A0A087WRF9_MOUSE Loading...

RIKEN cDNA 1700088E04 gene

AlphaFold DB , UniProt , Accession A0A087WRF9, Species MOUSE (Mus musculus, Mouse), Gene 1700088E04Rik, Length 195 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
1M38.6Very low45.6Very low229 Ų229152.6 Ų152.6100%1.12884%0.837SS**  089.50-63.6-60.6157.400105.8
2A40.8Very low46.5Very low89 Ų89155.7 Ų155.774%0.73684%0.835SS**  61.5118.384.400000109
3S48.2Very low46.4Very low114 Ų114149.5 Ų149.580%0.79783%0.831SS**  cis-163151.326.6-730000110.7
4Q50.3Low46.8Very low178 Ų178148.6 Ų148.683%0.83283%0.832SS**  trans-83.1114.1167.9-160.7164.72800107.2R6Q4-R6 PolarHBondContact O-N 3.4Å
5E46.6Very low46.8Very low195 Ų195143.1 Ų143.191%0.91182%0.822SS**PPolyproline II helixtrans-77.8116.7173.2-83.4-166.4152.100109.7
6R50.2Low47Very low216 Ų216146.1 Ų146.182%0.81582%0.823SS**PPolyproline II helixtrans-83.3137.9172.6-74.6-176.6170.9170.5-2.4109.3Q4Q4-R6 PolarHBondContact O-N 3.4Å
7V46Very low47.2Very low139 Ų139151.1 Ų151.184%0.84283%0.826SS**PPolyproline II helixtrans-67.1126.8167.1-70.20000109.9
8D38.8Very low47.7Very low156 Ų156155.4 Ų155.483%0.83483%0.828SS**  trans-118.1105.2166.3-76.8-31.9000109.2V10D8-V10 PolarHBondContact O-N 3.45Å
9S49.8Very low47.5Very low105 Ų105153.5 Ų153.573%0.73483%0.827SS**  trans-69.5120.3171.754.40000110.1T11S9-T11 PolarHBondContact O-N 3.19Å
10V43.3Very low47.6Very low130 Ų130155.1 Ų155.179%0.78882%0.82SS**  trans-68.4101.6170.3172.60000109.1D8 K12D8-V10 PolarHBondContact O-N 3.45Å; V10-K12 HydrophobicContact CG1-CG 4.44Å; V10-K12 PolarHBondContact O-N 3.05Å
11T49.5Very low48Very low128 Ų128157.3 Ų157.379%0.78582%0.823SS**  trans-74.2101.6167.845.30000108.7S9 G13S9-T11 PolarHBondContact O-N 3.19Å; T11-G13 PolarHBondContact O-N 2.99Å
12K55.5Low48.7Very low189 Ų189155.1 Ų155.182%0.82281%0.81SS**  trans-67.5100.4167.7-74.9-173177.8178.80108.3V10 T14V10-K12 HydrophobicContact CG1-CG 4.44Å; V10-K12 PolarHBondContact O-N 3.05Å; K12-T14 PolarHBondContact O-N 2.88Å
13G45.8Very low49.5Very low76 Ų76154.9 Ų154.978%0.78481%0.808SS**  trans-57.7107170.600000110.3T11 G15T11-G13 PolarHBondContact O-N 2.99Å; G13-G15 PolarHBondContact O-N 3Å
14T51.8Low50.1Low136 Ų136152.3 Ų152.383%0.83480%0.8SS**  trans-71.479.6167.946.40000108.8K12 F16K12-T14 PolarHBondContact O-N 2.88Å; T14-F16 VanDerWaalsContact C-N 3.31Å; T14-F16 PolarHBondContact O-N 3Å
15G46.4Very low50.7Low67 Ų67151 Ų15169%0.69179%0.788SS**  trans-69.791.5164.100000108.7G13 R17G13-G15 PolarHBondContact O-N 3Å; G15-R17 PolarHBondContact O-N 2.79Å
16F49.9Very low51.8Low190 Ų190145.9 Ų145.983%0.83377%0.77SS**  trans-66.483.3169.3-149.5-91.4000107.8T14 R18T14-F16 VanDerWaalsContact C-N 3.31Å; T14-F16 PolarHBondContact O-N 3Å; F16-R18 PolarHBondContact O-N 3.05Å
17R50.8Low52.7Low232 Ų232140.6 Ų140.688%0.87576%0.764SS**  trans-62.7104.7168.5-69.2-157.3-160-105.96.9105.8G15 C19G15-R17 PolarHBondContact O-N 2.79Å; R17-C19 PolarHBondContact O-N 2.9Å
18R55.4Low54Low229 Ų229135.8 Ų135.886%0.86474%0.742SS**  trans-60.6105.8167.8-63.6-169.5-137.3-149.14.6106.4F16 R20F16-R18 PolarHBondContact O-N 3.05Å; R18-R20 PolarHBondContact O-N 2.93Å
19C44.3Very low55.6Low119 Ų119130 Ų13080%0.80471%0.712SS**  trans-52.9117.3166.4-910000107.4R17 K21R17-C19 PolarHBondContact O-N 2.9Å; C19-K21 PolarHBondContact O-N 3.08Å; C19-K21 VanDerWaalsContact O-N 3.08Å
20R50Low56.8Low185 Ų185127.8 Ų127.870%0.69870%0.696SS**  trans-57.7115.8168.6-168.9178.1-172.7-175.11.7105.9R18 Q22 S47R18-R20 PolarHBondContact O-N 2.93Å; R20-Q22 PolarHBondContact O-N 2.84Å; R20-S47 PolarHBondContact NH2-OG 3Å
21K55.4Low58.5Low201 Ų201128.5 Ų128.587%0.87469%0.691SS**  trans-54.9115.8172.5-69.7-170.1178.8-173.90106.5C19 A23C19-K21 PolarHBondContact O-N 3.08Å; C19-K21 VanDerWaalsContact O-N 3.08Å; K21-A23 PolarHBondContact O-N 3.47Å
22Q53.6Low60Low184 Ų184127.5 Ų127.586%0.8668%0.681SS**  trans-61.6129.4168-61.7-169.237.100105.9R20 G24R20-Q22 PolarHBondContact O-N 2.84Å; Q22-G24 PolarHBondContact O-N 3.44Å
23A58.6Low61.1Low83 Ų83121.4 Ų121.469%0.68666%0.657SS**  trans-64.595.6169.700000106.3K21K21-A23 PolarHBondContact O-N 3.47Å
24G59.7Low62.9Low61 Ų61128.9 Ų128.963%0.62966%0.661SS**PPolyproline II helixtrans-72.2132.6-179.200000109.7Q22 T26Q22-G24 PolarHBondContact O-N 3.44Å; G24-T26 PolarHBondContact O-N 2.88Å
25Y63.6Low64.4Low150 Ų150125.7 Ų125.759%0.58866%0.655SS**PPolyproline II helixtrans-53.2134.1160-73.2-79.6000108.8T29 C30 L33Y25-T29 WeakPolarHBondContact CB-OG1 3.43Å; Y25-C30 WeakPolarHBondContact CB-SG 3.46Å; Y25-L33 HydrophobicContact CD1-CD1 4.34Å; Y25-L33 HydrophobicContact CE1-CD1 4.29Å
26T68.9Low66.3Low87 Ų87125.8 Ų125.853%0.53466%0.656SS.*PPolyproline II helixtrans-67.1149.717361.30000108.6G24 G28 T29 C30G24-T26 PolarHBondContact O-N 2.88Å; T26-G28 PolarHBondContact O-N 2.68Å; T26-G28 VanDerWaalsContact O-N 3.08Å; T26-T29 PolarHBondContact N-OG1 3.2Å; T26-T29 PolarHBondContact O-N 3.34Å; T26-T29 PolarHBondContact O-OG1 3.08Å; T26-T29 WeakPolarHBondContact OG1-CG2 3.47Å; T26-T29 PolarHBondContact OG1-OG1 3.44Å; T26-C30 PolarHBondContact O-N 3.2Å
27P69.2Low67.7Low106 Ų106118.5 Ų118.569%0.68863%0.631SS**Hα-helixtrans-49.9-39.9-176.7-28.834.7000113.8T29 C30 E31P27-T29 PolarHBondContact O-N 3.4Å; P27-C30 WeakPolarHBondContact O-CB 3.43Å; P27-C30 PolarHBondContact O-N 2.98Å; P27-E31 PolarHBondContact O-N 3.49Å
28G73.9Confident69.1Low37 Ų37113.3 Ų113.338%0.38163%0.627SS.*Hα-helixtrans-66.6-31.6176.900000114.7T26 C30 E31 L32T26-G28 PolarHBondContact O-N 2.68Å; T26-G28 VanDerWaalsContact O-N 3.08Å; G28-C30 VanDerWaalsContact C-N 3.35Å; G28-E31 PolarHBondContact O-N 3.17Å; G28-L32 PolarHBondContact O-N 3.07Å
29T71.9Confident70.1Confident34 Ų34108.3 Ų108.321%0.20962%0.617CS.*Hα-helixtrans-70.5-32.7173.755.70000112.2Y25 T26 P27 L33Y25-T29 WeakPolarHBondContact CB-OG1 3.43Å; T26-T29 PolarHBondContact N-OG1 3.2Å; T26-T29 PolarHBondContact O-N 3.34Å; T26-T29 PolarHBondContact O-OG1 3.08Å; T26-T29 WeakPolarHBondContact OG1-CG2 3.47Å; T26-T29 PolarHBondContact OG1-OG1 3.44Å; P27-T29 PolarHBondContact O-N 3.4Å; T29-L33 VanDerWaalsContact O-CG 3.28Å; T29-L33 WeakPolarHBondContact O-CG 3.37Å; T29-L33 PolarHBondContact O-N 3.09Å; T29-L33 VanDerWaalsContact O-N 3.14Å
30C74.3Confident71.5Confident59 Ų59105.5 Ų105.540%0.39960%0.597SS.*Hα-helixtrans-67.4-37.6175.3-65.40000112.1Y25 T26 P27 G28 R34Y25-C30 WeakPolarHBondContact CB-SG 3.46Å; T26-C30 PolarHBondContact O-N 3.2Å; P27-C30 WeakPolarHBondContact O-CB 3.43Å; P27-C30 PolarHBondContact O-N 2.98Å; G28-C30 VanDerWaalsContact C-N 3.35Å; C30-R34 WeakPolarHBondContact O-CB 3.28Å; C30-R34 PolarHBondContact O-N 3.22Å; C30-R34 VanDerWaalsContact O-N 3.09Å
31E79.9Confident72.5Confident145 Ų145105 Ų10568%0.67861%0.608SS**Hα-helixtrans-66.2-44175.9-73.5179174.600112P27 G28 L33 R34 G35P27-E31 PolarHBondContact O-N 3.49Å; G28-E31 PolarHBondContact O-N 3.17Å; E31-L33 VanDerWaalsContact C-N 3.35Å; E31-L33 PolarHBondContact O-N 3.47Å; E31-R34 PolarHBondContact O-N 3.28Å; E31-G35 PolarHBondContact O-N 3.14Å
32L80.6Confident72.8Confident108 Ų108104 Ų10457%0.56561%0.606SS**Hα-helixtrans-58.4-44.3175.3-79.5160.8000112.4G28 R34 G35 G36 A37G28-L32 PolarHBondContact O-N 3.07Å; L32-R34 VanDerWaalsContact C-N 3.33Å; L32-R34 PolarHBondContact O-N 3.43Å; L32-G35 CarbonylContact O-C 3.57Å; L32-G35 PolarHBondContact O-N 3.19Å; L32-G36 PolarHBondContact O-N 2.63Å; L32-A37 HydrophobicContact CB-CB 4.13Å; L32-A37 HydrophobicContact CD2-CB 4.06Å; L32-A37 VanDerWaalsContact O-CB 3.27Å; L32-A37 WeakPolarHBondContact O-CB 3.27Å; L32-A37 PolarHBondContact O-N 3.22Å; L32-A37 VanDerWaalsContact O-N 3.08Å
33L79.5Confident73.4Confident60 Ų60100.4 Ų100.431%0.31460%0.6SS.*Hα-helixtrans-63.5-39.8176.7-71.1169.2000111.9Y25 T29 E31 G35 G36 L39Y25-L33 HydrophobicContact CD1-CD1 4.34Å; Y25-L33 HydrophobicContact CE1-CD1 4.29Å; T29-L33 VanDerWaalsContact O-CG 3.28Å; T29-L33 WeakPolarHBondContact O-CG 3.37Å; T29-L33 PolarHBondContact O-N 3.09Å; T29-L33 VanDerWaalsContact O-N 3.14Å; E31-L33 VanDerWaalsContact C-N 3.35Å; E31-L33 PolarHBondContact O-N 3.47Å; L33-G35 PolarHBondContact O-N 3.17Å; L33-G36 PolarHBondContact O-N 3.22Å; L33-G36 VanDerWaalsContact O-N 3.17Å; L33-L39 HydrophobicContact CD2-CD2 3.48Å; L33-L39 VanDerWaalsContact CD2-CD2 3.48Å
34R82.4Confident73.6Confident234 Ų234102.8 Ų102.888%0.88360%0.601SS**Hα-helixtrans-67.9-26.8177.8-156.1179-80.3-106.65.5111.8C30 E31 L32C30-R34 WeakPolarHBondContact O-CB 3.28Å; C30-R34 PolarHBondContact O-N 3.22Å; C30-R34 VanDerWaalsContact O-N 3.09Å; E31-R34 PolarHBondContact O-N 3.28Å; L32-R34 VanDerWaalsContact C-N 3.33Å; L32-R34 PolarHBondContact O-N 3.43Å
35G84.7Confident73.8Confident69 Ų69103.9 Ų103.971%0.71160%0.597SS**THydrogen-bonded Turntrans-84.43.8172.800000115.6E31 L32 L33E31-G35 PolarHBondContact O-N 3.14Å; L32-G35 CarbonylContact O-C 3.57Å; L32-G35 PolarHBondContact O-N 3.19Å; L33-G35 PolarHBondContact O-N 3.17Å
36G85.2Confident73.5Confident69 Ų69101.5 Ų101.571%0.71160%0.599SS**THydrogen-bonded Turntrans78.516.7177.600000115.2L32 L33L32-G36 PolarHBondContact O-N 2.63Å; L33-G36 PolarHBondContact O-N 3.22Å; L33-G36 VanDerWaalsContact O-N 3.17Å
