakPolarHBondContact O-CB 3.42Å; R725-D729 PolarHBondContact O-N 3.21Å
726M71.3Confident70.9Confident115 Ų115101 Ų10157%0.56748%0.475SS*.Hα-helixtrans-67.6-43.5173.7-74.5178.565.500109.9E722 L728 D729 E730E722-M726 VanDerWaalsContact O-CB 3.23Å; E722-M726 WeakPolarHBondContact O-CB 3.3Å; E722-M726 WeakPolarHBondContact O-CG 3.46Å; E722-M726 PolarHBondContact O-N 2.89Å; M726-L728 VanDerWaalsContact C-N 3.32Å; M726-L728 PolarHBondContact O-N 2.9Å; M726-D729 PolarHBondContact O-N 2.7Å; M726-E730 WeakPolarHBondContact O-CA 3.43Å; M726-E730 WeakPolarHBondContact O-CB 3.22Å; M726-E730 WeakPolarHBondContact O-CG 3.41Å; M726-E730 PolarHBondContact O-N 3.38Å
727Q70.4Confident70.8Confident67 Ų67103.1 Ų103.131%0.31348%0.479SS..Hα-helixtrans-68.3-24.5168.1-71.4178.417.900112.2H723 L731H723-Q727 PolarHBondContact CD2-NE2 3.29Å; H723-Q727 VanDerWaalsContact CD2-NE2 3.28Å; H723-Q727 PolarHBondContact NE2-NE2 2.89Å; H723-Q727 WeakPolarHBondContact O-CA 3.4Å; H723-Q727 WeakPolarHBondContact O-CB 3.3Å; H723-Q727 WeakPolarHBondContact O-CG 3.34Å; H723-Q727 PolarHBondContact O-N 3.37Å; Q727-L731 VanDerWaalsContact O-CA 3.27Å; Q727-L731 WeakPolarHBondContact O-CA 3.43Å; Q727-L731 WeakPolarHBondContact O-CB 3.47Å; Q727-L731 WeakPolarHBondContact O-CD1 3.49Å; Q727-L731 WeakPolarHBondContact O-CG 3.41Å; Q727-L731 PolarHBondContact O-N 2.84Å
728L70.8Confident70.8Confident111 Ų111103.1 Ų103.158%0.58148%0.476SS*.Hα-helixtrans-81.8-26.5171.2-79.8167.5000112.6L724 R725 M726 Q732L724-L728 WeakPolarHBondContact O-CA 3.38Å; L724-L728 WeakPolarHBondContact O-CB 3.26Å; L724-L728 VanDerWaalsContact O-CD1 3.31Å; L724-L728 WeakPolarHBondContact O-CD1 3.17Å; L724-L728 WeakPolarHBondContact O-CG 3.47Å; L724-L728 PolarHBondContact O-N 3.38Å; R725-L728 CarbonylContact O-C 3.38Å; R725-L728 PolarHBondContact O-N 3.32Å; R725-L728 VanDerWaalsContact O-N 3.17Å; M726-L728 VanDerWaalsContact C-N 3.32Å; M726-L728 PolarHBondContact O-N 2.9Å; L728-Q732 VanDerWaalsContact O-CA 3.31Å; L728-Q732 WeakPolarHBondContact O-CA 3.3Å; L728-Q732 WeakPolarHBondContact O-CB 3.24Å; L728-Q732 PolarHBondContact O-N 2.7Å
729D72.1Confident70.6Confident95 Ų95105.9 Ų105.951%0.50848%0.484SS..Hα-helixtrans-83.8-31.4171-92.3-32.1000111.3R725 M726 Q732 T733R725-D729 WeakPolarHBondContact O-CB 3.42Å; R725-D729 PolarHBondContact O-N 3.21Å; M726-D729 PolarHBondContact O-N 2.7Å; D729-Q732 PolarHBondContact O-N 2.74Å; D729-T733 WeakPolarHBondContact O-CA 3.36Å; D729-T733 VanDerWaalsContact O-CB 3.23Å; D729-T733 WeakPolarHBondContact O-CB 3.47Å; D729-T733 VanDerWaalsContact O-CG2 3.24Å; D729-T733 WeakPolarHBondContact O-CG2 3.31Å; D729-T733 PolarHBondContact O-N 3.23Å; D729-T733 PolarHBondContact O-OG1 2.76Å
730E72.9Confident70.2Confident109 Ų109106.8 Ų106.851%0.50949%0.489SS..Hα-helixtrans-75.3-39.2169.1-71.2178.7155.300110.2M726 E734M726-E730 WeakPolarHBondContact O-CA 3.43Å; M726-E730 WeakPolarHBondContact O-CB 3.22Å; M726-E730 WeakPolarHBondContact O-CG 3.41Å; M726-E730 PolarHBondContact O-N 3.38Å; E730-E734 VanDerWaalsContact O-CA 3.27Å; E730-E734 WeakPolarHBondContact O-CA 3.31Å; E730-E734 WeakPolarHBondContact O-CB 3.31Å; E730-E734 WeakPolarHBondContact O-CG 3.15Å; E730-E734 PolarHBondContact O-N 2.94Å
731L70.9Confident70.3Confident82 Ų82109.9 Ų109.943%0.42950%0.496SS..Hα-helixtrans-75.1-22.1167.1-67.6167.9000111.9Q727 H735Q727-L731 VanDerWaalsContact O-CA 3.27Å; Q727-L731 WeakPolarHBondContact O-CA 3.43Å; Q727-L731 WeakPolarHBondContact O-CB 3.47Å; Q727-L731 WeakPolarHBondContact O-CD1 3.49Å; Q727-L731 WeakPolarHBondContact O-CG 3.41Å; Q727-L731 PolarHBondContact O-N 2.84Å; L731-H735 VanDerWaalsContact O-CA 3.24Å; L731-H735 WeakPolarHBondContact O-CA 3.36Å; L731-H735 WeakPolarHBondContact O-CB 3.46Å; L731-H735 PolarHBondContact O-N 3.27Å
732Q71.9Confident70.2Confident105 Ų105107.3 Ų107.349%0.49150%0.495SS..Hα-helixtrans-82.8-33.6173.5-178.8170.3-91.600111L728 D729 Q736L728-Q732 VanDerWaalsContact O-CA 3.31Å; L728-Q732 WeakPolarHBondContact O-CA 3.3Å; L728-Q732 WeakPolarHBondContact O-CB 3.24Å; L728-Q732 PolarHBondContact O-N 2.7Å; D729-Q732 PolarHBondContact O-N 2.74Å; Q732-Q736 WeakPolarHBondContact O-CB 3.24Å; Q732-Q736 VanDerWaalsContact O-CD 3.3Å; Q732-Q736 WeakPolarHBondContact O-CG 3.34Å; Q732-Q736 PolarHBondContact O-N 2.78Å
733T68.8Low70Confident52 Ų52107.4 Ų107.432%0.31950%0.495SS..Hα-helixtrans-82-32171.559.90000112.2D729 R737D729-T733 WeakPolarHBondContact O-CA 3.36Å; D729-T733 VanDerWaalsContact O-CB 3.23Å; D729-T733 WeakPolarHBondContact O-CB 3.47Å; D729-T733 VanDerWaalsContact O-CG2 3.24Å; D729-T733 WeakPolarHBondContact O-CG2 3.31Å; D729-T733 PolarHBondContact O-N 3.23Å; D729-T733 PolarHBondContact O-OG1 2.76Å; T733-R737 WeakPolarHBondContact O-CB 3.29Å; T733-R737 VanDerWaalsContact O-CD 3.29Å; T733-R737 WeakPolarHBondContact O-CD 3.37Å; T733-R737 WeakPolarHBondContact O-CG 3.49Å; T733-R737 PolarHBondContact O-N 3.16Å
734E69.9Low69.6Low78 Ų78107.5 Ų107.536%0.36450%0.496SS..Hα-helixtrans-71.9-32.5164.3-76.5-149.711200111.4E730 R738E730-E734 VanDerWaalsContact O-CA 3.27Å; E730-E734 WeakPolarHBondContact O-CA 3.31Å; E730-E734 WeakPolarHBondContact O-CB 3.31Å; E730-E734 WeakPolarHBondContact O-CG 3.15Å; E730-E734 PolarHBondContact O-N 2.94Å; E734-R738 VanDerWaalsContact O-CA 3.31Å; E734-R738 WeakPolarHBondContact O-CA 3.25Å; E734-R738 WeakPolarHBondContact O-CB 3.43Å; E734-R738 WeakPolarHBondContact O-CG 3.47Å; E734-R738 PolarHBondContact O-N 3.15Å; E734-R738 IonicContact OE1-CZ 3.24Å; E734-R738 IonicContact OE1-NH1 3.88Å; E734-R738 IonicContact OE1-NH2 2.71Å; E734-R738 PolarHBondContact OE1-NH2 2.96Å; E734-R738 IonicContact OE2-CZ 2.86Å; E734-R738 IonicContact OE2-NH1 3.55Å; E734-R738 PolarHBondContact OE2-NH1 3.48Å; E734-R738 IonicContact OE2-NH2 3.03Å; E734-R738 PolarHBondContact OE2-NH2 3.32Å
735H68.9Low69.4Low117 Ų117106.2 Ų106.254%0.54250%0.498SS..Hα-helixtrans-77.8-31.9173.7-164.899000110.2L731 R738 Q739L731-H735 VanDerWaalsContact O-CA 3.24Å; L731-H735 WeakPolarHBondContact O-CA 3.36Å; L731-H735 WeakPolarHBondContact O-CB 3.46Å; L731-H735 PolarHBondContact O-N 3.27Å; H735-R738 CarbonylContact O-C 3.41Å; H735-Q739 WeakPolarHBondContact O-CA 3.16Å; H735-Q739 WeakPolarHBondContact O-CB 3.3Å; H735-Q739 PolarHBondContact O-N 3.49Å
736Q65.9Low69Low96 Ų96104 Ų10445%0.44949%0.494SS..Hα-helixtrans-67.3-43.3167.7-75.2162.95.700111.2Q732 Q739 Q740Q732-Q736 WeakPolarHBondContact O-CB 3.24Å; Q732-Q736 VanDerWaalsContact O-CD 3.3Å; Q732-Q736 WeakPolarHBondContact O-CG 3.34Å; Q732-Q736 PolarHBondContact O-N 2.78Å; Q736-Q739 PolarHBondContact O-N 3.27Å; Q736-Q740 WeakPolarHBondContact O-CB 3.34Å; Q736-Q740 VanDerWaalsContact O-CG 3.28Å; Q736-Q740 WeakPolarHBondContact O-CG 3.5Å; Q736-Q740 PolarHBondContact O-N 3.09Å
737R71.8Confident68.8Low144 Ų144105.6 Ų105.654%0.54349%0.494SS..Hα-helixtrans-69.3-35.6174.1-71.7164.3-179164.10.7112.5T733 R741T733-R737 WeakPolarHBondContact O-CB 3.29Å; T733-R737 VanDerWaalsContact O-CD 3.29Å; T733-R737 WeakPolarHBondContact O-CD 3.37Å; T733-R737 WeakPolarHBondContact O-CG 3.49Å; T733-R737 PolarHBondContact O-N 3.16Å; R737-R741 WeakPolarHBondContact O-CB 3.29Å; R737-R741 WeakPolarHBondContact O-CD 3.03Å; R737-R741 WeakPolarHBondContact O-CG 3.25Å; R737-R741 PolarHBondContact O-N 3.37Å
738R66.5Low68.6Low110 Ų110105.4 Ų105.442%0.41550%0.499SS..Hα-helixtrans-75.2-27.2172.5-76.7178.9-176.6109.612.9110.9E734 H735 L742E734-R738 VanDerWaalsContact O-CA 3.31Å; E734-R738 WeakPolarHBondContact O-CA 3.25Å; E734-R738 WeakPolarHBondContact O-CB 3.43Å; E734-R738 WeakPolarHBondContact O-CG 3.47Å; E734-R738 PolarHBondContact O-N 3.15Å; E734-R738 IonicContact OE1-CZ 3.24Å; E734-R738 IonicContact OE1-NH1 3.88Å; E734-R738 IonicContact OE1-NH2 2.71Å; E734-R738 PolarHBondContact OE1-NH2 2.96Å; E734-R738 IonicContact OE2-CZ 2.86Å; E734-R738 IonicContact OE2-NH1 3.55Å; E734-R738 PolarHBondContact OE2-NH1 3.48Å; E734-R738 IonicContact OE2-NH2 3.03Å; E734-R738 PolarHBondContact OE2-NH2 3.32Å; H735-R738 CarbonylContact O-C 3.41Å; R738-L742 WeakPolarHBondContact O-CA 3.21Å; R738-L742 WeakPolarHBondContact O-CB 3.48Å; R738-L742 WeakPolarHBondContact O-CD1 3.37Å; R738-L742 PolarHBondContact O-N 2.98Å
739Q68.3Low68.4Low93 Ų93102.5 Ų102.544%0.43549%0.492SS..Hα-helixtrans-81.7-34.1176.7-176175.240.300110.5H735 Q736 Q743H735-Q739 WeakPolarHBondContact O-CA 3.16Å; H735-Q739 WeakPolarHBondContact O-CB 3.3Å; H735-Q739 PolarHBondContact O-N 3.49Å; Q736-Q739 PolarHBondContact O-N 3.27Å; Q739-Q743 WeakPolarHBondContact O-CB 3.48Å; Q739-Q743 WeakPolarHBondContact O-CG 3.46Å; Q739-Q743 PolarHBondContact O-N 2.76Å
740Q63.3Low68Low118 Ų118101.5 Ų101.555%0.55149%0.485SS*.Hα-helixtrans-65.7-52.3164.8-73.7170.8-14.300110.4Q736 L742 Q743 E744Q736-Q740 WeakPolarHBondContact O-CB 3.34Å; Q736-Q740 VanDerWaalsContact O-CG 3.28Å; Q736-Q740 WeakPolarHBondContact O-CG 3.5Å; Q736-Q740 PolarHBondContact O-N 3.09Å; Q740-L742 VanDerWaalsContact C-N 3.3Å; Q740-L742 PolarHBondContact O-N 3.39Å; Q740-Q743 PolarHBondContact O-N 3.29Å; Q740-Q743 VanDerWaalsContact O-N 3.1Å; Q740-E744 WeakPolarHBondContact O-CB 3.49Å; Q740-E744 WeakPolarHBondContact O-CG 3.37Å; Q740-E744 PolarHBondContact O-N 2.77Å
741R71.8Confident67.2Low163 Ų163101.9 Ų101.962%0.61549%0.487SS*.Hα-helixtrans-63.1-30.4175.5-70.9167.4-178.2174.1-0.8113.1R737 A745R737-R741 WeakPolarHBondContact O-CB 3.29Å; R737-R741 WeakPolarHBondContact O-CD 3.03Å; R737-R741 WeakPolarHBondContact O-CG 3.25Å; R737-R741 PolarHBondContact O-N 3.37Å; R741-A745 WeakPolarHBondContact O-CA 3.4Å; R741-A745 WeakPolarHBondContact O-CB 3.44Å; R741-A745 PolarHBondContact O-N 2.78Å
742L67.9Low67Low116 Ų116103.3 Ų103.361%0.60750%0.495SS*.Hα-helixtrans-73.4-45.6169.7-101.364.5000109.8R738 Q740 E744 A745 H746R738-L742 WeakPolarHBondContact O-CA 3.21Å; R738-L742 WeakPolarHBondContact O-CB 3.48Å; R738-L742 WeakPolarHBondContact O-CD1 3.37Å; R738-L742 PolarHBondContact O-N 2.98Å; Q740-L742 VanDerWaalsContact C-N 3.3Å; Q740-L742 PolarHBondContact O-N 3.39Å; L742-E744 PolarHBondContact O-N 3.45Å; L742-A745 PolarHBondContact O-N 2.77Å; L742-H746 VanDerWaalsContact O-CA 3.3Å; L742-H746 WeakPolarHBondContact O-CA 3.31Å; L742-H746 WeakPolarHBondContact O-CB 3.48Å; L742-H746 PolarHBondContact O-N 3.17Å
743Q66.3Low66.1Low123 Ų123103.6 Ų103.658%0.57550%0.497SS*.Hα-helixtrans-59.8-34.9178-77.5163.8-5.100111.4Q739 Q740 R747Q739-Q743 WeakPolarHBondContact O-CB 3.48Å; Q739-Q743 WeakPolarHBondContact O-CG 3.46Å; Q739-Q743 PolarHBondContact O-N 2.76Å; Q740-Q743 PolarHBondContact O-N 3.29Å; Q740-Q743 VanDerWaalsContact O-N 3.1Å; Q743-R747 WeakPolarHBondContact O-CB 3.37Å; Q743-R747 PolarHBondContact O-N 3.43Å
744E65.6Low65.7Low108 Ų108105.8 Ų105.851%0.50550%0.504SS..Hα-helixtrans-79.6-49175.6-65.8-177.513300112.8Q740 L742 R747 C748Q740-E744 WeakPolarHBondContact O-CB 3.49Å; Q740-E744 WeakPolarHBondContact O-CG 3.37Å; Q740-E744 PolarHBondContact O-N 2.77Å; L742-E744 PolarHBondContact O-N 3.45Å; E744-R747 PolarHBondContact O-N 2.8Å; E744-C748 PolarHBondContact O-N 2.81Å; E744-C748 PolarHBondContact O-SG 2.98Å
745A67.7Low65.1Low60 Ų60108.4 Ų108.450%0.49652%0.516SS..Hα-helixtrans-73.4-27.818000000113.5R741 L742 A749R741-A745 WeakPolarHBondContact O-CA 3.4Å; R741-A745 WeakPolarHBondContact O-CB 3.44Å; R741-A745 PolarHBondContact O-N 2.78Å; L742-A745 PolarHBondContact O-N 2.77Å; A745-A749 WeakPolarHBondContact O-CA 3.39Å; A745-A749 WeakPolarHBondContact O-CB 3.24Å; A745-A749 PolarHBondContact O-N 3.42Å
746H66.3Low64.7Low121 Ų121105.1 Ų105.156%0.5651%0.509SS*.Hα-helixtrans-74.7-39.6171.1-171.542.1000109.9L742 C748 M750L742-H746 VanDerWaalsContact O-CA 3.3Å; L742-H746 WeakPolarHBondContact O-CA 3.31Å; L742-H746 WeakPolarHBondContact O-CB 3.48Å; L742-H746 PolarHBondContact O-N 3.17Å; H746-C748 PolarHBondContact O-N 2.84Å; H746-M750 VanDerWaalsContact CE1-CG 3.43Å; H746-M750 WeakPolarHBondContact CE1-CG 3.14Å; H746-M750 VanDerWaalsContact CE1-SD 3.52Å; H746-M750 VanDerWaalsContact ND1-CG 3.28Å; H746-M750 WeakPolarHBondContact ND1-CG 3.22Å; H746-M750 WeakPolarHBondContact O-CB 3.44Å; H746-M750 WeakPolarHBondContact O-CG 3.47Å; H746-M750 PolarHBondContact O-N 3.19Å
747R67.4Low64.5Low149 Ų149106.1 Ų106.156%0.56251%0.509SS*.Hα-helixtrans-57.3-48171177.2177.963.1172.6-4.7111.2Q743 E744 Q751Q743-R747 WeakPolarHBondContact O-CB 3.37Å; Q743-R747 PolarHBondContact O-N 3.43Å; E744-R747 PolarHBondContact O-N 2.8Å; R747-Q751 WeakPolarHBondContact O-CB 3.14Å; R747-Q751 WeakPolarHBondContact O-CG 3.33Å; R747-Q751 PolarHBondContact O-N 2.72Å; R747-Q751 PolarHBondContact O-OE1 2.9Å
748C65.7Low63.9Low63 Ų63104.9 Ų104.943%0.42651%0.509SS..Hα-helixtrans-71.6-51.1177.6-65.10000112.5E744 H746 M750 Q751 D752E744-C748 PolarHBondContact O-N 2.81Å; E744-C748 PolarHBondContact O-SG 2.98Å; H746-C748 PolarHBondContact O-N 2.84Å; C748-M750 VanDerWaalsContact C-N 3.33Å; C748-M750 PolarHBondContact O-N 3.13Å; C748-Q751 PolarHBondContact O-N 2.87Å; C748-Q751 VanDerWaalsContact O-N 3.11Å; C748-D752 PolarHBondContact O-N 3.17Å
749A66.2Low63.6Low51 Ų51106.8 Ų106.842%0.42152%0.516SS..Hα-helixtrans-67.8-27.6-17600000113.7A745 M753A745-A749 WeakPolarHBondContact O-CA 3.39Å; A745-A749 WeakPolarHBondContact O-CB 3.24Å; A745-A749 PolarHBondContact O-N 3.42Å; A749-M753 WeakPolarHBondContact O-CB 3.35Å; A749-M753 WeakPolarHBondContact O-CG 3.46Å; A749-M753 PolarHBondContact O-N 3.17Å
750M64.9Low63.4Low74 Ų74107.3 Ų107.337%0.36552%0.522SS..Hα-helixtrans-67.3-48.8169-70.3-66.9-67.700110.4H746 C748 D752 M753 E754H746-M750 VanDerWaalsContact CE1-CG 3.43Å; H746-M750 WeakPolarHBondContact CE1-CG 3.14Å; H746-M750 VanDerWaalsContact CE1-SD 3.52Å; H746-M750 VanDerWaalsContact ND1-CG 3.28Å; H746-M750 WeakPolarHBondContact ND1-CG 3.22Å; H746-M750 WeakPolarHBondContact O-CB 3.44Å; H746-M750 WeakPolarHBondContact O-CG 3.47Å; H746-M750 PolarHBondContact O-N 3.19Å; C748-M750 VanDerWaalsContact C-N 3.33Å; C748-M750 PolarHBondContact O-N 3.13Å; M750-D752 PolarHBondContact O-N 3.31Å; M750-M753 PolarHBondContact O-N 2.94Å; M750-E754 HydrophobicContact CE-CG 4.32Å; M750-E754 VanDerWaalsContact O-CB 3.31Å; M750-E754 WeakPolarHBondContact O-CB 3.33Å; M750-E754 WeakPolarHBondContact O-CG 3.47Å; M750-E754 PolarHBondContact O-N 3.39Å
751Q55.3Low63.4Low117 Ų117104.8 Ų104.855%0.54751%0.512SS..Hα-helixtrans-57.8-33.6178.8-73.7178.6-38.200112.6R747 C748 H755R747-Q751 WeakPolarHBondContact O-CB 3.14Å; R747-Q751 WeakPolarHBondContact O-CG 3.33Å; R747-Q751 PolarHBondContact O-N 2.72Å; R747-Q751 PolarHBondContact O-OE1 2.9Å; C748-Q751 PolarHBondContact O-N 2.87Å; C748-Q751 VanDerWaalsContact O-N 3.11Å; Q751-H755 WeakPolarHBondContact O-CB 3.3Å; Q751-H755 PolarHBondContact O-CD2 2.84Å
752D65.9Low63.1Low112 Ų112103.8 Ų103.860%0.59951%0.512SS*.Hα-helixtrans-88.8-40.8178.3-64.4-36000113.8C748 M750 H755 A756C748-D752 PolarHBondContact O-N 3.17Å; M750-D752 PolarHBondContact O-N 3.31Å; D752-H755 PolarHBondContact O-N 3.29Å; D752-A756 PolarHBondContact O-N 3.1Å
753M53.4Low62.8Low110 Ų110103.2 Ų103.254%0.54251%0.506SS..Hα-helixtrans-71.4-34.7179.8-81.2-73.9-71.400113.3A749 M750 H755 R757A749-M753 WeakPolarHBondContact O-CB 3.35Å; A749-M753 WeakPolarHBondContact O-CG 3.46Å; A749-M753 PolarHBondContact O-N 3.17Å; M750-M753 PolarHBondContact O-N 2.94Å; M753-H755 PolarHBondContact O-N 2.86Å; M753-R757 HydrophobicContact CE-CB 4.49Å; M753-R757 HydrophobicContact SD-CB 4.16Å
754E60Low62.7Low99 Ų99102 Ų10246%0.46350%0.503SS..THydrogen-bonded Turntrans-70.1-24173.4-65.2-173.613000111.8M750M750-E754 HydrophobicContact CE-CG 4.32Å; M750-E754 VanDerWaalsContact O-CB 3.31Å; M750-E754 WeakPolarHBondContact O-CB 3.33Å; M750-E754 WeakPolarHBondContact O-CG 3.47Å; M750-E754 PolarHBondContact O-N 3.39Å
755H57.6Low62.8Low132 Ų132100.7 Ų100.761%0.61150%0.497SS*.THydrogen-bonded Turntrans-102.7-9.8-176.8-74.3-15.2000116.3Q751 D752 M753 R759Q751-H755 WeakPolarHBondContact O-CB 3.3Å; Q751-H755 PolarHBondContact O-CD2 2.84Å; D752-H755 PolarHBondContact O-N 3.29Å; M753-H755 PolarHBondContact O-N 2.86Å; H755-R759 PolarHBondContact O-NH1 2.76Å; H755-R759 PolarHBondContact O-NH2 3.37Å
756A62.2Low62.6Low49 Ų49104.2 Ų104.241%0.40550%0.503SS..THydrogen-bonded Turntrans-111.2-76.2171.300000112.2D752 Q758 R759D752-A756 PolarHBondContact O-N 3.1Å; A756-Q758 VanDerWaalsContact C-N 3.34Å; A756-Q758 PolarHBondContact O-N 2.96Å; A756-R759 PolarHBondContact O-N 2.79Å
757R59.8Low62.6Low117 Ų117105.8 Ų105.844%0.44250%0.504SS..Hα-helixtrans-79.2-10.5-153.5-148.7174.2175.3118.3-0.7115.3M753 R759 L761M753-R757 HydrophobicContact CE-CB 4.49Å; M753-R757 HydrophobicContact SD-CB 4.16Å; R757-R759 PolarHBondContact O-N 3.47Å; R757-L761 HydrophobicContact CG-CB 4.42Å; R757-L761 HydrophobicContact CG-CD1 3.88Å; R757-L761 HydrophobicContact CG-CG 3.94Å; R757-L761 PolarHBondContact O-N 2.93Å; R757-L761 VanDerWaalsContact O-N 3.09Å
758Q61Low62.6Low117 Ų117102.9 Ų102.955%0.54750%0.499SS..Hα-helixtrans-61.2-21168.7-68.4-164.916.100113.5A756A756-Q758 VanDerWaalsContact C-N 3.34Å; A756-Q758 PolarHBondContact O-N 2.96Å
759R58.9Low62.9Low151 Ų151106.9 Ų106.957%0.5751%0.505SS*.Hα-helixtrans-83.3-62173.1-50.5-167.5-160.487.111.5109.9H755 A756 R757 L761 K762H755-R759 PolarHBondContact O-NH1 2.76Å; H755-R759 PolarHBondContact O-NH2 3.37Å; A756-R759 PolarHBondContact O-N 2.79Å; R757-R759 PolarHBondContact O-N 3.47Å; R759-L761 PolarHBondContact O-N 2.77Å; R759-K762 PolarHBondContact O-N 2.69Å
760D64.4Low62.8Low104 Ų104111.7 Ų111.756%0.55652%0.519SS*.Hα-helixtrans-64.9-38-169.1-53.2-8.4000114.2K762 E763 L764D760-K762 PolarHBondContact O-N 3.4Å; D760-E763 PolarHBondContact O-N 2.78Å; D760-L764 WeakPolarHBondContact O-CB 3.49Å; D760-L764 PolarHBondContact O-N 3.05Å
761L63.4Low63Low64 Ų64113.4 Ų113.434%0.33553%0.526SS..Hα-helixtrans-70-32.1-177.6-97.6171.5000112.9R757 R759 L764 E765R757-L761 HydrophobicContact CG-CB 4.42Å; R757-L761 HydrophobicContact CG-CD1 3.88Å; R757-L761 HydrophobicContact CG-CG 3.94Å; R757-L761 PolarHBondContact O-N 2.93Å; R757-L761 VanDerWaalsContact O-N 3.09Å; R759-L761 PolarHBondContact O-N 2.77Å; L761-L764 PolarHBondContact O-N 3.26Å; L761-E765 HydrophobicContact CD2-CG 4.01Å; L761-E765 VanDerWaalsContact O-CB 3.22Å; L761-E765 WeakPolarHBondContact O-CB 3.41Å; L761-E765 VanDerWaalsContact O-CG 3.24Å; L761-E765 WeakPolarHBondContact O-CG 3.48Å; L761-E765 PolarHBondContact O-N 2.91Å
762K65.6Low63.3Low143 Ų143112.4 Ų112.462%0.62252%0.521SS*.Hα-helixtrans-63.1-49.7174.7-71.5-177.9177.51770110.4R759 D760 L764 E766R759-K762 PolarHBondContact O-N 2.69Å; D760-K762 PolarHBondContact O-N 3.4Å; K762-L764 VanDerWaalsContact C-N 3.35Å; K762-L764 PolarHBondContact O-N 3.37Å; K762-E766 WeakPolarHBondContact O-CG 3.17Å; K762-E766 PolarHBondContact O-N 3.47Å
763E60.8Low63.6Low104 Ų104112.5 Ų112.549%0.48652%0.518SS..Hα-helixtrans-61.9-38.6177-81.7-159.5-147.700113.5D760 R767D760-E763 PolarHBondContact O-N 2.78Å; E763-R767 WeakPolarHBondContact O-CD 3.13Å; E763-R767 VanDerWaalsContact O-CG 3.22Å; E763-R767 WeakPolarHBondContact O-CG 3.35Å; E763-R767 PolarHBondContact O-NE 3.24Å; E763-R767 IonicContact OE2-CZ 3.11Å; E763-R767 IonicContact OE2-NH1 3.22Å; E763-R767 PolarHBondContact OE2-NH1 3.43Å; E763-R767 IonicContact OE2-NH2 3.69Å; E763-R767 PolarHBondContact OE2-NH2 3.4Å
764L64.8Low64.2Low98 Ų98110 Ų11051%0.51352%0.515SS..Hα-helixtrans-79.2-40.1-178.6-15081.3000112.4D760 L761 K762 R767 L768D760-L764 WeakPolarHBondContact O-CB 3.49Å; D760-L764 PolarHBondContact O-N 3.05Å; L761-L764 PolarHBondContact O-N 3.26Å; K762-L764 VanDerWaalsContact C-N 3.35Å; K762-L764 PolarHBondContact O-N 3.37Å; L764-R767 PolarHBondContact O-N 3.32Å; L764-L768 VanDerWaalsContact O-CB 3.31Å; L764-L768 WeakPolarHBondContact O-CB 3.5Å; L764-L768 PolarHBondContact O-N 2.76Å
765E68.1Low64.6Low79 Ų79109.1 Ų109.137%0.36951%0.51SS..Hα-helixtrans-66.7-37.4-179.9-74.8-166142.600112.5L761 R767 L768 R769L761-E765 HydrophobicContact CD2-CG 4.01Å; L761-E765 VanDerWaalsContact O-CB 3.22Å; L761-E765 WeakPolarHBondContact O-CB 3.41Å; L761-E765 VanDerWaalsContact O-CG 3.24Å; L761-E765 WeakPolarHBondContact O-CG 3.48Å; L761-E765 PolarHBondContact O-N 2.91Å; E765-R767 VanDerWaalsContact C-N 3.33Å; E765-L768 PolarHBondContact O-N 3.25Å; E765-R769 WeakPolarHBondContact O-CB 3.27Å; E765-R769 WeakPolarHBondContact O-CG 3.08Å; E765-R769 PolarHBondContact O-N 2.75Å; E765-R769 IonicContact OE1-CZ 2.73Å; E765-R769 IonicContact OE1-NH2 2.74Å; E765-R769 PolarHBondContact OE1-NH2 3.29Å; E765-R769 IonicContact OE2-CZ 3.87Å; E765-R769 IonicContact OE2-NH1 2.77Å; E765-R769 PolarHBondContact OE2-NH1 3.47Å; E765-R769 IonicContact OE2-NH2 3.61Å; E765-R769 PolarHBondContact OE2-NH2 3.46Å
766E62.6Low65Low135 Ų135106.4 Ų106.463%0.63150%0.5SS*.Hα-helixtrans-64.9-39.2176.2-72.9-179175.800111.7K762 H770K762-E766 WeakPolarHBondContact O-CG 3.17Å; K762-E766 PolarHBondContact O-N 3.47Å; E766-H770 PolarHBondContact O-N 2.74Å; E766-H770 PolarHBondContact O-ND1 2.71Å
767R67.3Low65.4Low154 Ų154109.2 Ų109.258%0.58151%0.505SS*.Hα-helixtrans-69.3-45.7175.8-65.9169.1-171.3143.98.7111.5E763 L764 E765 H771E763-R767 WeakPolarHBondContact O-CD 3.13Å; E763-R767 VanDerWaalsContact O-CG 3.22Å; E763-R767 WeakPolarHBondContact O-CG 3.35Å; E763-R767 PolarHBondContact O-NE 3.24Å; E763-R767 IonicContact OE2-CZ 3.11Å; E763-R767 IonicContact OE2-NH1 3.22Å; E763-R767 PolarHBondContact OE2-NH1 3.43Å; E763-R767 IonicContact OE2-NH2 3.69Å; E763-R767 PolarHBondContact OE2-NH2 3.4Å; L764-R767 PolarHBondContact O-N 3.32Å; E765-R767 VanDerWaalsContact C-N 3.33Å; R767-H771 PolarHBondContact O-N 3.02Å
768L66.4Low65.7Low87 Ų87107.1 Ų107.146%0.45551%0.508SS..Hα-helixtrans-73-35.9-177.6-152.382.2000112.6L764 E765 H770 H771 H772L764-L768 VanDerWaalsContact O-CB 3.31Å; L764-L768 WeakPolarHBondContact O-CB 3.5Å; L764-L768 PolarHBondContact O-N 2.76Å; E765-L768 PolarHBondContact O-N 3.25Å; L768-H770 VanDerWaalsContact C-N 3.34Å; L768-H770 PolarHBondContact O-N 2.75Å; L768-H771 PolarHBondContact O-N 3.45Å; L768-H772 WeakPolarHBondContact O-CB 3.15Å; L768-H772 PolarHBondContact O-N 2.78Å