37A80.8Confident72.8Confident36 Ų36101.5 Ų101.530%0.29860%0.602SS.*PPolyproline II helixtrans-67.7151.8174.100000111.5L32L32-A37 HydrophobicContact CB-CB 4.13Å; L32-A37 HydrophobicContact CD2-CB 4.06Å; L32-A37 VanDerWaalsContact O-CB 3.27Å; L32-A37 WeakPolarHBondContact O-CB 3.27Å; L32-A37 PolarHBondContact O-N 3.22Å; L32-A37 VanDerWaalsContact O-N 3.08Å
38P80.2Confident72.2Confident123 Ų123101 Ų10180%0.79960%0.601SS**PPolyproline II helixtrans-60148.7177.124.9-33.9000111.7
39L75.9Confident71.1Confident125 Ų125105.8 Ų105.865%0.65462%0.617SS**PPolyproline II helixtrans-57.7142.9-179.8-70.1166.5000111L33 L41L33-L39 HydrophobicContact CD2-CD2 3.48Å; L33-L39 VanDerWaalsContact CD2-CD2 3.48Å; L39-L41 PolarHBondContact O-N 3.35Å
40P74.3Confident70.1Confident59 Ų59114.9 Ų114.938%0.38365%0.648SS.*PPolyproline II helixtrans-56.4123.5178.6-21.330.3000111Q42P40-Q42 PolarHBondContact O-N 3.07Å
41L69.3Low69Low175 Ų175115.3 Ų115.392%0.91666%0.662SS**SBendtrans-67-21.6177.6-63.4177.5000112.5L39L39-L41 PolarHBondContact O-N 3.35Å
42Q63.6Low68Low180 Ų180113 Ų11384%0.84166%0.662SS**  trans-114.4104.5175.4-67.3-176.42.900109.1P40P40-Q42 PolarHBondContact O-N 3.07Å
43C66.2Low67Low109 Ų109113.2 Ų113.274%0.73667%0.67SS**PPolyproline II helixtrans-89140.9163.948.50000109
44N61.4Low66.1Low133 Ų133115.5 Ų115.571%0.71169%0.691SS**PPolyproline II helixtrans-57.7131.5168.2-74.2-52.7000107.8T46N44-T46 PolarHBondContact O-N 3.08Å
45P64.7Low65.1Low84 Ų84113.8 Ų113.855%0.54569%0.69SS.*PPolyproline II helixtrans-56.1123.1-177.120.9-30.9000108.5S47 L49P45-S47 PolarHBondContact O-N 3.05Å; P45-L49 HydrophobicContact CB-CB 3.94Å
46T56.2Low63.9Low100 Ų100119.7 Ų119.761%0.61370%0.696SS**PPolyproline II helixtrans-49.3131.8161.446.50000106.5N44 S48 L49N44-T46 PolarHBondContact O-N 3.08Å; T46-S48 PolarHBondContact O-N 3.18Å; T46-S48 PolarHBondContact O-OG 3.33Å; T46-L49 PolarHBondContact O-N 3.28Å; T46-L49 VanDerWaalsContact O-N 3.07Å
47S54.4Low62.8Low87 Ų87121.2 Ų121.261%0.60870%0.701SS**THydrogen-bonded Turntrans-50.3-2.6-166.273.20000117.6R20 P45R20-S47 PolarHBondContact NH2-OG 3Å; P45-S47 PolarHBondContact O-N 3.05Å
48S56.7Low62Low95 Ų95124 Ų12466%0.66473%0.725SS**THydrogen-bonded Turntrans-76.8-22.1172.549.60000114.1T46 R50T46-S48 PolarHBondContact O-N 3.18Å; T46-S48 PolarHBondContact O-OG 3.33Å; S48-R50 VanDerWaalsContact C-N 3.27Å; S48-R50 PolarHBondContact O-N 3.11Å; S48-R50 VanDerWaalsContact O-N 3.11Å
49L51.2Low61.3Low137 Ų137123.1 Ų123.172%0.71772%0.722SS**  trans-88.164.1175-144.190.3000110.7P45 T46 G51P45-L49 HydrophobicContact CB-CB 3.94Å; T46-L49 PolarHBondContact O-N 3.28Å; T46-L49 VanDerWaalsContact O-N 3.07Å; L49-G51 PolarHBondContact O-N 2.9Å
50R51.3Low60.7Low225 Ų225121.5 Ų121.585%0.84973%0.726SS**  trans-71.6105.9155.1-85.5-152.1-73.5-95.63.6106S48 S52S48-R50 VanDerWaalsContact C-N 3.27Å; S48-R50 PolarHBondContact O-N 3.11Å; S48-R50 VanDerWaalsContact O-N 3.11Å; R50-S52 PolarHBondContact O-N 3.18Å
51G51.8Low60.3Low68 Ų68125.4 Ų125.470%0.70174%0.742SS**  trans-51.2108.3162.400000107.3L49L49-G51 PolarHBondContact O-N 2.9Å
52S57.6Low60.1Low96 Ų96127.8 Ų127.867%0.67174%0.74SS**PPolyproline II helixtrans-59.8134.3168.251.60000106.7R50 S54R50-S52 PolarHBondContact O-N 3.18Å; S52-S54 PolarHBondContact O-N 3.37Å
53P59.8Low60.3Low113 Ų113124 Ų12473%0.73473%0.726SS**PPolyproline II helixtrans-52.9140.8168.124-31.8000108.1K55P53-K55 PolarHBondContact O-N 2.88Å
54S60.7Low60.4Low108 Ų108122.3 Ų122.376%0.75571%0.713SS**PPolyproline II helixtrans-53.3118.717768.90000107.5S52 K56S52-S54 PolarHBondContact O-N 3.37Å; S54-K56 VanDerWaalsContact C-N 3.34Å; S54-K56 PolarHBondContact O-N 2.98Å
55K60.6Low60.6Low199 Ų199121.1 Ų121.187%0.86571%0.712SS**  trans-63104.4172.9-75.4-179.1178.7178.80105.3P53 A57P53-K55 PolarHBondContact O-N 2.88Å; K55-A57 PolarHBondContact O-N 3.06Å
56K60.4Low60.5Low193 Ų193124.8 Ų124.884%0.83973%0.726SS**PPolyproline II helixtrans-51.6125.5161.7-66.3-176.2178.8-178.30105.7S54 A58S54-K56 VanDerWaalsContact C-N 3.34Å; S54-K56 PolarHBondContact O-N 2.98Å; K56-A58 PolarHBondContact O-N 3.19Å
57A62.1Low60.6Low100 Ų100125.9 Ų125.983%0.82673%0.727SS**PPolyproline II helixtrans-53.3119.7178.500000107.9K55 S59K55-A57 PolarHBondContact O-N 3.06Å; A57-S59 PolarHBondContact O-N 3.38Å
58A64.3Low61.1Low95 Ų95123.8 Ų123.879%0.78572%0.716SS**PPolyproline II helixtrans-59.6134.5174.700000107.8K56 A60K56-A58 PolarHBondContact O-N 3.19Å; A58-A60 PolarHBondContact O-N 2.9Å
59S65.3Low61.4Low105 Ų105125.9 Ų125.973%0.73472%0.724SS**PPolyproline II helixtrans-51.8126.4174.350.30000109A57 I61A57-S59 PolarHBondContact O-N 3.38Å; S59-I61 PolarHBondContact O-N 3.3Å
60A62.5Low62.1Low90 Ų90126.5 Ų126.574%0.74472%0.723SS**  trans-55.9111.5-177.700000110A58 Y62A58-A60 PolarHBondContact O-N 2.9Å; A60-Y62 PolarHBondContact O-N 3.16Å
61I66.2Low62.8Low141 Ų141120.1 Ų120.172%0.72371%0.713SS**  trans-72110170.7-58.3172.8000105.8S59 L63S59-I61 PolarHBondContact O-N 3.3Å; I61-L63 HydrophobicContact CG2-CD2 4.25Å; I61-L63 HydrophobicContact CG2-CG 4.05Å; I61-L63 PolarHBondContact O-N 3.4Å
62Y65.1Low64Low225 Ų225125.8 Ų125.888%0.88272%0.721SS**  trans-72.991.5173.5-114-92.3000108.7A60A60-Y62 PolarHBondContact O-N 3.16Å
63L67Low65Low102 Ų102127.9 Ų127.953%0.53472%0.724SS.*  trans-82.8140.6169.4-71.8169.8000109.5I61I61-L63 HydrophobicContact CG2-CD2 4.25Å; I61-L63 HydrophobicContact CG2-CG 4.05Å; I61-L63 PolarHBondContact O-N 3.4Å
64P69.6Low66Low72 Ų72131.4 Ų131.447%0.46872%0.723SS.*  trans-59.9144.217523-31000110.5I66 L67 A68P64-I66 PolarHBondContact O-N 2.83Å; P64-L67 HydrophobicContact CG-CD1 4.21Å; P64-L67 HydrophobicContact CG-CG 4.45Å; P64-L67 PolarHBondContact O-N 3.36Å; P64-A68 PolarHBondContact O-N 3.22Å
65P65.3Low67.2Low108 Ų108130 Ų13070%0.70171%0.711SS**G310 helixtrans-53.4-25.8-170.9-28.534.4000115.4L67 A68P65-L67 VanDerWaalsContact C-N 3.3Å; P65-L67 PolarHBondContact O-N 3.28Å; P65-A68 WeakPolarHBondContact O-CB 3.47Å; P65-A68 PolarHBondContact O-N 2.99Å
66I61.5Low68.3Low162 Ų162123.7 Ų123.783%0.83170%0.696SS**G310 helixtrans-70.7-27.6-178.2-37.2174.4000111.8P64P64-I66 PolarHBondContact O-N 2.83Å
67L60.2Low69.5Low122 Ų122118.2 Ų118.264%0.63968%0.682SS**G310 helixtrans-101.41.2177.2-59.2179.7000112.3P64 P65 T69P64-L67 HydrophobicContact CG-CD1 4.21Å; P64-L67 HydrophobicContact CG-CG 4.45Å; P64-L67 PolarHBondContact O-N 3.36Å; P65-L67 VanDerWaalsContact C-N 3.3Å; P65-L67 PolarHBondContact O-N 3.28Å; L67-T69 PolarHBondContact O-N 3.05Å; L67-T69 VanDerWaalsContact O-N 3.16Å
68A64.3Low70.6Confident44 Ų44117.5 Ų117.536%0.36466%0.663SS.*  trans-69.5113175.600000108.4P64 P65 H70P64-A68 PolarHBondContact O-N 3.22Å; P65-A68 WeakPolarHBondContact O-CB 3.47Å; P65-A68 PolarHBondContact O-N 2.99Å; A68-H70 PolarHBondContact O-N 2.82Å
69T63.1Low71.5Confident138 Ų138115.2 Ų115.285%0.84764%0.641SS**  trans-63.1100.5169.653.70000107.6L67 S71L67-T69 PolarHBondContact O-N 3.05Å; L67-T69 VanDerWaalsContact O-N 3.16Å; T69-S71 PolarHBondContact O-N 3.39Å
70H65.6Low72.4Confident151 Ų151116.2 Ų116.270%0.69963%0.634SS**  trans-57.1113.3172.5-68.3-73.5000107.6A68 H72A68-H70 PolarHBondContact O-N 2.82Å; H70-H72 PolarHBondContact O-N 2.93Å
71S66.4Low73.6Confident90 Ų90115.5 Ų115.563%0.62963%0.629SS**  trans-61.3116.6174.461.30000107.6T69 L73T69-S71 PolarHBondContact O-N 3.39Å; S71-L73 PolarHBondContact O-N 3.35Å
72H75.3Confident74.3Confident187 Ų187115.5 Ų115.587%0.86663%0.63SS**  trans-66.46.2174.3-61.7-66.8000113.3H70H70-H72 PolarHBondContact O-N 2.93Å
73L79.4Confident75.3Confident141 Ų141106.3 Ų106.374%0.73860%0.604SS**SBendtrans-77.4138.9177.6-57.1179.5000110S71S71-L73 PolarHBondContact O-N 3.35Å
74R81.6Confident76Confident187 Ų187105.4 Ų105.471%0.70661%0.611SS**PPolyproline II helixtrans-70.1135.4173.6-66.5-69.4-176.8165.3-0.3109.5
75P86.2Confident76.6Confident78 Ų78110.2 Ų110.251%0.50662%0.621SS.*PPolyproline II helixtrans-55146.4169.9-24.832.8000111.6S77 L78 C79P75-S77 PolarHBondContact O-N 3.34Å; P75-S77 VanDerWaalsContact O-N 3.1Å; P75-L78 PolarHBondContact O-N 2.84Å; P75-C79 PolarHBondContact O-N 3.23Å
76A83.8Confident77.6Confident66 Ų66109.4 Ų109.455%0.54562%0.618SS.*Hα-helixtrans-55-33.8-176.400000113.3L78 C79 Q80A76-L78 PolarHBondContact O-N 2.68Å; A76-C79 PolarHBondContact O-N 2.94Å; A76-Q80 WeakPolarHBondContact O-CB 3.44Å; A76-Q80 VanDerWaalsContact O-CG 3.3Å; A76-Q80 WeakPolarHBondContact O-CG 3.46Å; A76-Q80 PolarHBondContact O-N 3.23Å
77S85.2Confident78.9Confident78 Ų78113 Ų11355%0.54562%0.621SS.*Hα-helixtrans-60.9-41.8176.556.60000112.8P75 Q80 A81P75-S77 PolarHBondContact O-N 3.34Å; P75-S77 VanDerWaalsContact O-N 3.1Å; S77-Q80 PolarHBondContact O-N 2.9Å; S77-A81 WeakPolarHBondContact O-CB 3.37Å; S77-A81 PolarHBondContact O-N 3.28Å
78L85.4Confident80.3Confident85 Ų85115.9 Ų115.945%0.44563%0.632SS.*Hα-helixtrans-69.2-35.7177.2-69.3-174.1000111.8P75 A76 Q80P75-L78 PolarHBondContact O-N 2.84Å; A76-L78 PolarHBondContact O-N 2.68Å; L78-Q80 VanDerWaalsContact C-N 3.31Å
79C81.7Confident81.5Confident47 Ų47122 Ų12232%0.31865%0.652SS.*Hα-helixtrans-65.4-37.6174.6-61.40000111.4P75 A76 Y85P75-C79 PolarHBondContact O-N 3.23Å; A76-C79 PolarHBondContact O-N 2.94Å; C79-Y85 HydrophobicContact CB-CE2 4.17Å; C79-Y85 WeakPolarHBondContact O-CE2 3.3Å
80Q85.8Confident82.7Confident126 Ų126124.1 Ų124.159%0.58965%0.65SS**Hα-helixtrans-77.3-28.8-179.8-70.8172.7200113.6A76 S77 L78 N82 G83 Y85A76-Q80 WeakPolarHBondContact O-CB 3.44Å; A76-Q80 VanDerWaalsContact O-CG 3.3Å; A76-Q80 WeakPolarHBondContact O-CG 3.46Å; A76-Q80 PolarHBondContact O-N 3.23Å; S77-Q80 PolarHBondContact O-N 2.9Å; L78-Q80 VanDerWaalsContact C-N 3.31Å; Q80-N82 PolarHBondContact O-N 3.27Å; Q80-N82 VanDerWaalsContact O-N 3.16Å; Q80-G83 PolarHBondContact O-N 3.04Å; Q80-Y85 HydrophobicContact CG-CD2 4.09Å; Q80-Y85 HydrophobicContact CG-CE2 4.27Å
81A86.9Confident83.7Confident76 Ų76125.3 Ų125.363%0.62865%0.654SS**Hα-helixtrans-58.4-30-175.400000114.1S77 G83S77-A81 WeakPolarHBondContact O-CB 3.37Å; S77-A81 PolarHBondContact O-N 3.28Å; A81-G83 PolarHBondContact O-N 3.16Å
82N81.6Confident84.4Confident140 Ų140125.8 Ų125.875%0.74965%0.654SS**THydrogen-bonded Turntrans-78.65.2-176.8-65.4-16000113.8Q80 A84Q80-N82 PolarHBondContact O-N 3.27Å; Q80-N82 VanDerWaalsContact O-N 3.16Å; N82-A84 PolarHBondContact O-N 3.01Å
83G84.5Confident84.6Confident33 Ų33125.2 Ų125.234%0.3465%0.652SS.*SBendtrans64.88.2-178.800000114.1Q80 A81 Y85 S86Q80-G83 PolarHBondContact O-N 3.04Å; A81-G83 PolarHBondContact O-N 3.16Å; G83-Y85 PolarHBondContact O-N 3.2Å; G83-Y85 VanDerWaalsContact O-N 3.11Å; G83-S86 VanDerWaalsContact O-CB 3.25Å; G83-S86 WeakPolarHBondContact O-CB 3.34Å; G83-S86 PolarHBondContact O-N 3.27Å
84A82.1Confident84.5Confident82 Ų82123.2 Ų123.268%0.67866%0.656SS**THydrogen-bonded Turntrans-61.9-20.7-179.100000113.3N82N82-A84 PolarHBondContact O-N 3.01Å
85Y81.7Confident84.3Confident173 Ų173119.8 Ų119.868%0.67866%0.656SS**THydrogen-bonded Turntrans-93.4-6.7176.2-64.1-85.1000113.1C79 Q80 G83 R87C79-Y85 HydrophobicContact CB-CE2 4.17Å; C79-Y85 WeakPolarHBondContact O-CE2 3.3Å; Q80-Y85 HydrophobicContact CG-CD2 4.09Å; Q80-Y85 HydrophobicContact CG-CE2 4.27Å; G83-Y85 PolarHBondContact O-N 3.2Å; G83-Y85 VanDerWaalsContact O-N 3.11Å; Y85-R87 PolarHBondContact O-N 2.9Å
86S86.8Confident83.9Confident92 Ų92125.5 Ų125.564%0.64367%0.667SS**SBendtrans-78.3120.2175.6-610000109.2G83G83-S86 VanDerWaalsContact O-CB 3.25Å; G83-S86 WeakPolarHBondContact O-CB 3.34Å; G83-S86 PolarHBondContact O-N 3.27Å
87R88.6Confident83.9Confident237 Ų237126.7 Ų126.789%0.89466%0.664SS**PPolyproline II helixtrans-71.2131176.5-173.3172.8-1791670.3109.9Y85 Q89Y85-R87 PolarHBondContact O-N 2.9Å; R87-Q89 PolarHBondContact O-N 3.45Å
88E89.4Confident84.1Confident183 Ų183129.3 Ų129.386%0.85567%0.672SS**PPolyproline II helixtrans-56.3131.2172.4-67.1-175.8-179.500110.6
89Q90.3Very high84.3Confident171 Ų171133.3 Ų133.380%0.79969%0.688SS**PPolyproline II helixtrans-71.5132.1176.1-68.3178.7-10.700109.4R87 K91R87-Q89 PolarHBondContact O-N 3.45Å; Q89-K91 PolarHBondContact O-N 3.29Å; Q89-K91 VanDerWaalsContact O-N 3.15Å
90F89.2Confident84.6Confident184 Ų184137 Ų13781%0.80770%0.699SS**PPolyproline II helixtrans-60.1118174.8174.1-105000109.8P92F90-P92 HydrophobicContact CE1-CB 3.82Å; F90-P92 HydrophobicContact CE1-CG 4.37Å; F90-P92 HydrophobicContact CZ-CB 4.17Å
91K85.3Confident84.8Confident176 Ų176133.6 Ų133.677%0.76568%0.683SS**  trans-103.5108.4170.9-65.5-173.8-180-179.60107.5Q89 Q93Q89-K91 PolarHBondContact O-N 3.29Å; Q89-K91 VanDerWaalsContact O-N 3.15Å; K91-Q93 PolarHBondContact O-N 2.92Å
92P81.8Confident85Confident99 Ų99136.5 Ų136.564%0.64368%0.681SS**  trans-58.6125175.223.8-31.3000108.6F90F90-P92 HydrophobicContact CE1-CB 3.82Å; F90-P92 HydrophobicContact CE1-CG 4.37Å; F90-P92 HydrophobicContact CZ-CB 4.17Å
93Q80.4Confident85.4Confident175 Ų175138.1 Ų138.182%0.81868%0.677SS**  trans-70.2150169.2-76-173.5-4.200109.1K91 T95K91-Q93 PolarHBondContact O-N 2.92Å; Q93-T95 PolarHBondContact O-N 3.47Å
94A77.1Confident85.7Confident99 Ų99140.6 Ų140.682%0.81868%0.676SS**  trans-55.2112.8168.300000108.5R96A94-R96 PolarHBondContact O-N 3.44Å
95T76.4Confident86.2Confident116 Ų116140.1 Ų140.171%0.71266%0.662SS**  trans-61.7126.1179.1-490000108Q93 L98Q93-T95 PolarHBondContact O-N 3.47Å; T95-L98 HydrophobicContact CG2-CD2 4.44Å
96R78.4Confident86.8Confident198 Ų198137.1 Ų137.175%0.74765%0.654SS**  trans-64.1146.6169.3-61.8179.8-179.4176.80.2108.5A94 L98A94-R96 PolarHBondContact O-N 3.44Å; R96-L98 PolarHBondContact O-N 3Å
97D84.4Confident87Confident90 Ų90135.1 Ų135.148%0.48164%0.636SS.*  trans-59.9107.6177.5-65.8-33.9000110.3E99 K100 E101D97-E99 PolarHBondContact O-N 3.28Å; D97-K100 HydrophobicContact CB-CB 4.05Å; D97-K100 HydrophobicContact CB-CD 3.83Å; D97-K100 HydrophobicContact CB-CG 3.79Å; D97-K100 PolarHBondContact O-N 2.97Å; D97-K100 WeakPolarHBondContact OD2-CD 3.3Å; D97-K100 WeakPolarHBondContact OD2-CE 3.4Å; D97-K100 IonicContact OD2-NZ 2.8Å; D97-K100 PolarHBondContact OD2-NZ 2.92Å; D97-E101 PolarHBondContact O-N 3.47Å; D97-E101 VanDerWaalsContact O-N 3.15Å
98L88.1Confident87.3Confident134 Ų134126.2 Ų126.270%0.70261%0.606SS**Hα-helixtrans-59.1-33.6-175.7-62.6179.9000111.9T95 R96 E101 K102T95-L98 HydrophobicContact CG2-CD2 4.44Å; R96-L98 PolarHBondContact O-N 3Å; L98-E101 PolarHBondContact O-N 3.11Å; L98-K102 VanDerWaalsContact O-CB 3.31Å; L98-K102 WeakPolarHBondContact O-CB 3.47Å; L98-K102 PolarHBondContact O-N 2.99Å
99E89.4Confident87.4Confident168 Ų168125.7 Ų125.779%0.78560%0.601SS**Hα-helixtrans-66.8-38.3177.4-65.5-178172.500112.5D97 R103D97-E99 PolarHBondContact O-N 3.28Å; E99-R103 WeakPolarHBondContact O-CB 3.47Å; E99-R103 PolarHBondContact O-N 3.05Å
100K88.6Confident87.5Confident124 Ų124121.6 Ų121.654%0.53960%0.597SS.*Hα-helixtrans-66.4-45.3175.7-67-176.2-176.2155.30110.4D97 K102 R103 R104D97-K100 HydrophobicContact CB-CB 4.05Å; D97-K100 HydrophobicContact CB-CD 3.83Å; D97-K100 HydrophobicContact CB-CG 3.79Å; D97-K100 PolarHBondContact O-N 2.97Å; D97-K100 WeakPolarHBondContact OD2-CD 3.3Å; D97-K100 WeakPolarHBondContact OD2-CE 3.4Å; D97-K100 IonicContact OD2-NZ 2.8Å; D97-K100 PolarHBondContact OD2-NZ 2.92Å; K100-K102 PolarHBondContact O-N 3.42Å; K100-R103 PolarHBondContact O-N 2.88Å; K100-R104 VanDerWaalsContact O-CB 3.29Å; K100-R104 WeakPolarHBondContact O-CB 3.46Å; K100-R104 PolarHBondContact O-N 3.46Å
101E89.1Confident87.4Confident56 Ų56116.9 Ų116.926%0.26258%0.583SS.*Hα-helixtrans-65.8-39.9178.6-163.265.9-149.500111.7D97 L98 R103 R104 L105D97-E101 PolarHBondContact O-N 3.47Å; D97-E101 VanDerWaalsContact O-N 3.15Å; L98-E101 PolarHBondContact O-N 3.11Å; E101-R103 VanDerWaalsContact C-N 3.35Å; E101-R103 PolarHBondContact O-N 3.3Å; E101-R104 WeakPolarHBondContact O-CB 3.47Å; E101-R104 PolarHBondContact O-N 3.46Å; E101-R104 IonicContact OE1-CZ 3.49Å; E101-R104 IonicContact OE1-NH1 3.51Å; E101-R104 PolarHBondContact OE1-NH1 3.17Å; E101-L105 HydrophobicContact CG-CD1 4.33Å; E101-L105 WeakPolarHBondContact O-CB 3.28Å; E101-L105 WeakPolarHBondContact O-CG 3.47Å; E101-L105 PolarHBondContact O-N 2.85Å
102K91Very high87.5Confident137 Ų137111.5 Ų111.560%0.59658%0.577SS**Hα-helixtrans-59-47.2174.2-175.5-180177.8-176.60111L98 K100 L105 Q106L98-K102 VanDerWaalsContact O-CB 3.31Å; L98-K102 WeakPolarHBondContact O-CB 3.47Å; L98-K102 PolarHBondContact O-N 2.99Å; K100-K102 PolarHBondContact O-N 3.42Å; K102-L105 PolarHBondContact O-N 3.39Å; K102-Q106 WeakPolarHBondContact O-CB 3.38Å; K102-Q106 VanDerWaalsContact O-CG 3.29Å; K102-Q106 WeakPolarHBondContact O-CG 3.31Å; K102-Q106 PolarHBondContact O-N 3.41Å
103R90.4Very high87.5Confident174 Ų174113.5 Ų113.566%0.65758%0.576SS**Hα-helixtrans-64.3-41.8178.1-172.7178.3-177-179.91.5112E99 K100 E101 Q106 N107E99-R103 WeakPolarHBondContact O-CB 3.47Å; E99-R103 PolarHBondContact O-N 3.05Å; K100-R103 PolarHBondContact O-N 2.88Å; E101-R103 VanDerWaalsContact C-N 3.35Å; E101-R103 PolarHBondContact O-N 3.3Å; R103-Q106 WeakPolarHBondContact O-CB 3.43Å; R103-Q106 PolarHBondContact O-N 2.92Å; R103-N107 VanDerWaalsContact O-CG 3.3Å; R103-N107 PolarHBondContact O-N 2.74Å
104R91.8Very high87.4Confident84 Ų84108.6 Ų108.632%0.31756%0.555SS.*Hα-helixtrans-57-50.9175.2-169.9-165.5170.3-133.2-7.3111.3K100 E101 Q106 N107 I108 D114K100-R104 VanDerWaalsContact O-CB 3.29Å; K100-R104 WeakPolarHBondContact O-CB 3.46Å; K100-R104 PolarHBondContact O-N 3.46Å; E101-R104 WeakPolarHBondContact O-CB 3.47Å; E101-R104 PolarHBondContact O-N 3.46Å; E101-R104 IonicContact OE1-CZ 3.49Å; E101-R104 IonicContact OE1-NH1 3.51Å; E101-R104 PolarHBondContact OE1-NH1 3.17Å; R104-Q106 PolarHBondContact O-N 2.94Å; R104-N107 WeakPolarHBondContact O-CB 3.46Å; R104-N107 PolarHBondContact O-N 3.44Å; R104-I108 HydrophobicContact CG-CD1 4.23Å; R104-I108 WeakPolarHBondContact O-CG1 3.14Å; R104-I108 PolarHBondContact O-N 3.3Å; R104-D114 WeakPolarHBondContact CG-OD1 3.46Å; R104-D114 IonicContact CZ-OD2 2.66Å; R104-D114 IonicContact NE-OD1 2.67Å; R104-D114 IonicContact NE-OD2 2.79Å; R104-D114 PolarHBondContact NE-OD2 3.03Å; R104-D114 IonicContact NH2-OD2 2.65Å; R104-D114 PolarHBondContact NH2-OD2 2.91Å