769R71.6Confident66.1Low147 Ų147105.7 Ų105.756%0.55550%0.504SS*.Hα-helixtrans-62.6-39.2175.5-77.2174.8179.6124.513.4111.8E765 H773E765-R769 WeakPolarHBondContact O-CB 3.27Å; E765-R769 WeakPolarHBondContact O-CG 3.08Å; E765-R769 PolarHBondContact O-N 2.75Å; E765-R769 IonicContact OE1-CZ 2.73Å; E765-R769 IonicContact OE1-NH2 2.74Å; E765-R769 PolarHBondContact OE1-NH2 3.29Å; E765-R769 IonicContact OE2-CZ 3.87Å; E765-R769 IonicContact OE2-NH1 2.77Å; E765-R769 PolarHBondContact OE2-NH1 3.47Å; E765-R769 IonicContact OE2-NH2 3.61Å; E765-R769 PolarHBondContact OE2-NH2 3.46Å; R769-H773 VanDerWaalsContact O-CB 3.25Å; R769-H773 WeakPolarHBondContact O-CB 3.43Å; R769-H773 PolarHBondContact O-N 2.77Å
770H64.8Low66.6Low152 Ų152105.6 Ų105.670%0.70450%0.503SS*.Hα-helixtrans-65.3-44.6173.4-78.589.7000112E766 L768 A774E766-H770 PolarHBondContact O-N 2.74Å; E766-H770 PolarHBondContact O-ND1 2.71Å; L768-H770 VanDerWaalsContact C-N 3.34Å; L768-H770 PolarHBondContact O-N 2.75Å; H770-A774 PolarHBondContact O-N 2.76Å
771H69.9Low66.8Low111 Ų111106.4 Ų106.451%0.51450%0.504SS..Hα-helixtrans-65.2-52.4-179.4-159.6-19.6000112R767 L768 H773 A774 E775R767-H771 PolarHBondContact O-N 3.02Å; L768-H771 PolarHBondContact O-N 3.45Å; H771-H773 VanDerWaalsContact C-N 3.33Å; H771-H773 PolarHBondContact O-N 3.21Å; H771-A774 PolarHBondContact O-N 3.32Å; H771-E775 VanDerWaalsContact CE1-CD 3.45Å; H771-E775 IonicContact CE1-OE1 3.47Å; H771-E775 PolarHBondContact CE1-OE1 2.83Å; H771-E775 IonicContact CE1-OE2 2.63Å; H771-E775 IonicContact CG-OE2 3.2Å; H771-E775 VanDerWaalsContact ND1-CD 3.25Å; H771-E775 IonicContact ND1-OE1 2.92Å; H771-E775 PolarHBondContact ND1-OE1 2.83Å; H771-E775 IonicContact ND1-OE2 2.82Å; H771-E775 PolarHBondContact ND1-OE2 2.87Å; H771-E775 IonicContact NE2-OE1 2.7Å; H771-E775 WeakPolarHBondContact O-CG 3.36Å; H771-E775 PolarHBondContact O-N 2.83Å; H771-E775 VanDerWaalsContact O-N 3.08Å
772H61.4Low67.1Low96 Ų96106 Ų10644%0.44451%0.51SS..Hα-helixtrans-68.5-24.6179.9-81.9-5.1000113.7L768 E775 L776L768-H772 WeakPolarHBondContact O-CB 3.15Å; L768-H772 PolarHBondContact O-N 2.78Å; H772-E775 IonicContact CE1-OE2 3.57Å; H772-E775 IonicContact CG-OE2 2.7Å; H772-E775 IonicContact ND1-OE2 3.82Å; H772-E775 PolarHBondContact ND1-OE2 3.45Å; H772-L776 WeakPolarHBondContact O-CB 3.24Å; H772-L776 WeakPolarHBondContact O-CD1 3.4Å; H772-L776 VanDerWaalsContact O-CG 3.22Å; H772-L776 WeakPolarHBondContact O-CG 3.36Å; H772-L776 PolarHBondContact O-N 2.69Å
773H72.4Confident66.7Low114 Ų114104.1 Ų104.153%0.52850%0.503SS..Hα-helixtrans-68.6-41.8174.4-160.196.5000111.3R769 H771 Q777R769-H773 VanDerWaalsContact O-CB 3.25Å; R769-H773 WeakPolarHBondContact O-CB 3.43Å; R769-H773 PolarHBondContact O-N 2.77Å; H771-H773 VanDerWaalsContact C-N 3.33Å; H771-H773 PolarHBondContact O-N 3.21Å; H773-Q777 WeakPolarHBondContact O-CG 3.41Å; H773-Q777 PolarHBondContact O-N 3.44Å; H773-Q777 VanDerWaalsContact O-N 3.09Å
774A65.1Low67.4Low58 Ų58106 Ų10648%0.47951%0.505SS..Hα-helixtrans-65.9-43.4174.900000111.9H770 H771 Q777 S778H770-A774 PolarHBondContact O-N 2.76Å; H771-A774 PolarHBondContact O-N 3.32Å; A774-Q777 PolarHBondContact O-N 3.22Å; A774-S778 PolarHBondContact O-N 3.29Å
775E67.6Low67.5Low80 Ų80107.2 Ų107.237%0.37451%0.509SS..Hα-helixtrans-65.4-40.6176.1-67171.2135.800112.2H771 H772 Q777 S778 L779H771-E775 VanDerWaalsContact CE1-CD 3.45Å; H771-E775 IonicContact CE1-OE1 3.47Å; H771-E775 PolarHBondContact CE1-OE1 2.83Å; H771-E775 IonicContact CE1-OE2 2.63Å; H771-E775 IonicContact CG-OE2 3.2Å; H771-E775 VanDerWaalsContact ND1-CD 3.25Å; H771-E775 IonicContact ND1-OE1 2.92Å; H771-E775 PolarHBondContact ND1-OE1 2.83Å; H771-E775 IonicContact ND1-OE2 2.82Å; H771-E775 PolarHBondContact ND1-OE2 2.87Å; H771-E775 IonicContact NE2-OE1 2.7Å; H771-E775 WeakPolarHBondContact O-CG 3.36Å; H771-E775 PolarHBondContact O-N 2.83Å; H771-E775 VanDerWaalsContact O-N 3.08Å; H772-E775 IonicContact CE1-OE2 3.57Å; H772-E775 IonicContact CG-OE2 2.7Å; H772-E775 IonicContact ND1-OE2 3.82Å; H772-E775 PolarHBondContact ND1-OE2 3.45Å; E775-Q777 VanDerWaalsContact C-N 3.28Å; E775-Q777 PolarHBondContact O-N 3.22Å; E775-S778 PolarHBondContact O-N 3.08Å; E775-S778 PolarHBondContact O-OG 3.5Å; E775-S778 VanDerWaalsContact O-OG 3.13Å; E775-L779 WeakPolarHBondContact O-CB 3.3Å; E775-L779 PolarHBondContact O-N 3.43Å
776L67.8Low67.5Low75 Ų75106.2 Ų106.239%0.39351%0.51SS..Hα-helixtrans-67.5-26175.5-79165.4000112.7H772 R780H772-L776 WeakPolarHBondContact O-CB 3.24Å; H772-L776 WeakPolarHBondContact O-CD1 3.4Å; H772-L776 VanDerWaalsContact O-CG 3.22Å; H772-L776 WeakPolarHBondContact O-CG 3.36Å; H772-L776 PolarHBondContact O-N 2.69Å; L776-R780 WeakPolarHBondContact O-CB 3.09Å; L776-R780 WeakPolarHBondContact O-CD 3.44Å; L776-R780 WeakPolarHBondContact O-CG 3.29Å; L776-R780 PolarHBondContact O-N 3.03Å; L776-R780 VanDerWaalsContact O-N 3.1Å
777Q69.2Low67.9Low107 Ų107104.6 Ų104.650%0.551%0.505SS..Hα-helixtrans-71.4-52.1172.1-75.7-176-7800111.3H773 A774 E775 L779 R780 E781H773-Q777 WeakPolarHBondContact O-CG 3.41Å; H773-Q777 PolarHBondContact O-N 3.44Å; H773-Q777 VanDerWaalsContact O-N 3.09Å; A774-Q777 PolarHBondContact O-N 3.22Å; E775-Q777 VanDerWaalsContact C-N 3.28Å; E775-Q777 PolarHBondContact O-N 3.22Å; Q777-L779 VanDerWaalsContact C-N 3.33Å; Q777-L779 PolarHBondContact O-N 2.81Å; Q777-R780 PolarHBondContact O-N 2.9Å; Q777-E781 PolarHBondContact O-N 2.7Å; Q777-E781 VanDerWaalsContact O-N 3.08Å
778S66.7Low68.1Low73 Ų73102 Ų10251%0.5150%0.5SS..Hα-helixtrans-63.2-38.717963.20000112.6A774 E775 E781 A782A774-S778 PolarHBondContact O-N 3.29Å; E775-S778 PolarHBondContact O-N 3.08Å; E775-S778 PolarHBondContact O-OG 3.5Å; E775-S778 VanDerWaalsContact O-OG 3.13Å; S778-E781 PolarHBondContact O-N 3.42Å; S778-A782 PolarHBondContact O-N 3.32Å
779L68.4Low68.1Low88 Ų88101.5 Ų101.546%0.46150%0.5SS..Hα-helixtrans-68.3-37.3177.3-172.760.2000112.3E775 Q777 A782 H783E775-L779 WeakPolarHBondContact O-CB 3.3Å; E775-L779 PolarHBondContact O-N 3.43Å; Q777-L779 VanDerWaalsContact C-N 3.33Å; Q777-L779 PolarHBondContact O-N 2.81Å; L779-A782 PolarHBondContact O-N 2.74Å; L779-H783 WeakPolarHBondContact O-CB 3.18Å; L779-H783 PolarHBondContact O-CD2 2.84Å; L779-H783 PolarHBondContact O-N 3.31Å
780R70.9Confident67.8Low149 Ų14999.7 Ų99.756%0.56250%0.501SS*.Hα-helixtrans-65.7-36.9173.2-78.7167.8-175.4149.1-0.5112.3L776 Q777 R784L776-R780 WeakPolarHBondContact O-CB 3.09Å; L776-R780 WeakPolarHBondContact O-CD 3.44Å; L776-R780 WeakPolarHBondContact O-CG 3.29Å; L776-R780 PolarHBondContact O-N 3.03Å; L776-R780 VanDerWaalsContact O-N 3.1Å; Q777-R780 PolarHBondContact O-N 2.9Å; R780-R784 WeakPolarHBondContact O-CB 3.49Å; R780-R784 PolarHBondContact O-N 3.36Å
781E68.1Low67.9Low121 Ų12198.5 Ų98.557%0.56549%0.493SS*.Hα-helixtrans-70.7-37.7177.3-70-179.1159.700112Q777 S778 R784 Q785Q777-E781 PolarHBondContact O-N 2.7Å; Q777-E781 VanDerWaalsContact O-N 3.08Å; S778-E781 PolarHBondContact O-N 3.42Å; E781-R784 PolarHBondContact O-N 2.69Å; E781-Q785 PolarHBondContact O-N 3.43Å
782A69.1Low67.8Low55 Ų5599 Ų9946%0.45550%0.496SS..Hα-helixtrans-64.7-45.7170.500000112.5S778 L779 R784 Q785 S786S778-A782 PolarHBondContact O-N 3.32Å; L779-A782 PolarHBondContact O-N 2.74Å; A782-R784 VanDerWaalsContact C-N 3.31Å; A782-R784 PolarHBondContact O-N 2.82Å; A782-Q785 PolarHBondContact O-N 3.15Å; A782-S786 PolarHBondContact O-N 2.73Å
783H58.8Low67.9Low104 Ų10499.6 Ų99.648%0.48150%0.499SS..Hα-helixtrans-62.5-35.9175.7-78.6-58.5000112.6L779 Q785 S786 I787L779-H783 WeakPolarHBondContact O-CB 3.18Å; L779-H783 PolarHBondContact O-CD2 2.84Å; L779-H783 PolarHBondContact O-N 3.31Å; H783-Q785 VanDerWaalsContact C-N 3.35Å; H783-Q785 PolarHBondContact O-N 3.1Å; H783-S786 PolarHBondContact O-N 3.01Å; H783-I787 WeakPolarHBondContact O-CB 3.21Å; H783-I787 WeakPolarHBondContact O-CD1 3.36Å; H783-I787 VanDerWaalsContact O-CG1 3.26Å; H783-I787 WeakPolarHBondContact O-CG1 3.16Å; H783-I787 PolarHBondContact O-N 3.34Å
784R75.5Confident67.2Low142 Ų14296.6 Ų96.654%0.53649%0.491SS..Hα-helixtrans-59-46.4175-174.31736579.9-6.8111.5R780 E781 A782 I787 E788R780-R784 WeakPolarHBondContact O-CB 3.49Å; R780-R784 PolarHBondContact O-N 3.36Å; E781-R784 PolarHBondContact O-N 2.69Å; A782-R784 VanDerWaalsContact C-N 3.31Å; A782-R784 PolarHBondContact O-N 2.82Å; R784-I787 PolarHBondContact O-N 3.08Å; R784-E788 IonicContact NH1-OE2 2.74Å; R784-E788 PolarHBondContact O-N 2.73Å
785Q66.9Low67.3Low125 Ų125100 Ų10058%0.58450%0.497SS*.Hα-helixtrans-65.2-39.3177.9-66.2175.85.500112E781 A782 H783 E788 T789E781-Q785 PolarHBondContact O-N 3.43Å; A782-Q785 PolarHBondContact O-N 3.15Å; H783-Q785 VanDerWaalsContact C-N 3.35Å; H783-Q785 PolarHBondContact O-N 3.1Å; Q785-E788 WeakPolarHBondContact O-CB 3.13Å; Q785-E788 PolarHBondContact O-N 3.46Å; Q785-T789 PolarHBondContact O-N 2.89Å; Q785-T789 VanDerWaalsContact O-N 3.15Å; Q785-T789 PolarHBondContact O-OG1 3.08Å
786S68.3Low67.1Low58 Ų58102.6 Ų102.641%0.40651%0.509SS..Hα-helixtrans-64.4-38.6175.6-1780000113A782 H783 T789 L790A782-S786 PolarHBondContact O-N 2.73Å; H783-S786 PolarHBondContact O-N 3.01Å; S786-T789 WeakPolarHBondContact CA-OG1 3.24Å; S786-T789 PolarHBondContact O-N 2.95Å; S786-T789 PolarHBondContact O-OG1 3.2Å; S786-L790 PolarHBondContact O-N 3.45Å
787I70.9Confident66.9Low101 Ų101105.3 Ų105.352%0.51852%0.52SS..Hα-helixtrans-69.3-36.5175.2-69.5164.1000111.5H783 R784 T789 L790 K791H783-I787 WeakPolarHBondContact O-CB 3.21Å; H783-I787 WeakPolarHBondContact O-CD1 3.36Å; H783-I787 VanDerWaalsContact O-CG1 3.26Å; H783-I787 WeakPolarHBondContact O-CG1 3.16Å; H783-I787 PolarHBondContact O-N 3.34Å; R784-I787 PolarHBondContact O-N 3.08Å; I787-T789 VanDerWaalsContact C-N 3.32Å; I787-T789 PolarHBondContact O-N 3.34Å; I787-L790 PolarHBondContact O-N 2.77Å; I787-K791 PolarHBondContact O-N 2.72Å; I787-K791 VanDerWaalsContact O-N 3.09Å
788E70.8Confident66.8Low100 Ų100105.1 Ų105.147%0.46752%0.521SS..Hα-helixtrans-60.1-41.6173.7-137.997.8-112.900110.9R784 Q785R784-E788 IonicContact NH1-OE2 2.74Å; R784-E788 PolarHBondContact O-N 2.73Å; Q785-E788 WeakPolarHBondContact O-CB 3.13Å; Q785-E788 PolarHBondContact O-N 3.46Å
789T67.1Low66.7Low76 Ų76108.5 Ų108.547%0.46653%0.529SS..Hα-helixtrans-72.8-38175.445.40000113.9Q785 S786 I787 K791 Q792 Q793Q785-T789 PolarHBondContact O-N 2.89Å; Q785-T789 VanDerWaalsContact O-N 3.15Å; Q785-T789 PolarHBondContact O-OG1 3.08Å; S786-T789 WeakPolarHBondContact CA-OG1 3.24Å; S786-T789 PolarHBondContact O-N 2.95Å; S786-T789 PolarHBondContact O-OG1 3.2Å; I787-T789 VanDerWaalsContact C-N 3.32Å; I787-T789 PolarHBondContact O-N 3.34Å; T789-K791 VanDerWaalsContact C-N 3.29Å; T789-K791 PolarHBondContact O-N 3.45Å; T789-Q792 PolarHBondContact O-N 2.94Å; T789-Q793 PolarHBondContact O-N 3.37Å
790L63.3Low66.4Low109 Ų109108.2 Ų108.257%0.57153%0.532SS*.Hα-helixtrans-62.9-36.7177-120.183.9000111.9S786 I787 Q792 Q793 S794S786-L790 PolarHBondContact O-N 3.45Å; I787-L790 PolarHBondContact O-N 2.77Å; L790-Q792 PolarHBondContact O-N 2.76Å; L790-Q793 PolarHBondContact O-N 2.65Å; L790-S794 PolarHBondContact O-N 2.8Å
791K68.1Low65.8Low126 Ų126105.6 Ų105.655%0.54853%0.528SS..Hα-helixtrans-58-48175.4-84.8-175170.5-174.80112.2I787 T789 Q793 S794 E795I787-K791 PolarHBondContact O-N 2.72Å; I787-K791 VanDerWaalsContact O-N 3.09Å; T789-K791 VanDerWaalsContact C-N 3.29Å; T789-K791 PolarHBondContact O-N 3.45Å; K791-Q793 PolarHBondContact O-N 2.68Å; K791-S794 PolarHBondContact O-N 2.88Å; K791-S794 VanDerWaalsContact O-N 3.13Å; K791-S794 PolarHBondContact O-OG 2.66Å; K791-E795 PolarHBondContact O-N 2.78Å
792Q67.4Low65.7Low123 Ų123108.8 Ų108.858%0.57554%0.535SS*.Hα-helixtrans-63.4-29.4-179.4-67.9-178.7-12.900112.7T789 L790 Q796T789-Q792 PolarHBondContact O-N 2.94Å; L790-Q792 PolarHBondContact O-N 2.76Å; Q792-Q796 WeakPolarHBondContact O-CG 3.35Å; Q792-Q796 PolarHBondContact O-N 2.86Å
793Q64.1Low65.5Low108 Ų108112.9 Ų112.951%0.50554%0.543SS..Hα-helixtrans-72.1-46.9172.3-67172.9-41.800111.1T789 L790 K791 E795 Q796 E797T789-Q793 PolarHBondContact O-N 3.37Å; L790-Q793 PolarHBondContact O-N 2.65Å; K791-Q793 PolarHBondContact O-N 2.68Å; Q793-E795 VanDerWaalsContact C-N 3.31Å; Q793-E795 PolarHBondContact O-N 3.5Å; Q793-Q796 WeakPolarHBondContact O-CB 3.33Å; Q793-Q796 PolarHBondContact O-N 2.67Å; Q793-Q796 VanDerWaalsContact O-N 3.08Å; Q793-E797 PolarHBondContact O-N 3.12Å; Q793-E797 VanDerWaalsContact O-N 3.08Å
794S58.2Low65.8Low51 Ų51113.2 Ų113.236%0.35754%0.544SS..Hα-helixtrans-64.8-29.3178.168.30000114.3L790 K791 L798L790-S794 PolarHBondContact O-N 2.8Å; K791-S794 PolarHBondContact O-N 2.88Å; K791-S794 VanDerWaalsContact O-N 3.13Å; K791-S794 PolarHBondContact O-OG 2.66Å; S794-L798 WeakPolarHBondContact O-CB 3.29Å; S794-L798 WeakPolarHBondContact O-CG 3.38Å; S794-L798 PolarHBondContact O-N 3.46Å
795E67Low65.2Low130 Ų130111.4 Ų111.461%0.60755%0.545SS*.Hα-helixtrans-70.6-31173.1-77.2-175.2135.600112.3K791 Q793 Q799K791-E795 PolarHBondContact O-N 2.78Å; Q793-E795 VanDerWaalsContact C-N 3.31Å; Q793-E795 PolarHBondContact O-N 3.5Å; E795-Q799 WeakPolarHBondContact O-CB 3.43Å; E795-Q799 PolarHBondContact O-N 2.84Å
796Q62.8Low65.2Low134 Ų134111 Ų11163%0.62654%0.543SS*.Hα-helixtrans-72.6-42174-70.8175.9-5.700111.6Q792 Q793 L798 Q799 T800Q792-Q796 WeakPolarHBondContact O-CG 3.35Å; Q792-Q796 PolarHBondContact O-N 2.86Å; Q793-Q796 WeakPolarHBondContact O-CB 3.33Å; Q793-Q796 PolarHBondContact O-N 2.67Å; Q793-Q796 VanDerWaalsContact O-N 3.08Å; Q796-L798 PolarHBondContact O-N 3.4Å; Q796-Q799 WeakPolarHBondContact O-CA 3.47Å; Q796-Q799 WeakPolarHBondContact O-CB 3.38Å; Q796-Q799 PolarHBondContact O-N 2.99Å; Q796-T800 PolarHBondContact O-N 2.96Å; Q796-T800 VanDerWaalsContact O-N 3.1Å
797E64.1Low64.8Low132 Ų132112.2 Ų112.262%0.61755%0.545SS*.Hα-helixtrans-64-38174.8-67.4172.816600112.1Q793 Q799 T800 L801Q793-E797 PolarHBondContact O-N 3.12Å; Q793-E797 VanDerWaalsContact O-N 3.08Å; E797-Q799 PolarHBondContact O-N 3.3Å; E797-T800 PolarHBondContact O-N 3.19Å; E797-T800 PolarHBondContact O-OG1 3.03Å; E797-L801 WeakPolarHBondContact O-CB 3.49Å; E797-L801 PolarHBondContact O-N 2.91Å; E797-L801 VanDerWaalsContact O-N 3.09Å
798L66.4Low64.5Low102 Ų102113.1 Ų113.153%0.53455%0.547SS..Hα-helixtrans-65.6-16.1170.8-86.7166.2000113.7S794 Q796 R802S794-L798 WeakPolarHBondContact O-CB 3.29Å; S794-L798 WeakPolarHBondContact O-CG 3.38Å; S794-L798 PolarHBondContact O-N 3.46Å; Q796-L798 PolarHBondContact O-N 3.4Å; L798-R802 VanDerWaalsContact O-CD 3.3Å; L798-R802 WeakPolarHBondContact O-CD 3.16Å; L798-R802 VanDerWaalsContact O-CG 3.24Å; L798-R802 WeakPolarHBondContact O-CG 2.97Å
799Q63.8Low64Low144 Ų144109.9 Ų109.967%0.67354%0.541SS*.Hα-helixtrans-96.3-28.3-179.2-156.2160.416.100112.5E795 Q796 E797E795-Q799 WeakPolarHBondContact O-CB 3.43Å; E795-Q799 PolarHBondContact O-N 2.84Å; Q796-Q799 WeakPolarHBondContact O-CA 3.47Å; Q796-Q799 WeakPolarHBondContact O-CB 3.38Å; Q796-Q799 PolarHBondContact O-N 2.99Å; E797-Q799 PolarHBondContact O-N 3.3Å
800T62.7Low63.8Low83 Ų83111 Ų11151%0.50954%0.539SS..Hα-helixtrans-72-46.6166.350.30000111.6Q796 E797 R802 F803 E804Q796-T800 PolarHBondContact O-N 2.96Å; Q796-T800 VanDerWaalsContact O-N 3.1Å; E797-T800 PolarHBondContact O-N 3.19Å; E797-T800 PolarHBondContact O-OG1 3.03Å; T800-R802 PolarHBondContact O-N 2.78Å; T800-R802 VanDerWaalsContact O-N 3.14Å; T800-F803 WeakPolarHBondContact O-CB 3.22Å; T800-F803 PolarHBondContact O-N 2.78Å; T800-E804 PolarHBondContact O-N 3.25Å; T800-E804 VanDerWaalsContact O-N 3.15Å
801L57.8Low63.8Low94 Ų94108.6 Ų108.649%0.49254%0.535SS..Hα-helixtrans-61-28.9-178.5-159.679.6000112.6E797 L805E797-L801 WeakPolarHBondContact O-CB 3.49Å; E797-L801 PolarHBondContact O-N 2.91Å; E797-L801 VanDerWaalsContact O-N 3.09Å; L801-L805 HydrophobicContact CG-CD1 4.34Å; L801-L805 WeakPolarHBondContact O-CB 3.4Å; L801-L805 VanDerWaalsContact O-CG 3.29Å; L801-L805 WeakPolarHBondContact O-CG 3.26Å; L801-L805 PolarHBondContact O-N 3.37Å; L801-L805 VanDerWaalsContact O-N 3.08Å
802R66.8Low63.5Low188 Ų188108.3 Ų108.371%0.70954%0.537SS*.Hα-helixtrans-66.8-33.3172.2-83.3172179-991.3113.5L798 T800 E806L798-R802 VanDerWaalsContact O-CD 3.3Å; L798-R802 WeakPolarHBondContact O-CD 3.16Å; L798-R802 VanDerWaalsContact O-CG 3.24Å; L798-R802 WeakPolarHBondContact O-CG 2.97Å; T800-R802 PolarHBondContact O-N 2.78Å; T800-R802 VanDerWaalsContact O-N 3.14Å; R802-E806 WeakPolarHBondContact O-CB 3.41Å; R802-E806 PolarHBondContact O-N 3.46Å
803F64.4Low63.4Low141 Ų141107.4 Ų107.462%0.61854%0.536SS*.Hα-helixtrans-76.8-41.7179.8-141-77.8000110.4T800 E806 D807T800-F803 WeakPolarHBondContact O-CB 3.22Å; T800-F803 PolarHBondContact O-N 2.78Å; F803-E806 PolarHBondContact O-N 3.45Å; F803-D807 PolarHBondContact O-N 3.13Å; F803-D807 VanDerWaalsContact O-N 3.08Å
804E65.6Low63.5Low110 Ų110105.1 Ų105.151%0.51454%0.535SS..Hα-helixtrans-60.7-50.3176.4-67.6166.3159.800111T800 E806 D807 E808T800-E804 PolarHBondContact O-N 3.25Å; T800-E804 VanDerWaalsContact O-N 3.15Å; E804-E806 VanDerWaalsContact C-N 3.27Å; E804-E806 PolarHBondContact O-N 3.46Å; E804-D807 PolarHBondContact O-N 2.84Å; E804-E808 WeakPolarHBondContact O-CB 3.33Å; E804-E808 WeakPolarHBondContact O-CG 3.21Å; E804-E808 PolarHBondContact O-N 3.39Å
805L62.6Low63.8Low104 Ų104105.2 Ų105.255%0.54554%0.536SS..Hα-helixtrans-63.4-27.7176.5-72.3169.5000113.8L801 G809L801-L805 HydrophobicContact CG-CD1 4.34Å; L801-L805 WeakPolarHBondContact O-CB 3.4Å; L801-L805 VanDerWaalsContact O-CG 3.29Å; L801-L805 WeakPolarHBondContact O-CG 3.26Å; L801-L805 PolarHBondContact O-N 3.37Å; L801-L805 VanDerWaalsContact O-N 3.08Å; L805-G809 PolarHBondContact O-N 3.43Å
806E66.5Low63.5Low118 Ų118103.6 Ų103.655%0.55153%0.531SS*.Hα-helixtrans-78.5-35.6178.2-145.9-167.6-11700112R802 F803 E804 K810R802-E806 WeakPolarHBondContact O-CB 3.41Å; R802-E806 PolarHBondContact O-N 3.46Å; F803-E806 PolarHBondContact O-N 3.45Å; E804-E806 VanDerWaalsContact C-N 3.27Å; E804-E806 PolarHBondContact O-N 3.46Å; E806-K810 WeakPolarHBondContact O-CD 3.26Å; E806-K810 VanDerWaalsContact O-CE 3.22Å; E806-K810 WeakPolarHBondContact O-CE 3.1Å; E806-K810 WeakPolarHBondContact O-CG 3.49Å; E806-K810 PolarHBondContact O-N 2.73Å; E806-K810 VanDerWaalsContact OE2-CE 3.27Å; E806-K810 WeakPolarHBondContact OE2-CE 3.09Å; E806-K810 IonicContact OE2-NZ 2.76Å; E806-K810 PolarHBondContact OE2-NZ 3.35Å
807D60.6Low63.8Low82 Ų82105.3 Ų105.344%0.43953%0.532SS..Hα-helixtrans-79.8-34.3175.2-82.63.3000112.6F803 E804 G809 K810 A811F803-D807 PolarHBondContact O-N 3.13Å; F803-D807 VanDerWaalsContact O-N 3.08Å; E804-D807 PolarHBondContact O-N 2.84Å; D807-G809 VanDerWaalsContact C-N 3.33Å; D807-K810 PolarHBondContact O-N 3.26Å; D807-K810 WeakPolarHBondContact OD1-CD 3.47Å; D807-K810 IonicContact OD1-NZ 3.88Å; D807-K810 PolarHBondContact OD1-NZ 3.1Å; D807-A811 VanDerWaalsContact O-CB 3.3Å; D807-A811 WeakPolarHBondContact O-CB 3.47Å; D807-A811 PolarHBondContact O-N 2.72Å
808E64.3Low63.8Low120 Ų120102.9 Ų102.956%0.56153%0.529SS*.Hα-helixtrans-61.2-42.3165.4-74.1-170.9153.700111.1E804 K810 A811 M812E804-E808 WeakPolarHBondContact O-CB 3.33Å; E804-E808 WeakPolarHBondContact O-CG 3.21Å; E804-E808 PolarHBondContact O-N 3.39Å; E808-K810 PolarHBondContact O-N 2.88Å; E808-A811 PolarHBondContact O-N 2.68Å; E808-M812 VanDerWaalsContact O-CB 3.29Å; E808-M812 WeakPolarHBondContact O-CB 3.07Å; E808-M812 PolarHBondContact O-N 2.73Å
809G59.9Low64Low33 Ų33103.5 Ų103.534%0.3453%0.529SS..Hα-helixtrans-60.2-41.8174.100000113.1L805 D807 L813L805-G809 PolarHBondContact O-N 3.43Å; D807-G809 VanDerWaalsContact C-N 3.33Å; G809-L813 VanDerWaalsContact O-CB 3.31Å; G809-L813 WeakPolarHBondContact O-CB 3.22Å; G809-L813 PolarHBondContact O-N 3.18Å
810K63.8Low64.3Low98 Ų98101.2 Ų101.243%0.42652%0.522SS..Hα-helixtrans-67.4-42.2174-70.1159.5-147.3155.20111.8E806 D807 E808 A814E806-K810 WeakPolarHBondContact O-CD 3.26Å; E806-K810 VanDerWaalsContact O-CE 3.22Å; E806-K810 WeakPolarHBondContact O-CE 3.1Å; E806-K810 WeakPolarHBondContact O-CG 3.49Å; E806-K810 PolarHBondContact O-N 2.73Å; E806-K810 VanDerWaalsContact OE2-CE 3.27Å; E806-K810 WeakPolarHBondContact OE2-CE 3.09Å; E806-K810 IonicContact OE2-NZ 2.76Å; E806-K810 PolarHBondContact OE2-NZ 3.35Å; D807-K810 PolarHBondContact O-N 3.26Å; D807-K810 WeakPolarHBondContact OD1-CD 3.47Å; D807-K810 IonicContact OD1-NZ 3.88Å; D807-K810 PolarHBondContact OD1-NZ 3.1Å; E808-K810 PolarHBondContact O-N 2.88Å; K810-A814 VanDerWaalsContact O-CB 3.28Å; K810-A814 WeakPolarHBondContact O-CB 3.16Å; K810-A814 PolarHBondContact O-N 3.38Å
811A63.9Low64.5Low60 Ų60102.3 Ų102.350%0.49652%0.524SS..Hα-helixtrans-65.4-42.8178.900000111.8D807 E808 A814 S815D807-A811 VanDerWaalsContact O-CB 3.3Å; D807-A811 WeakPolarHBondContact O-CB 3.47Å; D807-A811 PolarHBondContact O-N 2.72Å; E808-A811 PolarHBondContact O-N 2.68Å; A811-A814 CarbonylContact O-C 3.56Å; A811-A814 WeakPolarHBondContact O-CB 3.23Å; A811-A814 PolarHBondContact O-N 3.43Å; A811-S815 PolarHBondContact O-N 2.73Å
812M61.4Low65Low119 Ų119104.2 Ų104.259%0.58653%0.53SS*.Hα-helixtrans-72.2-35178.1-162.6-176-59.700112.1E808 A814 S815 L816E808-M812 VanDerWaalsContact O-CB 3.29Å; E808-M812 WeakPolarHBondContact O-CB 3.07Å; E808-M812 PolarHBondContact O-N 2.73Å; M812-A814 VanDerWaalsContact C-N 3.31Å; M812-S815 WeakPolarHBondContact CA-OG 3.35Å; M812-S815 PolarHBondContact O-OG 2.75Å; M812-S815 VanDerWaalsContact O-OG 3.07Å; M812-L816 HydrophobicContact CG-CD1 4.23Å; M812-L816 VanDerWaalsContact O-CB 3.27Å; M812-L816 WeakPolarHBondContact O-CB 3.4Å; M812-L816 WeakPolarHBondContact O-CG 3.2Å; M812-L816 PolarHBondContact O-N 3.34Å