105L91.8Very high86.8Confident73 Ų73108.9 Ų108.938%0.38254%0.538SS..Hα-helixtrans-64.7-38.3178-69.9173.7000112.4E101 K102 N107 I108 F109E101-L105 HydrophobicContact CG-CD1 4.33Å; E101-L105 WeakPolarHBondContact O-CB 3.28Å; E101-L105 WeakPolarHBondContact O-CG 3.47Å; E101-L105 PolarHBondContact O-N 2.85Å; K102-L105 PolarHBondContact O-N 3.39Å; L105-N107 PolarHBondContact O-N 3.03Å; L105-I108 HydrophobicContact CD2-CD1 4.45Å; L105-I108 PolarHBondContact O-N 2.87Å; L105-F109 WeakPolarHBondContact O-CB 3.28Å; L105-F109 WeakPolarHBondContact O-CG 3.38Å; L105-F109 PolarHBondContact O-N 2.93Å
106Q93.8Very high86.2Confident109 Ų109110 Ų11051%0.50954%0.535SS..Hα-helixtrans-58.9-45.6172.1-76.7174.9-16.200111.8K102 R103 R104 I108 F109 A110K102-Q106 WeakPolarHBondContact O-CB 3.38Å; K102-Q106 VanDerWaalsContact O-CG 3.29Å; K102-Q106 WeakPolarHBondContact O-CG 3.31Å; K102-Q106 PolarHBondContact O-N 3.41Å; R103-Q106 WeakPolarHBondContact O-CB 3.43Å; R103-Q106 PolarHBondContact O-N 2.92Å; R104-Q106 PolarHBondContact O-N 2.94Å; Q106-I108 VanDerWaalsContact C-N 3.33Å; Q106-I108 PolarHBondContact O-N 3.06Å; Q106-F109 PolarHBondContact O-N 3.27Å; Q106-A110 VanDerWaalsContact O-CB 3.26Å; Q106-A110 WeakPolarHBondContact O-CB 3.45Å; Q106-A110 PolarHBondContact O-N 2.89Å
107N92.5Very high85.1Confident50 Ų50105.2 Ų105.227%0.26752%0.521SS..Hα-helixtrans-61.7-42.3176.9-69.5-17000111.5R103 R104 L105 T111R103-N107 VanDerWaalsContact O-CG 3.3Å; R103-N107 PolarHBondContact O-N 2.74Å; R104-N107 WeakPolarHBondContact O-CB 3.46Å; R104-N107 PolarHBondContact O-N 3.44Å; L105-N107 PolarHBondContact O-N 3.03Å; N107-T111 WeakPolarHBondContact O-CB 3.4Å; N107-T111 PolarHBondContact O-N 3.29Å; N107-T111 PolarHBondContact O-OG1 3.44Å
108I93.9Very high83.7Confident50 Ų50112.3 Ų112.326%0.25654%0.541SS..Hα-helixtrans-63.7-45.3176.9-66.8164.9000110.8R104 L105 Q106 G112 D114R104-I108 HydrophobicContact CG-CD1 4.23Å; R104-I108 WeakPolarHBondContact O-CG1 3.14Å; R104-I108 PolarHBondContact O-N 3.3Å; L105-I108 HydrophobicContact CD2-CD1 4.45Å; L105-I108 PolarHBondContact O-N 2.87Å; Q106-I108 VanDerWaalsContact C-N 3.33Å; Q106-I108 PolarHBondContact O-N 3.06Å; I108-G112 WeakPolarHBondContact O-CA 3.42Å; I108-G112 PolarHBondContact O-N 3.1Å; I108-D114 HydrophobicContact CD1-CB 4.11Å; I108-D114 HydrophobicContact CG1-CB 3.99Å
109F91.3Very high82.1Confident172 Ų172113.2 Ų113.275%0.75454%0.54SS*.Hα-helixtrans-70.3-37.3-179.9-71-8.1000113L105 Q106L105-F109 WeakPolarHBondContact O-CB 3.28Å; L105-F109 WeakPolarHBondContact O-CG 3.38Å; L105-F109 PolarHBondContact O-N 2.93Å; Q106-F109 PolarHBondContact O-N 3.27Å
110A92.1Very high80.4Confident86 Ų86114.6 Ų114.671%0.71154%0.543SS*.Hα-helixtrans-75.3-40.9179.700000112.8Q106Q106-A110 VanDerWaalsContact O-CB 3.26Å; Q106-A110 WeakPolarHBondContact O-CB 3.45Å; Q106-A110 PolarHBondContact O-N 2.89Å
111T87.2Confident78.1Confident84 Ų84114 Ų11452%0.51555%0.55SS..Hα-helixtrans-120.4-5.1-168.670.30000114.6N107 K113N107-T111 WeakPolarHBondContact O-CB 3.4Å; N107-T111 PolarHBondContact O-N 3.29Å; N107-T111 PolarHBondContact O-OG1 3.44Å; T111-K113 PolarHBondContact O-N 3.02Å; T111-K113 PolarHBondContact OG1-O 2.9Å
112G88.8Confident76.1Confident63 Ų63116.9 Ų116.965%0.64957%0.573SS**SBendtrans71.41.2-176.500000114.6I108I108-G112 WeakPolarHBondContact O-CA 3.42Å; I108-G112 PolarHBondContact O-N 3.1Å
113K81.9Confident74.1Confident141 Ų141118.3 Ų118.361%0.61358%0.582SS**SBendtrans-129.9139.6-175.3-65-177.9-177.6178.60111.3T111 K115T111-K113 PolarHBondContact O-N 3.02Å; T111-K113 PolarHBondContact OG1-O 2.9Å; K113-K115 HydrophobicContact CB-CG 4.24Å; K113-K115 PolarHBondContact O-N 3.17Å
114D77.9Confident71.9Confident73 Ų73115 Ų11539%0.3958%0.58SS.*  trans-80.567.3173.3-166.56.1000110.2R104 I108 E116R104-D114 WeakPolarHBondContact CG-OD1 3.46Å; R104-D114 IonicContact CZ-OD2 2.66Å; R104-D114 IonicContact NE-OD1 2.67Å; R104-D114 IonicContact NE-OD2 2.79Å; R104-D114 PolarHBondContact NE-OD2 3.03Å; R104-D114 IonicContact NH2-OD2 2.65Å; R104-D114 PolarHBondContact NH2-OD2 2.91Å; I108-D114 HydrophobicContact CD1-CB 4.11Å; I108-D114 HydrophobicContact CG1-CB 3.99Å; D114-E116 PolarHBondContact O-N 2.66Å
115K64Low69.8Low104 Ų104121.6 Ų121.645%0.45261%0.605SS.*  trans-77.178.1175.2-76.4-176.9169.3-135.90109.1K113 E117K113-K115 HydrophobicContact CB-CG 4.24Å; K113-K115 PolarHBondContact O-N 3.17Å; K115-E117 HydrophobicContact CB-CG 4.19Å; K115-E117 WeakPolarHBondContact CD-OE1 3.33Å; K115-E117 VanDerWaalsContact CE-OE1 3.31Å; K115-E117 WeakPolarHBondContact CE-OE1 3.29Å; K115-E117 HydrophobicContact CG-CG 4.39Å; K115-E117 IonicContact NZ-OE1 3.31Å; K115-E117 PolarHBondContact NZ-OE1 3.49Å; K115-E117 PolarHBondContact O-N 2.65Å
116E63.8Low68Low141 Ų141126.2 Ų126.266%0.65963%0.625SS**  trans-70.660148.6-79.8-139.6155.900109D114 R118D114-E116 PolarHBondContact O-N 2.66Å; E116-R118 PolarHBondContact O-N 3.31Å
117E56.2Low66.1Low97 Ų97129.7 Ų129.745%0.45364%0.641SS.*  trans-70.9105.6161.5-71.6176.9-166.400105K115 K119K115-E117 HydrophobicContact CB-CG 4.19Å; K115-E117 WeakPolarHBondContact CD-OE1 3.33Å; K115-E117 VanDerWaalsContact CE-OE1 3.31Å; K115-E117 WeakPolarHBondContact CE-OE1 3.29Å; K115-E117 HydrophobicContact CG-CG 4.39Å; K115-E117 IonicContact NZ-OE1 3.31Å; K115-E117 PolarHBondContact NZ-OE1 3.49Å; K115-E117 PolarHBondContact O-N 2.65Å; E117-K119 HydrophobicContact CB-CG 4.02Å; E117-K119 PolarHBondContact O-N 2.91Å; E117-K119 WeakPolarHBondContact OE2-CE 3.44Å
118R54.4Low64.2Low238 Ų238134.2 Ų134.290%0.89867%0.665SS**  trans-56.973.6149-68.8-179.2179.4-179.5-0.7106.9E116 K120E116-R118 PolarHBondContact O-N 3.31Å; R118-K120 PolarHBondContact O-N 3.07Å
119K55.2Low62.6Low154 Ų154137.2 Ų137.267%0.6769%0.688SS**  trans-6398.8158.8-74.3-172.4179-178.70103.4E117 V121E117-K119 HydrophobicContact CB-CG 4.02Å; E117-K119 PolarHBondContact O-N 2.91Å; E117-K119 WeakPolarHBondContact OE2-CE 3.44Å; K119-V121 PolarHBondContact O-N 3.02Å
120K52Low61.2Low197 Ų197133 Ų13386%0.85768%0.684SS**  trans-48.1103.1151-71.9-176.4178.9-177.30103.6R118 P122R118-K120 PolarHBondContact O-N 3.07Å; K120-P122 WeakPolarHBondContact O-CD 3.46Å
121V41.8Very low59.9Low112 Ų112134.1 Ų134.168%0.67969%0.685SS**  trans-57.5113.7177.1-173.60000103.5K119 H123K119-V121 PolarHBondContact O-N 3.02Å; V121-H123 PolarHBondContact O-N 3.43Å; V121-H123 VanDerWaalsContact O-N 3.11Å
122P45.5Very low58.9Low115 Ų115139.1 Ų139.175%0.74770%0.702SS**  trans-58.2122.9161.9-8.624.9000103.8K120 V124K120-P122 WeakPolarHBondContact O-CD 3.46Å; P122-V124 PolarHBondContact O-N 2.95Å
123H49.4Very low57.9Low168 Ų168140 Ų14078%0.77869%0.692SS**  trans-4.1114.6166.6-174.973.1000112.1V121 R125V121-H123 PolarHBondContact O-N 3.43Å; V121-H123 VanDerWaalsContact O-N 3.11Å; H123-R125 VanDerWaalsContact C-N 3.27Å; H123-R125 PolarHBondContact O-N 3.3Å
124V44.5Very low58.1Low104 Ų104136.1 Ų136.163%0.6368%0.678SS**  trans-38.3101.3166.1171.60000106.4P122 Q126P122-V124 PolarHBondContact O-N 2.95Å; V124-Q126 PolarHBondContact O-N 2.86Å
125R48.7Very low58.9Low223 Ų223137.1 Ų137.184%0.84268%0.676SS**  trans-60.6110.9154.1-70.8-172.9177.5-173.1-1.8100.7H123 E127H123-R125 VanDerWaalsContact C-N 3.27Å; H123-R125 PolarHBondContact O-N 3.3Å; R125-E127 PolarHBondContact O-N 3.47Å
126Q53.7Low60.3Low170 Ų170134.3 Ų134.379%0.79466%0.664SS**  trans-45.7110155.8-68.4173.9-6.400103.1V124 D128V124-Q126 PolarHBondContact O-N 2.86Å; Q126-D128 PolarHBondContact O-N 2.88Å; Q126-D128 VanDerWaalsContact O-N 3.1Å
127E53.2Low61.8Low182 Ų182131.3 Ų131.385%0.8565%0.652SS**  trans-50.8124162.7-73.1-179.3159.400103.5R125 P129R125-E127 PolarHBondContact O-N 3.47Å; E127-P129 VanDerWaalsContact O-N 3.13Å
128D52.8Low63.7Low145 Ų145130.1 Ų130.178%0.77565%0.647SS**  trans-42.3128.3172.9-64-54.8000106.3Q126 A130Q126-D128 PolarHBondContact O-N 2.88Å; Q126-D128 VanDerWaalsContact O-N 3.1Å; D128-A130 PolarHBondContact O-N 3.26Å
129P60.8Low65.7Low113 Ų113118.8 Ų118.873%0.73460%0.604SS**  trans-48118.9-177.620.9-31.8000105.9E127 P131E127-P129 VanDerWaalsContact O-N 3.13Å; P129-P131 VanDerWaalsContact O-N 3.1Å
130A60.7Low67.7Low82 Ų82114.7 Ų114.768%0.67859%0.592SS**  trans-42.8127.7-175.400000106.8D128 E132D128-A130 PolarHBondContact O-N 3.26Å; A130-E132 PolarHBondContact O-N 3.17Å
131P66.1Low69.9Low111 Ų111110.3 Ų110.372%0.72157%0.573SS**  trans-46117.5-168.214.8-28.9000107.5P129 L133P129-P131 VanDerWaalsContact O-N 3.1Å; P131-L133 VanDerWaalsContact C-N 3.35Å; P131-L133 PolarHBondContact O-N 2.96Å
132E65.6Low72.5Confident189 Ų189107.8 Ų107.888%0.88355%0.554SS**  trans-50108.4-177.4-79.4-175.8165.800105.6A130 D134A130-E132 PolarHBondContact O-N 3.17Å; E132-D134 PolarHBondContact O-N 3.48Å; E132-D134 VanDerWaalsContact O-N 3.09Å
133L67.8Low75.1Confident82 Ų82103 Ų10343%0.42952%0.521SS..  trans-61124.7-177.8-72.2172.9000104.9P131 R135 E138P131-L133 VanDerWaalsContact C-N 3.35Å; P131-L133 PolarHBondContact O-N 2.96Å; L133-R135 PolarHBondContact O-N 3.24Å; L133-E138 HydrophobicContact CB-CG 3.93Å
134D86.9Confident77.4Confident59 Ų5999 Ų9932%0.31650%0.503SS..  trans-53.7133.5178.1-178.415.9000107.8E132 F136 D137 E138 R184E132-D134 PolarHBondContact O-N 3.48Å; E132-D134 VanDerWaalsContact O-N 3.09Å; D134-F136 CarbonylContact O-C 3.56Å; D134-F136 PolarHBondContact O-N 3.02Å; D134-D137 WeakPolarHBondContact O-CA 3.46Å; D134-D137 WeakPolarHBondContact O-CB 3.35Å; D134-D137 PolarHBondContact O-N 3.47Å; D134-E138 PolarHBondContact O-N 3.11Å; D134-E138 VanDerWaalsContact O-N 3.13Å; D134-R184 IonicContact OD1-CZ 3.02Å; D134-R184 IonicContact OD1-NH2 3.9Å; D134-R184 PolarHBondContact OD1-NH2 3.06Å; D134-R184 IonicContact OD2-CZ 3.92Å; D134-R184 IonicContact OD2-NH1 3.34Å; D134-R184 PolarHBondContact OD2-NH1 2.67Å; D134-R184 IonicContact OD2-NH2 2.66Å; D134-R184 PolarHBondContact OD2-NH2 3.18Å
135R92.9Very high80Confident94 Ų9498.8 Ų98.836%0.35550%0.498SS..Hα-helixtrans-50.2-31.9-177.6179.860.3178.8163.96.3111.6L133 E138 L139 E142 E176 I180L133-R135 PolarHBondContact O-N 3.24Å; R135-E138 WeakPolarHBondContact CD-OE2 3.23Å; R135-E138 IonicContact CZ-OE2 3.15Å; R135-E138 IonicContact NH1-OE2 3.3Å; R135-E138 PolarHBondContact NH1-OE2 3.45Å; R135-E138 PolarHBondContact O-N 3.32Å; R135-L139 WeakPolarHBondContact O-CG 3.49Å; R135-L139 PolarHBondContact O-N 3.27Å; R135-L139 VanDerWaalsContact O-N 3.11Å; R135-E142 IonicContact NH1-OE1 3.2Å; R135-E176 IonicContact CZ-OE1 3.79Å; R135-E176 IonicContact NE-OE1 2.66Å; R135-E176 PolarHBondContact NE-OE1 3.38Å; R135-E176 IonicContact NH2-OE1 2.7Å; R135-E176 PolarHBondContact NH2-OE1 2.71Å; R135-E176 IonicContact NH2-OE2 2.71Å; R135-E176 PolarHBondContact NH2-OE2 3.35Å; R135-I180 HydrophobicContact CB-CD1 4.21Å; R135-I180 HydrophobicContact CG-CD1 3.75Å
136F95.4Very high82.4Confident45 Ų4591.7 Ų91.720%0.19747%0.472CS..Hα-helixtrans-58.6-49.1172.9-167.3-84.9000112.7D134 E138 L139 V140 M177 I180 D181D134-F136 CarbonylContact O-C 3.56Å; D134-F136 PolarHBondContact O-N 3.02Å; F136-E138 PolarHBondContact O-N 3.19Å; F136-L139 PolarHBondContact O-N 2.98Å; F136-V140 HydrophobicContact CD1-CG2 4.28Å; F136-V140 HydrophobicContact CE1-CG2 4.12Å; F136-V140 WeakPolarHBondContact O-CG2 3.41Å; F136-V140 PolarHBondContact O-N 3.31Å; F136-V140 VanDerWaalsContact O-N 3.13Å; F136-M177 HydrophobicContact CD2-CG 3.7Å; F136-M177 HydrophobicContact CE1-CG 4.46Å; F136-M177 HydrophobicContact CE1-SD 4.37Å; F136-M177 HydrophobicContact CE2-CB 4.47Å; F136-M177 HydrophobicContact CE2-CG 3.16Å; F136-M177 HydrophobicContact CE2-SD 3.97Å; F136-M177 HydrophobicContact CZ-CG 3.6Å; F136-M177 HydrophobicContact CZ-SD 3.74Å; F136-I180 HydrophobicContact CD2-CG2 4.21Å; F136-D181 VanDerWaalsContact CE2-OD1 3.26Å; F136-D181 WeakPolarHBondContact CE2-OD1 3.4Å
137D94.7Very high84.5Confident78 Ų7888.7 Ų88.742%0.41746%0.456SS..Hα-helixtrans-67.1-35.7179.3-67.8-27.8000112D134 V140 K141D134-D137 WeakPolarHBondContact O-CA 3.46Å; D134-D137 WeakPolarHBondContact O-CB 3.35Å; D134-D137 PolarHBondContact O-N 3.47Å; D137-V140 PolarHBondContact O-N 3.47Å; D137-K141 WeakPolarHBondContact O-CG 3.46Å; D137-K141 PolarHBondContact O-N 3.1Å; D137-K141 VanDerWaalsContact O-N 3.12Å
138E95.2Very high86.6Confident71 Ų7185.2 Ų85.233%0.33244%0.44SS..Hα-helixtrans-59.3-46.8172.1-63.3-175.8163.400111.3L133 D134 R135 F136 V140 K141 E142L133-E138 HydrophobicContact CB-CG 3.93Å; D134-E138 PolarHBondContact O-N 3.11Å; D134-E138 VanDerWaalsContact O-N 3.13Å; R135-E138 WeakPolarHBondContact CD-OE2 3.23Å; R135-E138 IonicContact CZ-OE2 3.15Å; R135-E138 IonicContact NH1-OE2 3.3Å; R135-E138 PolarHBondContact NH1-OE2 3.45Å; R135-E138 PolarHBondContact O-N 3.32Å; F136-E138 PolarHBondContact O-N 3.19Å; E138-V140 VanDerWaalsContact C-N 3.3Å; E138-V140 PolarHBondContact O-N 2.99Å; E138-K141 WeakPolarHBondContact O-CB 3.35Å; E138-K141 PolarHBondContact O-N 2.89Å; E138-K141 VanDerWaalsContact O-N 3.13Å; E138-E142 WeakPolarHBondContact O-CG 3.45Å; E138-E142 PolarHBondContact O-N 2.79Å
139L96.9Very high88.8Confident0 Ų082 Ų820%042%0.419CS..Hα-helixtrans-62.8-36178.9-70.7171.3000112.4R135 F136 E142 I143 K173 E176 M177 I180R135-L139 WeakPolarHBondContact O-CG 3.49Å; R135-L139 PolarHBondContact O-N 3.27Å; R135-L139 VanDerWaalsContact O-N 3.11Å; F136-L139 PolarHBondContact O-N 2.98Å; L139-E142 PolarHBondContact O-N 2.88Å; L139-I143 WeakPolarHBondContact O-CB 3.42Å; L139-I143 VanDerWaalsContact O-CG1 3.25Å; L139-I143 WeakPolarHBondContact O-CG1 3.43Å; L139-I143 PolarHBondContact O-N 3.32Å; L139-K173 HydrophobicContact CD2-CB 4.15Å; L139-K173 HydrophobicContact CD2-CG 4.17Å; L139-E176 HydrophobicContact CD1-CB 3.88Å; L139-E176 HydrophobicContact CD1-CG 3.75Å; L139-E176 HydrophobicContact CD2-CB 4.43Å; L139-E176 HydrophobicContact CD2-CG 4.45Å; L139-M177 HydrophobicContact CB-CE 4.06Å; L139-M177 HydrophobicContact CD1-CB 4.27Å; L139-I180 HydrophobicContact CD1-CD1 3.77Å
140V97.4Very high90.6Very high69 Ų6977.6 Ų77.642%0.41839%0.389SS..Hα-helixtrans-61.6-45.6174173.90000110.5F136 D137 E138 I143 Q144 M177F136-V140 HydrophobicContact CD1-CG2 4.28Å; F136-V140 HydrophobicContact CE1-CG2 4.12Å; F136-V140 WeakPolarHBondContact O-CG2 3.41Å; F136-V140 PolarHBondContact O-N 3.31Å; F136-V140 VanDerWaalsContact O-N 3.13Å; D137-V140 PolarHBondContact O-N 3.47Å; E138-V140 VanDerWaalsContact C-N 3.3Å; E138-V140 PolarHBondContact O-N 2.99Å; V140-I143 PolarHBondContact O-N 2.86Å; V140-Q144 PolarHBondContact O-N 3.12Å; V140-Q144 VanDerWaalsContact O-N 3.07Å; V140-M177 HydrophobicContact CG2-CE 3.74Å
141K97.1Very high92.4Very high105 Ų10576.4 Ų76.446%0.45738%0.379SS..Hα-helixtrans-62.6-48.8176.9-68.5175.1-175.8-179.90111.3D137 E138 I143 Q144 D145D137-K141 WeakPolarHBondContact O-CG 3.46Å; D137-K141 PolarHBondContact O-N 3.1Å; D137-K141 VanDerWaalsContact O-N 3.12Å; E138-K141 WeakPolarHBondContact O-CB 3.35Å; E138-K141 PolarHBondContact O-N 2.89Å; E138-K141 VanDerWaalsContact O-N 3.13Å; K141-I143 VanDerWaalsContact C-N 3.3Å; K141-I143 PolarHBondContact O-N 3.29Å; K141-Q144 WeakPolarHBondContact O-CA 3.37Å; K141-Q144 WeakPolarHBondContact O-CB 3.46Å; K141-Q144 PolarHBondContact O-N 3.37Å; K141-D145 PolarHBondContact O-N 3.13Å
142E97.9Very high94Very high59 Ų5973.4 Ų73.428%0.27636%0.364SS..Hα-helixtrans-60.7-37.9179.4-71-178.6-176.200112.5R135 E138 L139 Q144 R146 K173R135-E142 IonicContact NH1-OE1 3.2Å; E138-E142 WeakPolarHBondContact O-CG 3.45Å; E138-E142 PolarHBondContact O-N 2.79Å; L139-E142 PolarHBondContact O-N 2.88Å; E142-Q144 VanDerWaalsContact C-N 3.34Å; E142-R146 WeakPolarHBondContact O-CB 3.37Å; E142-R146 VanDerWaalsContact O-CG 3.23Å; E142-R146 WeakPolarHBondContact O-CG 3.3Å; E142-R146 PolarHBondContact O-N 3.26Å; E142-R146 VanDerWaalsContact O-N 3.1Å; E142-K173 HydrophobicContact CB-CD 3.71Å; E142-K173 WeakPolarHBondContact OE2-CE 3.43Å; E142-K173 IonicContact OE2-NZ 2.75Å; E142-K173 PolarHBondContact OE2-NZ 3.46Å
143I98.5Very high95.5Very high13 Ų1366 Ų667%0.06733%0.33CS..Hα-helixtrans-64.1-42.3174.3-73.4167.9000110.6L139 V140 K141 R146 K147 I170 K173 L174 M177L139-I143 WeakPolarHBondContact O-CB 3.42Å; L139-I143 VanDerWaalsContact O-CG1 3.25Å; L139-I143 WeakPolarHBondContact O-CG1 3.43Å; L139-I143 PolarHBondContact O-N 3.32Å; V140-I143 PolarHBondContact O-N 2.86Å; K141-I143 VanDerWaalsContact C-N 3.3Å; K141-I143 PolarHBondContact O-N 3.29Å; I143-R146 PolarHBondContact O-N 3.5Å; I143-K147 HydrophobicContact CG2-CD 4.32Å; I143-K147 WeakPolarHBondContact O-CG 3.06Å; I143-K147 PolarHBondContact O-N 3.13Å; I143-I170 HydrophobicContact CG2-CG2 4.27Å; I143-K173 HydrophobicContact CD1-CB 3.83Å; I143-K173 HydrophobicContact CG1-CB 3.59Å; I143-K173 HydrophobicContact CG1-CD 3.91Å; I143-K173 HydrophobicContact CG1-CG 4.4Å; I143-L174 HydrophobicContact CD1-CD2 3.83Å; I143-L174 HydrophobicContact CD1-CG 4.03Å; I143-M177 HydrophobicContact CD1-CE 3.69Å
144Q98.6Very high96.9Very high86 Ų8665.6 Ų65.640%0.40233%0.326SS..Hα-helixtrans-65.1-46.6179.4-174.156.630.400111.2V140 K141 E142 R146 K147 E148V140-Q144 PolarHBondContact O-N 3.12Å; V140-Q144 VanDerWaalsContact O-N 3.07Å; K141-Q144 WeakPolarHBondContact O-CA 3.37Å; K141-Q144 WeakPolarHBondContact O-CB 3.46Å; K141-Q144 PolarHBondContact O-N 3.37Å; E142-Q144 VanDerWaalsContact C-N 3.34Å; Q144-R146 VanDerWaalsContact C-N 3.25Å; Q144-R146 PolarHBondContact O-N 3.35Å; Q144-K147 WeakPolarHBondContact O-CB 3.5Å; Q144-K147 PolarHBondContact O-N 3.11Å; Q144-E148 WeakPolarHBondContact CG-OE1 3.49Å; Q144-E148 PolarHBondContact NE2-OE1 3.33Å; Q144-E148 WeakPolarHBondContact O-CG 3.4Å; Q144-E148 PolarHBondContact O-N 3.32Å
145D98.6Very high97.5Very high98 Ų9867.1 Ų67.152%0.52435%0.346SS..Hα-helixtrans-56.5-41.2175.9-67.2-13.9000111.5K141 E148 F149K141-D145 PolarHBondContact O-N 3.13Å; D145-E148 PolarHBondContact O-N 2.93Å; D145-F149 WeakPolarHBondContact O-CB 3.43Å; D145-F149 PolarHBondContact O-N 2.95Å