813L65.8Low65.1Low104 Ų104100.2 Ų100.255%0.54552%0.522SS..Hα-helixtrans-68.2-29.9168.1-85.4165.7000112.5G809 R817G809-L813 VanDerWaalsContact O-CB 3.31Å; G809-L813 WeakPolarHBondContact O-CB 3.22Å; G809-L813 PolarHBondContact O-N 3.18Å; L813-R817 WeakPolarHBondContact O-CB 3.48Å; L813-R817 WeakPolarHBondContact O-CD 3.12Å; L813-R817 WeakPolarHBondContact O-CG 3.23Å; L813-R817 PolarHBondContact O-N 3.44Å
814A65.1Low65.3Low60 Ų6098.5 Ų98.550%0.49652%0.515SS..Hα-helixtrans-74.2-40.4173.700000111.8K810 A811 M812 S818K810-A814 VanDerWaalsContact O-CB 3.28Å; K810-A814 WeakPolarHBondContact O-CB 3.16Å; K810-A814 PolarHBondContact O-N 3.38Å; A811-A814 CarbonylContact O-C 3.56Å; A811-A814 WeakPolarHBondContact O-CB 3.23Å; A811-A814 PolarHBondContact O-N 3.43Å; M812-A814 VanDerWaalsContact C-N 3.31Å; A814-S818 WeakPolarHBondContact O-CB 3.39Å; A814-S818 PolarHBondContact O-N 2.67Å
815S64.9Low65.5Low53 Ų5395.9 Ų95.937%0.37151%0.513SS..Hα-helixtrans-67-48.7174.268.90000111A811 M812 R817 S818 E819A811-S815 PolarHBondContact O-N 2.73Å; M812-S815 WeakPolarHBondContact CA-OG 3.35Å; M812-S815 PolarHBondContact O-OG 2.75Å; M812-S815 VanDerWaalsContact O-OG 3.07Å; S815-R817 VanDerWaalsContact C-N 3.32Å; S815-R817 PolarHBondContact O-N 2.71Å; S815-S818 CarbonylContact O-C 3.52Å; S815-S818 WeakPolarHBondContact O-CA 3.49Å; S815-S818 WeakPolarHBondContact O-CB 3.37Å; S815-S818 PolarHBondContact O-N 3.11Å; S815-E819 WeakPolarHBondContact O-CB 3.42Å; S815-E819 WeakPolarHBondContact O-CG 3.37Å; S815-E819 PolarHBondContact O-N 3.42Å
816L60.8Low65.9Low97 Ų9793.6 Ų93.651%0.50851%0.505SS..Hα-helixtrans-63.5-33.5175.9-77.4164.8000112.8M812 L820M812-L816 HydrophobicContact CG-CD1 4.23Å; M812-L816 VanDerWaalsContact O-CB 3.27Å; M812-L816 WeakPolarHBondContact O-CB 3.4Å; M812-L816 WeakPolarHBondContact O-CG 3.2Å; M812-L816 PolarHBondContact O-N 3.34Å; L816-L820 WeakPolarHBondContact O-CB 3.32Å; L816-L820 PolarHBondContact O-N 3.47Å
817R69.3Low66.1Low170 Ų17090.4 Ų90.464%0.64250%0.499SS*.Hα-helixtrans-72.3-32.2169.8-76.9173.8174.6-172-0.5112.4L813 S815 N821L813-R817 WeakPolarHBondContact O-CB 3.48Å; L813-R817 WeakPolarHBondContact O-CD 3.12Å; L813-R817 WeakPolarHBondContact O-CG 3.23Å; L813-R817 PolarHBondContact O-N 3.44Å; S815-R817 VanDerWaalsContact C-N 3.32Å; S815-R817 PolarHBondContact O-N 2.71Å; R817-N821 WeakPolarHBondContact O-CB 3.42Å; R817-N821 PolarHBondContact O-N 3.36Å; R817-N821 PolarHBondContact O-ND2 3.44Å
818S64.6Low66.7Low80 Ų8090.3 Ų90.356%0.55950%0.498SS*.Hα-helixtrans-71.4-41.3175.6-170.80000111.1A814 S815 N821 H822A814-S818 WeakPolarHBondContact O-CB 3.39Å; A814-S818 PolarHBondContact O-N 2.67Å; S815-S818 CarbonylContact O-C 3.52Å; S815-S818 WeakPolarHBondContact O-CA 3.49Å; S815-S818 WeakPolarHBondContact O-CB 3.37Å; S815-S818 PolarHBondContact O-N 3.11Å; S818-N821 CarbonylContact O-C 3.55Å; S818-H822 WeakPolarHBondContact O-CA 3.35Å; S818-H822 WeakPolarHBondContact O-CB 3.49Å; S818-H822 PolarHBondContact O-N 3.22Å
819E70.1Confident66.9Low115 Ų11589.1 Ų89.154%0.53749%0.492SS..Hα-helixtrans-72.9-43.3176.6-71.4178.9152.500111.1S815 N821 H822 I823S815-E819 WeakPolarHBondContact O-CB 3.42Å; S815-E819 WeakPolarHBondContact O-CG 3.37Å; S815-E819 PolarHBondContact O-N 3.42Å; E819-N821 VanDerWaalsContact C-N 3.34Å; E819-N821 PolarHBondContact O-N 2.94Å; E819-H822 CarbonylContact O-C 3.54Å; E819-H822 PolarHBondContact O-N 2.89Å; E819-H822 VanDerWaalsContact O-N 3.11Å; E819-I823 VanDerWaalsContact O-CB 3.32Å; E819-I823 WeakPolarHBondContact O-CB 3.24Å; E819-I823 VanDerWaalsContact O-CG1 3.26Å; E819-I823 WeakPolarHBondContact O-CG1 3.33Å; E819-I823 PolarHBondContact O-N 3.29Å
820L70.4Confident67.5Low97 Ų9793.3 Ų93.351%0.50850%0.503SS..Hα-helixtrans-65.7-36.4173.2-172.965.3000111.6L816 H824L816-L820 WeakPolarHBondContact O-CB 3.32Å; L816-L820 PolarHBondContact O-N 3.47Å; L820-H824 VanDerWaalsContact O-CB 3.24Å; L820-H824 WeakPolarHBondContact O-CB 3.38Å; L820-H824 PolarHBondContact O-N 2.95Å
821N66.3Low67.8Low106 Ų10694.6 Ų94.657%0.56751%0.514SS*.Hα-helixtrans-73.9-25.7170.8-75.4-34.4000112.6R817 S818 E819 A825R817-N821 WeakPolarHBondContact O-CB 3.42Å; R817-N821 PolarHBondContact O-N 3.36Å; R817-N821 PolarHBondContact O-ND2 3.44Å; S818-N821 CarbonylContact O-C 3.55Å; E819-N821 VanDerWaalsContact C-N 3.34Å; E819-N821 PolarHBondContact O-N 2.94Å; N821-A825 WeakPolarHBondContact O-CA 3.4Å; N821-A825 WeakPolarHBondContact O-CB 3.31Å; N821-A825 PolarHBondContact O-N 3.26Å
822H69.1Low68.2Low133 Ų13399 Ų9962%0.61652%0.517SS*.Hα-helixtrans-79.1-34.4174.9-175.466.7000111.4S818 E819 S826S818-H822 WeakPolarHBondContact O-CA 3.35Å; S818-H822 WeakPolarHBondContact O-CB 3.49Å; S818-H822 PolarHBondContact O-N 3.22Å; E819-H822 CarbonylContact O-C 3.54Å; E819-H822 PolarHBondContact O-N 2.89Å; E819-H822 VanDerWaalsContact O-N 3.11Å; H822-S826 WeakPolarHBondContact O-CA 3.32Å; H822-S826 WeakPolarHBondContact O-CB 3.46Å; H822-S826 PolarHBondContact O-N 3.29Å; H822-S826 PolarHBondContact O-OG 3.09Å
823I68.8Low68.6Low104 Ų10498.5 Ų98.553%0.53351%0.514SS..Hα-helixtrans-73.8-41.9171.7-67.6166.1000109.7E819 S826 A827E819-I823 VanDerWaalsContact O-CB 3.32Å; E819-I823 WeakPolarHBondContact O-CB 3.24Å; E819-I823 VanDerWaalsContact O-CG1 3.26Å; E819-I823 WeakPolarHBondContact O-CG1 3.33Å; E819-I823 PolarHBondContact O-N 3.29Å; I823-S826 PolarHBondContact O-OG 2.9Å; I823-A827 WeakPolarHBondContact O-CA 3.3Å; I823-A827 WeakPolarHBondContact O-CB 3.36Å; I823-A827 PolarHBondContact O-N 2.72Å
824H68.4Low68.7Low105 Ų10595.2 Ų95.249%0.48650%0.498SS..Hα-helixtrans-68.4-40.3170.2-87.1163.5000112.5L820 I828L820-H824 VanDerWaalsContact O-CB 3.24Å; L820-H824 WeakPolarHBondContact O-CB 3.38Å; L820-H824 PolarHBondContact O-N 2.95Å; H824-I828 HydrophobicContact CB-CD1 4.5Å; H824-I828 WeakPolarHBondContact O-CB 3.14Å; H824-I828 WeakPolarHBondContact O-CD1 3.48Å; H824-I828 WeakPolarHBondContact O-CG1 3.46Å; H824-I828 PolarHBondContact O-N 3.5Å
825A69.9Low68.9Low55 Ų5598.2 Ų98.246%0.45550%0.502SS..Hα-helixtrans-68.9-44.4177.600000110.8N821 I828 E829N821-A825 WeakPolarHBondContact O-CA 3.4Å; N821-A825 WeakPolarHBondContact O-CB 3.31Å; N821-A825 PolarHBondContact O-N 3.26Å; A825-I828 PolarHBondContact O-N 3.34Å; A825-E829 WeakPolarHBondContact O-CA 3.48Å; A825-E829 WeakPolarHBondContact O-CB 3.43Å; A825-E829 PolarHBondContact O-N 2.78Å
826S70.4Confident69.3Low56 Ų56102.4 Ų102.439%0.39252%0.515SS..Hα-helixtrans-68.1-39.7174.761.40000111.9H822 I823 E829 H830H822-S826 WeakPolarHBondContact O-CA 3.32Å; H822-S826 WeakPolarHBondContact O-CB 3.46Å; H822-S826 PolarHBondContact O-N 3.29Å; H822-S826 PolarHBondContact O-OG 3.09Å; I823-S826 PolarHBondContact O-OG 2.9Å; S826-E829 PolarHBondContact O-N 2.76Å; S826-H830 WeakPolarHBondContact O-CA 3.14Å; S826-H830 WeakPolarHBondContact O-CB 3.5Å; S826-H830 PolarHBondContact O-N 2.68Å
827A70.1Confident69.7Low51 Ų51104 Ų10442%0.42152%0.52SS..Hα-helixtrans-65.8-40.4173.800000111.6I823 L831I823-A827 WeakPolarHBondContact O-CA 3.3Å; I823-A827 WeakPolarHBondContact O-CB 3.36Å; I823-A827 PolarHBondContact O-N 2.72Å; A827-L831 WeakPolarHBondContact O-CA 3.28Å; A827-L831 WeakPolarHBondContact O-CB 3.24Å; A827-L831 PolarHBondContact O-N 3.19Å
828I73.7Confident69.8Low81 Ų81101.5 Ų101.542%0.41552%0.515SS..Hα-helixtrans-70.1-36.5175.1-71.2166.8000110.9H824 A825 R832H824-I828 HydrophobicContact CB-CD1 4.5Å; H824-I828 WeakPolarHBondContact O-CB 3.14Å; H824-I828 WeakPolarHBondContact O-CD1 3.48Å; H824-I828 WeakPolarHBondContact O-CG1 3.46Å; H824-I828 PolarHBondContact O-N 3.5Å; A825-I828 PolarHBondContact O-N 3.34Å; I828-R832 HydrophobicContact CG2-CG 4.39Å; I828-R832 WeakPolarHBondContact O-CA 3.15Å; I828-R832 WeakPolarHBondContact O-CB 3.47Å; I828-R832 WeakPolarHBondContact O-CD 3.06Å; I828-R832 WeakPolarHBondContact O-CG 3.19Å; I828-R832 PolarHBondContact O-N 3.1Å
829E69Low70.1Confident95 Ų9599.5 Ų99.544%0.44450%0.502SS..Hα-helixtrans-76.5-29.4178-15273.6168.800111.5A825 S826 R832 Q833A825-E829 WeakPolarHBondContact O-CA 3.48Å; A825-E829 WeakPolarHBondContact O-CB 3.43Å; A825-E829 PolarHBondContact O-N 2.78Å; S826-E829 PolarHBondContact O-N 2.76Å; E829-R832 CarbonylContact O-C 3.5Å; E829-R832 WeakPolarHBondContact OE2-CD 3.43Å; E829-R832 IonicContact OE2-CZ 3.68Å; E829-R832 IonicContact OE2-NE 3.5Å; E829-R832 IonicContact OE2-NH1 3.91Å; E829-R832 PolarHBondContact OE2-NH1 3.37Å; E829-Q833 VanDerWaalsContact O-CB 3.29Å; E829-Q833 WeakPolarHBondContact O-CB 3.42Å; E829-Q833 VanDerWaalsContact O-CG 3.22Å; E829-Q833 WeakPolarHBondContact O-CG 3.48Å; E829-Q833 PolarHBondContact O-N 3.26Å
830H70.8Confident70.1Confident120 Ų12096.3 Ų96.356%0.55650%0.495SS*.Hα-helixtrans-79.9-32.4173.1-159.9-46.3000111.3S826 Q833 T834S826-H830 WeakPolarHBondContact O-CA 3.14Å; S826-H830 WeakPolarHBondContact O-CB 3.5Å; S826-H830 PolarHBondContact O-N 2.68Å; H830-Q833 PolarHBondContact O-N 2.76Å; H830-T834 WeakPolarHBondContact O-CG2 3.31Å; H830-T834 PolarHBondContact O-N 3.08Å; H830-T834 PolarHBondContact O-OG1 3.27Å
831L70.6Confident70.1Confident126 Ų12694 Ų9466%0.6649%0.49SS*.Hα-helixtrans-74.4-30168.8-151.883000111.1A827 T834 H835A827-L831 WeakPolarHBondContact O-CA 3.28Å; A827-L831 WeakPolarHBondContact O-CB 3.24Å; A827-L831 PolarHBondContact O-N 3.19Å; L831-T834 WeakPolarHBondContact CA-OG1 3.44Å; L831-T834 PolarHBondContact O-OG1 3.38Å; L831-H835 WeakPolarHBondContact O-CA 3.38Å; L831-H835 WeakPolarHBondContact O-CB 3.45Å; L831-H835 PolarHBondContact O-N 3.3Å
832R72.9Confident70.3Confident151 Ų15191.8 Ų91.857%0.5749%0.486SS*.Hα-helixtrans-71.3-35.9166.3-78.5163.9178.4168.31.2110.9I828 E829 H836I828-R832 HydrophobicContact CG2-CG 4.39Å; I828-R832 WeakPolarHBondContact O-CA 3.15Å; I828-R832 WeakPolarHBondContact O-CB 3.47Å; I828-R832 WeakPolarHBondContact O-CD 3.06Å; I828-R832 WeakPolarHBondContact O-CG 3.19Å; I828-R832 PolarHBondContact O-N 3.1Å; E829-R832 CarbonylContact O-C 3.5Å; E829-R832 WeakPolarHBondContact OE2-CD 3.43Å; E829-R832 IonicContact OE2-CZ 3.68Å; E829-R832 IonicContact OE2-NE 3.5Å; E829-R832 IonicContact OE2-NH1 3.91Å; E829-R832 PolarHBondContact OE2-NH1 3.37Å; R832-H836 WeakPolarHBondContact O-CA 3.42Å; R832-H836 WeakPolarHBondContact O-CB 3.47Å; R832-H836 PolarHBondContact O-N 3.09Å
833Q68.6Low70.2Confident109 Ų10991.1 Ų91.151%0.50948%0.481SS..Hα-helixtrans-72.3-42175.8-81.3177.17.400111.2E829 H830 H836 Q837E829-Q833 VanDerWaalsContact O-CB 3.29Å; E829-Q833 WeakPolarHBondContact O-CB 3.42Å; E829-Q833 VanDerWaalsContact O-CG 3.22Å; E829-Q833 WeakPolarHBondContact O-CG 3.48Å; E829-Q833 PolarHBondContact O-N 3.26Å; H830-Q833 PolarHBondContact O-N 2.76Å; Q833-H836 PolarHBondContact O-N 3.41Å; Q833-Q837 WeakPolarHBondContact O-CB 3.13Å; Q833-Q837 WeakPolarHBondContact O-CG 3.48Å; Q833-Q837 PolarHBondContact O-N 2.84Å
834T69.6Low70.3Confident35 Ų3588.6 Ų88.622%0.21548%0.476CS..Hα-helixtrans-66.4-49.4170.9600000110.1H830 L831 H836 Q837 E838H830-T834 WeakPolarHBondContact O-CG2 3.31Å; H830-T834 PolarHBondContact O-N 3.08Å; H830-T834 PolarHBondContact O-OG1 3.27Å; L831-T834 WeakPolarHBondContact CA-OG1 3.44Å; L831-T834 PolarHBondContact O-OG1 3.38Å; T834-H836 PolarHBondContact O-N 3.44Å; T834-Q837 CarbonylContact O-C 3.54Å; T834-Q837 PolarHBondContact O-N 3.41Å; T834-Q837 VanDerWaalsContact O-N 3.1Å; T834-E838 WeakPolarHBondContact O-CA 3.39Å; T834-E838 WeakPolarHBondContact O-CB 3.14Å; T834-E838 WeakPolarHBondContact O-CG 3.17Å; T834-E838 PolarHBondContact O-N 2.98Å
835H69.4Low70.4Confident124 Ų12489.9 Ų89.957%0.57448%0.482SS*.Hα-helixtrans-64-25.1175.8-174.4-82000113.2L831 S839L831-H835 WeakPolarHBondContact O-CA 3.38Å; L831-H835 WeakPolarHBondContact O-CB 3.45Å; L831-H835 PolarHBondContact O-N 3.3Å; H835-S839 WeakPolarHBondContact O-CA 3.05Å; H835-S839 WeakPolarHBondContact O-CB 3.45Å; H835-S839 PolarHBondContact O-N 3.4Å
836H72.3Confident70.3Confident141 Ų14192 Ų9265%0.65349%0.486SS*.Hα-helixtrans-83.8-30.2173.8-169.293.1000111.5R832 Q833 T834 A840R832-H836 WeakPolarHBondContact O-CA 3.42Å; R832-H836 WeakPolarHBondContact O-CB 3.47Å; R832-H836 PolarHBondContact O-N 3.09Å; Q833-H836 PolarHBondContact O-N 3.41Å; T834-H836 PolarHBondContact O-N 3.44Å; H836-A840 WeakPolarHBondContact O-CA 3.49Å; H836-A840 WeakPolarHBondContact O-CB 3.44Å; H836-A840 PolarHBondContact O-N 2.92Å
837Q69.9Low70.4Confident129 Ų12995.1 Ų95.160%0.60349%0.494SS*.Hα-helixtrans-75.4-37170.4-75.2170.91.200111.7Q833 T834 A841Q833-Q837 WeakPolarHBondContact O-CB 3.13Å; Q833-Q837 WeakPolarHBondContact O-CG 3.48Å; Q833-Q837 PolarHBondContact O-N 2.84Å; T834-Q837 CarbonylContact O-C 3.54Å; T834-Q837 PolarHBondContact O-N 3.41Å; T834-Q837 VanDerWaalsContact O-N 3.1Å; Q837-A841 WeakPolarHBondContact O-CA 3.18Å; Q837-A841 WeakPolarHBondContact O-CB 3.41Å; Q837-A841 PolarHBondContact O-N 3.28Å
838E71.5Confident70.4Confident118 Ų11898.6 Ų98.655%0.55150%0.5SS*.Hα-helixtrans-75.1-38.7173.7-70.3163-168.200110.5T834 A842T834-E838 WeakPolarHBondContact O-CA 3.39Å; T834-E838 WeakPolarHBondContact O-CB 3.14Å; T834-E838 WeakPolarHBondContact O-CG 3.17Å; T834-E838 PolarHBondContact O-N 2.98Å; E838-A842 WeakPolarHBondContact O-CA 3.17Å; E838-A842 WeakPolarHBondContact O-CB 3.04Å; E838-A842 PolarHBondContact O-N 2.63Å
839S69.4Low70.3Confident39 Ų3998.1 Ų98.127%0.27350%0.501SS..Hα-helixtrans-74.7-29.6171.1-172.30000111.7H835 K843H835-S839 WeakPolarHBondContact O-CA 3.05Å; H835-S839 WeakPolarHBondContact O-CB 3.45Å; H835-S839 PolarHBondContact O-N 3.4Å; S839-K843 WeakPolarHBondContact O-CA 3.05Å; S839-K843 WeakPolarHBondContact O-CB 3.21Å; S839-K843 WeakPolarHBondContact O-CD 3.43Å; S839-K843 WeakPolarHBondContact O-CG 3.15Å; S839-K843 PolarHBondContact O-N 3.35Å
840A71.2Confident70.4Confident47 Ų4797.8 Ų97.839%0.38850%0.501SS..Hα-helixtrans-76.2-32.617000000112.1H836 A844H836-A840 WeakPolarHBondContact O-CA 3.49Å; H836-A840 WeakPolarHBondContact O-CB 3.44Å; H836-A840 PolarHBondContact O-N 2.92Å; A840-A844 WeakPolarHBondContact O-CA 3.22Å; A840-A844 WeakPolarHBondContact O-CB 3.2Å; A840-A844 PolarHBondContact O-N 3.32Å
841A70.8Confident70.5Confident50 Ų5098 Ų9841%0.41350%0.502SS..Hα-helixtrans-74.5-42.1173.900000110.6Q837 K843 A844 E845Q837-A841 WeakPolarHBondContact O-CA 3.18Å; Q837-A841 WeakPolarHBondContact O-CB 3.41Å; Q837-A841 PolarHBondContact O-N 3.28Å; A841-K843 VanDerWaalsContact C-N 3.33Å; A841-A844 CarbonylContact O-C 3.53Å; A841-A844 PolarHBondContact O-N 2.72Å; A841-E845 VanDerWaalsContact O-CB 3.27Å; A841-E845 WeakPolarHBondContact O-CB 3.18Å; A841-E845 WeakPolarHBondContact O-CG 3.09Å; A841-E845 PolarHBondContact O-N 2.74Å
842A69.4Low70.6Confident58 Ų5895.7 Ų95.748%0.47949%0.491SS..Hα-helixtrans-69.8-28.6171.800000112E838 L846E838-A842 WeakPolarHBondContact O-CA 3.17Å; E838-A842 WeakPolarHBondContact O-CB 3.04Å; E838-A842 PolarHBondContact O-N 2.63Å; A842-L846 WeakPolarHBondContact O-CA 2.94Å; A842-L846 WeakPolarHBondContact O-CB 3.42Å; A842-L846 PolarHBondContact O-N 2.69Å
843K67.1Low70.3Confident119 Ų11992.6 Ų92.652%0.51749%0.486SS..Hα-helixtrans-73.5-38.2166.9-79.7168.3-174.5173.30112.2S839 A841 L846 E847S839-K843 WeakPolarHBondContact O-CA 3.05Å; S839-K843 WeakPolarHBondContact O-CB 3.21Å; S839-K843 WeakPolarHBondContact O-CD 3.43Å; S839-K843 WeakPolarHBondContact O-CG 3.15Å; S839-K843 PolarHBondContact O-N 3.35Å; A841-K843 VanDerWaalsContact C-N 3.33Å; K843-L846 CarbonylContact O-C 3.57Å; K843-L846 PolarHBondContact O-N 3.49Å; K843-E847 WeakPolarHBondContact O-CA 3.25Å; K843-E847 WeakPolarHBondContact O-CB 3.33Å; K843-E847 WeakPolarHBondContact O-CG 3.04Å; K843-E847 PolarHBondContact O-N 2.72Å
844A70.9Confident70.3Confident52 Ų5291.1 Ų91.143%0.4348%0.479SS..Hα-helixtrans-73.4-29.4176.300000111.7A840 A841 K848A840-A844 WeakPolarHBondContact O-CA 3.22Å; A840-A844 WeakPolarHBondContact O-CB 3.2Å; A840-A844 PolarHBondContact O-N 3.32Å; A841-A844 CarbonylContact O-C 3.53Å; A841-A844 PolarHBondContact O-N 2.72Å; A844-K848 WeakPolarHBondContact O-CA 3.49Å; A844-K848 WeakPolarHBondContact O-CB 3.37Å; A844-K848 PolarHBondContact O-N 2.74Å
845E70.3Confident70.3Confident131 Ų13192.2 Ų92.261%0.61249%0.486SS*.Hα-helixtrans-76.5-36.3168.9-75.6-164.214300111A841 K848 V849A841-E845 VanDerWaalsContact O-CB 3.27Å; A841-E845 WeakPolarHBondContact O-CB 3.18Å; A841-E845 WeakPolarHBondContact O-CG 3.09Å; A841-E845 PolarHBondContact O-N 2.74Å; E845-K848 CarbonylContact O-C 3.56Å; E845-V849 WeakPolarHBondContact O-CA 3.2Å; E845-V849 WeakPolarHBondContact O-CB 3.46Å; E845-V849 WeakPolarHBondContact O-CG2 2.99Å; E845-V849 PolarHBondContact O-N 2.84Å
846L69.1Low70.4Confident100 Ų10091.6 Ų91.652%0.52448%0.483SS..Hα-helixtrans-69-38.4171.1-177.264.1000111.5A842 K843 V849 L850A842-L846 WeakPolarHBondContact O-CA 2.94Å; A842-L846 WeakPolarHBondContact O-CB 3.42Å; A842-L846 PolarHBondContact O-N 2.69Å; K843-L846 CarbonylContact O-C 3.57Å; K843-L846 PolarHBondContact O-N 3.49Å; L846-V849 CarbonylContact O-C 3.59Å; L846-V849 PolarHBondContact O-N 2.89Å; L846-L850 HydrophobicContact CD1-CD1 4.44Å; L846-L850 HydrophobicContact CD1-CG 4.46Å; L846-L850 HydrophobicContact CG-CD1 4.04Å; L846-L850 HydrophobicContact CG-CG 4.48Å; L846-L850 WeakPolarHBondContact O-CB 3.48Å; L846-L850 WeakPolarHBondContact O-CD1 3.47Å; L846-L850 WeakPolarHBondContact O-CG 3.1Å; L846-L850 PolarHBondContact O-N 2.74Å
847E70.9Confident70Confident121 Ų12190.5 Ų90.557%0.56548%0.478SS*.Hα-helixtrans-70.7-38.2174.3-77.2170.9166.100110.2K843 L850 E851K843-E847 WeakPolarHBondContact O-CA 3.25Å; K843-E847 WeakPolarHBondContact O-CB 3.33Å; K843-E847 WeakPolarHBondContact O-CG 3.04Å; K843-E847 PolarHBondContact O-N 2.72Å; E847-L850 CarbonylContact O-C 3.58Å; E847-L850 PolarHBondContact O-N 2.65Å; E847-E851 VanDerWaalsContact O-CB 3.27Å; E847-E851 WeakPolarHBondContact O-CB 3.45Å; E847-E851 VanDerWaalsContact O-CG 3.3Å; E847-E851 WeakPolarHBondContact O-CG 3.46Å; E847-E851 PolarHBondContact O-N 3.25Å
848K70.8Confident70.1Confident124 Ų12490.7 Ų90.754%0.53947%0.473SS..Hα-helixtrans-70.8-30.4170.7-179.9179.3177.3-174.40112.8A844 E845 N852A844-K848 WeakPolarHBondContact O-CA 3.49Å; A844-K848 WeakPolarHBondContact O-CB 3.37Å; A844-K848 PolarHBondContact O-N 2.74Å; E845-K848 CarbonylContact O-C 3.56Å; K848-N852 WeakPolarHBondContact O-CB 3.3Å; K848-N852 PolarHBondContact O-N 3.37Å; K848-N852 PolarHBondContact O-ND2 2.72Å
849V71.9Confident70.3Confident72 Ų7290 Ų9044%0.43647%0.473SS..Hα-helixtrans-76.9-32.2171.8165.20000110.3E845 L846 N853E845-V849 WeakPolarHBondContact O-CA 3.2Å; E845-V849 WeakPolarHBondContact O-CB 3.46Å; E845-V849 WeakPolarHBondContact O-CG2 2.99Å; E845-V849 PolarHBondContact O-N 2.84Å; L846-V849 CarbonylContact O-C 3.59Å; L846-V849 PolarHBondContact O-N 2.89Å; V849-N853 WeakPolarHBondContact O-CB 3.13Å; V849-N853 PolarHBondContact O-N 3.44Å; V849-N853 PolarHBondContact O-ND2 3.1Å
850L71.3Confident70.4Confident87 Ų8793.4 Ų93.446%0.45549%0.488SS..Hα-helixtrans-75.1-34.3171.3-75.5167.5000111.3L846 E847 N853 Q854L846-L850 HydrophobicContact CD1-CD1 4.44Å; L846-L850 HydrophobicContact CD1-CG 4.46Å; L846-L850 HydrophobicContact CG-CD1 4.04Å; L846-L850 HydrophobicContact CG-CG 4.48Å; L846-L850 WeakPolarHBondContact O-CB 3.48Å; L846-L850 WeakPolarHBondContact O-CD1 3.47Å; L846-L850 WeakPolarHBondContact O-CG 3.1Å; L846-L850 PolarHBondContact O-N 2.74Å; E847-L850 CarbonylContact O-C 3.58Å; E847-L850 PolarHBondContact O-N 2.65Å; L850-N853 PolarHBondContact O-N 3.34Å; L850-Q854 WeakPolarHBondContact O-CB 3.26Å; L850-Q854 WeakPolarHBondContact O-CG 3.31Å; L850-Q854 PolarHBondContact O-N 3.05Å
851E72.1Confident70.5Confident124 Ų12495.7 Ų95.758%0.57949%0.493SS*.Hα-helixtrans-69.3-43.5170.1-80.2-173.4150.400109.9E847 N853 Q854 T855E847-E851 VanDerWaalsContact O-CB 3.27Å; E847-E851 WeakPolarHBondContact O-CB 3.45Å; E847-E851 VanDerWaalsContact O-CG 3.3Å; E847-E851 WeakPolarHBondContact O-CG 3.46Å; E847-E851 PolarHBondContact O-N 3.25Å; E851-N853 VanDerWaalsContact C-N 3.35Å; E851-Q854 CarbonylContact O-C 3.59Å; E851-Q854 PolarHBondContact O-N 3.24Å; E851-T855 WeakPolarHBondContact O-CG2 3.38Å; E851-T855 PolarHBondContact O-N 3.45Å; E851-T855 PolarHBondContact O-OG1 3.14Å
852N72.5Confident70.4Confident79 Ų7995.9 Ų95.942%0.42249%0.491SS..Hα-helixtrans-65-36172.6-75.8-20.2000112.2K848 T855 Q856K848-N852 WeakPolarHBondContact O-CB 3.3Å; K848-N852 PolarHBondContact O-N 3.37Å; K848-N852 PolarHBondContact O-ND2 2.72Å; N852-T855 WeakPolarHBondContact CA-OG1 3.39Å; N852-T855 PolarHBondContact O-OG1 3Å; N852-T855 VanDerWaalsContact O-OG1 3.08Å; N852-Q856 WeakPolarHBondContact O-CB 3.49Å; N852-Q856 WeakPolarHBondContact O-CG 3.13Å; N852-Q856 PolarHBondContact O-N 3.03Å
853N66.8Low70.8Confident86 Ų8699.7 Ų99.746%0.4649%0.493SS..Hα-helixtrans-72-33.6172.1-88.5-90.5000110.7V849 L850 E851 Q856 E857V849-N853 WeakPolarHBondContact O-CB 3.13Å; V849-N853 PolarHBondContact O-N 3.44Å; V849-N853 PolarHBondContact O-ND2 3.1Å; L850-N853 PolarHBondContact O-N 3.34Å; E851-N853 VanDerWaalsContact C-N 3.35Å; N853-Q856 CarbonylContact O-C 3.57Å; N853-E857 WeakPolarHBondContact O-CA 3.44Å; N853-E857 WeakPolarHBondContact O-CB 3.48Å; N853-E857 PolarHBondContact O-N 3.47Å
854Q68.5Low71.1Confident78 Ų7897.9 Ų97.936%0.36449%0.488SS..Hα-helixtrans-77.8-26174.8-75.51733000112.6L850 E851 R858L850-Q854 WeakPolarHBondContact O-CB 3.26Å; L850-Q854 WeakPolarHBondContact O-CG 3.31Å; L850-Q854 PolarHBondContact O-N 3.05Å; E851-Q854 CarbonylContact O-C 3.59Å; E851-Q854 PolarHBondContact O-N 3.24Å; Q854-R858 VanDerWaalsContact CB-NH1 3.34Å; Q854-R858 VanDerWaalsContact O-CB 3.22Å; Q854-R858 WeakPolarHBondContact O-CB 3.13Å; Q854-R858 VanDerWaalsContact O-CD 3.29Å; Q854-R858 WeakPolarHBondContact O-CD 3.21Å; Q854-R858 WeakPolarHBondContact O-CG 3.08Å; Q854-R858 PolarHBondContact O-N 3.04Å; Q854-R858 PolarHBondContact O-NH1 2.68Å