146R98.6Very high97.7Very high75 Ų7568.5 Ų68.528%0.28336%0.36SS..Hα-helixtrans-66.9-38.3177-73.1-57.3-165.3146.714.1112.9E142 I143 Q144 L150 I166 E169 I170E142-R146 WeakPolarHBondContact O-CB 3.37Å; E142-R146 VanDerWaalsContact O-CG 3.23Å; E142-R146 WeakPolarHBondContact O-CG 3.3Å; E142-R146 PolarHBondContact O-N 3.26Å; E142-R146 VanDerWaalsContact O-N 3.1Å; I143-R146 PolarHBondContact O-N 3.5Å; Q144-R146 VanDerWaalsContact C-N 3.25Å; Q144-R146 PolarHBondContact O-N 3.35Å; R146-L150 WeakPolarHBondContact O-CB 3.25Å; R146-L150 PolarHBondContact O-N 3.01Å; R146-I166 HydrophobicContact CB-CG2 4Å; R146-I166 WeakPolarHBondContact O-CG2 3.46Å; R146-E169 IonicContact CZ-OE1 4Å; R146-E169 VanDerWaalsContact CZ-OE1 3.3Å; R146-E169 IonicContact CZ-OE2 3.85Å; R146-E169 IonicContact NE-OE2 2.77Å; R146-E169 PolarHBondContact NE-OE2 3.49Å; R146-E169 VanDerWaalsContact NH1-CD 3.33Å; R146-E169 IonicContact NH1-OE1 2.78Å; R146-E169 PolarHBondContact NH1-OE1 3.28Å; R146-E169 IonicContact NH1-OE2 3.03Å; R146-E169 PolarHBondContact NH1-OE2 2.82Å; R146-E169 IonicContact NH2-OE1 3.21Å; R146-E169 PolarHBondContact NH2-OE1 3.01Å; R146-E169 IonicContact NH2-OE2 2.82Å; R146-E169 PolarHBondContact NH2-OE2 3.41Å; R146-I170 HydrophobicContact CB-CD1 4.29Å; R146-I170 HydrophobicContact CB-CG1 3.94Å
147K98.5Very high97.8Very high107 Ų10769.2 Ų69.247%0.46538%0.381SS..Hα-helixtrans-64.6-44.6174.1-73.9174.1178.1177.50111.3I143 Q144 L150 A151 I170I143-K147 HydrophobicContact CG2-CD 4.32Å; I143-K147 WeakPolarHBondContact O-CG 3.06Å; I143-K147 PolarHBondContact O-N 3.13Å; Q144-K147 WeakPolarHBondContact O-CB 3.5Å; Q144-K147 PolarHBondContact O-N 3.11Å; K147-L150 PolarHBondContact O-N 3.5Å; K147-A151 WeakPolarHBondContact O-CB 3.42Å; K147-A151 PolarHBondContact O-N 3.27Å; K147-I170 HydrophobicContact CG-CD1 4.01Å
148E98.6Very high97.9Very high109 Ų10969.4 Ų69.451%0.50938%0.379SS..Hα-helixtrans-64.9-43.2178.8-71.4176.7-166.600111.5Q144 D145 L150 A151 A152Q144-E148 WeakPolarHBondContact CG-OE1 3.49Å; Q144-E148 PolarHBondContact NE2-OE1 3.33Å; Q144-E148 WeakPolarHBondContact O-CG 3.4Å; Q144-E148 PolarHBondContact O-N 3.32Å; D145-E148 PolarHBondContact O-N 2.93Å; E148-L150 VanDerWaalsContact C-N 3.34Å; E148-L150 PolarHBondContact O-N 3.02Å; E148-A151 PolarHBondContact O-N 3.48Å; E148-A152 WeakPolarHBondContact O-CB 3.26Å; E148-A152 PolarHBondContact O-N 3.13Å
149F98.5Very high98Very high78 Ų7866.3 Ų66.334%0.34237%0.366SS..Hα-helixtrans-57.4-47.5172.5174.7-94.6000111.6D145 A151 A152 M153 Y162 I166D145-F149 WeakPolarHBondContact O-CB 3.43Å; D145-F149 PolarHBondContact O-N 2.95Å; F149-A151 VanDerWaalsContact C-N 3.35Å; F149-A151 PolarHBondContact O-N 2.98Å; F149-A152 PolarHBondContact O-N 2.66Å; F149-M153 HydrophobicContact CD1-CG 4.19Å; F149-M153 HydrophobicContact CD2-CG 4.44Å; F149-M153 HydrophobicContact CE1-CG 3.65Å; F149-M153 HydrophobicContact CE2-CE 4.08Å; F149-M153 HydrophobicContact CE2-CG 3.94Å; F149-M153 HydrophobicContact CE2-SD 4.19Å; F149-M153 HydrophobicContact CZ-CE 4.49Å; F149-M153 HydrophobicContact CZ-CG 3.51Å; F149-M153 HydrophobicContact CZ-SD 4.01Å; F149-M153 WeakPolarHBondContact O-CG 3.47Å; F149-M153 PolarHBondContact O-N 3.35Å; F149-Y162 HydrophobicContact CE1-CD1 4.14Å; F149-Y162 HydrophobicContact CE1-CG 4.21Å; F149-Y162 HydrophobicContact CZ-CD1 4.32Å; F149-Y162 HydrophobicContact CZ-CE1 4.45Å; F149-I166 HydrophobicContact CD1-CD1 3.63Å; F149-I166 HydrophobicContact CD1-CG1 4.01Å; F149-I166 HydrophobicContact CE1-CD1 3.74Å; F149-I166 HydrophobicContact CE1-CG1 4.14Å
150L98.6Very high97.9Very high19 Ų1977.8 Ų77.810%0.09941%0.409CS..Hα-helixtrans-62.4-43.5179-176.660.7000111.5R146 K147 E148 A152 M153 E154 R163 I166R146-L150 WeakPolarHBondContact O-CB 3.25Å; R146-L150 PolarHBondContact O-N 3.01Å; K147-L150 PolarHBondContact O-N 3.5Å; E148-L150 VanDerWaalsContact C-N 3.34Å; E148-L150 PolarHBondContact O-N 3.02Å; L150-A152 VanDerWaalsContact C-N 3.33Å; L150-A152 PolarHBondContact O-N 3.34Å; L150-M153 PolarHBondContact O-N 3.48Å; L150-E154 HydrophobicContact CD1-CG 4.4Å; L150-E154 HydrophobicContact CG-CG 4.46Å; L150-E154 WeakPolarHBondContact O-CB 3.46Å; L150-E154 WeakPolarHBondContact O-CG 3.47Å; L150-E154 PolarHBondContact O-N 2.91Å; L150-R163 HydrophobicContact CD1-CG 3.95Å; L150-R163 HydrophobicContact CD2-CG 4.41Å; L150-I166 HydrophobicContact CB-CG2 4.05Å; L150-I166 HydrophobicContact CD1-CB 4.42Å; L150-I166 HydrophobicContact CD1-CG1 4.33Å; L150-I166 HydrophobicContact CD2-CB 4.47Å; L150-I166 HydrophobicContact CD2-CG2 4.32Å
151A98.4Very high97.9Very high57 Ų5780 Ų8047%0.47142%0.415SS..Hα-helixtrans-60.2-42.4176.400000111.8K147 E148 F149 E154 A155K147-A151 WeakPolarHBondContact O-CB 3.42Å; K147-A151 PolarHBondContact O-N 3.27Å; E148-A151 PolarHBondContact O-N 3.48Å; F149-A151 VanDerWaalsContact C-N 3.35Å; F149-A151 PolarHBondContact O-N 2.98Å; A151-E154 PolarHBondContact O-N 3.3Å; A151-A155 WeakPolarHBondContact O-CB 3.46Å; A151-A155 PolarHBondContact O-N 3.18Å
152A98.4Very high98Very high48 Ų4878.9 Ų78.940%0.39741%0.409SS..Hα-helixtrans-63-43.4175.300000111.9E148 F149 L150 E154 A155 L156E148-A152 WeakPolarHBondContact O-CB 3.26Å; E148-A152 PolarHBondContact O-N 3.13Å; F149-A152 PolarHBondContact O-N 2.66Å; L150-A152 VanDerWaalsContact C-N 3.33Å; L150-A152 PolarHBondContact O-N 3.34Å; A152-E154 VanDerWaalsContact C-N 3.35Å; A152-A155 PolarHBondContact O-N 3.16Å; A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 2.95Å; A152-L156 VanDerWaalsContact O-N 3.16Å
153M98.3Very high97.9Very high34 Ų3482.5 Ų82.517%0.16742%0.42CS..Hα-helixtrans-68-34.2177.2-67.8-55.710400112.5F149 L150 L156 G157 Q158 G159 Y162F149-M153 HydrophobicContact CD1-CG 4.19Å; F149-M153 HydrophobicContact CD2-CG 4.44Å; F149-M153 HydrophobicContact CE1-CG 3.65Å; F149-M153 HydrophobicContact CE2-CE 4.08Å; F149-M153 HydrophobicContact CE2-CG 3.94Å; F149-M153 HydrophobicContact CE2-SD 4.19Å; F149-M153 HydrophobicContact CZ-CE 4.49Å; F149-M153 HydrophobicContact CZ-CG 3.51Å; F149-M153 HydrophobicContact CZ-SD 4.01Å; F149-M153 WeakPolarHBondContact O-CG 3.47Å; F149-M153 PolarHBondContact O-N 3.35Å; L150-M153 PolarHBondContact O-N 3.48Å; M153-L156 HydrophobicContact CE-CD1 3.82Å; M153-L156 PolarHBondContact O-N 3.39Å; M153-G157 PolarHBondContact O-N 2.94Å; M153-Q158 WeakPolarHBondContact O-CA 3.29Å; M153-Q158 PolarHBondContact O-N 3.21Å; M153-G159 PolarHBondContact O-N 2.99Å; M153-Y162 HydrophobicContact CB-CD2 3.89Å; M153-Y162 HydrophobicContact CG-CD2 3.76Å; M153-Y162 HydrophobicContact CG-CE2 4.11Å; M153-Y162 HydrophobicContact CG-CG 4.27Å; M153-Y162 HydrophobicContact SD-CD2 4.2Å; M153-Y162 HydrophobicContact SD-CE2 3.92Å
154E97.4Very high97.9Very high74 Ų7485.9 Ų85.935%0.34645%0.445SS..Hα-helixtrans-67.2-42.2173.6-76.6-175.8170.300112.1L150 A151 A152 L156 G157 R163L150-E154 HydrophobicContact CD1-CG 4.4Å; L150-E154 HydrophobicContact CG-CG 4.46Å; L150-E154 WeakPolarHBondContact O-CB 3.46Å; L150-E154 WeakPolarHBondContact O-CG 3.47Å; L150-E154 PolarHBondContact O-N 2.91Å; A151-E154 PolarHBondContact O-N 3.3Å; A152-E154 VanDerWaalsContact C-N 3.35Å; E154-L156 PolarHBondContact O-N 3Å; E154-G157 WeakPolarHBondContact O-CA 3.33Å; E154-G157 PolarHBondContact O-N 3.18Å; E154-R163 IonicContact OE1-CZ 3.19Å; E154-R163 IonicContact OE1-NE 2.68Å; E154-R163 PolarHBondContact OE1-NE 2.89Å; E154-R163 IonicContact OE1-NH2 2.82Å; E154-R163 PolarHBondContact OE1-NH2 3.48Å; E154-R163 IonicContact OE2-NH2 3.75Å
155A98Very high97.9Very high91 Ų9186.1 Ų86.175%0.75245%0.448SS*.Hα-helixtrans-60.8-31.8174.700000112.3A151 A152 G157A151-A155 WeakPolarHBondContact O-CB 3.46Å; A151-A155 PolarHBondContact O-N 3.18Å; A152-A155 PolarHBondContact O-N 3.16Å; A155-G157 VanDerWaalsContact C-N 3.28Å
156L97.9Very high97.9Very high122 Ų12281.6 Ų81.664%0.63942%0.423SS*.THydrogen-bonded Turntrans-82.10.7173-65.2173000113.9A152 M153 E154 Q158A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 2.95Å; A152-L156 VanDerWaalsContact O-N 3.16Å; M153-L156 HydrophobicContact CE-CD1 3.82Å; M153-L156 PolarHBondContact O-N 3.39Å; E154-L156 PolarHBondContact O-N 3Å; L156-Q158 VanDerWaalsContact C-N 3.26Å; L156-Q158 HydrophobicContact CB-CG 4.49Å; L156-Q158 PolarHBondContact O-N 2.68Å
157G97.6Very high97.9Very high61 Ų6182.4 Ų82.463%0.62943%0.433SS*.THydrogen-bonded Turntrans76.73.7-178.500000115.3M153 E154 A155M153-G157 PolarHBondContact O-N 2.94Å; E154-G157 WeakPolarHBondContact O-CA 3.33Å; E154-G157 PolarHBondContact O-N 3.18Å; A155-G157 VanDerWaalsContact C-N 3.28Å
158Q97Very high97.9Very high81 Ų8180 Ų8038%0.37943%0.433SS..  trans-90.35-178.1-59.6-59.6-35.700113.7M153 L156 R160 Q161 Y162M153-Q158 WeakPolarHBondContact O-CA 3.29Å; M153-Q158 PolarHBondContact O-N 3.21Å; L156-Q158 VanDerWaalsContact C-N 3.26Å; L156-Q158 HydrophobicContact CB-CG 4.49Å; L156-Q158 PolarHBondContact O-N 2.68Å; Q158-R160 PolarHBondContact O-N 3.48Å; Q158-Q161 PolarHBondContact O-N 2.8Å; Q158-Y162 HydrophobicContact CB-CD2 4.18Å; Q158-Y162 HydrophobicContact CB-CE2 3.98Å; Q158-Y162 WeakPolarHBondContact O-CD2 3.38Å
159G96.8Very high97.9Very high6 Ų676.8 Ų76.86%0.06242%0.418CS..Hα-helixtrans-54.5-31-175.200000115.2M153 Q161 Y162 R163M153-G159 PolarHBondContact O-N 2.99Å; G159-Q161 PolarHBondContact O-N 3.21Å; G159-Y162 PolarHBondContact O-N 2.95Å; G159-R163 VanDerWaalsContact O-CB 3.3Å; G159-R163 WeakPolarHBondContact O-CB 3.48Å; G159-R163 VanDerWaalsContact O-CG 3.3Å; G159-R163 WeakPolarHBondContact O-CG 3.34Å; G159-R163 PolarHBondContact O-N 2.8Å
160R96Very high97.9Very high241 Ų24174 Ų7491%0.90941%0.406SS*.Hα-helixtrans-61.5-30.8178.6-67.5-173.6-178.5-137.11.3113.3Q158Q158-R160 PolarHBondContact O-N 3.48Å
161Q96.8Very high97.9Very high116 Ų11675.4 Ų75.454%0.54242%0.418SS..Hα-helixtrans-78.8-35.1-179.2-61.1179.910.300111.7Q158 G159Q158-Q161 PolarHBondContact O-N 2.8Å; G159-Q161 PolarHBondContact O-N 3.21Å
162Y98.3Very high97.9Very high82 Ų8278.2 Ų78.232%0.32242%0.421SS..Hα-helixtrans-101.7-25.5-169.5-62-71.2000114F149 M153 Q158 G159 S164 I165 I166F149-Y162 HydrophobicContact CE1-CD1 4.14Å; F149-Y162 HydrophobicContact CE1-CG 4.21Å; F149-Y162 HydrophobicContact CZ-CD1 4.32Å; F149-Y162 HydrophobicContact CZ-CE1 4.45Å; M153-Y162 HydrophobicContact CB-CD2 3.89Å; M153-Y162 HydrophobicContact CG-CD2 3.76Å; M153-Y162 HydrophobicContact CG-CE2 4.11Å; M153-Y162 HydrophobicContact CG-CG 4.27Å; M153-Y162 HydrophobicContact SD-CD2 4.2Å; M153-Y162 HydrophobicContact SD-CE2 3.92Å; Q158-Y162 HydrophobicContact CB-CD2 4.18Å; Q158-Y162 HydrophobicContact CB-CE2 3.98Å; Q158-Y162 WeakPolarHBondContact O-CD2 3.38Å; G159-Y162 PolarHBondContact O-N 2.95Å; Y162-S164 PolarHBondContact O-N 3.49Å; Y162-I165 PolarHBondContact O-N 3.04Å; Y162-I165 VanDerWaalsContact O-N 3.17Å; Y162-I166 VanDerWaalsContact O-CG1 3.31Å; Y162-I166 WeakPolarHBondContact O-CG1 3.48Å; Y162-I166 PolarHBondContact O-N 3.47Å
163R97.8Very high97.9Very high134 Ų13477.4 Ų77.451%0.50641%0.409SS..Hα-helixtrans-48.1-53.1-174.4-96.6-176.8177.1-170.2-2114L150 E154 G159 I165 L167L150-R163 HydrophobicContact CD1-CG 3.95Å; L150-R163 HydrophobicContact CD2-CG 4.41Å; E154-R163 IonicContact OE1-CZ 3.19Å; E154-R163 IonicContact OE1-NE 2.68Å; E154-R163 PolarHBondContact OE1-NE 2.89Å; E154-R163 IonicContact OE1-NH2 2.82Å; E154-R163 PolarHBondContact OE1-NH2 3.48Å; E154-R163 IonicContact OE2-NH2 3.75Å; G159-R163 VanDerWaalsContact O-CB 3.3Å; G159-R163 WeakPolarHBondContact O-CB 3.48Å; G159-R163 VanDerWaalsContact O-CG 3.3Å; G159-R163 WeakPolarHBondContact O-CG 3.34Å; G159-R163 PolarHBondContact O-N 2.8Å; R163-I165 PolarHBondContact O-N 3.13Å; R163-L167 VanDerWaalsContact O-CB 3.28Å; R163-L167 WeakPolarHBondContact O-CB 3.25Å; R163-L167 WeakPolarHBondContact O-CD1 3.41Å; R163-L167 WeakPolarHBondContact O-CG 3.26Å; R163-L167 PolarHBondContact O-N 3.42Å
164S98Very high97.9Very high85 Ų8579.5 Ų79.559%0.59442%0.42SS*.Hα-helixtrans-63-43.6-175.751.70000112.2Y162 A168Y162-S164 PolarHBondContact O-N 3.49Å; S164-A168 WeakPolarHBondContact O-CB 3.25Å; S164-A168 PolarHBondContact O-N 3.36Å; S164-A168 VanDerWaalsContact O-N 3.11Å
165I98.2Very high97.9Very high91 Ų9182.6 Ų82.647%0.46743%0.429SS..Hα-helixtrans-66.5-50.7-179.1-59172.1000109.9Y162 R163 L167 A168 E169Y162-I165 PolarHBondContact O-N 3.04Å; Y162-I165 VanDerWaalsContact O-N 3.17Å; R163-I165 PolarHBondContact O-N 3.13Å; I165-L167 PolarHBondContact O-N 2.9Å; I165-A168 WeakPolarHBondContact O-CB 3.43Å; I165-A168 PolarHBondContact O-N 3.31Å; I165-A168 VanDerWaalsContact O-N 3.17Å; I165-E169 WeakPolarHBondContact O-CG 3.48Å; I165-E169 PolarHBondContact O-N 3.46Å
166I98.4Very high97.9Very high2 Ų281.3 Ų81.31%0.0141%0.407CS..Hα-helixtrans-64.9-40.4-177.4-57.8-55.6000111.6R146 F149 L150 Y162 A168 E169 I170R146-I166 HydrophobicContact CB-CG2 4Å; R146-I166 WeakPolarHBondContact O-CG2 3.46Å; F149-I166 HydrophobicContact CD1-CD1 3.63Å; F149-I166 HydrophobicContact CD1-CG1 4.01Å; F149-I166 HydrophobicContact CE1-CD1 3.74Å; F149-I166 HydrophobicContact CE1-CG1 4.14Å; L150-I166 HydrophobicContact CB-CG2 4.05Å; L150-I166 HydrophobicContact CD1-CB 4.42Å; L150-I166 HydrophobicContact CD1-CG1 4.33Å; L150-I166 HydrophobicContact CD2-CB 4.47Å; L150-I166 HydrophobicContact CD2-CG2 4.32Å; Y162-I166 VanDerWaalsContact O-CG1 3.31Å; Y162-I166 WeakPolarHBondContact O-CG1 3.48Å; Y162-I166 PolarHBondContact O-N 3.47Å; I166-A168 VanDerWaalsContact C-N 3.31Å; I166-A168 PolarHBondContact O-N 2.76Å; I166-E169 WeakPolarHBondContact CA-OE2 3.44Å; I166-E169 VanDerWaalsContact CD1-OE2 3.28Å; I166-E169 WeakPolarHBondContact CD1-OE2 3.33Å; I166-E169 PolarHBondContact O-N 2.93Å; I166-I170 HydrophobicContact CG2-CD1 3.85Å; I166-I170 HydrophobicContact CG2-CG1 4.31Å; I166-I170 VanDerWaalsContact O-CG1 3.29Å; I166-I170 WeakPolarHBondContact O-CG1 3.49Å; I166-I170 PolarHBondContact O-N 3.47Å
167L98.3Very high97.8Very high93 Ų9376.8 Ų76.849%0.48738%0.383SS..Hα-helixtrans-64.1-37.4176.1-71.5172.4000112R163 I165 S171R163-L167 VanDerWaalsContact O-CB 3.28Å; R163-L167 WeakPolarHBondContact O-CB 3.25Å; R163-L167 WeakPolarHBondContact O-CD1 3.41Å; R163-L167 WeakPolarHBondContact O-CG 3.26Å; R163-L167 PolarHBondContact O-N 3.42Å; I165-L167 PolarHBondContact O-N 2.9Å; L167-S171 WeakPolarHBondContact O-CB 3.43Å; L167-S171 PolarHBondContact O-N 3.06Å; L167-S171 PolarHBondContact O-OG 3.27Å
168A98.6Very high97.8Very high56 Ų5678.4 Ų78.446%0.46337%0.374SS..Hα-helixtrans-65-41.7175.600000111.8S164 I165 I166 S171 Q172S164-A168 WeakPolarHBondContact O-CB 3.25Å; S164-A168 PolarHBondContact O-N 3.36Å; S164-A168 VanDerWaalsContact O-N 3.11Å; I165-A168 WeakPolarHBondContact O-CB 3.43Å; I165-A168 PolarHBondContact O-N 3.31Å; I165-A168 VanDerWaalsContact O-N 3.17Å; I166-A168 VanDerWaalsContact C-N 3.31Å; I166-A168 PolarHBondContact O-N 2.76Å; A168-S171 WeakPolarHBondContact O-CB 3.4Å; A168-S171 PolarHBondContact O-N 3.01Å; A168-Q172 PolarHBondContact O-N 2.86Å
169E98.4Very high97.9Very high42 Ų4278 Ų7820%0.19638%0.375CS..Hα-helixtrans-67.6-42177.3-66.8163.514800112R146 I165 I166 S171 Q172 K173R146-E169 IonicContact CZ-OE1 4Å; R146-E169 VanDerWaalsContact CZ-OE1 3.3Å; R146-E169 IonicContact CZ-OE2 3.85Å; R146-E169 IonicContact NE-OE2 2.77Å; R146-E169 PolarHBondContact NE-OE2 3.49Å; R146-E169 VanDerWaalsContact NH1-CD 3.33Å; R146-E169 IonicContact NH1-OE1 2.78Å; R146-E169 PolarHBondContact NH1-OE1 3.28Å; R146-E169 IonicContact NH1-OE2 3.03Å; R146-E169 PolarHBondContact NH1-OE2 2.82Å; R146-E169 IonicContact NH2-OE1 3.21Å; R146-E169 PolarHBondContact NH2-OE1 3.01Å; R146-E169 IonicContact NH2-OE2 2.82Å; R146-E169 PolarHBondContact NH2-OE2 3.41Å; I165-E169 WeakPolarHBondContact O-CG 3.48Å; I165-E169 PolarHBondContact O-N 3.46Å; I166-E169 WeakPolarHBondContact CA-OE2 3.44Å; I166-E169 VanDerWaalsContact CD1-OE2 3.28Å; I166-E169 WeakPolarHBondContact CD1-OE2 3.33Å; I166-E169 PolarHBondContact O-N 2.93Å; E169-S171 VanDerWaalsContact C-N 3.29Å; E169-S171 PolarHBondContact O-N 3.39Å; E169-Q172 WeakPolarHBondContact O-CB 3.29Å; E169-Q172 PolarHBondContact O-N 3.03Å; E169-K173 WeakPolarHBondContact O-CG 3.21Å; E169-K173 PolarHBondContact O-N 2.77Å
170I98.4Very high97.8Very high18 Ų1878.9 Ų78.99%0.09238%0.378CS..Hα-helixtrans-58.9-45.3172.5-70.2168.5000109.7I143 R146 K147 I166 Q172 K173 L174I143-I170 HydrophobicContact CG2-CG2 4.27Å; R146-I170 HydrophobicContact CB-CD1 4.29Å; R146-I170 HydrophobicContact CB-CG1 3.94Å; K147-I170 HydrophobicContact CG-CD1 4.01Å; I166-I170 HydrophobicContact CG2-CD1 3.85Å; I166-I170 HydrophobicContact CG2-CG1 4.31Å; I166-I170 VanDerWaalsContact O-CG1 3.29Å; I166-I170 WeakPolarHBondContact O-CG1 3.49Å; I166-I170 PolarHBondContact O-N 3.47Å; I170-Q172 VanDerWaalsContact C-N 3.29Å; I170-Q172 PolarHBondContact O-N 2.9Å; I170-K173 PolarHBondContact O-N 3.26Å; I170-L174 HydrophobicContact CG2-CD1 4.08Å; I170-L174 HydrophobicContact CG2-CG 4.47Å; I170-L174 WeakPolarHBondContact O-CG 3.37Å; I170-L174 PolarHBondContact O-N 2.87Å
171S98.4Very high97.8Very high49 Ų4970.7 Ų70.734%0.34335%0.352SS..Hα-helixtrans-63.4-35.1178.1-57.70000112.4L167 A168 E169 R175L167-S171 WeakPolarHBondContact O-CB 3.43Å; L167-S171 PolarHBondContact O-N 3.06Å; L167-S171 PolarHBondContact O-OG 3.27Å; A168-S171 WeakPolarHBondContact O-CB 3.4Å; A168-S171 PolarHBondContact O-N 3.01Å; E169-S171 VanDerWaalsContact C-N 3.29Å; E169-S171 PolarHBondContact O-N 3.39Å; S171-R175 WeakPolarHBondContact O-CG 3.43Å; S171-R175 PolarHBondContact O-N 2.93Å; S171-R175 VanDerWaalsContact O-N 3.17Å; S171-R175 PolarHBondContact O-NH1 2.75Å
172Q98.6Very high97.8Very high116 Ų11671.7 Ų71.754%0.54235%0.351SS..Hα-helixtrans-64.1-46.6174.4-179.4-179-4.600111.4A168 E169 I170 L174 R175 E176A168-Q172 PolarHBondContact O-N 2.86Å; E169-Q172 WeakPolarHBondContact O-CB 3.29Å; E169-Q172 PolarHBondContact O-N 3.03Å; I170-Q172 VanDerWaalsContact C-N 3.29Å; I170-Q172 PolarHBondContact O-N 2.9Å; Q172-L174 VanDerWaalsContact C-N 3.34Å; Q172-L174 PolarHBondContact O-N 3.45Å; Q172-R175 PolarHBondContact O-N 2.97Å; Q172-E176 PolarHBondContact O-N 2.99Å; Q172-E176 VanDerWaalsContact O-N 3.13Å
173K98.2Very high97.7Very high32 Ų3275.3 Ų75.314%0.13936%0.364CS..Hα-helixtrans-64.5-38.2178.9-66.4176.6-164.9-50.40112.3L139 E142 I143 E169 I170 E176 M177L139-K173 HydrophobicContact CD2-CB 4.15Å; L139-K173 HydrophobicContact CD2-CG 4.17Å; E142-K173 HydrophobicContact CB-CD 3.71Å; E142-K173 WeakPolarHBondContact OE2-CE 3.43Å; E142-K173 IonicContact OE2-NZ 2.75Å; E142-K173 PolarHBondContact OE2-NZ 3.46Å; I143-K173 HydrophobicContact CD1-CB 3.83Å; I143-K173 HydrophobicContact CG1-CB 3.59Å; I143-K173 HydrophobicContact CG1-CD 3.91Å; I143-K173 HydrophobicContact CG1-CG 4.4Å; E169-K173 WeakPolarHBondContact O-CG 3.21Å; E169-K173 PolarHBondContact O-N 2.77Å; I170-K173 PolarHBondContact O-N 3.26Å; K173-E176 PolarHBondContact O-N 2.91Å; K173-M177 WeakPolarHBondContact O-CB 3.31Å; K173-M177 PolarHBondContact O-N 3.08Å