855T71.1Confident71.4Confident58 Ų5898.3 Ų98.336%0.35649%0.488SS..Hα-helixtrans-75.5-45.2167.655.10000108.8E851 N852 E857 R858 D859E851-T855 WeakPolarHBondContact O-CG2 3.38Å; E851-T855 PolarHBondContact O-N 3.45Å; E851-T855 PolarHBondContact O-OG1 3.14Å; N852-T855 WeakPolarHBondContact CA-OG1 3.39Å; N852-T855 PolarHBondContact O-OG1 3Å; N852-T855 VanDerWaalsContact O-OG1 3.08Å; T855-E857 VanDerWaalsContact C-N 3.25Å; T855-E857 PolarHBondContact O-N 3.27Å; T855-R858 CarbonylContact O-C 3.56Å; T855-R858 PolarHBondContact O-N 3.32Å; T855-R858 VanDerWaalsContact O-N 3.1Å; T855-D859 VanDerWaalsContact O-CB 3.23Å; T855-D859 WeakPolarHBondContact O-CB 3.14Å; T855-D859 PolarHBondContact O-N 2.82Å
856Q70Confident71.6Confident111 Ų11195.7 Ų95.752%0.51948%0.476SS..Hα-helixtrans-59-34.8169.9-74174.33.200112.6N852 N853 D859 L860N852-Q856 WeakPolarHBondContact O-CB 3.49Å; N852-Q856 WeakPolarHBondContact O-CG 3.13Å; N852-Q856 PolarHBondContact O-N 3.03Å; N853-Q856 CarbonylContact O-C 3.57Å; Q856-D859 PolarHBondContact O-N 3.02Å; Q856-L860 WeakPolarHBondContact O-CB 3.5Å; Q856-L860 WeakPolarHBondContact O-CD1 3.17Å; Q856-L860 WeakPolarHBondContact O-CG 3.22Å; Q856-L860 PolarHBondContact O-N 3.18Å
857E64.5Low71.8Confident117 Ų11795.2 Ų95.255%0.54747%0.474SS..Hα-helixtrans-75.3-36.2174.9-173.7175.5-139.200111N853 T855 L861N853-E857 WeakPolarHBondContact O-CA 3.44Å; N853-E857 WeakPolarHBondContact O-CB 3.48Å; N853-E857 PolarHBondContact O-N 3.47Å; T855-E857 VanDerWaalsContact C-N 3.25Å; T855-E857 PolarHBondContact O-N 3.27Å; E857-L861 HydrophobicContact CG-CD1 4.07Å; E857-L861 HydrophobicContact CG-CG 4.48Å; E857-L861 WeakPolarHBondContact O-CA 3.36Å; E857-L861 WeakPolarHBondContact O-CB 3.18Å; E857-L861 WeakPolarHBondContact O-CD1 3.47Å; E857-L861 WeakPolarHBondContact O-CG 3.06Å; E857-L861 PolarHBondContact O-N 3.4Å
858R72.9Confident71.8Confident133 Ų13395 Ų9550%0.50247%0.473SS..Hα-helixtrans-68.7-31.8169.4-74.8164.1-162120.46.6112.7Q854 T855 S862Q854-R858 VanDerWaalsContact CB-NH1 3.34Å; Q854-R858 VanDerWaalsContact O-CB 3.22Å; Q854-R858 WeakPolarHBondContact O-CB 3.13Å; Q854-R858 VanDerWaalsContact O-CD 3.29Å; Q854-R858 WeakPolarHBondContact O-CD 3.21Å; Q854-R858 WeakPolarHBondContact O-CG 3.08Å; Q854-R858 PolarHBondContact O-N 3.04Å; Q854-R858 PolarHBondContact O-NH1 2.68Å; T855-R858 CarbonylContact O-C 3.56Å; T855-R858 PolarHBondContact O-N 3.32Å; T855-R858 VanDerWaalsContact O-N 3.1Å; R858-S862 WeakPolarHBondContact O-CA 3.2Å; R858-S862 WeakPolarHBondContact O-CB 3.48Å; R858-S862 PolarHBondContact O-N 2.78Å
859D74Confident72Confident104 Ų10494.2 Ų94.256%0.55647%0.471SS*.Hα-helixtrans-79.6-35.7178.1-66.1-23.4000109.8T855 Q856 R863T855-D859 VanDerWaalsContact O-CB 3.23Å; T855-D859 WeakPolarHBondContact O-CB 3.14Å; T855-D859 PolarHBondContact O-N 2.82Å; Q856-D859 PolarHBondContact O-N 3.02Å; D859-R863 WeakPolarHBondContact O-CB 3.07Å; D859-R863 PolarHBondContact O-N 3.46Å
860L72.6Confident72.2Confident110 Ų11093.6 Ų93.658%0.57646%0.463SS*.Hα-helixtrans-72.5-35169.4-74.4167.9000111.4Q856 R863 I864Q856-L860 WeakPolarHBondContact O-CB 3.5Å; Q856-L860 WeakPolarHBondContact O-CD1 3.17Å; Q856-L860 WeakPolarHBondContact O-CG 3.22Å; Q856-L860 PolarHBondContact O-N 3.18Å; L860-R863 CarbonylContact O-C 3.6Å; L860-R863 PolarHBondContact O-N 3.26Å; L860-I864 VanDerWaalsContact O-CB 3.24Å; L860-I864 WeakPolarHBondContact O-CB 3.43Å; L860-I864 WeakPolarHBondContact O-CD1 3.13Å; L860-I864 WeakPolarHBondContact O-CG1 3.13Å; L860-I864 PolarHBondContact O-N 3.06Å
861L72.6Confident72.5Confident95 Ų9592.9 Ų92.950%0.49746%0.462SS..Hα-helixtrans-72.2-37.5171.5-75.3168000111.2E857 R863 I864 S865E857-L861 HydrophobicContact CG-CD1 4.07Å; E857-L861 HydrophobicContact CG-CG 4.48Å; E857-L861 WeakPolarHBondContact O-CA 3.36Å; E857-L861 WeakPolarHBondContact O-CB 3.18Å; E857-L861 WeakPolarHBondContact O-CD1 3.47Å; E857-L861 WeakPolarHBondContact O-CG 3.06Å; E857-L861 PolarHBondContact O-N 3.4Å; L861-R863 VanDerWaalsContact C-N 3.34Å; L861-I864 CarbonylContact O-C 3.55Å; L861-I864 PolarHBondContact O-N 3.43Å; L861-S865 WeakPolarHBondContact O-CB 3.47Å; L861-S865 PolarHBondContact O-N 3.25Å; L861-S865 PolarHBondContact O-OG 3.48Å
862S69.8Low72.6Confident54 Ų5490.1 Ų90.138%0.37846%0.457SS..Hα-helixtrans-60.8-46.1167.7-175.60000109.4R858 I864 S865 E866R858-S862 WeakPolarHBondContact O-CA 3.2Å; R858-S862 WeakPolarHBondContact O-CB 3.48Å; R858-S862 PolarHBondContact O-N 2.78Å; S862-I864 VanDerWaalsContact C-N 3.33Å; S862-I864 PolarHBondContact O-N 3.19Å; S862-S865 CarbonylContact O-C 3.57Å; S862-S865 WeakPolarHBondContact O-CA 3.12Å; S862-S865 WeakPolarHBondContact O-CB 2.88Å; S862-S865 PolarHBondContact O-N 3.04Å; S862-S865 VanDerWaalsContact O-N 3.08Å; S862-E866 WeakPolarHBondContact O-CB 3.12Å; S862-E866 VanDerWaalsContact O-CG 3.26Å; S862-E866 WeakPolarHBondContact O-CG 3.47Å; S862-E866 PolarHBondContact O-N 2.84Å; S862-E866 PolarHBondContact OG-OE1 2.66Å
863R76.8Confident72.8Confident139 Ų13993 Ų9353%0.52546%0.461SS..Hα-helixtrans-67.4-33.8178.5-16855.3166.2-173.6-2.8112.5D859 L860 L861 E866 L867D859-R863 WeakPolarHBondContact O-CB 3.07Å; D859-R863 PolarHBondContact O-N 3.46Å; L860-R863 CarbonylContact O-C 3.6Å; L860-R863 PolarHBondContact O-N 3.26Å; L861-R863 VanDerWaalsContact C-N 3.34Å; R863-E866 WeakPolarHBondContact CD-OE2 3.41Å; R863-E866 IonicContact CZ-OE2 2.9Å; R863-E866 IonicContact NE-OE2 3.21Å; R863-E866 IonicContact NH1-OE2 3.38Å; R863-E866 PolarHBondContact NH1-OE2 2.68Å; R863-L867 HydrophobicContact CG-CD1 4.17Å; R863-L867 WeakPolarHBondContact O-CB 3.45Å; R863-L867 WeakPolarHBondContact O-CD1 3.42Å; R863-L867 WeakPolarHBondContact O-CG 3.09Å; R863-L867 PolarHBondContact O-N 2.65Å
864I74.3Confident73.2Confident81 Ų8196 Ų9642%0.41547%0.467SS..Hα-helixtrans-69.6-37.5170.9-74.5162.1000110L860 L861 S862 L867 Q868L860-I864 VanDerWaalsContact O-CB 3.24Å; L860-I864 WeakPolarHBondContact O-CB 3.43Å; L860-I864 WeakPolarHBondContact O-CD1 3.13Å; L860-I864 WeakPolarHBondContact O-CG1 3.13Å; L860-I864 PolarHBondContact O-N 3.06Å; L861-I864 CarbonylContact O-C 3.55Å; L861-I864 PolarHBondContact O-N 3.43Å; S862-I864 VanDerWaalsContact C-N 3.33Å; S862-I864 PolarHBondContact O-N 3.19Å; I864-L867 CarbonylContact O-C 3.49Å; I864-L867 PolarHBondContact O-N 2.71Å; I864-Q868 HydrophobicContact CG2-CG 4.33Å; I864-Q868 WeakPolarHBondContact O-CB 3.13Å; I864-Q868 WeakPolarHBondContact O-CG 3.47Å; I864-Q868 PolarHBondContact O-N 3.4Å
865S76.1Confident73.5Confident61 Ų6198.8 Ų98.843%0.42748%0.477SS..Hα-helixtrans-69-39.4173.3-67.40000112.2L861 S862 Q868 E869L861-S865 WeakPolarHBondContact O-CB 3.47Å; L861-S865 PolarHBondContact O-N 3.25Å; L861-S865 PolarHBondContact O-OG 3.48Å; S862-S865 CarbonylContact O-C 3.57Å; S862-S865 WeakPolarHBondContact O-CA 3.12Å; S862-S865 WeakPolarHBondContact O-CB 2.88Å; S862-S865 PolarHBondContact O-N 3.04Å; S862-S865 VanDerWaalsContact O-N 3.08Å; S865-Q868 CarbonylContact O-C 3.59Å; S865-Q868 PolarHBondContact O-N 2.71Å; S865-E869 VanDerWaalsContact O-CB 3.29Å; S865-E869 WeakPolarHBondContact O-CB 3.4Å; S865-E869 PolarHBondContact O-N 2.9Å
866E75.1Confident73.5Confident75 Ų7598.8 Ų98.835%0.3548%0.48SS..Hα-helixtrans-64.5-39.9171.5-72.9159.7-135.800111.1S862 R863 E870S862-E866 WeakPolarHBondContact O-CB 3.12Å; S862-E866 VanDerWaalsContact O-CG 3.26Å; S862-E866 WeakPolarHBondContact O-CG 3.47Å; S862-E866 PolarHBondContact O-N 2.84Å; S862-E866 PolarHBondContact OG-OE1 2.66Å; R863-E866 WeakPolarHBondContact CD-OE2 3.41Å; R863-E866 IonicContact CZ-OE2 2.9Å; R863-E866 IonicContact NE-OE2 3.21Å; R863-E866 IonicContact NH1-OE2 3.38Å; R863-E866 PolarHBondContact NH1-OE2 2.68Å; E866-E870 WeakPolarHBondContact O-CB 3.38Å; E866-E870 PolarHBondContact O-N 2.77Å
867L73.4Confident73.9Confident91 Ų9198.4 Ų98.448%0.47648%0.478SS..Hα-helixtrans-75.2-30.4175.5-73.1168.8000111.9R863 I864 V871R863-L867 HydrophobicContact CG-CD1 4.17Å; R863-L867 WeakPolarHBondContact O-CB 3.45Å; R863-L867 WeakPolarHBondContact O-CD1 3.42Å; R863-L867 WeakPolarHBondContact O-CG 3.09Å; R863-L867 PolarHBondContact O-N 2.65Å; I864-L867 CarbonylContact O-C 3.49Å; I864-L867 PolarHBondContact O-N 2.71Å; L867-V871 WeakPolarHBondContact O-CB 3.43Å; L867-V871 WeakPolarHBondContact O-CG2 3.18Å; L867-V871 PolarHBondContact O-N 3.23Å
868Q71.3Confident74.6Confident117 Ų11797.3 Ų97.355%0.54748%0.475SS..Hα-helixtrans-73.4-36170.5-78173.26.700111.3I864 S865 V871 S872I864-Q868 HydrophobicContact CG2-CG 4.33Å; I864-Q868 WeakPolarHBondContact O-CB 3.13Å; I864-Q868 WeakPolarHBondContact O-CG 3.47Å; I864-Q868 PolarHBondContact O-N 3.4Å; S865-Q868 CarbonylContact O-C 3.59Å; S865-Q868 PolarHBondContact O-N 2.71Å; Q868-V871 CarbonylContact O-C 3.54Å; Q868-S872 WeakPolarHBondContact O-CB 3.4Å; Q868-S872 PolarHBondContact O-N 3.16Å; Q868-S872 PolarHBondContact O-OG 3.45Å
869E74.1Confident74.7Confident107 Ų10793.5 Ų93.550%0.547%0.472SS..Hα-helixtrans-66.2-44.4168.8-88.7-160.5-144.900110.5S865 S872 R873S865-E869 VanDerWaalsContact O-CB 3.29Å; S865-E869 WeakPolarHBondContact O-CB 3.4Å; S865-E869 PolarHBondContact O-N 2.9Å; E869-S872 CarbonylContact O-C 3.58Å; E869-S872 WeakPolarHBondContact O-CA 3.32Å; E869-S872 WeakPolarHBondContact O-CB 3.43Å; E869-S872 PolarHBondContact O-N 3.46Å; E869-R873 WeakPolarHBondContact O-CB 3.35Å; E869-R873 WeakPolarHBondContact O-CG 3.02Å; E869-R873 PolarHBondContact O-N 3.4Å; E869-R873 IonicContact OE2-CZ 3.88Å; E869-R873 IonicContact OE2-NE 3.27Å; E869-R873 IonicContact OE2-NH2 2.78Å; E869-R873 PolarHBondContact OE2-NH2 2.97Å
870E77.3Confident74.6Confident59 Ų5993.6 Ų93.628%0.27647%0.469SS..Hα-helixtrans-65.7-39176.2178.961-170.200111.2E866 S872 R873 R874E866-E870 WeakPolarHBondContact O-CB 3.38Å; E866-E870 PolarHBondContact O-N 2.77Å; E870-S872 VanDerWaalsContact C-N 3.28Å; E870-S872 PolarHBondContact O-N 3.47Å; E870-R873 PolarHBondContact O-N 3.09Å; E870-R874 VanDerWaalsContact O-CB 3.26Å; E870-R874 WeakPolarHBondContact O-CB 3.48Å; E870-R874 WeakPolarHBondContact O-CG 3.37Å; E870-R874 PolarHBondContact O-N 2.8Å; E870-R874 IonicContact OE1-CZ 2.7Å; E870-R874 IonicContact OE1-NE 3.58Å; E870-R874 PolarHBondContact OE1-NE 2.65Å; E870-R874 IonicContact OE1-NH2 3.53Å; E870-R874 PolarHBondContact OE1-NH2 2.77Å
871V76.9Confident74.7Confident71 Ų7191.6 Ų91.643%0.4346%0.458SS..Hα-helixtrans-65.6-30.7168.4164.60000111.4L867 Q868 K875L867-V871 WeakPolarHBondContact O-CB 3.43Å; L867-V871 WeakPolarHBondContact O-CG2 3.18Å; L867-V871 PolarHBondContact O-N 3.23Å; Q868-V871 CarbonylContact O-C 3.54Å; V871-K875 HydrophobicContact CG1-CD 4.07Å; V871-K875 HydrophobicContact CG1-CG 4.47Å; V871-K875 VanDerWaalsContact O-CB 3.26Å; V871-K875 WeakPolarHBondContact O-CB 3.41Å; V871-K875 WeakPolarHBondContact O-CG 3.35Å; V871-K875 PolarHBondContact O-N 3.17Å
872S74.2Confident74.9Confident67 Ų6791.1 Ų91.147%0.46946%0.456SS..Hα-helixtrans-79.5-33.6176.6-61.40000112.6Q868 E869 E870 K875 S876Q868-S872 WeakPolarHBondContact O-CB 3.4Å; Q868-S872 PolarHBondContact O-N 3.16Å; Q868-S872 PolarHBondContact O-OG 3.45Å; E869-S872 CarbonylContact O-C 3.58Å; E869-S872 WeakPolarHBondContact O-CA 3.32Å; E869-S872 WeakPolarHBondContact O-CB 3.43Å; E869-S872 PolarHBondContact O-N 3.46Å; E870-S872 VanDerWaalsContact C-N 3.28Å; E870-S872 PolarHBondContact O-N 3.47Å; S872-K875 PolarHBondContact O-N 3.46Å; S872-S876 WeakPolarHBondContact O-CB 3.25Å; S872-S876 PolarHBondContact O-N 3.11Å
873R77.3Confident75.2Confident138 Ų13894.8 Ų94.852%0.52147%0.468SS..Hα-helixtrans-67.8-42169.8-68.3164.6-1631771.3109.6E869 E870 S876 H877E869-R873 WeakPolarHBondContact O-CB 3.35Å; E869-R873 WeakPolarHBondContact O-CG 3.02Å; E869-R873 PolarHBondContact O-N 3.4Å; E869-R873 IonicContact OE2-CZ 3.88Å; E869-R873 IonicContact OE2-NE 3.27Å; E869-R873 IonicContact OE2-NH2 2.78Å; E869-R873 PolarHBondContact OE2-NH2 2.97Å; E870-R873 PolarHBondContact O-N 3.09Å; R873-S876 CarbonylContact O-C 3.53Å; R873-S876 PolarHBondContact O-N 3.44Å; R873-H877 VanDerWaalsContact O-CB 3.27Å; R873-H877 WeakPolarHBondContact O-CB 3.33Å; R873-H877 PolarHBondContact O-N 3.37Å
874R75.5Confident75.2Confident151 Ų15193.2 Ų93.257%0.5747%0.466SS*.Hα-helixtrans-67.7-38.6171.5-72.4175.4-167.5-140.2-0.8112.6E870 H877 I878E870-R874 VanDerWaalsContact O-CB 3.26Å; E870-R874 WeakPolarHBondContact O-CB 3.48Å; E870-R874 WeakPolarHBondContact O-CG 3.37Å; E870-R874 PolarHBondContact O-N 2.8Å; E870-R874 IonicContact OE1-CZ 2.7Å; E870-R874 IonicContact OE1-NE 3.58Å; E870-R874 PolarHBondContact OE1-NE 2.65Å; E870-R874 IonicContact OE1-NH2 3.53Å; E870-R874 PolarHBondContact OE1-NH2 2.77Å; R874-H877 PolarHBondContact O-N 3.41Å; R874-I878 WeakPolarHBondContact O-CB 3Å; R874-I878 WeakPolarHBondContact O-CD1 3.45Å; R874-I878 WeakPolarHBondContact O-CG1 3.16Å; R874-I878 PolarHBondContact O-N 2.72Å
875K74.4Confident75.3Confident135 Ų13593.4 Ų93.459%0.58747%0.467SS*.Hα-helixtrans-65.9-36.8170.6-79169.5179.9178.50112V871 S872 A879V871-K875 HydrophobicContact CG1-CD 4.07Å; V871-K875 HydrophobicContact CG1-CG 4.47Å; V871-K875 VanDerWaalsContact O-CB 3.26Å; V871-K875 WeakPolarHBondContact O-CB 3.41Å; V871-K875 WeakPolarHBondContact O-CG 3.35Å; V871-K875 PolarHBondContact O-N 3.17Å; S872-K875 PolarHBondContact O-N 3.46Å; K875-A879 VanDerWaalsContact O-CB 3.25Å; K875-A879 WeakPolarHBondContact O-CB 3.37Å; K875-A879 PolarHBondContact O-N 3.38Å
876S70.7Confident75.4Confident59 Ų5996.1 Ų96.141%0.41347%0.473SS..Hα-helixtrans-69.2-37.3173.9-174.90000111.3S872 R873 A879 Q880S872-S876 WeakPolarHBondContact O-CB 3.25Å; S872-S876 PolarHBondContact O-N 3.11Å; R873-S876 CarbonylContact O-C 3.53Å; R873-S876 PolarHBondContact O-N 3.44Å; S876-A879 CarbonylContact O-C 3.51Å; S876-A879 PolarHBondContact O-N 2.93Å; S876-Q880 WeakPolarHBondContact O-CB 3.08Å; S876-Q880 WeakPolarHBondContact O-CG 3.33Å; S876-Q880 PolarHBondContact O-N 3.2Å
877H79.2Confident75.4Confident102 Ų10295.2 Ų95.247%0.47247%0.472SS..Hα-helixtrans-71.5-38.9174.4-171.354000112.1R873 R874 Q880 L881R873-H877 VanDerWaalsContact O-CB 3.27Å; R873-H877 WeakPolarHBondContact O-CB 3.33Å; R873-H877 PolarHBondContact O-N 3.37Å; R874-H877 PolarHBondContact O-N 3.41Å; H877-Q880 CarbonylContact O-C 3.54Å; H877-Q880 WeakPolarHBondContact O-CB 3.03Å; H877-Q880 PolarHBondContact O-N 3.27Å; H877-L881 WeakPolarHBondContact O-CB 3.27Å; H877-L881 VanDerWaalsContact O-CG 3.26Å; H877-L881 WeakPolarHBondContact O-CG 3.45Å; H877-L881 PolarHBondContact O-N 3.23Å
878I78.4Confident75.5Confident94 Ų9495.7 Ų95.748%0.48248%0.475SS..Hα-helixtrans-62-45.1168.8-71.3162.4000109.6R874 Q880 L881 D882R874-I878 WeakPolarHBondContact O-CB 3Å; R874-I878 WeakPolarHBondContact O-CD1 3.45Å; R874-I878 WeakPolarHBondContact O-CG1 3.16Å; R874-I878 PolarHBondContact O-N 2.72Å; I878-Q880 VanDerWaalsContact C-N 3.3Å; I878-Q880 PolarHBondContact O-N 3.13Å; I878-L881 CarbonylContact O-C 3.59Å; I878-L881 WeakPolarHBondContact O-CA 3.23Å; I878-L881 WeakPolarHBondContact O-CB 3.07Å; I878-L881 PolarHBondContact O-N 2.84Å; I878-L881 VanDerWaalsContact O-N 3.09Å; I878-D882 WeakPolarHBondContact O-CB 3.11Å; I878-D882 PolarHBondContact O-N 3.49Å
879A74Confident75.7Confident54 Ų5494.5 Ų94.545%0.44647%0.472SS..Hα-helixtrans-63.9-33.2174.700000112.7K875 S876 H883K875-A879 VanDerWaalsContact O-CB 3.25Å; K875-A879 WeakPolarHBondContact O-CB 3.37Å; K875-A879 PolarHBondContact O-N 3.38Å; S876-A879 CarbonylContact O-C 3.51Å; S876-A879 PolarHBondContact O-N 2.93Å; A879-H883 VanDerWaalsContact O-CB 3.26Å; A879-H883 WeakPolarHBondContact O-CB 2.91Å; A879-H883 PolarHBondContact O-N 2.83Å
880Q72.8Confident75.8Confident105 Ų10594.9 Ų94.949%0.49147%0.474SS..Hα-helixtrans-68.8-38.6170.9-75.2165.11.800111.7S876 H877 I878 H883 Q884S876-Q880 WeakPolarHBondContact O-CB 3.08Å; S876-Q880 WeakPolarHBondContact O-CG 3.33Å; S876-Q880 PolarHBondContact O-N 3.2Å; H877-Q880 CarbonylContact O-C 3.54Å; H877-Q880 WeakPolarHBondContact O-CB 3.03Å; H877-Q880 PolarHBondContact O-N 3.27Å; I878-Q880 VanDerWaalsContact C-N 3.3Å; I878-Q880 PolarHBondContact O-N 3.13Å; Q880-H883 CarbonylContact O-C 3.6Å; Q880-H883 PolarHBondContact O-N 3.42Å; Q880-Q884 WeakPolarHBondContact O-CB 2.92Å; Q880-Q884 VanDerWaalsContact O-CG 3.28Å; Q880-Q884 WeakPolarHBondContact O-CG 3.42Å; Q880-Q884 PolarHBondContact O-N 2.65Å
881L75.6Confident75.7Confident68 Ų6896.3 Ų96.336%0.35648%0.483SS..Hα-helixtrans-68.5-38.6173.8-71.9165.9000111.1H877 I878 H883 Q884 I885H877-L881 WeakPolarHBondContact O-CB 3.27Å; H877-L881 VanDerWaalsContact O-CG 3.26Å; H877-L881 WeakPolarHBondContact O-CG 3.45Å; H877-L881 PolarHBondContact O-N 3.23Å; I878-L881 CarbonylContact O-C 3.59Å; I878-L881 WeakPolarHBondContact O-CA 3.23Å; I878-L881 WeakPolarHBondContact O-CB 3.07Å; I878-L881 PolarHBondContact O-N 2.84Å; I878-L881 VanDerWaalsContact O-N 3.09Å; L881-H883 VanDerWaalsContact C-N 3.31Å; L881-H883 PolarHBondContact O-N 2.82Å; L881-Q884 CarbonylContact O-C 3.59Å; L881-Q884 PolarHBondContact O-N 2.66Å; L881-I885 WeakPolarHBondContact O-CB 3.17Å; L881-I885 WeakPolarHBondContact O-CD1 3.18Å; L881-I885 WeakPolarHBondContact O-CG1 3.45Å; L881-I885 PolarHBondContact O-N 3.33Å
882D75Confident75.6Confident85 Ų8597.4 Ų97.446%0.45549%0.486SS..Hα-helixtrans-66.8-32.8172.3-72.3-36.2000111.5I878 H886I878-D882 WeakPolarHBondContact O-CB 3.11Å; I878-D882 PolarHBondContact O-N 3.49Å; D882-H886 WeakPolarHBondContact O-CB 3.03Å; D882-H886 PolarHBondContact O-N 3.22Å; D882-H886 PolarHBondContact O-ND1 3.35Å
883H76.2Confident75.6Confident132 Ų13296.5 Ų96.561%0.61148%0.479SS*.Hα-helixtrans-75.7-33.1173-151.361.9000112A879 Q880 L881 H886 T887A879-H883 VanDerWaalsContact O-CB 3.26Å; A879-H883 WeakPolarHBondContact O-CB 2.91Å; A879-H883 PolarHBondContact O-N 2.83Å; Q880-H883 CarbonylContact O-C 3.6Å; Q880-H883 PolarHBondContact O-N 3.42Å; L881-H883 VanDerWaalsContact C-N 3.31Å; L881-H883 PolarHBondContact O-N 2.82Å; H883-H886 PolarHBondContact O-N 2.82Å; H883-T887 WeakPolarHBondContact O-CG2 3.27Å; H883-T887 PolarHBondContact O-N 3.47Å; H883-T887 PolarHBondContact O-OG1 3.4Å; H883-T887 VanDerWaalsContact O-OG1 3.13Å
884Q78.1Confident75.5Confident105 Ų10593 Ų9349%0.49147%0.473SS..Hα-helixtrans-69.3-38168.5-75.11739.100111.4Q880 L881 H886 T887 L888Q880-Q884 WeakPolarHBondContact O-CB 2.92Å; Q880-Q884 VanDerWaalsContact O-CG 3.28Å; Q880-Q884 WeakPolarHBondContact O-CG 3.42Å; Q880-Q884 PolarHBondContact O-N 2.65Å; L881-Q884 CarbonylContact O-C 3.59Å; L881-Q884 PolarHBondContact O-N 2.66Å; Q884-H886 VanDerWaalsContact C-N 3.34Å; Q884-T887 WeakPolarHBondContact CA-OG1 3.17Å; Q884-T887 PolarHBondContact O-N 2.98Å; Q884-T887 PolarHBondContact O-OG1 2.7Å; Q884-L888 WeakPolarHBondContact O-CB 3.26Å; Q884-L888 WeakPolarHBondContact O-CD1 2.95Å; Q884-L888 WeakPolarHBondContact O-CG 3.38Å; Q884-L888 PolarHBondContact O-N 2.68Å
885I76.8Confident75.3Confident85 Ų8590.5 Ų90.544%0.43647%0.471SS..Hα-helixtrans-67.5-36.9172.2-72161.6000109.9L881 N889L881-I885 WeakPolarHBondContact O-CB 3.17Å; L881-I885 WeakPolarHBondContact O-CD1 3.18Å; L881-I885 WeakPolarHBondContact O-CG1 3.45Å; L881-I885 PolarHBondContact O-N 3.33Å; I885-N889 WeakPolarHBondContact CG2-ND2 3.39Å; I885-N889 WeakPolarHBondContact O-CB 3.16Å; I885-N889 PolarHBondContact O-N 2.71Å; I885-N889 PolarHBondContact O-ND2 3.45Å
886H76.8Confident75.2Confident119 Ų11987.4 Ų87.455%0.55146%0.464SS*.Hα-helixtrans-63.9-51.2170.6-98.774.4000112D882 H883 Q884 L888 N889 E890D882-H886 WeakPolarHBondContact O-CB 3.03Å; D882-H886 PolarHBondContact O-N 3.22Å; D882-H886 PolarHBondContact O-ND1 3.35Å; H883-H886 PolarHBondContact O-N 2.82Å; Q884-H886 VanDerWaalsContact C-N 3.34Å; H886-L888 VanDerWaalsContact C-N 3.29Å; H886-L888 PolarHBondContact O-N 2.78Å; H886-N889 CarbonylContact O-C 3.58Å; H886-N889 PolarHBondContact O-N 3.17Å; H886-N889 VanDerWaalsContact O-N 3.1Å; H886-E890 WeakPolarHBondContact O-CB 3.36Å; H886-E890 WeakPolarHBondContact O-CG 3.31Å; H886-E890 PolarHBondContact O-N 2.92Å
887T76.3Confident75.4Confident56 Ų5690 Ų9034%0.34447%0.468SS..Hα-helixtrans-68-29.2179.154.90000112.4H883 Q884 N891H883-T887 WeakPolarHBondContact O-CG2 3.27Å; H883-T887 PolarHBondContact O-N 3.47Å; H883-T887 PolarHBondContact O-OG1 3.4Å; H883-T887 VanDerWaalsContact O-OG1 3.13Å; Q884-T887 WeakPolarHBondContact CA-OG1 3.17Å; Q884-T887 PolarHBondContact O-N 2.98Å; Q884-T887 PolarHBondContact O-OG1 2.7Å; T887-N891 VanDerWaalsContact O-CB 3.25Å; T887-N891 WeakPolarHBondContact O-CB 3.49Å; T887-N891 PolarHBondContact O-N 2.74Å; T887-N891 PolarHBondContact O-ND2 3.4Å; T887-N891 VanDerWaalsContact O-ND2 3.09Å
888L75Confident75.3Confident100 Ų10090.5 Ų90.552%0.52447%0.47SS..Hα-helixtrans-69.6-38.1168.8-74.2168.4000112Q884 H886 N891 I892Q884-L888 WeakPolarHBondContact O-CB 3.26Å; Q884-L888 WeakPolarHBondContact O-CD1 2.95Å; Q884-L888 WeakPolarHBondContact O-CG 3.38Å; Q884-L888 PolarHBondContact O-N 2.68Å; H886-L888 VanDerWaalsContact C-N 3.29Å; H886-L888 PolarHBondContact O-N 2.78Å; L888-N891 CarbonylContact O-C 3.57Å; L888-N891 PolarHBondContact O-N 3.43Å; L888-I892 WeakPolarHBondContact O-CB 3.34Å; L888-I892 WeakPolarHBondContact O-CD1 3.04Å; L888-I892 WeakPolarHBondContact O-CG1 3.45Å; L888-I892 PolarHBondContact O-N 3.49Å
889N74.6Confident75Confident92 Ų9292.2 Ų92.249%0.49248%0.48SS..Hα-helixtrans-71.2-31.6173.4-76.9-33.8000112.3I885 H886 S893I885-N889 WeakPolarHBondContact CG2-ND2 3.39Å; I885-N889 WeakPolarHBondContact O-CB 3.16Å; I885-N889 PolarHBondContact O-N 2.71Å; I885-N889 PolarHBondContact O-ND2 3.45Å; H886-N889 CarbonylContact O-C 3.58Å; H886-N889 PolarHBondContact O-N 3.17Å; H886-N889 VanDerWaalsContact O-N 3.1Å; N889-S893 VanDerWaalsContact O-CB 3.25Å; N889-S893 WeakPolarHBondContact O-CB 3.18Å; N889-S893 PolarHBondContact O-N 2.79Å
890E75.9Confident74.9Confident116 Ų11694.5 Ų94.554%0.54248%0.481SS..Hα-helixtrans-68.9-42.7169.5-73.2-178.5150.600110.6H886 S893 T894H886-E890 WeakPolarHBondContact O-CB 3.36Å; H886-E890 WeakPolarHBondContact O-CG 3.31Å; H886-E890 PolarHBondContact O-N 2.92Å; E890-S893 CarbonylContact O-C 3.58Å; E890-S893 WeakPolarHBondContact O-CA 3.19Å; E890-S893 WeakPolarHBondContact O-CB 3.22Å; E890-S893 PolarHBondContact O-N 2.69Å; E890-S893 VanDerWaalsContact O-N 3.08Å; E890-T894 PolarHBondContact O-N 3.11Å; E890-T894 PolarHBondContact O-OG1 3.36Å
891N75.8Confident75Confident88 Ų8894.7 Ų94.747%0.47149%0.485SS..Hα-helixtrans-63.5-38172.4-73-27.6000112T887 L888 S893 T894 L895T887-N891 VanDerWaalsContact O-CB 3.25Å; T887-N891 WeakPolarHBondContact O-CB 3.49Å; T887-N891 PolarHBondContact O-N 2.74Å; T887-N891 PolarHBondContact O-ND2 3.4Å; T887-N891 VanDerWaalsContact O-ND2 3.09Å; L888-N891 CarbonylContact O-C 3.57Å; L888-N891 PolarHBondContact O-N 3.43Å; N891-S893 VanDerWaalsContact C-N 3.34Å; N891-T894 WeakPolarHBondContact CA-OG1 3.18Å; N891-T894 PolarHBondContact O-OG1 3.38Å; N891-L895 WeakPolarHBondContact O-CB 3.22Å; N891-L895 WeakPolarHBondContact O-CD1 3.19Å; N891-L895 WeakPolarHBondContact O-CG 3.27Å; N891-L895 PolarHBondContact O-N 3.06Å
892I75.8Confident74.9Confident95 Ų9597.3 Ų97.349%0.48749%0.493SS..Hα-helixtrans-67.9-36.4171.1-71.5161.9000109.8L888 T896L888-I892 WeakPolarHBondContact O-CB 3.34Å; L888-I892 WeakPolarHBondContact O-CD1 3.04Å; L888-I892 WeakPolarHBondContact O-CG1 3.45Å; L888-I892 PolarHBondContact O-N 3.49Å; I892-T896 WeakPolarHBondContact O-CB 2.95Å; I892-T896 PolarHBondContact O-N 3.2Å; I892-T896 PolarHBondContact O-OG1 2.6Å
893S73.9Confident74.8Confident47 Ų4794.8 Ų94.833%0.32949%0.488SS..Hα-helixtrans-69.4-39.2176.5-167.10000112.5N889 E890 N891 K897N889-S893 VanDerWaalsContact O-CB 3.25Å; N889-S893 WeakPolarHBondContact O-CB 3.18Å; N889-S893 PolarHBondContact O-N 2.79Å; E890-S893 CarbonylContact O-C 3.58Å; E890-S893 WeakPolarHBondContact O-CA 3.19Å; E890-S893 WeakPolarHBondContact O-CB 3.22Å; E890-S893 PolarHBondContact O-N 2.69Å; E890-S893 VanDerWaalsContact O-N 3.08Å; N891-S893 VanDerWaalsContact C-N 3.34Å; S893-K897 WeakPolarHBondContact O-CB 3.08Å; S893-K897 VanDerWaalsContact O-CD 3.31Å; S893-K897 WeakPolarHBondContact O-CD 3.1Å; S893-K897 WeakPolarHBondContact O-CG 3.19Å; S893-K897 PolarHBondContact O-N 2.67Å; S893-K897 PolarHBondContact OG-NZ 3.22Å
894T73.9Confident74.7Confident64 Ų6493.9 Ų93.939%0.39348%0.482SS..Hα-helixtrans-71.1-46.5173.952.20000110.5E890 N891 T896 K897 E898E890-T894 PolarHBondContact O-N 3.11Å; E890-T894 PolarHBondContact O-OG1 3.36Å; N891-T894 WeakPolarHBondContact CA-OG1 3.18Å; N891-T894 PolarHBondContact O-OG1 3.38Å; T894-T896 VanDerWaalsContact C-N 3.26Å; T894-T896 PolarHBondContact O-N 2.75Å; T894-K897 CarbonylContact O-C 3.51Å; T894-K897 WeakPolarHBondContact O-CA 3.19Å; T894-K897 WeakPolarHBondContact O-CB 3.39Å; T894-K897 PolarHBondContact O-N 2.71Å; T894-K897 VanDerWaalsContact O-N 3.09Å; T894-E898 WeakPolarHBondContact O-CB 3.38Å; T894-E898 WeakPolarHBondContact O-CG 3Å; T894-E898 PolarHBondContact O-N 3.36Å
895L71.8Confident74.6Confident100 Ų10093 Ų9352%0.52448%0.477SS..Hα-helixtrans-59.4-35.2172.6-74.3168.1000112.3N891 E898 L899N891-L895 WeakPolarHBondContact O-CB 3.22Å; N891-L895 WeakPolarHBondContact O-CD1 3.19Å; N891-L895 WeakPolarHBondContact O-CG 3.27Å; N891-L895 PolarHBondContact O-N 3.06Å; L895-E898 PolarHBondContact O-N 3.3Å; L895-L899 WeakPolarHBondContact O-CB 2.9Å; L895-L899 PolarHBondContact O-N 3.09Å
896T72.3Confident74.4Confident70 Ų7093.3 Ų93.343%0.42948%0.483SS..Hα-helixtrans-70.2-40.4174.2-60.30000111.3I892 T894 E898 L899 E900I892-T896 WeakPolarHBondContact O-CB 2.95Å; I892-T896 PolarHBondContact O-N 3.2Å; I892-T896 PolarHBondContact O-OG1 2.6Å; T894-T896 VanDerWaalsContact C-N 3.26Å; T894-T896 PolarHBondContact O-N 2.75Å; T896-E898 VanDerWaalsContact C-N 3.32Å; T896-L899 PolarHBondContact O-N 2.99Å; T896-E900 WeakPolarHBondContact O-CB 3.27Å; T896-E900 PolarHBondContact O-N 3.02Å
897K75.9Confident74.3Confident114 Ų11492.8 Ų92.850%0.49648%0.484SS..Hα-helixtrans-65.8-34.5172.4-73.5159.2-175.4143.70111.8S893 T894 E900 L901S893-K897 WeakPolarHBondContact O-CB 3.08Å; S893-K897 VanDerWaalsContact O-CD 3.31Å; S893-K897 WeakPolarHBondContact O-CD 3.1Å; S893-K897 WeakPolarHBondContact O-CG 3.19Å; S893-K897 PolarHBondContact O-N 2.67Å; S893-K897 PolarHBondContact OG-NZ 3.22Å; T894-K897 CarbonylContact O-C 3.51Å; T894-K897 WeakPolarHBondContact O-CA 3.19Å; T894-K897 WeakPolarHBondContact O-CB 3.39Å; T894-K897 PolarHBondContact O-N 2.71Å; T894-K897 VanDerWaalsContact O-N 3.09Å; K897-E900 PolarHBondContact O-N 3.04Å; K897-L901 VanDerWaalsContact O-CB 3.32Å; K897-L901 WeakPolarHBondContact O-CB 3.45Å; K897-L901 WeakPolarHBondContact O-CG 3.09Å; K897-L901 PolarHBondContact O-N 3.25Å
898E75.8Confident74.3Confident111 Ų11195.4 Ų95.452%0.51949%0.491SS..Hα-helixtrans-70.7-38172.5-74.2179.2-173.700111.5T894 L895 T896 L901 K902T894-E898 WeakPolarHBondContact O-CB 3.38Å; T894-E898 WeakPolarHBondContact O-CG 3Å; T894-E898 PolarHBondContact O-N 3.36Å; L895-E898 PolarHBondContact O-N 3.3Å; T896-E898 VanDerWaalsContact C-N 3.32Å; E898-L901 PolarHBondContact O-N 2.98Å; E898-K902 VanDerWaalsContact O-CB 3.24Å; E898-K902 WeakPolarHBondContact O-CB 2.96Å; E898-K902 WeakPolarHBondContact O-CG 3.01Å; E898-K902 PolarHBondContact O-N 2.82Å
899L71.9Confident74.3Confident131 Ų13195.3 Ų95.369%0.68649%0.49SS*.Hα-helixtrans-65.5-37.8170.7-111.9159.3000111.9L895 T896 G903L895-L899 WeakPolarHBondContact O-CB 2.9Å; L895-L899 PolarHBondContact O-N 3.09Å; T896-L899 PolarHBondContact O-N 2.99Å; L899-G903 WeakPolarHBondContact O-CA 2.95Å; L899-G903 PolarHBondContact O-N 2.85Å
900E73Confident74.2Confident101 Ų10199 Ų9947%0.47250%0.497SS..Hα-helixtrans-65.9-42.4170.3-87.4-166.5-140.700112.2T896 K897 G903 K904T896-E900 WeakPolarHBondContact O-CB 3.27Å; T896-E900 PolarHBondContact O-N 3.02Å; K897-E900 PolarHBondContact O-N 3.04Å; E900-G903 PolarHBondContact O-N 3.43Å; E900-K904 WeakPolarHBondContact O-CB 3.16Å; E900-K904 VanDerWaalsContact O-CD 3.27Å; E900-K904 WeakPolarHBondContact O-CD 3Å; E900-K904 WeakPolarHBondContact O-CG 3.31Å; E900-K904 PolarHBondContact O-N 3.13Å; E900-K904 IonicContact OE2-NZ 3.79Å; E900-K904 PolarHBondContact OE2-NZ 3.37Å
901L74.6Confident74.2Confident109 Ų10996.2 Ų96.257%0.57149%0.49SS*.Hα-helixtrans-67.8-42.2177.7-77.1166.8000110.8K897 E898 G903 K904 E905K897-L901 VanDerWaalsContact O-CB 3.32Å; K897-L901 WeakPolarHBondContact O-CB 3.45Å; K897-L901 WeakPolarHBondContact O-CG 3.09Å; K897-L901 PolarHBondContact O-N 3.25Å; E898-L901 PolarHBondContact O-N 2.98Å; L901-G903 VanDerWaalsContact C-N 3.34Å; L901-K904 CarbonylContact O-C 3.44Å; L901-K904 PolarHBondContact O-N 2.68Å; L901-E905 VanDerWaalsContact O-CB 3.23Å; L901-E905 WeakPolarHBondContact O-CB 3.5Å; L901-E905 PolarHBondContact O-N 3.43Å
902K74.6Confident74.3Confident123 Ų12395.6 Ų95.654%0.53548%0.484SS..Hα-helixtrans-66.7-34171.8-70.5-72.8164.3-163.50111.7E898 E905 V906E898-K902 VanDerWaalsContact O-CB 3.24Å; E898-K902 WeakPolarHBondContact O-CB 2.96Å; E898-K902 WeakPolarHBondContact O-CG 3.01Å; E898-K902 PolarHBondContact O-N 2.82Å; K902-E905 WeakPolarHBondContact CD-OE2 3.29Å; K902-E905 WeakPolarHBondContact CE-OE2 3.49Å; K902-E905 IonicContact NZ-OE2 2.92Å; K902-E905 PolarHBondContact NZ-OE2 2.7Å; K902-E905 PolarHBondContact O-N 3.48Å; K902-V906 WeakPolarHBondContact O-CB 3.39Å; K902-V906 VanDerWaalsContact O-CG2 3.26Å; K902-V906 WeakPolarHBondContact O-CG2 3.46Å; K902-V906 PolarHBondContact O-N 3.48Å
903G72.9Confident74.2Confident33 Ų3392.8 Ų92.834%0.3448%0.475SS..Hα-helixtrans-64.9-44.4170.500000112.2L899 E900 L901 E905 V906 L907L899-G903 WeakPolarHBondContact O-CA 2.95Å; L899-G903 PolarHBondContact O-N 2.85Å; E900-G903 PolarHBondContact O-N 3.43Å; L901-G903 VanDerWaalsContact C-N 3.34Å; G903-E905 VanDerWaalsContact C-N 3.33Å; G903-V906 PolarHBondContact O-N 3.23Å; G903-L907 WeakPolarHBondContact O-CB 3.39Å; G903-L907 VanDerWaalsContact O-CG 3.27Å; G903-L907 WeakPolarHBondContact O-CG 3.16Å; G903-L907 PolarHBondContact O-N 2.9Å
904K73.9Confident74.3Confident112 Ų11294 Ų9449%0.48748%0.478SS..Hα-helixtrans-65.8-34.8173.1-69.4156.7-163.8164.90111.5E900 L901 L907 K908E900-K904 WeakPolarHBondContact O-CB 3.16Å; E900-K904 VanDerWaalsContact O-CD 3.27Å; E900-K904 WeakPolarHBondContact O-CD 3Å; E900-K904 WeakPolarHBondContact O-CG 3.31Å; E900-K904 PolarHBondContact O-N 3.13Å; E900-K904 IonicContact OE2-NZ 3.79Å; E900-K904 PolarHBondContact OE2-NZ 3.37Å; L901-K904 CarbonylContact O-C 3.44Å; L901-K904 PolarHBondContact O-N 2.68Å; K904-L907 PolarHBondContact O-N 3.43Å; K904-K908 VanDerWaalsContact O-CB 3.26Å; K904-K908 WeakPolarHBondContact O-CB 3.44Å; K904-K908 PolarHBondContact O-N 3.44Å
905E74.4Confident74.5Confident86 Ų8697.2 Ų97.240%0.40249%0.489SS..Hα-helixtrans-73.7-38.4176.3-167.1171.2-118.900111.9L901 K902 G903 K908 I909L901-E905 VanDerWaalsContact O-CB 3.23Å; L901-E905 WeakPolarHBondContact O-CB 3.5Å; L901-E905 PolarHBondContact O-N 3.43Å; K902-E905 WeakPolarHBondContact CD-OE2 3.29Å; K902-E905 WeakPolarHBondContact CE-OE2 3.49Å; K902-E905 IonicContact NZ-OE2 2.92Å; K902-E905 PolarHBondContact NZ-OE2 2.7Å; K902-E905 PolarHBondContact O-N 3.48Å; G903-E905 VanDerWaalsContact C-N 3.33Å; E905-K908 CarbonylContact O-C 3.32Å; E905-K908 WeakPolarHBondContact O-CB 3.38Å; E905-K908 PolarHBondContact O-N 3.35Å; E905-I909 HydrophobicContact CG-CD1 4.18Å; E905-I909 WeakPolarHBondContact O-CB 3.15Å; E905-I909 VanDerWaalsContact O-CG1 3.25Å; E905-I909 WeakPolarHBondContact O-CG1 3.31Å; E905-I909 PolarHBondContact O-N 2.92Å
906V74.1Confident74.6Confident92 Ų9298.5 Ų98.556%0.55849%0.492SS*.Hα-helixtrans-66.4-39.4170.2165.50000110.8K902 G903 K908 R910K902-V906 WeakPolarHBondContact O-CB 3.39Å; K902-V906 VanDerWaalsContact O-CG2 3.26Å; K902-V906 WeakPolarHBondContact O-CG2 3.46Å; K902-V906 PolarHBondContact O-N 3.48Å; G903-V906 PolarHBondContact O-N 3.23Å; V906-K908 VanDerWaalsContact C-N 3.34Å; V906-R910 WeakPolarHBondContact O-CB 3.34Å; V906-R910 PolarHBondContact O-N 3.48Å
907L74.4Confident74.8Confident108 Ų10899.1 Ų99.157%0.56549%0.492SS*.Hα-helixtrans-64.6-38.1171.3-74.5169.2000111.8G903 K904 R910 S911G903-L907 WeakPolarHBondContact O-CB 3.39Å; G903-L907 VanDerWaalsContact O-CG 3.27Å; G903-L907 WeakPolarHBondContact O-CG 3.16Å; G903-L907 PolarHBondContact O-N 2.9Å; K904-L907 PolarHBondContact O-N 3.43Å; L907-R910 PolarHBondContact O-N 2.63Å; L907-S911 WeakPolarHBondContact O-CB 3.29Å; L907-S911 PolarHBondContact O-N 2.72Å
908K75.7Confident75Confident111 Ų111100.5 Ų100.548%0.48349%0.494SS..Hα-helixtrans-65.1-52.3174.7-177.8176.4175.1-650111.1K904 E905 V906 R910 S911 E912K904-K908 VanDerWaalsContact O-CB 3.26Å; K904-K908 WeakPolarHBondContact O-CB 3.44Å; K904-K908 PolarHBondContact O-N 3.44Å; E905-K908 CarbonylContact O-C 3.32Å; E905-K908 WeakPolarHBondContact O-CB 3.38Å; E905-K908 PolarHBondContact O-N 3.35Å; V906-K908 VanDerWaalsContact C-N 3.34Å; K908-R910 VanDerWaalsContact C-N 3.29Å; K908-R910 PolarHBondContact O-N 2.84Å; K908-S911 CarbonylContact O-C 3.51Å; K908-S911 WeakPolarHBondContact O-CA 3.44Å; K908-S911 WeakPolarHBondContact O-CB 3.19Å; K908-S911 PolarHBondContact O-N 3.25Å; K908-S911 PolarHBondContact O-OG 2.75Å; K908-E912 WeakPolarHBondContact CE-OE1 3.31Å; K908-E912 VanDerWaalsContact NZ-CD 3.33Å; K908-E912 IonicContact NZ-OE1 2.66Å; K908-E912 PolarHBondContact NZ-OE1 3.06Å; K908-E912 IonicContact NZ-OE2 2.66Å; K908-E912 PolarHBondContact NZ-OE2 2.68Å; K908-E912 WeakPolarHBondContact O-CB 3.38Å; K908-E912 WeakPolarHBondContact O-CG 3.49Å; K908-E912 PolarHBondContact O-N 2.66Å
909I75.8Confident74.9Confident99 Ų9997.7 Ų97.751%0.50849%0.49SS..Hα-helixtrans-57.5-41.9174.6-69.9163.7000110.5E905 S911 E912 A913E905-I909 HydrophobicContact CG-CD1 4.18Å; E905-I909 WeakPolarHBondContact O-CB 3.15Å; E905-I909 VanDerWaalsContact O-CG1 3.25Å; E905-I909 WeakPolarHBondContact O-CG1 3.31Å; E905-I909 PolarHBondContact O-N 2.92Å; I909-S911 VanDerWaalsContact C-N 3.35Å; I909-S911 PolarHBondContact O-N 2.79Å; I909-E912 PolarHBondContact O-N 2.74Å; I909-A913 WeakPolarHBondContact O-CB 3.29Å; I909-A913 PolarHBondContact O-N 2.71Å
910R72.8Confident75.1Confident168 Ų16897.4 Ų97.463%0.63449%0.485SS*.Hα-helixtrans-66.7-34.4174.9-171.6178.3-177.5-160.80.8112.2V906 L907 K908 N914V906-R910 WeakPolarHBondContact O-CB 3.34Å; V906-R910 PolarHBondContact O-N 3.48Å; L907-R910 PolarHBondContact O-N 2.63Å; K908-R910 VanDerWaalsContact C-N 3.29Å; K908-R910 PolarHBondContact O-N 2.84Å; R910-N914 WeakPolarHBondContact O-CB 3.24Å; R910-N914 PolarHBondContact O-N 2.65Å; R910-N914 PolarHBondContact O-ND2 3.38Å
911S74.1Confident75.2Confident59 Ų5997.6 Ų97.641%0.41349%0.486SS..Hα-helixtrans-71.9-39174.677.60000112.2L907 K908 I909 N914 Q915L907-S911 WeakPolarHBondContact O-CB 3.29Å; L907-S911 PolarHBondContact O-N 2.72Å; K908-S911 CarbonylContact O-C 3.51Å; K908-S911 WeakPolarHBondContact O-CA 3.44Å; K908-S911 WeakPolarHBondContact O-CB 3.19Å; K908-S911 PolarHBondContact O-N 3.25Å; K908-S911 PolarHBondContact O-OG 2.75Å; I909-S911 VanDerWaalsContact C-N 3.35Å; I909-S911 PolarHBondContact O-N 2.79Å; S911-N914 CarbonylContact O-C 3.52Å; S911-N914 PolarHBondContact O-N 3.24Å; S911-Q915 VanDerWaalsContact O-CB 3.26Å; S911-Q915 WeakPolarHBondContact O-CB 3.14Å; S911-Q915 PolarHBondContact O-N 2.66Å
912E77.8Confident75.3Confident74 Ų7497.8 Ų97.835%0.34648%0.484SS..Hα-helixtrans-69.5-43.6177.3-72.7169.416300110.3K908 I909 Q915 Q916K908-E912 WeakPolarHBondContact CE-OE1 3.31Å; K908-E912 VanDerWaalsContact NZ-CD 3.33Å; K908-E912 IonicContact NZ-OE1 2.66Å; K908-E912 PolarHBondContact NZ-OE1 3.06Å; K908-E912 IonicContact NZ-OE2 2.66Å; K908-E912 PolarHBondContact NZ-OE2 2.68Å; K908-E912 WeakPolarHBondContact O-CB 3.38Å; K908-E912 WeakPolarHBondContact O-CG 3.49Å; K908-E912 PolarHBondContact O-N 2.66Å; I909-E912 PolarHBondContact O-N 2.74Å; E912-Q915 CarbonylContact O-C 3.59Å; E912-Q915 WeakPolarHBondContact O-CA 3.24Å; E912-Q915 WeakPolarHBondContact O-CB 3.22Å; E912-Q915 PolarHBondContact O-N 2.68Å; E912-Q915 VanDerWaalsContact O-N 3.08Å; E912-Q916 WeakPolarHBondContact O-CG 3.5Å; E912-Q916 PolarHBondContact O-N 2.8Å
913A73.9Confident75.5Confident36 Ų3695.9 Ų95.930%0.29848%0.477SS..Hα-helixtrans-62.3-45.6171.100000111.6I909 Q915 Q916 I917I909-A913 WeakPolarHBondContact O-CB 3.29Å; I909-A913 PolarHBondContact O-N 2.71Å; A913-Q915 PolarHBondContact O-N 2.7Å; A913-Q916 PolarHBondContact O-N 2.81Å; A913-I917 WeakPolarHBondContact O-CB 3.36Å; A913-I917 VanDerWaalsContact O-CG1 3.25Å; A913-I917 WeakPolarHBondContact O-CG1 3.06Å; A913-I917 PolarHBondContact O-N 3.41Å
914N75.8Confident75.7Confident72 Ų7298.8 Ų98.839%0.38548%0.484SS..Hα-helixtrans-66.8-15.3173.1-76.1-17.9000113.5R910 S911 R918R910-N914 WeakPolarHBondContact O-CB 3.24Å; R910-N914 PolarHBondContact O-N 2.65Å; R910-N914 PolarHBondContact O-ND2 3.38Å; S911-N914 CarbonylContact O-C 3.52Å; S911-N914 PolarHBondContact O-N 3.24Å; N914-R918 WeakPolarHBondContact O-CB 2.87Å; N914-R918 WeakPolarHBondContact O-CG 3.32Å; N914-R918 PolarHBondContact O-N 2.79Å; N914-R918 PolarHBondContact O-NE 3.06Å
915Q78.2Confident75.8Confident133 Ų13397 Ų9762%0.62148%0.483SS*.Hα-helixtrans-91.1-34.2173.7-170.1167.94.200111.3S911 E912 A913 A919S911-Q915 VanDerWaalsContact O-CB 3.26Å; S911-Q915 WeakPolarHBondContact O-CB 3.14Å; S911-Q915 PolarHBondContact O-N 2.66Å; E912-Q915 CarbonylContact O-C 3.59Å; E912-Q915 WeakPolarHBondContact O-CA 3.24Å; E912-Q915 WeakPolarHBondContact O-CB 3.22Å; E912-Q915 PolarHBondContact O-N 2.68Å; E912-Q915 VanDerWaalsContact O-N 3.08Å; A913-Q915 PolarHBondContact O-N 2.7Å; Q915-A919 VanDerWaalsContact O-CB 3.24Å; Q915-A919 WeakPolarHBondContact O-CB 3.24Å; Q915-A919 PolarHBondContact O-N 3.12Å
916Q75.6Confident76.1Confident126 Ų12697.5 Ų97.559%0.58948%0.483SS*.Hα-helixtrans-67.9-42.9169.7-72.7171.51.600111.7E912 A913 A919 H920E912-Q916 WeakPolarHBondContact O-CG 3.5Å; E912-Q916 PolarHBondContact O-N 2.8Å; A913-Q916 PolarHBondContact O-N 2.81Å; Q916-A919 PolarHBondContact O-N 2.82Å; Q916-H920 WeakPolarHBondContact O-CB 3.23Å; Q916-H920 PolarHBondContact O-CD2 3.12Å; Q916-H920 PolarHBondContact O-N 2.99Å
917I76.2Confident76.3Confident84 Ų8499 Ų9943%0.43148%0.479SS..Hα-helixtrans-57.7-53.1171.9-70.6164.4000109.3A913 A919 H920 E921A913-I917 WeakPolarHBondContact O-CB 3.36Å; A913-I917 VanDerWaalsContact O-CG1 3.25Å; A913-I917 WeakPolarHBondContact O-CG1 3.06Å; A913-I917 PolarHBondContact O-N 3.41Å; I917-A919 VanDerWaalsContact C-N 3.28Å; I917-A919 PolarHBondContact O-N 3.01Å; I917-H920 CarbonylContact O-C 3.55Å; I917-H920 PolarHBondContact O-N 3.25Å; I917-H920 VanDerWaalsContact O-N 3.15Å; I917-E921 HydrophobicContact CG2-CG 4.27Å; I917-E921 WeakPolarHBondContact O-CB 3.08Å; I917-E921 VanDerWaalsContact O-CG 3.3Å; I917-E921 WeakPolarHBondContact O-CG 3.14Å; I917-E921 PolarHBondContact O-N 3.13Å
918R78.8Confident76.4Confident142 Ų14298.3 Ų98.354%0.53647%0.473SS..Hα-helixtrans-64.5-28.1177.1-77.6180-68.41781.3113.9N914 E921 Q922N914-R918 WeakPolarHBondContact O-CB 2.87Å; N914-R918 WeakPolarHBondContact O-CG 3.32Å; N914-R918 PolarHBondContact O-N 2.79Å; N914-R918 PolarHBondContact O-NE 3.06Å; R918-E921 WeakPolarHBondContact CA-OE2 3.31Å; R918-E921 WeakPolarHBondContact CG-OE2 2.8Å; R918-Q922 WeakPolarHBondContact O-CB 3.17Å; R918-Q922 VanDerWaalsContact O-CG 3.24Å; R918-Q922 WeakPolarHBondContact O-CG 3.31Å; R918-Q922 PolarHBondContact O-N 3.05Å
919A75.3Confident76.5Confident53 Ų5398.4 Ų98.444%0.43848%0.475SS..Hα-helixtrans-70.4-44172.200000111.5Q915 Q916 I917 Q922 E923Q915-A919 VanDerWaalsContact O-CB 3.24Å; Q915-A919 WeakPolarHBondContact O-CB 3.24Å; Q915-A919 PolarHBondContact O-N 3.12Å; Q916-A919 PolarHBondContact O-N 2.82Å; I917-A919 VanDerWaalsContact C-N 3.28Å; I917-A919 PolarHBondContact O-N 3.01Å; A919-Q922 PolarHBondContact O-N 3.47Å; A919-E923 WeakPolarHBondContact O-CB 3.12Å; A919-E923 PolarHBondContact O-N 3.29Å
920H74.6Confident76.7Confident124 Ų124100.2 Ų100.257%0.57448%0.476SS*.Hα-helixtrans-69-36.4174.9-74.2-46.2000112.7Q916 I917 E923 L924Q916-H920 WeakPolarHBondContact O-CB 3.23Å; Q916-H920 PolarHBondContact O-CD2 3.12Å; Q916-H920 PolarHBondContact O-N 2.99Å; I917-H920 CarbonylContact O-C 3.55Å; I917-H920 PolarHBondContact O-N 3.25Å; I917-H920 VanDerWaalsContact O-N 3.15Å; H920-E923 IonicContact ND1-OE2 3.2Å; H920-E923 PolarHBondContact O-N 2.91Å; H920-L924 WeakPolarHBondContact O-CB 2.98Å; H920-L924 PolarHBondContact O-N 3.4Å
921E75.6Confident77.1Confident105 Ų10597.4 Ų97.449%0.49147%0.469SS..Hα-helixtrans-61.1-45.6170.7-72.9170158.900110.8I917 R918 T925I917-E921 HydrophobicContact CG2-CG 4.27Å; I917-E921 WeakPolarHBondContact O-CB 3.08Å; I917-E921 VanDerWaalsContact O-CG 3.3Å; I917-E921 WeakPolarHBondContact O-CG 3.14Å; I917-E921 PolarHBondContact O-N 3.13Å; R918-E921 WeakPolarHBondContact CA-OE2 3.31Å; R918-E921 WeakPolarHBondContact CG-OE2 2.8Å; E921-T925 VanDerWaalsContact O-CB 3.29Å; E921-T925 WeakPolarHBondContact O-CB 3.06Å; E921-T925 PolarHBondContact O-N 3.36Å; E921-T925 PolarHBondContact O-OG1 2.9Å
922Q77.6Confident77.3Confident114 Ų114100.2 Ų100.253%0.53348%0.479SS..Hα-helixtrans-67.3-35.7175.2-76.6-17821.400112.6R918 A919 K926R918-Q922 WeakPolarHBondContact O-CB 3.17Å; R918-Q922 VanDerWaalsContact O-CG 3.24Å; R918-Q922 WeakPolarHBondContact O-CG 3.31Å; R918-Q922 PolarHBondContact O-N 3.05Å; A919-Q922 PolarHBondContact O-N 3.47Å; Q922-K926 VanDerWaalsContact O-CB 3.29Å; Q922-K926 WeakPolarHBondContact O-CB 2.83Å; Q922-K926 WeakPolarHBondContact O-CD 3.19Å; Q922-K926 WeakPolarHBondContact O-CG 3.23Å; Q922-K926 PolarHBondContact O-N 2.95Å
923E78.7Confident77.6Confident82 Ų82100.9 Ų100.938%0.38349%0.489SS..Hα-helixtrans-71.7-40.2177.1-168.6-177.3-179.400111.5A919 H920 K926 R927A919-E923 WeakPolarHBondContact O-CB 3.12Å; A919-E923 PolarHBondContact O-N 3.29Å; H920-E923 IonicContact ND1-OE2 3.2Å; H920-E923 PolarHBondContact O-N 2.91Å; E923-K926 CarbonylContact O-C 3.35Å; E923-K926 PolarHBondContact O-N 3.49Å; E923-R927 WeakPolarHBondContact O-CG 3.31Å; E923-R927 PolarHBondContact O-N 3.21Å; E923-R927 IonicContact OE1-CZ 2.86Å; E923-R927 IonicContact OE1-NE 2.64Å; E923-R927 IonicContact OE1-NH2 3.77Å; E923-R927 PolarHBondContact OE1-NH2 2.75Å
924L76.8Confident78.1Confident94 Ų94105.4 Ų105.449%0.49250%0.504SS..Hα-helixtrans-66-42.7174.1-175.465.5000111H920 K926 R927 H928H920-L924 WeakPolarHBondContact O-CB 2.98Å; H920-L924 PolarHBondContact O-N 3.4Å; L924-K926 VanDerWaalsContact C-N 3.34Å; L924-K926 PolarHBondContact O-N 2.94Å; L924-R927 PolarHBondContact O-N 3.21Å; L924-R927 VanDerWaalsContact O-N 3.13Å; L924-H928 PolarHBondContact O-N 3.23Å; L924-H928 PolarHBondContact O-ND1 3.15Å
925T76.1Confident78.3Confident75 Ų75107.8 Ų107.846%0.4652%0.516SS..Hα-helixtrans-60.8-44.6172.4-55.90000110.6E921 R927 H928 E929E921-T925 VanDerWaalsContact O-CB 3.29Å; E921-T925 WeakPolarHBondContact O-CB 3.06Å; E921-T925 PolarHBondContact O-N 3.36Å; E921-T925 PolarHBondContact O-OG1 2.9Å; T925-R927 VanDerWaalsContact C-N 3.29Å; T925-R927 PolarHBondContact O-N 3.24Å; T925-H928 PolarHBondContact O-N 2.95Å; T925-E929 WeakPolarHBondContact O-CB 2.99Å; T925-E929 WeakPolarHBondContact O-CG 3.13Å; T925-E929 PolarHBondContact O-N 2.98Å
926K79.8Confident78.4Confident96 Ų96103.9 Ų103.942%0.41750%0.503SS..Hα-helixtrans-67.4-24.2174.8-74.6167.7-171.5167.70113.7Q922 E923 L924 R930Q922-K926 VanDerWaalsContact O-CB 3.29Å; Q922-K926 WeakPolarHBondContact O-CB 2.83Å; Q922-K926 WeakPolarHBondContact O-CD 3.19Å; Q922-K926 WeakPolarHBondContact O-CG 3.23Å; Q922-K926 PolarHBondContact O-N 2.95Å; E923-K926 CarbonylContact O-C 3.35Å; E923-K926 PolarHBondContact O-N 3.49Å; L924-K926 VanDerWaalsContact C-N 3.34Å; L924-K926 PolarHBondContact O-N 2.94Å; K926-R930 WeakPolarHBondContact O-CB 3.13Å; K926-R930 VanDerWaalsContact O-CD 3.28Å; K926-R930 WeakPolarHBondContact O-CD 3.37Å; K926-R930 WeakPolarHBondContact O-CG 3.24Å; K926-R930 PolarHBondContact O-N 3.39Å; K926-R930 VanDerWaalsContact O-N 3.14Å
927R78.5Confident78.7Confident123 Ų123100 Ų10046%0.46449%0.492SS..Hα-helixtrans-73.2-49.6169.5-76.8-177.2-165.41778110.4E923 L924 T925 E929 R930 E931E923-R927 WeakPolarHBondContact O-CG 3.31Å; E923-R927 PolarHBondContact O-N 3.21Å; E923-R927 IonicContact OE1-CZ 2.86Å; E923-R927 IonicContact OE1-NE 2.64Å; E923-R927 IonicContact OE1-NH2 3.77Å; E923-R927 PolarHBondContact OE1-NH2 2.75Å; L924-R927 PolarHBondContact O-N 3.21Å; L924-R927 VanDerWaalsContact O-N 3.13Å; T925-R927 VanDerWaalsContact C-N 3.29Å; T925-R927 PolarHBondContact O-N 3.24Å; R927-E929 VanDerWaalsContact C-N 3.31Å; R927-E929 PolarHBondContact O-N 3.09Å; R927-R930 CarbonylContact O-C 3.48Å; R927-R930 WeakPolarHBondContact O-CA 3.36Å; R927-R930 WeakPolarHBondContact O-CB 3.07Å; R927-R930 PolarHBondContact O-N 3.46Å; R927-E931 WeakPolarHBondContact O-CB 3.47Å; R927-E931 WeakPolarHBondContact O-CG 3.45Å; R927-E931 PolarHBondContact O-N 3.32Å
928H76.3Confident79Confident94 Ų9497.7 Ų97.744%0.43549%0.486SS..Hα-helixtrans-60.5-36.7174.5-62.2146.4000112.7L924 T925 E931 L932L924-H928 PolarHBondContact O-N 3.23Å; L924-H928 PolarHBondContact O-ND1 3.15Å; T925-H928 PolarHBondContact O-N 2.95Å; H928-E931 IonicContact CD2-OE2 2.65Å; H928-E931 PolarHBondContact O-N 2.8Å; H928-L932 WeakPolarHBondContact O-CB 3.47Å; H928-L932 WeakPolarHBondContact O-CD1 2.91Å; H928-L932 WeakPolarHBondContact O-CG 2.99Å; H928-L932 PolarHBondContact O-N 2.89Å
929E78.6Confident79.1Confident113 Ų11396.4 Ų96.453%0.52849%0.486SS..Hα-helixtrans-65.1-39.2172.1-75.7-179.7141.600112.3T925 R927 T933T925-E929 WeakPolarHBondContact O-CB 2.99Å; T925-E929 WeakPolarHBondContact O-CG 3.13Å; T925-E929 PolarHBondContact O-N 2.98Å; R927-E929 VanDerWaalsContact C-N 3.31Å; R927-E929 PolarHBondContact O-N 3.09Å; E929-T933 WeakPolarHBondContact O-CB 2.86Å; E929-T933 WeakPolarHBondContact O-CG2 3.39Å; E929-T933 PolarHBondContact O-N 3.03Å; E929-T933 PolarHBondContact O-OG1 3.34Å
930R80.6Confident79.4Confident138 Ų13896 Ų9652%0.52148%0.48SS..Hα-helixtrans-66.9-46.6173.8-75.6165.3-173.2149.3-2.1111.3K926 R927 L932 T933 E934K926-R930 WeakPolarHBondContact O-CB 3.13Å; K926-R930 VanDerWaalsContact O-CD 3.28Å; K926-R930 WeakPolarHBondContact O-CD 3.37Å; K926-R930 WeakPolarHBondContact O-CG 3.24Å; K926-R930 PolarHBondContact O-N 3.39Å; K926-R930 VanDerWaalsContact O-N 3.14Å; R927-R930 CarbonylContact O-C 3.48Å; R927-R930 WeakPolarHBondContact O-CA 3.36Å; R927-R930 WeakPolarHBondContact O-CB 3.07Å; R927-R930 PolarHBondContact O-N 3.46Å; R930-L932 PolarHBondContact O-N 3.38Å; R930-T933 WeakPolarHBondContact CA-OG1 3.46Å; R930-T933 PolarHBondContact O-N 2.96Å; R930-T933 PolarHBondContact O-OG1 2.84Å; R930-T933 VanDerWaalsContact O-OG1 3.11Å; R930-E934 VanDerWaalsContact O-CB 3.3Å; R930-E934 WeakPolarHBondContact O-CB 3.48Å; R930-E934 WeakPolarHBondContact O-CG 2.99Å; R930-E934 PolarHBondContact O-N 3.1Å
931E79.9Confident79.9Confident108 Ų10897.3 Ų97.351%0.50548%0.48SS..Hα-helixtrans-62.6-41.4177.8-70.9159.2-156.200111.1R927 H928 L935R927-E931 WeakPolarHBondContact O-CB 3.47Å; R927-E931 WeakPolarHBondContact O-CG 3.45Å; R927-E931 PolarHBondContact O-N 3.32Å; H928-E931 IonicContact CD2-OE2 2.65Å; H928-E931 PolarHBondContact O-N 2.8Å; E931-L935 WeakPolarHBondContact O-CB 3.44Å; E931-L935 PolarHBondContact O-N 2.71Å
932L79.6Confident80.2Confident118 Ų11898.3 Ų98.362%0.61848%0.484SS*.Hα-helixtrans-66.9-38.4173.4-74.9168.6000112.7H928 R930 S936H928-L932 WeakPolarHBondContact O-CB 3.47Å; H928-L932 WeakPolarHBondContact O-CD1 2.91Å; H928-L932 WeakPolarHBondContact O-CG 2.99Å; H928-L932 PolarHBondContact O-N 2.89Å; R930-L932 PolarHBondContact O-N 3.38Å; L932-S936 WeakPolarHBondContact O-CB 3.46Å; L932-S936 PolarHBondContact O-N 2.86Å
933T83.3Confident80.4Confident89 Ų8994.2 Ų94.255%0.54647%0.467SS..Hα-helixtrans-75.7-34.3177.248.10000112.6E929 R930 A937E929-T933 WeakPolarHBondContact O-CB 2.86Å; E929-T933 WeakPolarHBondContact O-CG2 3.39Å; E929-T933 PolarHBondContact O-N 3.03Å; E929-T933 PolarHBondContact O-OG1 3.34Å; R930-T933 WeakPolarHBondContact CA-OG1 3.46Å; R930-T933 PolarHBondContact O-N 2.96Å; R930-T933 PolarHBondContact O-OG1 2.84Å; R930-T933 VanDerWaalsContact O-OG1 3.11Å; T933-A937 WeakPolarHBondContact O-CB 3.17Å; T933-A937 PolarHBondContact O-N 3.32Å
934E83.5Confident80.6Confident131 Ų13195.9 Ų95.961%0.61248%0.475SS*.Hα-helixtrans-68.3-42171.4-76.3-177.8-161.100111.7R930 A937 A938R930-E934 VanDerWaalsContact O-CB 3.3Å; R930-E934 WeakPolarHBondContact O-CB 3.48Å; R930-E934 WeakPolarHBondContact O-CG 2.99Å; R930-E934 PolarHBondContact O-N 3.1Å; E934-A937 CarbonylContact O-C 3.44Å; E934-A937 PolarHBondContact O-N 2.69Å; E934-A938 VanDerWaalsContact O-CB 3.25Å; E934-A938 WeakPolarHBondContact O-CB 3.35Å; E934-A938 PolarHBondContact O-N 3.41Å
935L81.4Confident80.9Confident121 Ų12196.1 Ų96.163%0.63448%0.477SS*.Hα-helixtrans-67.2-41.1174.5-172.468.4000111.2E931 A938 H939E931-L935 WeakPolarHBondContact O-CB 3.44Å; E931-L935 PolarHBondContact O-N 2.71Å; L935-A938 PolarHBondContact O-N 3.36Å; L935-H939 WeakPolarHBondContact O-CB 3.45Å; L935-H939 PolarHBondContact O-N 3Å
936S80.4Confident81.3Confident51 Ų5195.9 Ų95.936%0.35747%0.471SS..Hα-helixtrans-64.2-39.7173-1730000111.7L932 S940L932-S936 WeakPolarHBondContact O-CB 3.46Å; L932-S936 PolarHBondContact O-N 2.86Å; S936-S940 VanDerWaalsContact O-CB 3.23Å; S936-S940 WeakPolarHBondContact O-CB 3.43Å; S936-S940 PolarHBondContact O-N 3.37Å; S936-S940 PolarHBondContact O-OG 3.19Å
937A82.1Confident81.4Confident44 Ų4493.1 Ų93.136%0.36446%0.461SS..Hα-helixtrans-72.3-30.3174.500000112.7T933 E934 R941T933-A937 WeakPolarHBondContact O-CB 3.17Å; T933-A937 PolarHBondContact O-N 3.32Å; E934-A937 CarbonylContact O-C 3.44Å; E934-A937 PolarHBondContact O-N 2.69Å; A937-R941 WeakPolarHBondContact O-CB 3.4Å; A937-R941 VanDerWaalsContact O-CG 3.27Å; A937-R941 WeakPolarHBondContact O-CG 2.85Å; A937-R941 PolarHBondContact O-N 2.75Å; A937-R941 PolarHBondContact O-NE 2.98Å
938A81.8Confident81.7Confident37 Ų3789.7 Ų89.731%0.30646%0.456SS..Hα-helixtrans-68.6-51.5171.900000110.4E934 L935 S940 R941 E942E934-A938 VanDerWaalsContact O-CB 3.25Å; E934-A938 WeakPolarHBondContact O-CB 3.35Å; E934-A938 PolarHBondContact O-N 3.41Å; L935-A938 PolarHBondContact O-N 3.36Å; A938-S940 VanDerWaalsContact C-N 3.29Å; A938-S940 PolarHBondContact O-N 3.42Å; A938-R941 PolarHBondContact O-N 2.68Å; A938-R941 VanDerWaalsContact O-N 3.11Å; A938-E942 WeakPolarHBondContact O-CB 3.42Å; A938-E942 PolarHBondContact O-N 3.48Å
939H80.9Confident82.1Confident115 Ų11589 Ų8953%0.53246%0.455SS..Hα-helixtrans-60.7-37.6175.6-175.153.4000112L935 T943L935-H939 WeakPolarHBondContact O-CB 3.45Å; L935-H939 PolarHBondContact O-N 3Å; H939-T943 WeakPolarHBondContact O-CB 3.28Å; H939-T943 PolarHBondContact O-N 3.11Å; H939-T943 PolarHBondContact O-OG1 2.77Å
940S80.5Confident82.3Confident43 Ų4387.2 Ų87.230%0.30145%0.446SS..Hα-helixtrans-66.7-39.2174-59.90000112.3S936 A938 Q944S936-S940 VanDerWaalsContact O-CB 3.23Å; S936-S940 WeakPolarHBondContact O-CB 3.43Å; S936-S940 PolarHBondContact O-N 3.37Å; S936-S940 PolarHBondContact O-OG 3.19Å; A938-S940 VanDerWaalsContact C-N 3.29Å; A938-S940 PolarHBondContact O-N 3.42Å; S940-Q944 VanDerWaalsContact O-CB 3.27Å; S940-Q944 WeakPolarHBondContact O-CB 3.43Å; S940-Q944 PolarHBondContact O-N 3.24Å
941R85.9Confident82.5Confident152 Ų15284.3 Ų84.357%0.57444%0.441SS*.Hα-helixtrans-67.6-44.2173.6-79.4173-71.7159.8-4.4112.5A937 A938 T943 Q944 N945A937-R941 WeakPolarHBondContact O-CB 3.4Å; A937-R941 VanDerWaalsContact O-CG 3.27Å; A937-R941 WeakPolarHBondContact O-CG 2.85Å; A937-R941 PolarHBondContact O-N 2.75Å; A937-R941 PolarHBondContact O-NE 2.98Å; A938-R941 PolarHBondContact O-N 2.68Å; A938-R941 VanDerWaalsContact O-N 3.11Å; R941-T943 VanDerWaalsContact C-N 3.32Å; R941-Q944 PolarHBondContact O-N 3.07Å; R941-N945 WeakPolarHBondContact O-CB 3.09Å; R941-N945 PolarHBondContact O-N 3.1Å; R941-N945 PolarHBondContact O-ND2 3.47Å; R941-N945 PolarHBondContact O-OD1 2.98Å
942E82.4Confident82.8Confident127 Ų12783.7 Ų83.759%0.59344%0.436SS*.Hα-helixtrans-63.2-41.4177.3-175.6174.1-119.200111.1A938 N945 M946A938-E942 WeakPolarHBondContact O-CB 3.42Å; A938-E942 PolarHBondContact O-N 3.48Å; E942-N945 PolarHBondContact O-N 3.4Å; E942-M946 VanDerWaalsContact O-CG 3.26Å; E942-M946 WeakPolarHBondContact O-CG 3.5Å; E942-M946 PolarHBondContact O-N 3.42Å
943T81Confident82.8Confident28 Ų2879.9 Ų79.917%0.17242%0.422CS..Hα-helixtrans-59.8-55.6169.3-63.60000110.5H939 R941 N945 M946 L947 T1082H939-T943 WeakPolarHBondContact O-CB 3.28Å; H939-T943 PolarHBondContact O-N 3.11Å; H939-T943 PolarHBondContact O-OG1 2.77Å; R941-T943 VanDerWaalsContact C-N 3.32Å; T943-N945 VanDerWaalsContact C-N 3.25Å; T943-N945 PolarHBondContact O-N 3.32Å; T943-M946 CarbonylContact O-C 2.8Å; T943-M946 WeakPolarHBondContact O-CA 3.34Å; T943-M946 VanDerWaalsContact O-CB 3.31Å; T943-M946 WeakPolarHBondContact O-CB 3.2Å; T943-M946 PolarHBondContact O-N 3.32Å; T943-L947 PolarHBondContact O-N 2.88Å; T943-T1082 CarbonylContact C-O 3.46Å; T943-T1082 VanDerWaalsContact C-O 3.32Å; T943-T1082 VanDerWaalsContact CG2-C 3.41Å; T943-T1082 WeakPolarHBondContact CG2-O 3.44Å
944Q82.6Confident82.8Confident117 Ų11779.1 Ų79.155%0.54741%0.412SS..Hα-helixtrans-54.2-38.1177.5-169.982.220.100113.1S940 R941 L947 S948S940-Q944 VanDerWaalsContact O-CB 3.27Å; S940-Q944 WeakPolarHBondContact O-CB 3.43Å; S940-Q944 PolarHBondContact O-N 3.24Å; R941-Q944 PolarHBondContact O-N 3.07Å; Q944-L947 WeakPolarHBondContact O-CB 3.08Å; Q944-L947 PolarHBondContact O-N 3.46Å; Q944-S948 PolarHBondContact O-N 3.46Å
945N84.8Confident82.9Confident99 Ų9978.6 Ų78.653%0.52941%0.409SS..Hα-helixtrans-64.2-46.2174.2-71.3-15000110.9R941 E942 T943 L947 S948 D949R941-N945 WeakPolarHBondContact O-CB 3.09Å; R941-N945 PolarHBondContact O-N 3.1Å; R941-N945 PolarHBondContact O-ND2 3.47Å; R941-N945 PolarHBondContact O-OD1 2.98Å; E942-N945 PolarHBondContact O-N 3.4Å; T943-N945 VanDerWaalsContact C-N 3.25Å; T943-N945 PolarHBondContact O-N 3.32Å; N945-L947 VanDerWaalsContact C-N 3.29Å; N945-L947 PolarHBondContact O-N 2.94Å; N945-S948 CarbonylContact O-C 3.57Å; N945-S948 WeakPolarHBondContact O-CA 3.44Å; N945-S948 VanDerWaalsContact O-CB 3.26Å; N945-S948 WeakPolarHBondContact O-CB 3.22Å; N945-S948 PolarHBondContact O-N 3.26Å; N945-D949 PolarHBondContact O-N 2.93Å
946M82.4Confident83Confident69 Ų6978.7 Ų78.734%0.3441%0.41SS..Hα-helixtrans-59.8-37.1172.9-69.3-82.8-117.600111.8E942 T943 D949 F950 S1083 P1084E942-M946 VanDerWaalsContact O-CG 3.26Å; E942-M946 WeakPolarHBondContact O-CG 3.5Å; E942-M946 PolarHBondContact O-N 3.42Å; T943-M946 CarbonylContact O-C 2.8Å; T943-M946 WeakPolarHBondContact O-CA 3.34Å; T943-M946 VanDerWaalsContact O-CB 3.31Å; T943-M946 WeakPolarHBondContact O-CB 3.2Å; T943-M946 PolarHBondContact O-N 3.32Å; M946-D949 PolarHBondContact O-N 3.42Å; M946-F950 VanDerWaalsContact O-CB 3.28Å; M946-F950 WeakPolarHBondContact O-CB 2.84Å; M946-F950 PolarHBondContact O-N 2.88Å; M946-S1083 CarbonylContact C-O 3.44Å; M946-S1083 WeakPolarHBondContact CB-O 3.35Å; M946-P1084 HydrophobicContact CE-CB 3.53Å; M946-P1084 HydrophobicContact SD-CB 4.29Å
947L83.4Confident83.1Confident39 Ų3981.5 Ų81.520%0.20442%0.421CS..Hα-helixtrans-60.2-44.9169.3-127.5-179.9000112.1T943 Q944 N945 D949 F950 N951 T1082T943-L947 PolarHBondContact O-N 2.88Å; Q944-L947 WeakPolarHBondContact O-CB 3.08Å; Q944-L947 PolarHBondContact O-N 3.46Å; N945-L947 VanDerWaalsContact C-N 3.29Å; N945-L947 PolarHBondContact O-N 2.94Å; L947-D949 VanDerWaalsContact C-N 3.31Å; L947-D949 PolarHBondContact O-N 3.41Å; L947-F950 PolarHBondContact O-N 3.21Å; L947-N951 WeakPolarHBondContact O-CB 3.48Å; L947-N951 VanDerWaalsContact O-CG 3.29Å; L947-N951 PolarHBondContact O-N 3.35Å; L947-T1082 WeakPolarHBondContact CA-O 3.3Å; L947-T1082 WeakPolarHBondContact CB-O 3.18Å; L947-T1082 WeakPolarHBondContact CD1-OG1 3.14Å; L947-T1082 WeakPolarHBondContact CG-O 3.48Å; L947-T1082 PolarHBondContact N-O 2.87Å
948S84.4Confident83.2Confident51 Ų5182.5 Ų82.536%0.35742%0.417SS..Hα-helixtrans-61-42.9178.7-166.80000110.8Q944 N945 N951 K952Q944-S948 PolarHBondContact O-N 3.46Å; N945-S948 CarbonylContact O-C 3.57Å; N945-S948 WeakPolarHBondContact O-CA 3.44Å; N945-S948 VanDerWaalsContact O-CB 3.26Å; N945-S948 WeakPolarHBondContact O-CB 3.22Å; N945-S948 PolarHBondContact O-N 3.26Å; S948-N951 PolarHBondContact O-N 2.98Å; S948-K952 WeakPolarHBondContact O-CD 3.35Å; S948-K952 WeakPolarHBondContact O-CE 3.43Å; S948-K952 WeakPolarHBondContact O-CG 3.28Å; S948-K952 PolarHBondContact O-N 3.25Å; S948-K952 WeakPolarHBondContact OG-CE 3.34Å; S948-K952 PolarHBondContact OG-NZ 3.44Å
949D84.9Confident83.3Confident78 Ų7884.3 Ų84.342%0.41742%0.421SS..Hα-helixtrans-77.7-31.9-179.7-66.8-23.3000112.6N945 M946 L947 K952 A953N945-D949 PolarHBondContact O-N 2.93Å; M946-D949 PolarHBondContact O-N 3.42Å; L947-D949 VanDerWaalsContact C-N 3.31Å; L947-D949 PolarHBondContact O-N 3.41Å; D949-K952 IonicContact OD1-NZ 3.23Å; D949-K952 PolarHBondContact OD1-NZ 3.26Å; D949-A953 WeakPolarHBondContact O-CB 3.31Å; D949-A953 PolarHBondContact O-N 2.98Å
950F82.8Confident83.4Confident76 Ų7685.7 Ų85.733%0.33343%0.426SS..Hα-helixtrans-63.7-45.9167.7-178.9-99.8000110.9M946 L947 A953 Q954M946-F950 VanDerWaalsContact O-CB 3.28Å; M946-F950 WeakPolarHBondContact O-CB 2.84Å; M946-F950 PolarHBondContact O-N 2.88Å; L947-F950 PolarHBondContact O-N 3.21Å; F950-A953 CarbonylContact O-C 3.51Å; F950-A953 PolarHBondContact O-N 3.12Å; F950-Q954 VanDerWaalsContact O-CB 3.23Å; F950-Q954 WeakPolarHBondContact O-CB 3.47Å; F950-Q954 PolarHBondContact O-N 2.71Å
951N85.3Confident83.5Confident77 Ų7785.2 Ų85.241%0.41242%0.419SS..Hα-helixtrans-64.3-43.8177.4-74.3-14000111.4L947 S948 A953 Q954 E955L947-N951 WeakPolarHBondContact O-CB 3.48Å; L947-N951 VanDerWaalsContact O-CG 3.29Å; L947-N951 PolarHBondContact O-N 3.35Å; S948-N951 PolarHBondContact O-N 2.98Å; N951-A953 PolarHBondContact O-N 3.36Å; N951-Q954 CarbonylContact O-C 3.57Å; N951-Q954 WeakPolarHBondContact O-CA 3.1Å; N951-Q954 PolarHBondContact O-N 3.21Å; N951-Q954 VanDerWaalsContact O-N 3.17Å; N951-E955 WeakPolarHBondContact O-CG 3.29Å; N951-E955 PolarHBondContact O-N 3.39Å
952K85.1Confident83.3Confident96 Ų9679 Ų7942%0.41740%0.399SS..Hα-helixtrans-59.1-44.9171.4-70163.2-1491550112S948 D949 Q954 E955 L956S948-K952 WeakPolarHBondContact O-CD 3.35Å; S948-K952 WeakPolarHBondContact O-CE 3.43Å; S948-K952 WeakPolarHBondContact O-CG 3.28Å; S948-K952 PolarHBondContact O-N 3.25Å; S948-K952 WeakPolarHBondContact OG-CE 3.34Å; S948-K952 PolarHBondContact OG-NZ 3.44Å; D949-K952 IonicContact OD1-NZ 3.23Å; D949-K952 PolarHBondContact OD1-NZ 3.26Å; K952-Q954 VanDerWaalsContact C-N 3.28Å; K952-Q954 PolarHBondContact O-N 2.89Å; K952-E955 CarbonylContact O-C 3.53Å; K952-E955 PolarHBondContact O-N 3.01Å; K952-E955 VanDerWaalsContact O-N 3.1Å; K952-L956 WeakPolarHBondContact O-CB 3.17Å; K952-L956 WeakPolarHBondContact O-CG 3.44Å; K952-L956 PolarHBondContact O-N 3.19Å
953A80.7Confident83.2Confident37 Ų3775.6 Ų75.631%0.30639%0.393SS..Hα-helixtrans-65.4-33.917700000111.9D949 F950 N951 E955 L957D949-A953 WeakPolarHBondContact O-CB 3.31Å; D949-A953 PolarHBondContact O-N 2.98Å; F950-A953 CarbonylContact O-C 3.51Å; F950-A953 PolarHBondContact O-N 3.12Å; N951-A953 PolarHBondContact O-N 3.36Å; A953-E955 VanDerWaalsContact C-N 3.33Å; A953-L957 WeakPolarHBondContact O-CB 3.36Å; A953-L957 WeakPolarHBondContact O-CG 3.46Å; A953-L957 PolarHBondContact O-N 3.31Å
954Q83.3Confident83.2Confident74 Ų7479.1 Ų79.135%0.34641%0.41SS..Hα-helixtrans-78.8-12173.3-148.7-146.263.600112.8F950 N951 K952 L957 K958F950-Q954 VanDerWaalsContact O-CB 3.23Å; F950-Q954 WeakPolarHBondContact O-CB 3.47Å; F950-Q954 PolarHBondContact O-N 2.71Å; N951-Q954 CarbonylContact O-C 3.57Å; N951-Q954 WeakPolarHBondContact O-CA 3.1Å; N951-Q954 PolarHBondContact O-N 3.21Å; N951-Q954 VanDerWaalsContact O-N 3.17Å; K952-Q954 VanDerWaalsContact C-N 3.28Å; K952-Q954 PolarHBondContact O-N 2.89Å; Q954-L957 CarbonylContact C-O 3.49Å; Q954-L957 VanDerWaalsContact O-O 3.11Å; Q954-K958 HydrophobicContact CG-CD 4.11Å; Q954-K958 WeakPolarHBondContact O-CB 3.3Å; Q954-K958 WeakPolarHBondContact O-CD 3.07Å
955E84.9Confident83.2Confident119 Ų11976.9 Ų76.956%0.55640%0.399SS*.Hα-helixtrans-93.8-26168.1-75-179.3151.800112N951 K952 A953 L957 D959N951-E955 WeakPolarHBondContact O-CG 3.29Å; N951-E955 PolarHBondContact O-N 3.39Å; K952-E955 CarbonylContact O-C 3.53Å; K952-E955 PolarHBondContact O-N 3.01Å; K952-E955 VanDerWaalsContact O-N 3.1Å; A953-E955 VanDerWaalsContact C-N 3.33Å; E955-L957 CarbonylContact C-O 3.59Å; E955-L957 WeakPolarHBondContact CA-O 3.46Å; E955-D959 WeakPolarHBondContact O-CB 3.35Å; E955-D959 PolarHBondContact O-N 3.29Å
956L84.4Confident83.1Confident123 Ų12377.8 Ų77.864%0.64440%0.403SS*.Hα-helixtrans-83.2-46.4174.2-70.8169.8000114.4K952 K960K952-L956 WeakPolarHBondContact O-CB 3.17Å; K952-L956 WeakPolarHBondContact O-CG 3.44Å; K952-L956 PolarHBondContact O-N 3.19Å; L956-K960 WeakPolarHBondContact O-CB 3.46Å; L956-K960 PolarHBondContact O-N 3.37Å; L956-K960 VanDerWaalsContact O-N 3.15Å
957L81.6Confident83.1Confident111 Ų11180.2 Ų80.258%0.58142%0.417SS*.Hα-helixtrans-56.6166.3142.8-67.4169.4000107A953 Q954 E955 D959A953-L957 WeakPolarHBondContact O-CB 3.36Å; A953-L957 WeakPolarHBondContact O-CG 3.46Å; A953-L957 PolarHBondContact O-N 3.31Å; Q954-L957 CarbonylContact C-O 3.49Å; Q954-L957 VanDerWaalsContact O-O 3.11Å; E955-L957 CarbonylContact C-O 3.59Å; E955-L957 WeakPolarHBondContact CA-O 3.46Å; L957-D959 PolarHBondContact O-N 3.45Å
958K83.7Confident83Confident65 Ų6582.8 Ų82.828%0.28343%0.43SS..Hα-helixtrans70.6-53.4179.7-117-175.5149.5-167.90109.8Q954 I961 S962 P1057 N1058Q954-K958 HydrophobicContact CG-CD 4.11Å; Q954-K958 WeakPolarHBondContact O-CB 3.3Å; Q954-K958 WeakPolarHBondContact O-CD 3.07Å; K958-I961 CarbonylContact O-C 3.58Å; K958-I961 WeakPolarHBondContact O-CA 2.97Å; K958-I961 WeakPolarHBondContact O-CB 3.36Å; K958-I961 VanDerWaalsContact O-CG2 3.28Å; K958-I961 WeakPolarHBondContact O-CG2 3.31Å; K958-I961 PolarHBondContact O-N 3.05Å; K958-S962 PolarHBondContact O-N 3.27Å; K958-S962 PolarHBondContact O-OG 3.48Å; K958-P1057 HydrophobicContact CG-CB 4.38Å; K958-N1058 HydrophobicContact CB-CB 3.63Å; K958-N1058 WeakPolarHBondContact CB-ND2 3.26Å; K958-N1058 WeakPolarHBondContact CB-OD1 3.48Å; K958-N1058 HydrophobicContact CD-CB 4.39Å; K958-N1058 WeakPolarHBondContact CD-OD1 3.24Å; K958-N1058 WeakPolarHBondContact CE-OD1 3.47Å; K958-N1058 HydrophobicContact CG-CB 3.46Å; K958-N1058 VanDerWaalsContact CG-CB 3.46Å; K958-N1058 WeakPolarHBondContact CG-OD1 3.44Å; K958-N1058 WeakPolarHBondContact O-CB 3.31Å; K958-N1058 PolarHBondContact O-ND2 3.21Å
959D84.4Confident82.9Confident75 Ų7586.8 Ų86.840%0.40144%0.443SS..Hα-helixtrans-68-49.5172-907.5000111.8E955 L957 I961 S962 A963 N1058 L1059E955-D959 WeakPolarHBondContact O-CB 3.35Å; E955-D959 PolarHBondContact O-N 3.29Å; L957-D959 PolarHBondContact O-N 3.45Å; D959-I961 PolarHBondContact O-N 3.19Å; D959-S962 WeakPolarHBondContact CA-OG 3.44Å; D959-S962 PolarHBondContact O-N 2.76Å; D959-S962 PolarHBondContact O-OG 2.64Å; D959-A963 PolarHBondContact O-N 2.64Å; D959-N1058 PolarHBondContact N-ND2 3.49Å; D959-N1058 PolarHBondContact OD1-ND2 3.15Å; D959-N1058 VanDerWaalsContact OD1-ND2 3.17Å; D959-L1059 WeakPolarHBondContact OD1-CD2 3.36Å
960K83.3Confident82.7Confident144 Ų14484.2 Ų84.263%0.62644%0.435SS*.Hα-helixtrans-53.3-24.2170.6-178.5171.4-176.3172.70112.5L956 L964L956-K960 WeakPolarHBondContact O-CB 3.46Å; L956-K960 PolarHBondContact O-N 3.37Å; L956-K960 VanDerWaalsContact O-N 3.15Å; K960-L964 VanDerWaalsContact O-CG 3.27Å; K960-L964 WeakPolarHBondContact O-CG 3.04Å; K960-L964 PolarHBondContact O-N 3Å; K960-L964 VanDerWaalsContact O-N 3.14Å
961I81.3Confident82.4Confident33 Ų3384.2 Ų84.217%0.16944%0.442CS..Hα-helixtrans-81.3-44177.5-96.259.9000110.9K958 D959 A963 L964 Q965 P1057 N1058K958-I961 CarbonylContact O-C 3.58Å; K958-I961 WeakPolarHBondContact O-CA 2.97Å; K958-I961 WeakPolarHBondContact O-CB 3.36Å; K958-I961 VanDerWaalsContact O-CG2 3.28Å; K958-I961 WeakPolarHBondContact O-CG2 3.31Å; K958-I961 PolarHBondContact O-N 3.05Å; D959-I961 PolarHBondContact O-N 3.19Å; I961-A963 PolarHBondContact O-N 2.76Å; I961-L964 HydrophobicContact CD1-CD1 4.44Å; I961-L964 CarbonylContact O-C 3.58Å; I961-L964 WeakPolarHBondContact O-CA 3.07Å; I961-L964 WeakPolarHBondContact O-CB 3.06Å; I961-L964 PolarHBondContact O-N 3.44Å; I961-Q965 PolarHBondContact O-N 2.79Å; I961-P1057 VanDerWaalsContact CG2-C 3.44Å; I961-P1057 WeakPolarHBondContact CG2-O 3.35Å; I961-N1058 HydrophobicContact CG2-CB 4.12Å
962S82.8Confident82.1Confident20 Ų2084.5 Ų84.514%0.1444%0.441CS..Hα-helixtrans-66-32.9174.348.40000110.8K958 D959 Q965 I966K958-S962 PolarHBondContact O-N 3.27Å; K958-S962 PolarHBondContact O-OG 3.48Å; D959-S962 WeakPolarHBondContact CA-OG 3.44Å; D959-S962 PolarHBondContact O-N 2.76Å; D959-S962 PolarHBondContact O-OG 2.64Å; S962-Q965 PolarHBondContact O-N 2.83Å; S962-I966 WeakPolarHBondContact O-CB 3.3Å; S962-I966 WeakPolarHBondContact O-CD1 3.43Å; S962-I966 WeakPolarHBondContact O-CG1 3.41Å; S962-I966 PolarHBondContact O-N 3.3Å
963A81.1Confident81.8Confident56 Ų5685.7 Ų85.746%0.46345%0.448SS..Hα-helixtrans-62.1-4016700000112.4D959 I961 L967D959-A963 PolarHBondContact O-N 2.64Å; I961-A963 PolarHBondContact O-N 2.76Å; A963-L967 WeakPolarHBondContact O-CB 3.37Å; A963-L967 PolarHBondContact O-N 3.07Å
964L80.1Confident81.7Confident103 Ų10391.8 Ų91.854%0.53947%0.467SS..Hα-helixtrans-68.8-36.3174.1-78.3165.9000112.9K960 I961 L967 L968K960-L964 VanDerWaalsContact O-CG 3.27Å; K960-L964 WeakPolarHBondContact O-CG 3.04Å; K960-L964 PolarHBondContact O-N 3Å; K960-L964 VanDerWaalsContact O-N 3.14Å; I961-L964 HydrophobicContact CD1-CD1 4.44Å; I961-L964 CarbonylContact O-C 3.58Å; I961-L964 WeakPolarHBondContact O-CA 3.07Å; I961-L964 WeakPolarHBondContact O-CB 3.06Å; I961-L964 PolarHBondContact O-N 3.44Å; L964-L967 PolarHBondContact O-N 2.76Å; L964-L968 VanDerWaalsContact O-CB 3.3Å; L964-L968 WeakPolarHBondContact O-CB 3.03Å; L964-L968 PolarHBondContact O-N 2.87Å
965Q81.8Confident81.2Confident69 Ų6995.5 Ų95.532%0.32248%0.483SS..Hα-helixtrans-68.2-44.6174.4-74.2162.8-13.800111.3I961 S962 L967 L968 E969 S1056 P1057I961-Q965 PolarHBondContact O-N 2.79Å; S962-Q965 PolarHBondContact O-N 2.83Å; Q965-L967 VanDerWaalsContact C-N 3.26Å; Q965-L967 PolarHBondContact O-N 3.42Å; Q965-L968 CarbonylContact O-C 3.56Å; Q965-L968 WeakPolarHBondContact O-CB 3.31Å; Q965-L968 PolarHBondContact O-N 2.91Å; Q965-L968 VanDerWaalsContact O-N 3.09Å; Q965-E969 WeakPolarHBondContact O-CB 3.49Å; Q965-E969 WeakPolarHBondContact O-CG 3.49Å; Q965-E969 PolarHBondContact O-N 3.48Å; Q965-S1056 PolarHBondContact NE2-O 3.1Å; Q965-P1057 PolarHBondContact NE2-O 2.85Å; Q965-P1057 PolarHBondContact OE1-O 3.37Å
966I82.7Confident80.7Confident118 Ų11898.5 Ų98.561%0.60549%0.489SS*.Hα-helixtrans-61-36.8172.7-69.2163.6000110.7S962 G970S962-I966 WeakPolarHBondContact O-CB 3.3Å; S962-I966 WeakPolarHBondContact O-CD1 3.43Å; S962-I966 WeakPolarHBondContact O-CG1 3.41Å; S962-I966 PolarHBondContact O-N 3.3Å; I966-G970 WeakPolarHBondContact O-CA 3.41Å; I966-G970 PolarHBondContact O-N 3.12Å
967L82.8Confident80.2Confident121 Ų12198.2 Ų98.263%0.63449%0.488SS*.Hα-helixtrans-67.3-41.5173.2-144.881.8000111.7A963 L964 Q965 G970 T971A963-L967 WeakPolarHBondContact O-CB 3.37Å; A963-L967 PolarHBondContact O-N 3.07Å; L964-L967 PolarHBondContact O-N 2.76Å; Q965-L967 VanDerWaalsContact C-N 3.26Å; Q965-L967 PolarHBondContact O-N 3.42Å; L967-G970 CarbonylContact O-C 3.45Å; L967-G970 PolarHBondContact O-N 3.13Å; L967-T971 WeakPolarHBondContact O-CG2 3.36Å; L967-T971 PolarHBondContact O-N 3.18Å; L967-T971 PolarHBondContact O-OG1 2.88Å
968L81.4Confident79.8Confident92 Ų92101.1 Ų101.148%0.48249%0.491SS..Hα-helixtrans-65.1-54.5179-176.266.6000110.8L964 Q965 G970 T971 E972L964-L968 VanDerWaalsContact O-CB 3.3Å; L964-L968 WeakPolarHBondContact O-CB 3.03Å; L964-L968 PolarHBondContact O-N 2.87Å; Q965-L968 CarbonylContact O-C 3.56Å; Q965-L968 WeakPolarHBondContact O-CB 3.31Å; Q965-L968 PolarHBondContact O-N 2.91Å; Q965-L968 VanDerWaalsContact O-N 3.09Å; L968-G970 VanDerWaalsContact C-N 3.28Å; L968-G970 PolarHBondContact O-N 3.11Å; L968-T971 CarbonylContact O-C 3.58Å; L968-T971 WeakPolarHBondContact O-CA 3.47Å; L968-T971 PolarHBondContact O-N 2.93Å; L968-T971 PolarHBondContact O-OG1 3.39Å; L968-E972 PolarHBondContact O-N 2.83Å
969E83Confident79.1Confident135 Ų135106.5 Ų106.563%0.63152%0.517SS*.Hα-helixtrans-55.9-43.1172.9-70.9-171.3134.600111Q965 T971 E972 E973Q965-E969 WeakPolarHBondContact O-CB 3.49Å; Q965-E969 WeakPolarHBondContact O-CG 3.49Å; Q965-E969 PolarHBondContact O-N 3.48Å; E969-T971 VanDerWaalsContact C-N 3.26Å; E969-T971 PolarHBondContact O-N 3.06Å; E969-E972 PolarHBondContact O-N 3.03Å; E969-E973 VanDerWaalsContact O-CB 3.28Å; E969-E973 WeakPolarHBondContact O-CB 3.46Å; E969-E973 PolarHBondContact O-N 3.03Å
970G80.1Confident78.3Confident24 Ų24106.5 Ų106.525%0.24752%0.523CS..Hα-helixtrans-64.9-23.9174.500000114.5I966 L967 L968 K974I966-G970 WeakPolarHBondContact O-CA 3.41Å; I966-G970 PolarHBondContact O-N 3.12Å; L967-G970 CarbonylContact O-C 3.45Å; L967-G970 PolarHBondContact O-N 3.13Å; L968-G970 VanDerWaalsContact C-N 3.28Å; L968-G970 PolarHBondContact O-N 3.11Å; G970-K974 VanDerWaalsContact O-CD 3.25Å; G970-K974 WeakPolarHBondContact O-CD 3.08Å; G970-K974 WeakPolarHBondContact O-CG 3.43Å; G970-K974 PolarHBondContact O-N 3.05Å
971T77.2Confident77.9Confident77 Ų77106.1 Ų106.147%0.47252%0.518SS..Hα-helixtrans-85.5-35.1169.755.40000112.9L967 L968 E969 K974 F975L967-T971 WeakPolarHBondContact O-CG2 3.36Å; L967-T971 PolarHBondContact O-N 3.18Å; L967-T971 PolarHBondContact O-OG1 2.88Å; L968-T971 CarbonylContact O-C 3.58Å; L968-T971 WeakPolarHBondContact O-CA 3.47Å; L968-T971 PolarHBondContact O-N 2.93Å; L968-T971 PolarHBondContact O-OG1 3.39Å; E969-T971 VanDerWaalsContact C-N 3.26Å; E969-T971 PolarHBondContact O-N 3.06Å; T971-K974 PolarHBondContact O-N 3Å; T971-F975 WeakPolarHBondContact O-CB 3.4Å; T971-F975 PolarHBondContact O-N 2.7Å
972E79.7Confident77.4Confident83 Ų83109.3 Ų109.339%0.38854%0.54SS..Hα-helixtrans-66.6-39.7172.7-75.7-160.5-150.400111.7L968 E969 F975 R976L968-E972 PolarHBondContact O-N 2.83Å; E969-E972 PolarHBondContact O-N 3.03Å; E972-F975 CarbonylContact O-C 3.59Å; E972-F975 WeakPolarHBondContact O-CB 3.47Å; E972-F975 PolarHBondContact O-N 2.76Å; E972-F975 VanDerWaalsContact O-N 3.12Å; E972-R976 WeakPolarHBondContact O-CB 3.34Å; E972-R976 VanDerWaalsContact O-CG 3.23Å; E972-R976 WeakPolarHBondContact O-CG 3.38Å; E972-R976 PolarHBondContact O-N 2.84Å; E972-R976 IonicContact OE2-CZ 2.68Å; E972-R976 IonicContact OE2-NE 3.77Å; E972-R976 IonicContact OE2-NH2 2.67Å; E972-R976 PolarHBondContact OE2-NH2 2.73Å
973E78.3Confident77.1Confident121 Ų121113.5 Ų113.557%0.56556%0.558SS**Hα-helixtrans-66.8-40.9176.2-172.3170.7-128.400110.8E969 F975 R976 N977E969-E973 VanDerWaalsContact O-CB 3.28Å; E969-E973 WeakPolarHBondContact O-CB 3.46Å; E969-E973 PolarHBondContact O-N 3.03Å; E973-F975 PolarHBondContact O-N 2.74Å; E973-R976 PolarHBondContact O-N 2.78Å; E973-N977 VanDerWaalsContact CG-ND2 3.27Å; E973-N977 WeakPolarHBondContact CG-ND2 3.44Å; E973-N977 VanDerWaalsContact O-CB 3.24Å; E973-N977 WeakPolarHBondContact O-CB 2.95Å; E973-N977 PolarHBondContact O-N 3.18Å
974K77.4Confident76.8Confident164 Ų164114.3 Ų114.371%0.71356%0.555SS**Hα-helixtrans-63.2-27.5169.5-74.4170.1-171.3171.40113.4G970 T971 R978G970-K974 VanDerWaalsContact O-CD 3.25Å; G970-K974 WeakPolarHBondContact O-CD 3.08Å; G970-K974 WeakPolarHBondContact O-CG 3.43Å; G970-K974 PolarHBondContact O-N 3.05Å; T971-K974 PolarHBondContact O-N 3Å; K974-R978 PolarHBondContact O-N 3.45Å
975F73.3Confident76.7Confident153 Ų153114.2 Ų114.267%0.67155%0.554SS**Hα-helixtrans-79.5-40.1175-176.7-94.5000112.2T971 E972 E973 R978T971-F975 WeakPolarHBondContact O-CB 3.4Å; T971-F975 PolarHBondContact O-N 2.7Å; E972-F975 CarbonylContact O-C 3.59Å; E972-F975 WeakPolarHBondContact O-CB 3.47Å; E972-F975 PolarHBondContact O-N 2.76Å; E972-F975 VanDerWaalsContact O-N 3.12Å; E973-F975 PolarHBondContact O-N 2.74Å; F975-R978 WeakPolarHBondContact O-CB 3.37Å
976R74.5Confident76.5Confident181 Ų181116.7 Ų116.768%0.68357%0.566SS**Hα-helixtrans-73-39.9178.2-68170.2-165.8-167.27.3112.3E972 E973 R978E972-R976 WeakPolarHBondContact O-CB 3.34Å; E972-R976 VanDerWaalsContact O-CG 3.23Å; E972-R976 WeakPolarHBondContact O-CG 3.38Å; E972-R976 PolarHBondContact O-N 2.84Å; E972-R976 IonicContact OE2-CZ 2.68Å; E972-R976 IonicContact OE2-NE 3.77Å; E972-R976 IonicContact OE2-NH2 2.67Å; E972-R976 PolarHBondContact OE2-NH2 2.73Å; E973-R976 PolarHBondContact O-N 2.78Å; R976-R978 VanDerWaalsContact C-N 3.27Å; R976-R978 PolarHBondContact O-N 3.41Å
977N73.1Confident76.5Confident118 Ų118114.5 Ų114.563%0.63156%0.558SS**THydrogen-bonded Turntrans-91.620.6177.9-60.7-21.3000112.5E973 E979E973-N977 VanDerWaalsContact CG-ND2 3.27Å; E973-N977 WeakPolarHBondContact CG-ND2 3.44Å; E973-N977 VanDerWaalsContact O-CB 3.24Å; E973-N977 WeakPolarHBondContact O-CB 2.95Å; E973-N977 PolarHBondContact O-N 3.18Å; N977-E979 PolarHBondContact O-N 2.93Å
978R73.2Confident76.3Confident172 Ų172112.6 Ų112.665%0.64955%0.547SS*.PPolyproline II helixtrans-66.5126.7174.4178.8177.3175.2166.22.2109.8K974 F975 R976K974-R978 PolarHBondContact O-N 3.45Å; F975-R978 WeakPolarHBondContact O-CB 3.37Å; R976-R978 VanDerWaalsContact C-N 3.27Å; R976-R978 PolarHBondContact O-N 3.41Å
979E69.1Low76.3Confident177 Ų177110.8 Ų110.883%0.82755%0.545SS*.PPolyproline II helixtrans-56.9138.6176.1-61.2-177.9152.100111.5N977N977-E979 PolarHBondContact O-N 2.93Å
980S69.3Low76.2Confident76 Ų76108.8 Ų108.853%0.53154%0.536SS..PPolyproline II helixtrans-63150.6171.9-53.20000110.1
981R74.3Confident76.3Confident136 Ų136112.1 Ų112.151%0.51355%0.548SS..PPolyproline II helixtrans-67.2153.7-171.8-55.3-174.3-173.5-167.32.1111E983 D984 L985R981-E983 HydrophobicContact CB-CB 4.09Å; R981-E983 WeakPolarHBondContact CD-OE2 3.08Å; R981-E983 IonicContact CZ-OE2 2.74Å; R981-E983 IonicContact NE-OE2 2.75Å; R981-E983 IonicContact NH1-OE2 3.96Å; R981-E983 PolarHBondContact NH1-OE2 2.81Å; R981-E983 PolarHBondContact O-N 3.23Å; R981-D984 HydrophobicContact CB-CB 4.47Å; R981-D984 VanDerWaalsContact CB-OD2 3.23Å; R981-D984 WeakPolarHBondContact CB-OD2 3.38Å; R981-D984 VanDerWaalsContact CG-OD2 3.31Å; R981-D984 WeakPolarHBondContact CG-OD2 3.49Å; R981-D984 PolarHBondContact N-OD2 3.35Å; R981-D984 PolarHBondContact O-N 2.73Å; R981-L985 WeakPolarHBondContact O-CG 3.45Å; R981-L985 PolarHBondContact O-N 3.47Å
982P71.1Confident76.4Confident99 Ų99115.1 Ų115.164%0.64355%0.554SS**Hα-helixtrans-56.5-34.8168.924.5-34000111.4L985 Q986P982-L985 PolarHBondContact O-N 2.96Å; P982-Q986 WeakPolarHBondContact O-CB 3.26Å; P982-Q986 PolarHBondContact O-N 2.82Å
983E76.6Confident76.6Confident108 Ų108117.4 Ų117.451%0.50557%0.565SS.*Hα-helixtrans-51.1-54.8168.7-61.4127.2-114.800112.1R981 V987R981-E983 HydrophobicContact CB-CB 4.09Å; R981-E983 WeakPolarHBondContact CD-OE2 3.08Å; R981-E983 IonicContact CZ-OE2 2.74Å; R981-E983 IonicContact NE-OE2 2.75Å; R981-E983 IonicContact NH1-OE2 3.96Å; R981-E983 PolarHBondContact NH1-OE2 2.81Å; R981-E983 PolarHBondContact O-N 3.23Å; E983-V987 WeakPolarHBondContact O-CG2 3.4Å; E983-V987 PolarHBondContact O-N 2.87Å; E983-V987 VanDerWaalsContact O-N 3.08Å
984D74.9Confident76.8Confident74 Ų74115.4 Ų115.440%0.39656%0.557SS.*Hα-helixtrans-65.5-41.8-177.2-55.4-47000111.3R981 I988R981-D984 HydrophobicContact CB-CB 4.47Å; R981-D984 VanDerWaalsContact CB-OD2 3.23Å; R981-D984 WeakPolarHBondContact CB-OD2 3.38Å; R981-D984 VanDerWaalsContact CG-OD2 3.31Å; R981-D984 WeakPolarHBondContact CG-OD2 3.49Å; R981-D984 PolarHBondContact N-OD2 3.35Å; R981-D984 PolarHBondContact O-N 2.73Å; D984-I988 WeakPolarHBondContact O-CB 3.48Å; D984-I988 WeakPolarHBondContact O-CD1 3.42Å; D984-I988 WeakPolarHBondContact O-CG1 3.45Å; D984-I988 PolarHBondContact O-N 3.31Å
985L77.1Confident77.1Confident101 Ų101111.2 Ų111.253%0.52955%0.545SS..Hα-helixtrans-68.2-39.9-178.7-69173.7000112.2R981 P982 I988 A989R981-L985 WeakPolarHBondContact O-CG 3.45Å; R981-L985 PolarHBondContact O-N 3.47Å; P982-L985 PolarHBondContact O-N 2.96Å; L985-I988 PolarHBondContact O-N 3.16Å; L985-A989 PolarHBondContact O-N 3.3Å
986Q78.3Confident77.5Confident120 Ų120107.9 Ų107.956%0.56154%0.537SS*.Hα-helixtrans-67.1-46175.7-179.2171-19.500111.1P982 I988 A989 E990P982-Q986 WeakPolarHBondContact O-CB 3.26Å; P982-Q986 PolarHBondContact O-N 2.82Å; Q986-I988 VanDerWaalsContact C-N 3.26Å; Q986-I988 PolarHBondContact O-N 3.41Å; Q986-A989 WeakPolarHBondContact O-CA 3.42Å; Q986-A989 WeakPolarHBondContact O-CB 3.39Å; Q986-A989 PolarHBondContact O-N 3.07Å; Q986-E990 HydrophobicContact CG-CG 4.42Å; Q986-E990 VanDerWaalsContact CG-OE1 3.3Å; Q986-E990 WeakPolarHBondContact CG-OE1 3.37Å; Q986-E990 PolarHBondContact NE2-OE1 3.25Å; Q986-E990 PolarHBondContact O-N 2.85Å
987V82.6Confident77.9Confident73 Ų73105.2 Ų105.244%0.44253%0.532SS..Hα-helixtrans-59.3-37.9174.6169.60000111.4E983 A989 L991E983-V987 WeakPolarHBondContact O-CG2 3.4Å; E983-V987 PolarHBondContact O-N 2.87Å; E983-V987 VanDerWaalsContact O-N 3.08Å; V987-A989 VanDerWaalsContact C-N 3.33Å; V987-A989 PolarHBondContact O-N 3.16Å; V987-L991 HydrophobicContact CG1-CD1 3.71Å; V987-L991 HydrophobicContact CG1-CG 4.24Å; V987-L991 VanDerWaalsContact O-CB 3.23Å; V987-L991 WeakPolarHBondContact O-CB 3.22Å; V987-L991 WeakPolarHBondContact O-CD1 3.43Å; V987-L991 WeakPolarHBondContact O-CG 3.4Å; V987-L991 PolarHBondContact O-N 2.88Å
988I77.6Confident78.3Confident80 Ų80106.7 Ų106.741%0.4153%0.529SS..Hα-helixtrans-67.2-30.3174.4-73.5166.3000112.6D984 L985 Q986 K992D984-I988 WeakPolarHBondContact O-CB 3.48Å; D984-I988 WeakPolarHBondContact O-CD1 3.42Å; D984-I988 WeakPolarHBondContact O-CG1 3.45Å; D984-I988 PolarHBondContact O-N 3.31Å; L985-I988 PolarHBondContact O-N 3.16Å; Q986-I988 VanDerWaalsContact C-N 3.26Å; Q986-I988 PolarHBondContact O-N 3.41Å; I988-K992 HydrophobicContact CG2-CD 4.35Å; I988-K992 WeakPolarHBondContact O-CD 3.41Å; I988-K992 VanDerWaalsContact O-CG 3.23Å; I988-K992 WeakPolarHBondContact O-CG 3.38Å; I988-K992 PolarHBondContact O-N 3.48Å
989A81.3Confident78.7Confident54 Ų54104.7 Ų104.745%0.44653%0.527SS..Hα-helixtrans-72.6-52.2173.900000111.4L985 Q986 V987 L991 K992 E993L985-A989 PolarHBondContact O-N 3.3Å; Q986-A989 WeakPolarHBondContact O-CA 3.42Å; Q986-A989 WeakPolarHBondContact O-CB 3.39Å; Q986-A989 PolarHBondContact O-N 3.07Å; V987-A989 VanDerWaalsContact C-N 3.33Å; V987-A989 PolarHBondContact O-N 3.16Å; A989-L991 VanDerWaalsContact C-N 3.31Å; A989-L991 PolarHBondContact O-N 3.04Å; A989-K992 WeakPolarHBondContact O-CB 3.44Å; A989-K992 PolarHBondContact O-N 2.9Å; A989-E993 PolarHBondContact O-N 2.97Å
990E82.3Confident79.1Confident94 Ų9499.5 Ų99.544%0.43951%0.51SS..Hα-helixtrans-58.8-40.2178.6-68.1171.9-171.200111.9Q986 K992 E993 M994Q986-E990 HydrophobicContact CG-CG 4.42Å; Q986-E990 VanDerWaalsContact CG-OE1 3.3Å; Q986-E990 WeakPolarHBondContact CG-OE1 3.37Å; Q986-E990 PolarHBondContact NE2-OE1 3.25Å; Q986-E990 PolarHBondContact O-N 2.85Å; E990-K992 PolarHBondContact O-N 3.37Å; E990-E993 PolarHBondContact O-N 3.43Å; E990-M994 WeakPolarHBondContact O-CB 3.43Å; E990-M994 PolarHBondContact O-N 3.49Å
991L81.1Confident79.7Confident94 Ų94100.5 Ų100.549%0.49251%0.509SS..Hα-helixtrans-65.4-35174.3-75.2171000113.1V987 A989 M994 V995V987-L991 HydrophobicContact CG1-CD1 3.71Å; V987-L991 HydrophobicContact CG1-CG 4.24Å; V987-L991 VanDerWaalsContact O-CB 3.23Å; V987-L991 WeakPolarHBondContact O-CB 3.22Å; V987-L991 WeakPolarHBondContact O-CD1 3.43Å; V987-L991 WeakPolarHBondContact O-CG 3.4Å; V987-L991 PolarHBondContact O-N 2.88Å; A989-L991 VanDerWaalsContact C-N 3.31Å; A989-L991 PolarHBondContact O-N 3.04Å; L991-M994 HydrophobicContact CD2-CE 3.92Å; L991-V995 VanDerWaalsContact O-CG2 3.26Å; L991-V995 WeakPolarHBondContact O-CG2 3.38Å; L991-V995 PolarHBondContact O-N 3.31Å
992K80.4Confident80Confident139 Ų13998.4 Ų98.460%0.60451%0.511SS*.Hα-helixtrans-69.7-44175.8-77.7167.5-177.5170.70111.2I988 A989 E990 V995 T996I988-K992 HydrophobicContact CG2-CD 4.35Å; I988-K992 WeakPolarHBondContact O-CD 3.41Å; I988-K992 VanDerWaalsContact O-CG 3.23Å; I988-K992 WeakPolarHBondContact O-CG 3.38Å; I988-K992 PolarHBondContact O-N 3.48Å; A989-K992 WeakPolarHBondContact O-CB 3.44Å; A989-K992 PolarHBondContact O-N 2.9Å; E990-K992 PolarHBondContact O-N 3.37Å; K992-V995 PolarHBondContact O-N 3.06Å; K992-T996 PolarHBondContact O-N 3.15Å; K992-T996 PolarHBondContact O-OG1 3.28Å
993E83.6Confident80.5Confident132 Ų132100.7 Ų100.762%0.61751%0.511SS*.Hα-helixtrans-60.4-52178-167.7159.7-140.400110.5A989 E990 V995 T996 E997A989-E993 PolarHBondContact O-N 2.97Å; E990-E993 PolarHBondContact O-N 3.43Å; E993-V995 PolarHBondContact O-N 2.95Å; E993-V995 VanDerWaalsContact O-N 3.12Å; E993-T996 PolarHBondContact O-N 3.14Å; E993-T996 PolarHBondContact O-OG1 2.85Å; E993-E997 PolarHBondContact O-N 3.42Å
994M82Confident80.7Confident78 Ų78102 Ų10238%0.38452%0.515SS..Hα-helixtrans-56.9-26.1173.8-89.9-150.9-63.600115.3E990 L991 R998E990-M994 WeakPolarHBondContact O-CB 3.43Å; E990-M994 PolarHBondContact O-N 3.49Å; L991-M994 HydrophobicContact CD2-CE 3.92Å; M994-R998 WeakPolarHBondContact O-CG 3.15Å; M994-R998 PolarHBondContact O-N 3.12Å; M994-R998 PolarHBondContact O-NH1 3.23Å; M994-R998 PolarHBondContact SD-NH1 3.45Å; M994-R998 VanDerWaalsContact SD-NH1 3.44Å
995V83.6Confident80.9Confident76 Ų76103.6 Ų103.646%0.46152%0.523SS..Hα-helixtrans-75.8-48.2173164.20000109.8L991 K992 E993 E997 R998 E999L991-V995 VanDerWaalsContact O-CG2 3.26Å; L991-V995 WeakPolarHBondContact O-CG2 3.38Å; L991-V995 PolarHBondContact O-N 3.31Å; K992-V995 PolarHBondContact O-N 3.06Å; E993-V995 PolarHBondContact O-N 2.95Å; E993-V995 VanDerWaalsContact O-N 3.12Å; V995-E997 VanDerWaalsContact C-N 3.32Å; V995-E997 PolarHBondContact O-N 2.76Å; V995-R998 PolarHBondContact O-N 3.3Å; V995-R998 VanDerWaalsContact O-N 3.16Å; V995-E999 HydrophobicContact CG1-CG 4.45Å; V995-E999 WeakPolarHBondContact O-CG 3.43Å; V995-E999 PolarHBondContact O-N 2.74Å
996T81Confident81Confident84 Ų84102.4 Ų102.452%0.51552%0.52SS..Hα-helixtrans-62.5-36.817857.60000113K992 E993 E999 S1000K992-T996 PolarHBondContact O-N 3.15Å; K992-T996 PolarHBondContact O-OG1 3.28Å; E993-T996 PolarHBondContact O-N 3.14Å; E993-T996 PolarHBondContact O-OG1 2.85Å; T996-E999 PolarHBondContact O-N 3.17Å; T996-S1000 PolarHBondContact O-N 3.45Å
997E83.3Confident81Confident124 Ų124100.4 Ų100.458%0.57951%0.513SS*.Hα-helixtrans-60.2-49.2171.7-71.3-168.5130.600111.8E993 V995 E999 S1000 L1001E993-E997 PolarHBondContact O-N 3.42Å; V995-E997 VanDerWaalsContact C-N 3.32Å; V995-E997 PolarHBondContact O-N 2.76Å; E997-E999 PolarHBondContact O-N 3.21Å; E997-S1000 WeakPolarHBondContact O-CB 3.1Å; E997-S1000 PolarHBondContact O-N 2.7Å; E997-S1000 PolarHBondContact O-OG 3Å; E997-L1001 PolarHBondContact O-N 3.49Å
998R81.6Confident80.8Confident149 Ų149100.9 Ų100.956%0.56251%0.513SS*.Hα-helixtrans-63.9-39.9179.4-79.8-177.3175.982.8-2.9112.4M994 V995 S1000 L1001 V1002M994-R998 WeakPolarHBondContact O-CG 3.15Å; M994-R998 PolarHBondContact O-N 3.12Å; M994-R998 PolarHBondContact O-NH1 3.23Å; M994-R998 PolarHBondContact SD-NH1 3.45Å; M994-R998 VanDerWaalsContact SD-NH1 3.44Å; V995-R998 PolarHBondContact O-N 3.3Å; V995-R998 VanDerWaalsContact O-N 3.16Å; R998-S1000 VanDerWaalsContact C-N 3.3Å; R998-S1000 PolarHBondContact O-N 3.12Å; R998-L1001 PolarHBondContact O-N 3.03Å; R998-V1002 WeakPolarHBondContact O-CG2 3.26Å; R998-V1002 PolarHBondContact O-N 2.96Å
999E81.4Confident80.7Confident130 Ų130103.3 Ų103.361%0.60752%0.521SS*.Hα-helixtrans-61.7-39.1174-72.1-178.2165.800111.5V995 T996 E997 K1003V995-E999 HydrophobicContact CG1-CG 4.45Å; V995-E999 WeakPolarHBondContact O-CG 3.43Å; V995-E999 PolarHBondContact O-N 2.74Å; T996-E999 PolarHBondContact O-N 3.17Å; E997-E999 PolarHBondContact O-N 3.21Å; E999-K1003 PolarHBondContact O-N 3.47Å
1000S78.2Confident80.3Confident68 Ų68106.8 Ų106.848%0.47653%0.526SS..Hα-helixtrans-65.7-37.4174.687.60000113.1T996 E997 R998 K1004T996-S1000 PolarHBondContact O-N 3.45Å; E997-S1000 WeakPolarHBondContact O-CB 3.1Å; E997-S1000 PolarHBondContact O-N 2.7Å; E997-S1000 PolarHBondContact O-OG 3Å; R998-S1000 VanDerWaalsContact C-N 3.3Å; R998-S1000 PolarHBondContact O-N 3.12Å; S1000-K1004 PolarHBondContact O-N 3.03Å
1001L81.9Confident80Confident98 Ų98108.7 Ų108.751%0.51353%0.533SS..Hα-helixtrans-72.9-43.5-179.7-175.564.6000111.8E997 R998 K1003 K1004 L1005E997-L1001 PolarHBondContact O-N 3.49Å; R998-L1001 PolarHBondContact O-N 3.03Å; L1001-K1003 PolarHBondContact O-N 2.68Å; L1001-K1004 PolarHBondContact O-N 3.12Å; L1001-L1005 HydrophobicContact CG-CD1 4.32Å; L1001-L1005 WeakPolarHBondContact O-CG 3.39Å; L1001-L1005 PolarHBondContact O-N 3.08Å
1002V81.1Confident79.8Confident91 Ų91111.2 Ų111.255%0.55254%0.537SS*.Hα-helixtrans-58.3-38.5174.6168.60000110.8R998 L1005 V1006R998-V1002 WeakPolarHBondContact O-CG2 3.26Å; R998-V1002 PolarHBondContact O-N 2.96Å; V1002-L1005 PolarHBondContact O-N 2.7Å; V1002-V1006 HydrophobicContact CG1-CG2 4.49Å; V1002-V1006 WeakPolarHBondContact O-CG2 3.49Å; V1002-V1006 PolarHBondContact O-N 3.33Å; V1002-V1006 VanDerWaalsContact O-N 3.13Å
1003K80.3Confident79.2Confident147 Ų147110 Ų11064%0.63953%0.533SS*.Hα-helixtrans-60.1-47.6177.1-168.9176.4-180-178.60112.3E999 L1001 V1006 D1007E999-K1003 PolarHBondContact O-N 3.47Å; L1001-K1003 PolarHBondContact O-N 2.68Å; K1003-V1006 PolarHBondContact O-N 2.64Å; K1003-D1007 PolarHBondContact O-N 3.2Å
1004K81.2Confident78.8Confident137 Ų137109.9 Ų109.960%0.59654%0.536SS*.Hα-helixtrans-57.7-50.7176.7-68.6179.1179.4176.40111.8S1000 L1001 V1006 D1007 D1008S1000-K1004 PolarHBondContact O-N 3.03Å; L1001-K1004 PolarHBondContact O-N 3.12Å; K1004-V1006 PolarHBondContact O-N 3.4Å; K1004-D1007 PolarHBondContact O-N 2.76Å; K1004-D1008 PolarHBondContact O-N 2.63Å
1005L79.7Confident78.5Confident107 Ų107110 Ų11056%0.5654%0.536SS*.Hα-helixtrans-62.1-27.5-178-65.8171.1000113.5L1001 V1002 K1009L1001-L1005 HydrophobicContact CG-CD1 4.32Å; L1001-L1005 WeakPolarHBondContact O-CG 3.39Å; L1001-L1005 PolarHBondContact O-N 3.08Å; V1002-L1005 PolarHBondContact O-N 2.7Å; L1005-K1009 WeakPolarHBondContact O-CB 3.21Å; L1005-K1009 PolarHBondContact O-N 3.05Å
1006V78.2Confident77.7Confident76 Ų76112.4 Ų112.446%0.46155%0.545SS..Hα-helixtrans-73.8-34.6174.2167.10000112.2V1002 K1003 K1004V1002-V1006 HydrophobicContact CG1-CG2 4.49Å; V1002-V1006 WeakPolarHBondContact O-CG2 3.49Å; V1002-V1006 PolarHBondContact O-N 3.33Å; V1002-V1006 VanDerWaalsContact O-N 3.13Å; K1003-V1006 PolarHBondContact O-N 2.64Å; K1004-V1006 PolarHBondContact O-N 3.4Å
1007D78.6Confident77.1Confident78 Ų78112.2 Ų112.242%0.41754%0.544SS..Hα-helixtrans-79.4-39.1177.8-69.9-35.3000111.5K1003 K1004 K1009 K1010 F1011K1003-D1007 PolarHBondContact O-N 3.2Å; K1004-D1007 PolarHBondContact O-N 2.76Å; D1007-K1009 VanDerWaalsContact C-N 3.29Å; D1007-K1009 PolarHBondContact O-N 3.11Å; D1007-K1010 WeakPolarHBondContact O-CB 3.23Å; D1007-K1010 PolarHBondContact O-N 3.04Å; D1007-K1010 VanDerWaalsContact O-N 3.1Å; D1007-K1010 IonicContact OD1-NZ 3.68Å; D1007-K1010 PolarHBondContact OD1-NZ 2.79Å; D1007-F1011 PolarHBondContact O-N 3.01Å
1008D78.1Confident76.3Confident83 Ų83112.5 Ų112.544%0.44455%0.55SS..Hα-helixtrans-57.5-41.6171.4-65.7-33000111.6K1004 K1010 F1011 Y1012K1004-D1008 PolarHBondContact O-N 2.63Å; D1008-K1010 VanDerWaalsContact C-N 3.31Å; D1008-K1010 PolarHBondContact O-N 3.28Å; D1008-F1011 WeakPolarHBondContact O-CB 3.4Å; D1008-F1011 PolarHBondContact O-N 3.07Å; D1008-Y1012 VanDerWaalsContact O-CD2 3.26Å; D1008-Y1012 WeakPolarHBondContact O-CD2 3.39Å; D1008-Y1012 PolarHBondContact O-N 3.48Å
1009K75.6Confident75.5Confident131 Ų131113.4 Ų113.457%0.5755%0.553SS**Hα-helixtrans-56.9-42.4175.2178.4-174.7171.6-175.10112.2L1005 D1007 F1011 Q1013L1005-K1009 WeakPolarHBondContact O-CB 3.21Å; L1005-K1009 PolarHBondContact O-N 3.05Å; D1007-K1009 VanDerWaalsContact C-N 3.29Å; D1007-K1009 PolarHBondContact O-N 3.11Å; K1009-F1011 VanDerWaalsContact C-N 3.32Å; K1009-F1011 PolarHBondContact O-N 3.01Å; K1009-Q1013 VanDerWaalsContact CE-OE1 3.23Å; K1009-Q1013 WeakPolarHBondContact O-CG 3.34Å; K1009-Q1013 PolarHBondContact O-N 3.32Å
1010K73.6Confident74.1Confident127 Ų127113 Ų11355%0.55255%0.551SS**Hα-helixtrans-64.8-37.5179.4-73.1172-176.5157.80111.8D1007 D1008 L1014D1007-K1010 WeakPolarHBondContact O-CB 3.23Å; D1007-K1010 PolarHBondContact O-N 3.04Å; D1007-K1010 VanDerWaalsContact O-N 3.1Å; D1007-K1010 IonicContact OD1-NZ 3.68Å; D1007-K1010 PolarHBondContact OD1-NZ 2.79Å; D1008-K1010 VanDerWaalsContact C-N 3.31Å; D1008-K1010 PolarHBondContact O-N 3.28Å; K1010-L1014 PolarHBondContact O-N 3.03Å
1011F76.6Confident73.2Confident134 Ų134115 Ų11559%0.58856%0.561SS**Hα-helixtrans-60.8-55.9-179.8-177-93.9000111.2D1007 D1008 K1009 Q1013 L1014 E1015D1007-F1011 PolarHBondContact O-N 3.01Å; D1008-F1011 WeakPolarHBondContact O-CB 3.4Å; D1008-F1011 PolarHBondContact O-N 3.07Å; K1009-F1011 VanDerWaalsContact C-N 3.32Å; K1009-F1011 PolarHBondContact O-N 3.01Å; F1011-Q1013 VanDerWaalsContact C-N 3.32Å; F1011-Q1013 PolarHBondContact O-N 3.42Å; F1011-L1014 PolarHBondContact O-N 3.02Å; F1011-L1014 VanDerWaalsContact O-N 3.12Å; F1011-E1015 PolarHBondContact O-N 2.85Å
1012Y75Confident71.8Confident146 Ų146117.2 Ų117.257%0.57357%0.573SS**Hα-helixtrans-66.1-31.3-177.7-65.6-63.1000113.8D1008 L1014 E1015 L1016D1008-Y1012 VanDerWaalsContact O-CD2 3.26Å; D1008-Y1012 WeakPolarHBondContact O-CD2 3.39Å; D1008-Y1012 PolarHBondContact O-N 3.48Å; Y1012-L1014 VanDerWaalsContact C-N 3.28Å; Y1012-L1014 PolarHBondContact O-N 3.07Å; Y1012-E1015 PolarHBondContact O-N 3.14Å; Y1012-L1016 PolarHBondContact O-N 3.48Å
1013Q69.8Low70.4Confident115 Ų115119.7 Ų119.754%0.53758%0.576SS.*Hα-helixtrans-67.2-26.6175.3-71.7-167.2-72.200113.1K1009 F1011 V1017K1009-Q1013 VanDerWaalsContact CE-OE1 3.23Å; K1009-Q1013 WeakPolarHBondContact O-CG 3.34Å; K1009-Q1013 PolarHBondContact O-N 3.32Å; F1011-Q1013 VanDerWaalsContact C-N 3.32Å; F1011-Q1013 PolarHBondContact O-N 3.42Å; Q1013-V1017 WeakPolarHBondContact O-CG2 2.97Å
1014L73.4Confident69Low129 Ų129117.6 Ų117.668%0.67557%0.572SS**Hα-helixtrans-78.5-36.4174-112.269000112.9K1010 F1011 Y1012 N1018K1010-L1014 PolarHBondContact O-N 3.03Å; F1011-L1014 PolarHBondContact O-N 3.02Å; F1011-L1014 VanDerWaalsContact O-N 3.12Å; Y1012-L1014 VanDerWaalsContact C-N 3.28Å; Y1012-L1014 PolarHBondContact O-N 3.07Å; L1014-N1018 PolarHBondContact O-N 3.09Å
1015E76.1Confident67.6Low81 Ų81120.9 Ų120.938%0.37959%0.586SS.*Hα-helixtrans-72.5-36.4-177-160.5-173166.900112.6F1011 Y1012 N1018 R1019F1011-E1015 PolarHBondContact O-N 2.85Å; Y1012-E1015 PolarHBondContact O-N 3.14Å; E1015-N1018 PolarHBondContact O-N 2.97Å; E1015-R1019 PolarHBondContact O-N 3.18Å; E1015-R1019 IonicContact OE1-CZ 2.72Å; E1015-R1019 IonicContact OE1-NH1 3.79Å; E1015-R1019 PolarHBondContact OE1-NH1 3.23Å; E1015-R1019 IonicContact OE1-NH2 3.18Å
1016L67.9Low66Low125 Ų125120.4 Ų120.465%0.65459%0.588SS**Hα-helixtrans-65.1-47.9178.6-89.7155.8000112.5Y1012 N1018 R1019 E1020Y1012-L1016 PolarHBondContact O-N 3.48Å; L1016-N1018 PolarHBondContact O-N 3.28Å; L1016-R1019 PolarHBondContact O-N 3.48Å; L1016-E1020 PolarHBondContact O-N 3.38Å; L1016-E1020 VanDerWaalsContact O-N 3.09Å
1017V68.2Low64.8Low81 Ų81123.5 Ų123.549%0.49160%0.595SS.*Hα-helixtrans-62.9-30.9-179.7176.40000111.9Q1013 R1019 E1020Q1013-V1017 WeakPolarHBondContact O-CG2 2.97Å; V1017-R1019 VanDerWaalsContact C-N 3.32Å; V1017-R1019 PolarHBondContact O-N 3.15Å; V1017-E1020 WeakPolarHBondContact O-CB 3.44Å; V1017-E1020 PolarHBondContact O-N 2.99Å
1018N66Low63.6Low130 Ų130126.3 Ų126.370%0.69561%0.61SS**Hα-helixtrans-71.6-20.4173.7-90.8-29.1000114.1L1014 E1015 L1016L1014-N1018 PolarHBondContact O-N 3.09Å; E1015-N1018 PolarHBondContact O-N 2.97Å; L1016-N1018 PolarHBondContact O-N 3.28Å
1019R64.2Low62.6Low168 Ų168127.3 Ų127.363%0.63463%0.63SS**Hα-helixtrans-88.4-27.1171.1-77.7-171.9169.288.2-6.7113E1015 L1016 V1017 T1021E1015-R1019 PolarHBondContact O-N 3.18Å; E1015-R1019 IonicContact OE1-CZ 2.72Å; E1015-R1019 IonicContact OE1-NH1 3.79Å; E1015-R1019 PolarHBondContact OE1-NH1 3.23Å; E1015-R1019 IonicContact OE1-NH2 3.18Å; L1016-R1019 PolarHBondContact O-N 3.48Å; V1017-R1019 VanDerWaalsContact C-N 3.32Å; V1017-R1019 PolarHBondContact O-N 3.15Å; R1019-T1021 PolarHBondContact O-N 3.35Å
1020E52Low61.2Low122 Ų122126.8 Ų126.857%0.5764%0.643SS**Hα-helixtrans-58.7-26.8-177.4-165.4169.7-172.800113.9L1016 V1017 N1024L1016-E1020 PolarHBondContact O-N 3.38Å; L1016-E1020 VanDerWaalsContact O-N 3.09Å; V1017-E1020 WeakPolarHBondContact O-CB 3.44Å; V1017-E1020 PolarHBondContact O-N 2.99Å; E1020-N1024 PolarHBondContact O-ND2 2.91Å
1021T59.7Low60.5Low110 Ų110126.7 Ų126.768%0.67566%0.655SS**THydrogen-bonded Turntrans-91.4-13.8-170.451.60000116.3R1019R1019-T1021 PolarHBondContact O-N 3.35Å
1022N53.2Low58.8Low143 Ų143127.7 Ų127.777%0.76567%0.667SS**THydrogen-bonded Turntrans-114.5-31.8-167.2-131.2-24.1000115.4
1023F51.7Low57.4Low143 Ų143127.6 Ų127.663%0.62768%0.681SS**SBendtrans-87.2-10.8178.5-154.3-100.8000113.9K1025 V1026F1023-K1025 PolarHBondContact O-N 2.93Å; F1023-V1026 HydrophobicContact CE1-CB 4.25Å; F1023-V1026 HydrophobicContact CZ-CB 4.43Å; F1023-V1026 PolarHBondContact O-N 2.67Å
1024N50.9Low56.2Low103 Ų103125.5 Ų125.555%0.55169%0.691SS**THydrogen-bonded Turntrans-69.822.6178.2-95.1-50.9000115E1020E1020-N1024 PolarHBondContact O-ND2 2.91Å
1025K50.7Low54.9Low206 Ų206126.4 Ų126.490%0.89670%0.701SS**THydrogen-bonded Turntrans-105.46.1161-77.7-175.1175.1177.30113.3F1023F1023-K1025 PolarHBondContact O-N 2.93Å
1026V45.8Very low53.1Low97 Ų97130.4 Ų130.459%0.58872%0.723SS**THydrogen-bonded Turntrans-130.6-38.4176.9-159.80000114.5F1023F1023-V1026 HydrophobicContact CE1-CB 4.25Å; F1023-V1026 HydrophobicContact CZ-CB 4.43Å; F1023-V1026 PolarHBondContact O-N 2.67Å
1027F53.4Low51.7Low141 Ų141129.6 Ų129.662%0.61872%0.72SS**  trans-156.3132.4-178.4-86.4-78.2000117.7
1028N53.1Low50.6Low138 Ų138131.6 Ų131.674%0.73873%0.734SS**  trans47.8136.5139.5-66.7-4.4000128.5
1029A57.3Low49.6Very low103 Ų103131.9 Ų131.985%0.85174%0.735SS**  trans86.9147135.800000124.9
1030S46.9Very low48.3Very low120 Ų120129.6 Ų129.684%0.83973%0.734SS**  trans-166.1170.8176.756.90000116.8
1031P57.6Low47.7Very low126 Ų126132.3 Ų132.382%0.81874%0.744SS**  trans-137.8-165.2-161.345.9-28.8000119
1032N42.5Very low46.6Very low155 Ų155134.5 Ų134.583%0.82975%0.747SS**  trans147.5153.4134.8-163.528.4000119.9
1033V44.7Very low45.8Very low143 Ų143136 Ų13687%0.86775%0.747SS**  trans-159159.5175.7-160.80000115.1
1034G43.8Very low44.9Very low72 Ų72137.4 Ų137.474%0.74275%0.752SS**  trans-178.2167.1168.300000119.5
1035V46.6Very low44Very low148 Ų148141.8 Ų141.890%0.89777%0.766SS**  trans-156.5143.4-176.7-175.20000115.8
1036I39.2Very low43Very low165 Ų165136.5 Ų136.585%0.84676%0.755SS**  trans-174.4168.5163.9-115.2169.4000110.7
1037N37.8Very low42.3Very low108 Ų108139.2 Ų139.258%0.57876%0.762SS**  cis-157.8165.818.2-155.56.2000112.4
1038P45.7Very low41.5Very low123 Ų123141.1 Ų141.180%0.79977%0.77SS**  -153.3163.2114.838.2-19.6000118.3
1039L44Very low40.6Very low136 Ų136138.9 Ų138.971%0.71277%0.77SS**  trans-152174.3-167.3-63.9173.4000116
1040I36.7Very low39.4Very low119 Ų119138.4 Ų138.461%0.6177%0.766SS**  cis-172.7139.3-48.9-150.2173.7000114.3
1041K39.7Very low38.5Very low180 Ų180137.6 Ų137.678%0.78376%0.761SS**  trans61174.2166.4-65.3151.5-172.2177.40117.3
1042Q37.9Very low37.3Very low156 Ų156142.1 Ų142.173%0.72976%0.762SS**  cis-125.9-147.31.8-60.7175.418.800109.7
1043K35.8Very low36.8Very low175 Ų175142.6 Ų142.676%0.76176%0.763SS**  cis-166.1-172.6-5.5-134.5-178.9-177.5109.20106.2
1044K33.4Very low35.9Very low171 Ų171141.4 Ų141.474%0.74376%0.761SS**  cis-168.3123.8-4.9172.5-164.4176.8-171.80110.5
1045K32.1Very low35.4Very low196 Ų196142.6 Ų142.685%0.85276%0.758SS**  trans57.4142.8171.4-77.2-161.9173.5-165.70119
1046S28.5Very low35Very low95 Ų95139.7 Ų139.766%0.66474%0.744SS**  cis-165.2120.7-19.346.10000112.6
1047E31.8Very low35.4Very low153 Ų153135.2 Ų135.272%0.71573%0.726SS**  trans50.3116.9140.6-56.3-159.4111.900121.2
1048K35.8Very low35.5Very low181 Ų181131.9 Ų131.979%0.78771%0.708SS**  89.5155.274.4-78.6176.7-173.8164.70113.1
1049A33.7Very low35.3Very low91 Ų91130.2 Ų130.275%0.75269%0.692SS**  cis-176.8155.3-33.300000110.5
1050A32.3Very low35Very low93 Ų93134 Ų13477%0.76970%0.697SS**  trans73.310915100000122.8
1051S29.4Very low35.1Very low103 Ų103132.3 Ų132.372%0.7270%0.701SS**  81.4135.7111-148.60000123.1
1052R31.7Very low35Very low222 Ų222130.4 Ų130.484%0.83870%0.698SS**  trans76.2116.6157.8-71.8172-176.4-168.30.2121.5
1053L31.6Very low35Very low165 Ų165131.2 Ų131.286%0.86470%0.702SS**  34.5105.6126.3-60.6169.2000119
1054S27Very low35.1Very low117 Ų117127 Ų12782%0.81870%0.7SS**  175.7-178.7119.9530000113
1055S33.4Very low35Very low98 Ų98124 Ų12469%0.68571%0.708SS**  trans-43.9125.8-17446.60000122
1056S36.6Very low34.9Very low87 Ų87117.8 Ų117.861%0.60870%0.699SS**  81178.2120.6-40.80000119.3Q965Q965-S1056 PolarHBondContact NE2-O 3.1Å
1057P48Very low35.1Very low70 Ų70122.4 Ų122.446%0.45572%0.715SS.*  -117.5-148.4-113.70.826.6000120.6K958 I961 Q965K958-P1057 HydrophobicContact CG-CB 4.38Å; I961-P1057 VanDerWaalsContact CG2-C 3.44Å; I961-P1057 WeakPolarHBondContact CG2-O 3.35Å; Q965-P1057 PolarHBondContact NE2-O 2.85Å; Q965-P1057 PolarHBondContact OE1-O 3.37Å
1058N39.9Very low34.9Very low39 Ų39118.3 Ų118.321%0.20971%0.714CS.*  trans94.9150.7159.5-141.322.5000126.8K958 D959 I961K958-N1058 HydrophobicContact CB-CB 3.63Å; K958-N1058 WeakPolarHBondContact CB-ND2 3.26Å; K958-N1058 WeakPolarHBondContact CB-OD1 3.48Å; K958-N1058 HydrophobicContact CD-CB 4.39Å; K958-N1058 WeakPolarHBondContact CD-OD1 3.24Å; K958-N1058 WeakPolarHBondContact CE-OD1 3.47Å; K958-N1058 HydrophobicContact CG-CB 3.46Å; K958-N1058 VanDerWaalsContact CG-CB 3.46Å; K958-N1058 WeakPolarHBondContact CG-OD1 3.44Å; K958-N1058 WeakPolarHBondContact O-CB 3.31Å; K958-N1058 PolarHBondContact O-ND2 3.21Å; D959-N1058 PolarHBondContact N-ND2 3.49Å; D959-N1058 PolarHBondContact OD1-ND2 3.15Å; D959-N1058 VanDerWaalsContact OD1-ND2 3.17Å; I961-N1058 HydrophobicContact CG2-CB 4.12Å
1059L42Very low34.8Very low88 Ų88118.8 Ų118.846%0.46172%0.724SS.*  trans76.2149.4163.2-66.6-169.3000118.1D959D959-L1059 WeakPolarHBondContact OD1-CD2 3.36Å
1060R38.1Very low34.7Very low214 Ų214117.9 Ų117.981%0.80872%0.724SS**  cis-158.7147.38.5-139.9179.2-168.5176.53113.3
1061A37.9Very low34.9Very low85 Ų85120.3 Ų120.370%0.70273%0.729SS**  trans48.6-179.9142.300000121.7
1062L38.7Very low35.3Very low139 Ų139122.3 Ų122.373%0.72874%0.736SS**  cis-161.51666.6-160.966.7000112.3
1063E38.3Very low35.3Very low173 Ų173114.2 Ų114.281%0.80872%0.722SS**  trans67157.2154-88162.1-15900121.3
1064A36.1Very low35.4Very low86 Ų86113.7 Ų113.771%0.71173%0.726SS**  cis-164.3161.5-700000114.4
1065A32.1Very low35.6Very low110 Ų110111.8 Ų111.891%0.90973%0.725SS**  trans61.9160.5159.100000120.5
1066G29.6Very low36Very low65 Ų65114.2 Ų114.267%0.6774%0.735SS**  cis164.7143.9-12.300000114.4
1067L32.8Very low35.8Very low192 Ų192113.3 Ų113.3100%1.00574%0.74SS**  trans66161.8178.6-56.4167.2000116.4
1068G29Very low35.1Very low66 Ų66119.6 Ų119.668%0.6876%0.763SS**  cis162.1110.7-14.700000115.8
1069L32.7Very low34.9Very low191 Ų191122.4 Ų122.4100%178%0.782SS**  trans63.9138.3169.6-96.772.9000120.8
1070G31.3Very low35.6Very low73 Ų73123.1 Ų123.175%0.75379%0.792SS**  trans128.289.2146.900000120.7
1071V37.3Very low35.3Very low143 Ų143119.4 Ų119.487%0.86778%0.784SS**  trans5.9131.9133.7173.20000116.6
1072V38.1Very low35.1Very low145 Ų145117.9 Ų117.988%0.87977%0.766SS**  cis-169.7170-1.4106.10000108.1
1073G30.7Very low35.3Very low52 Ų52113.4 Ų113.454%0.53675%0.746SS.*  cis173.9164.9-3.500000113.8
1074T34.8Very low36.6Very low155 Ų155109.3 Ų109.395%0.95173%0.734SS**  trans51.3121.3167.558.50000119.6
1075G31.1Very low38Very low77 Ų77108.1 Ų108.179%0.79472%0.719SS**  cis175.5134.1-600000112.2
1076T40.7Very low39.2Very low148 Ų148108.6 Ų108.691%0.90871%0.713SS**  trans-131.6178.3-172.553.60000110
1077G33.3Very low39.6Very low68 Ų68113.4 Ų113.470%0.70172%0.722SS**  cis137.1116.6-3.600000113.1
1078Q32.9Very low40.6Very low202 Ų202109.5 Ų109.594%0.94471%0.709SS**  trans67.7161.7165.9-69.4-175-11.300122
1079T35Very low40.7Very low98 Ų98111.6 Ų111.660%0.60171%0.713SS**  trans-92.2-171.2-16652.50000115.3
1080P56.3Low40.8Very low103 Ų103113.2 Ų113.267%0.66971%0.706SS**  cis-140-163-16.128.1-1.9000116.4
1081Q33.2Very low40.8Very low137 Ų137117.3 Ų117.364%0.6471%0.71SS**  trans92.4147.9162.9-63.9-157.1-20.400119.3
1082T33.4Very low41.2Very low53 Ų53118 Ų11833%0.32570%0.704SS.*  cis-155.5-179.3-21.323.60000106.8T943 L947T943-T1082 CarbonylContact C-O 3.46Å; T943-T1082 VanDerWaalsContact C-O 3.32Å; T943-T1082 VanDerWaalsContact CG2-C 3.41Å; T943-T1082 WeakPolarHBondContact CG2-O 3.44Å; L947-T1082 WeakPolarHBondContact CA-O 3.3Å; L947-T1082 WeakPolarHBondContact CB-O 3.18Å; L947-T1082 WeakPolarHBondContact CD1-OG1 3.14Å; L947-T1082 WeakPolarHBondContact CG-O 3.48Å; L947-T1082 PolarHBondContact N-O 2.87Å
1083S42.1Very low41.9Very low44 Ų44115.9 Ų115.931%0.30869%0.692SS.*  cis-171.2152.7-13.245.70000111M946M946-S1083 CarbonylContact C-O 3.44Å; M946-S1083 WeakPolarHBondContact CB-O 3.35Å
1084P66.3Low42.2Very low88 Ų88120.1 Ų120.157%0.57170%0.701SS**  trans-82.6156.6-164.534.1-41.1000119.7M946M946-P1084 HydrophobicContact CE-CB 3.53Å; M946-P1084 HydrophobicContact SD-CB 4.29Å
1085P65.8Low43.1Very low61 Ų61118.1 Ų118.140%0.39669%0.691SS.*  -151.8-15392.341.2-19.9000113.5
1086P56.8Low43.2Very low119 Ų119122 Ų12277%0.77369%0.694SS**  cis-134.2-138-7.544.1-21.7000116.4
1087L37.5Very low44.4Very low166 Ų166119.9 Ų119.987%0.86968%0.682SS**  trans-153.2-170.4-169.6-83.4169.7000111.4
1088P53.6Low45.5Very low111 Ų111122.1 Ų122.172%0.72168%0.684SS**  cis-151.9179.411.847.8-26.3000122
1089S32.8Very low45.7Very low110 Ų110119.4 Ų119.477%0.76968%0.676SS**  trans67110.9139.3-67.60000129.8
1090R33.8Very low45.7Very low225 Ų225121.4 Ų121.485%0.84968%0.678SS**  66.3121.8110-157.2-160.4-169.6-1764.4125.3
1091L31.7Very low44.6Very low159 Ų159123.3 Ų123.383%0.83268%0.678SS**  167.2174122.4-89.4175.8000116.6
1092E45.2Very low44.8Very low158 Ų158123.5 Ų123.574%0.73868%0.682SS**  trans-113.1-153.9-164.3-133.8-157.7-71.100113.1
1093P52.5Low44.9Very low99 Ų99128.4 Ų128.464%0.64370%0.701SS**  cis-146.9167.37.847-27.4000121.3
1094I38.7Very low44.4Very low142 Ų142133.7 Ų133.773%0.72873%0.725SS**  trans55.6168.8135-66.8171.9000121
1095P52.2Low42.7Very low112 Ų112136.6 Ų136.673%0.72774%0.736SS**  cis-133.3143.5-14.930-7.3000120.5
1096N32.7Very low41.4Very low160 Ų160138.2 Ų138.286%0.85675%0.749SS**  59.5172.5119.1-108.110.4000127
1097P66.3Low40.5Very low103 Ų103140 Ų14067%0.66975%0.752SS**  trans-132.4-162.9-130.742.6-19.3000117
1098P56.5Low40.8Very low114 Ų114141.9 Ų141.974%0.7475%0.753SS**  -162.2148.8104.938.8-17.2000122.6
1099L36.7Very low40.9Very low146 Ų146141.7 Ų141.776%0.76475%0.752SS**  trans62.6174.9147.2-57.9177.2000120.6
1100H35.5Very low41.1Very low139 Ų139144 Ų14464%0.64476%0.755SS**  cis-168.4-177.5-6.8-114.8-14.2000108.8
1101H34.3Very low41.5Very low144 Ų144137.4 Ų137.467%0.66775%0.748SS**  cis-172.8153.1-46.5-111.5-147.3000114.4
1102L37.4Very low43.2Very low140 Ų140135.5 Ų135.573%0.73375%0.745SS**  trans63.7160.5154.6-62.3167.2000122.1
1103E33.8Very low43.9Very low157 Ų157133.5 Ų133.573%0.73475%0.746SS**  cis-172.5172.7-38.1-148.3176-122.800113.4
1104L31.5Very low43.6Very low155 Ų155135 Ų13581%0.81275%0.753SS**  trans84-177.6158.6-64.7170.1000122.6
1105N31.7Very low45Very low149 Ų149133.6 Ų133.680%0.79775%0.754SS**  -146.1160.8-127.8-160.1-1.6000118
1106S37.5Very low45.6Very low94 Ų94133.7 Ų133.766%0.65775%0.754SS**  trans86.7125151.974.20000126.3
1107N39.6Very low45.9Very low156 Ų156132.3 Ų132.383%0.83475%0.752SS**  trans46.1124.1137.6-61.9-25000128
1108K43.8Very low44.5Very low206 Ų206133.8 Ų133.890%0.89675%0.749SS**  trans13.3165.8133.1-96-179.2-179.7178.20123.2
1109P55.5Low44.3Very low107 Ų107133.4 Ų133.470%0.69575%0.747SS**  cis-147.5172.58.841.2-19.4000121.7
1110L35.8Very low44.4Very low160 Ų160134.3 Ų134.384%0.83875%0.745SS**  trans61.6118.9139.7-75.7166.7000128.4
1111A41.9Very low44.4Very low85 Ų85136.3 Ų136.370%0.70275%0.752SS**  55.1166.4124.700000123
1112P68.7Low44.4Very low120 Ų120137.5 Ų137.578%0.77976%0.755SS**  cis-118.9-144.30.842.4-24.5000111.9
1113P60.6Low44.1Very low115 Ų115138 Ų13875%0.74776%0.756SS**  cis-134.9-160.7-1242.2-21.4000116
1114T45.2Very low44.3Very low131 Ų131135.1 Ų135.180%0.80475%0.753SS**  trans-147.4-169.7171.9630000109.1
1115P68.4Low45.5Very low113 Ų113133.3 Ų133.373%0.73475%0.751SS**  cis-124.3-138.3445.1-24.6000111.1
1116P64.4Low46.7Very low114 Ų114131.4 Ų131.474%0.7475%0.746SS**  cis-118.5-148.2-14.825.22.8000112.3
1117T38.2Very low46.7Very low130 Ų130135 Ų13580%0.79875%0.753SS**  cis-155.6-147.215.3-31.60000113.1
1118E37.8Very low46.8Very low134 Ų134133.5 Ų133.563%0.62675%0.749SS**  trans-157.3-179.2-166.4-112.9-154.3-140.400111K1120E1118-K1120 VanDerWaalsContact CD-NZ 3.34Å; E1118-K1120 IonicContact OE1-NZ 2.67Å; E1118-K1120 PolarHBondContact OE1-NZ 3.44Å; E1118-K1120 VanDerWaalsContact OE1-NZ 3.17Å; E1118-K1120 WeakPolarHBondContact OE2-CE 3.37Å; E1118-K1120 IonicContact OE2-NZ 3.65Å; E1118-K1120 PolarHBondContact OE2-NZ 2.96Å
1119P51.4Low46.6Very low107 Ų107132 Ų13270%0.69574%0.742SS**  cis-142.9153.712.740.8-20.1000120.8
1120K40Very low45.9Very low164 Ų164132.5 Ų132.571%0.71374%0.739SS**  trans45.1127.2134.3-66.3167.5177.4114.80126.8E1118E1118-K1120 VanDerWaalsContact CD-NZ 3.34Å; E1118-K1120 IonicContact OE1-NZ 2.67Å; E1118-K1120 PolarHBondContact OE1-NZ 3.44Å; E1118-K1120 VanDerWaalsContact OE1-NZ 3.17Å; E1118-K1120 WeakPolarHBondContact OE2-CE 3.37Å; E1118-K1120 IonicContact OE2-NZ 3.65Å; E1118-K1120 PolarHBondContact OE2-NZ 2.96Å
1121K35.8Very low46Very low182 Ų182129.3 Ų129.379%0.79173%0.731SS**  trans97.2123.9130.6-85.7-164.1173.1-171.60125.2
1122F32.7Very low47.2Very low169 Ų169130.2 Ų130.274%0.74173%0.729SS**  trans91.9124.5134-96.8-125.6000125.3
1123M31.2Very low45.7Very low151 Ų151131.6 Ų131.674%0.74473%0.729SS**  trans71.4110.4145.7-65.6-87.383.800125.1
1124S38Very low44.7Very low95 Ų95132.5 Ų132.566%0.66473%0.727SS**  trans79.5-177.9130.7-440000119.6
1125P58.3Low45.6Very low118 Ų118132 Ų13277%0.76673%0.726SS**  -129-156.3-109.343-21.7000113.1
1126P55.9Low44.2Very low109 Ų109130.8 Ų130.871%0.70873%0.726SS**  cis-133.6-156.8-11.238.3-15.4000115.1
1127E36.7Very low43Very low169 Ų169133 Ų13379%0.7973%0.732SS**  trans87.896.5153.7-76.4-179.7-173.300124.9
1128T41.8Very low43.2Very low124 Ų124130.7 Ų130.776%0.76173%0.725SS**  36.3136.1124.3540000125.9
1129K39.7Very low43.4Very low174 Ų174131.9 Ų131.976%0.75773%0.731SS**  173.2168.1126.6-96.9-175.7156.7-70.30109
1130D41.6Very low43.1Very low118 Ų118136.1 Ų136.163%0.63173%0.733SS**  cis-163.5-177.3-5.5-110.7-8.3000105.3
1131S38.4Very low43Very low94 Ų94133.8 Ų133.866%0.65773%0.725SS**  cis-179.2-175.8-6.8-97.90000106.8
1132P65.9Low43.2Very low103 Ų103131.9 Ų131.967%0.66972%0.718SS**  cis-134.2149.3-2533.5-13.8000117.1
1133I37.1Very low43.5Very low149 Ų149133.8 Ų133.876%0.76472%0.721SS**  trans64.9135.4131.2-64.2171.8000119.7
1134D40.4Very low43.7Very low135 Ų135133.8 Ų133.872%0.72272%0.717SS**  cis-167167.6-11-106.4-12.7000108.7
1135P64.2Low43.8Very low119 Ų119132.6 Ų132.677%0.77371%0.713SS**  cis-115.3-131.9-10.721.93.9000109.1
1136A38.3Very low42.9Very low88 Ų88134.1 Ų134.173%0.72771%0.71SS**  cis-161.3179.93.600000112.2
1137D39.7Very low42.4Very low162 Ų162138 Ų13887%0.86671%0.712SS**  trans-75.5154.7-179.4-70.3-50000114.8
1138A43.1Very low42.2Very low80 Ų80138.7 Ų138.766%0.66171%0.713SS**  cis-173.7-162.2-1800000106.7
1139Q42.1Very low41.7Very low159 Ų159137.8 Ų137.874%0.74371%0.711SS**  cis-160.3103.63.8-171.4175.7-44.300112.7
1140R43.5Very low41.4Very low197 Ų197143.3 Ų143.374%0.74374%0.736SS**  trans64.4166.8153.9-63.4174.6175.3-87.3-4117
1141Q39.4Very low41.4Very low115 Ų115144.6 Ų144.654%0.53774%0.741SS.*  cis-172.1161.8-22.2-98.4177.8-64.400106
1142E39.4Very low41.6Very low142 Ų142147.3 Ų147.366%0.66475%0.745SS**  cis-161.1136.2-15.8-117.8160.4-15500107.4
1143W38.4Very low40.2Very low208 Ų208149.7 Ų149.779%0.78875%0.75SS**  73.5113.5102.9-84.853.8000118.6
1144F36Very low40.4Very low151 Ų151149.8 Ų149.866%0.66275%0.749SS**  82.4149.6102-93.2-102.2000114.2
1145A40.1Very low40.4Very low71 Ų71150.7 Ų150.759%0.58775%0.751SS**  cis-148.3160.66.500000110.5
1146Q39.3Very low38.8Very low149 Ų149152.8 Ų152.870%0.69675%0.749SS**  52.7144.893.4-59.2-175-22.900116.8
1147Y46.3Very low38.9Very low190 Ų190157.4 Ų157.475%0.74575%0.751SS**  cis-161.7160-5.3-127.9-65.9000108.3
1148F32.4Very low38.8Very low185 Ų185157.1 Ų157.181%0.81174%0.742SS**  trans67.5126.4169.4-86.3-86.8000119.8
1149S31.3Very low38.4Very low104 Ų104163.5 Ų163.573%0.72775%0.748SS**  trans35.7130.7154.861.20000120.4
1150F33.2Very low38.1Very low291 Ų291163.9 Ų163.9100%1.27675%0.749SS**  cis-67.307.3-105.3-111.1000114.4

Retrieved 1,150 of 1,150 residues in 2810.4 ms (Link to these results)