174L98.3Very high97.6Very high78 Ų7872.9 Ų72.941%0.40836%0.355SS..Hα-helixtrans-62.2-41.7174.3-74.7172.6000112.4I143 I170 Q172 E176 M177 E178I143-L174 HydrophobicContact CD1-CD2 3.83Å; I143-L174 HydrophobicContact CD1-CG 4.03Å; I170-L174 HydrophobicContact CG2-CD1 4.08Å; I170-L174 HydrophobicContact CG2-CG 4.47Å; I170-L174 WeakPolarHBondContact O-CG 3.37Å; I170-L174 PolarHBondContact O-N 2.87Å; Q172-L174 VanDerWaalsContact C-N 3.34Å; Q172-L174 PolarHBondContact O-N 3.45Å; L174-E176 VanDerWaalsContact C-N 3.34Å; L174-E176 PolarHBondContact O-N 3.15Å; L174-M177 WeakPolarHBondContact O-CB 3.24Å; L174-M177 PolarHBondContact O-N 2.78Å; L174-E178 WeakPolarHBondContact O-CG 3.31Å; L174-E178 PolarHBondContact O-N 3.12Å
175R98.2Very high97.5Very high139 Ų13971.3 Ų71.353%0.52534%0.344SS..Hα-helixtrans-63.6-40.5175.5-73.8-175.9-68.1-92.73112.3S171 Q172 M177 E178 D179S171-R175 WeakPolarHBondContact O-CG 3.43Å; S171-R175 PolarHBondContact O-N 2.93Å; S171-R175 VanDerWaalsContact O-N 3.17Å; S171-R175 PolarHBondContact O-NH1 2.75Å; Q172-R175 PolarHBondContact O-N 2.97Å; R175-M177 VanDerWaalsContact C-N 3.3Å; R175-M177 PolarHBondContact O-N 3.17Å; R175-E178 PolarHBondContact O-N 3.08Å; R175-D179 PolarHBondContact O-N 3.15Å
176E97.1Very high97.4Very high63 Ų6373.1 Ų73.129%0.29435%0.348SS..Hα-helixtrans-62.2-41.6175.9-168-179.715800111.3R135 L139 Q172 K173 L174 D179 I180R135-E176 IonicContact CZ-OE1 3.79Å; R135-E176 IonicContact NE-OE1 2.66Å; R135-E176 PolarHBondContact NE-OE1 3.38Å; R135-E176 IonicContact NH2-OE1 2.7Å; R135-E176 PolarHBondContact NH2-OE1 2.71Å; R135-E176 IonicContact NH2-OE2 2.71Å; R135-E176 PolarHBondContact NH2-OE2 3.35Å; L139-E176 HydrophobicContact CD1-CB 3.88Å; L139-E176 HydrophobicContact CD1-CG 3.75Å; L139-E176 HydrophobicContact CD2-CB 4.43Å; L139-E176 HydrophobicContact CD2-CG 4.45Å; Q172-E176 PolarHBondContact O-N 2.99Å; Q172-E176 VanDerWaalsContact O-N 3.13Å; K173-E176 PolarHBondContact O-N 2.91Å; L174-E176 VanDerWaalsContact C-N 3.34Å; L174-E176 PolarHBondContact O-N 3.15Å; E176-D179 PolarHBondContact O-N 3.36Å; E176-I180 WeakPolarHBondContact O-CG1 3.06Å; E176-I180 PolarHBondContact O-N 2.95Å
177M97.2Very high97.3Very high28 Ų2879 Ų7914%0.13838%0.376CS..Hα-helixtrans-60.7-46.4175-170.1-176.6-65.200111.8F136 L139 V140 I143 K173 L174 R175 D179 I180 D181F136-M177 HydrophobicContact CD2-CG 3.7Å; F136-M177 HydrophobicContact CE1-CG 4.46Å; F136-M177 HydrophobicContact CE1-SD 4.37Å; F136-M177 HydrophobicContact CE2-CB 4.47Å; F136-M177 HydrophobicContact CE2-CG 3.16Å; F136-M177 HydrophobicContact CE2-SD 3.97Å; F136-M177 HydrophobicContact CZ-CG 3.6Å; F136-M177 HydrophobicContact CZ-SD 3.74Å; L139-M177 HydrophobicContact CB-CE 4.06Å; L139-M177 HydrophobicContact CD1-CB 4.27Å; V140-M177 HydrophobicContact CG2-CE 3.74Å; I143-M177 HydrophobicContact CD1-CE 3.69Å; K173-M177 WeakPolarHBondContact O-CB 3.31Å; K173-M177 PolarHBondContact O-N 3.08Å; L174-M177 WeakPolarHBondContact O-CB 3.24Å; L174-M177 PolarHBondContact O-N 2.78Å; R175-M177 VanDerWaalsContact C-N 3.3Å; R175-M177 PolarHBondContact O-N 3.17Å; M177-D179 VanDerWaalsContact C-N 3.31Å; M177-D179 PolarHBondContact O-N 2.88Å; M177-I180 PolarHBondContact O-N 2.7Å; M177-D181 PolarHBondContact O-N 2.66Å
178E97.6Very high97.2Very high95 Ų9580 Ų8044%0.44438%0.381SS..Hα-helixtrans-60.1-39.7175.3-73.2179.6-149.400112.7L174 R175 I180 D181 R182L174-E178 WeakPolarHBondContact O-CG 3.31Å; L174-E178 PolarHBondContact O-N 3.12Å; R175-E178 PolarHBondContact O-N 3.08Å; E178-I180 VanDerWaalsContact C-N 3.35Å; E178-D181 PolarHBondContact O-N 2.79Å; E178-R182 WeakPolarHBondContact O-CB 3.49Å; E178-R182 WeakPolarHBondContact O-CG 3.21Å; E178-R182 PolarHBondContact O-N 3.16Å; E178-R182 IonicContact OE2-CZ 2.8Å; E178-R182 IonicContact OE2-NH2 3.03Å; E178-R182 PolarHBondContact OE2-NH2 3.27Å
179D97.6Very high97Very high73 Ų7386 Ų8639%0.3939%0.392SS..Hα-helixtrans-66.1-38.9178.9-79.4-22.9000111.7R175 E176 M177 R182 R183R175-D179 PolarHBondContact O-N 3.15Å; E176-D179 PolarHBondContact O-N 3.36Å; M177-D179 VanDerWaalsContact C-N 3.31Å; M177-D179 PolarHBondContact O-N 2.88Å; D179-R182 PolarHBondContact O-N 3.04Å; D179-R183 VanDerWaalsContact O-CG 3.24Å; D179-R183 WeakPolarHBondContact O-CG 3.35Å; D179-R183 PolarHBondContact O-N 3.22Å
180I95.9Very high97Very high23 Ų2391.1 Ų91.112%0.11841%0.413CS..Hα-helixtrans-60.9-48.9173.2-68.1166.5000110R135 F136 L139 E176 M177 E178 R182 R183 R184R135-I180 HydrophobicContact CB-CD1 4.21Å; R135-I180 HydrophobicContact CG-CD1 3.75Å; F136-I180 HydrophobicContact CD2-CG2 4.21Å; L139-I180 HydrophobicContact CD1-CD1 3.77Å; E176-I180 WeakPolarHBondContact O-CG1 3.06Å; E176-I180 PolarHBondContact O-N 2.95Å; M177-I180 PolarHBondContact O-N 2.7Å; E178-I180 VanDerWaalsContact C-N 3.35Å; I180-R182 VanDerWaalsContact C-N 3.35Å; I180-R182 PolarHBondContact O-N 3.19Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.28Å; I180-R183 VanDerWaalsContact O-N 3.16Å; I180-R184 HydrophobicContact CG2-CG 4.47Å; I180-R184 VanDerWaalsContact CG2-CZ 3.5Å; I180-R184 VanDerWaalsContact CG2-NE 3.32Å; I180-R184 WeakPolarHBondContact O-CG 3.5Å; I180-R184 PolarHBondContact O-N 2.98Å
181D96.3Very high96.8Very high69 Ų6992.9 Ų92.937%0.36943%0.431SS..Hα-helixtrans-62.2-40.8179.3-82.9-9000112.8F136 M177 E178 R183 R184 S185F136-D181 VanDerWaalsContact CE2-OD1 3.26Å; F136-D181 WeakPolarHBondContact CE2-OD1 3.4Å; M177-D181 PolarHBondContact O-N 2.66Å; E178-D181 PolarHBondContact O-N 2.79Å; D181-R183 VanDerWaalsContact C-N 3.33Å; D181-R183 PolarHBondContact O-N 3.23Å; D181-R184 PolarHBondContact O-N 3.09Å; D181-S185 VanDerWaalsContact O-CB 3.25Å; D181-S185 WeakPolarHBondContact O-CB 3.29Å; D181-S185 PolarHBondContact O-N 2.78Å; D181-S185 PolarHBondContact O-OG 2.91Å
182R97.1Very high96.7Very high138 Ų13896.7 Ų96.752%0.52145%0.446SS..Hα-helixtrans-63.3-39.6175.4-73.2171.5-168.8-172.18.4111.6E178 D179 I180 K186E178-R182 WeakPolarHBondContact O-CB 3.49Å; E178-R182 WeakPolarHBondContact O-CG 3.21Å; E178-R182 PolarHBondContact O-N 3.16Å; E178-R182 IonicContact OE2-CZ 2.8Å; E178-R182 IonicContact OE2-NH2 3.03Å; E178-R182 PolarHBondContact OE2-NH2 3.27Å; D179-R182 PolarHBondContact O-N 3.04Å; I180-R182 VanDerWaalsContact C-N 3.35Å; I180-R182 PolarHBondContact O-N 3.19Å; R182-K186 WeakPolarHBondContact O-CD 3.3Å; R182-K186 WeakPolarHBondContact O-CG 3.34Å; R182-K186 PolarHBondContact O-N 3.42Å; R182-K186 VanDerWaalsContact O-N 3.12Å
183R95.8Very high96.4Very high157 Ų15795.2 Ų95.259%0.59245%0.454SS*.Hα-helixtrans-65.4-51.6176.9-72.5170.9-165.2-173.76.1110.7D179 I180 D181 S185 K186 E187D179-R183 VanDerWaalsContact O-CG 3.24Å; D179-R183 WeakPolarHBondContact O-CG 3.35Å; D179-R183 PolarHBondContact O-N 3.22Å; I180-R183 WeakPolarHBondContact O-CB 3.44Å; I180-R183 PolarHBondContact O-N 3.28Å; I180-R183 VanDerWaalsContact O-N 3.16Å; D181-R183 VanDerWaalsContact C-N 3.33Å; D181-R183 PolarHBondContact O-N 3.23Å; R183-S185 VanDerWaalsContact C-N 3.33Å; R183-S185 PolarHBondContact O-N 3.05Å; R183-K186 WeakPolarHBondContact O-CB 3.44Å; R183-K186 PolarHBondContact O-N 2.93Å; R183-K186 VanDerWaalsContact O-N 3.08Å; R183-E187 WeakPolarHBondContact O-CG 3.47Å; R183-E187 PolarHBondContact O-N 2.87Å
184R95.3Very high96Very high83 Ų8399.7 Ų99.731%0.31348%0.484SS..Hα-helixtrans-55.6-47.2177-70.7174.9-177.5-172.1-1.5112.2D134 I180 D181 K186 E187 L188D134-R184 IonicContact OD1-CZ 3.02Å; D134-R184 IonicContact OD1-NH2 3.9Å; D134-R184 PolarHBondContact OD1-NH2 3.06Å; D134-R184 IonicContact OD2-CZ 3.92Å; D134-R184 IonicContact OD2-NH1 3.34Å; D134-R184 PolarHBondContact OD2-NH1 2.67Å; D134-R184 IonicContact OD2-NH2 2.66Å; D134-R184 PolarHBondContact OD2-NH2 3.18Å; I180-R184 HydrophobicContact CG2-CG 4.47Å; I180-R184 VanDerWaalsContact CG2-CZ 3.5Å; I180-R184 VanDerWaalsContact CG2-NE 3.32Å; I180-R184 WeakPolarHBondContact O-CG 3.5Å; I180-R184 PolarHBondContact O-N 2.98Å; D181-R184 PolarHBondContact O-N 3.09Å; R184-K186 VanDerWaalsContact C-N 3.3Å; R184-K186 PolarHBondContact O-N 2.95Å; R184-E187 PolarHBondContact O-N 3.4Å; R184-L188 WeakPolarHBondContact O-CB 3.42Å; R184-L188 VanDerWaalsContact O-CG 3.3Å; R184-L188 WeakPolarHBondContact O-CG 3.49Å; R184-L188 PolarHBondContact O-N 3.1Å
185S96Very high94.7Very high53 Ų53104 Ų10437%0.37151%0.514SS..Hα-helixtrans-61.2-38.4178.6-62.60000112.4D181 R183 R189D181-S185 VanDerWaalsContact O-CB 3.25Å; D181-S185 WeakPolarHBondContact O-CB 3.29Å; D181-S185 PolarHBondContact O-N 2.78Å; D181-S185 PolarHBondContact O-OG 2.91Å; R183-S185 VanDerWaalsContact C-N 3.33Å; R183-S185 PolarHBondContact O-N 3.05Å; S185-R189 VanDerWaalsContact O-CG 3.29Å; S185-R189 WeakPolarHBondContact O-CG 3.17Å; S185-R189 PolarHBondContact O-N 3.44Å; S185-R189 VanDerWaalsContact O-N 3.08Å
186K96.8Very high94.5Very high128 Ų128102.2 Ų102.256%0.55751%0.513SS*.Hα-helixtrans-68.4-42.5176-74.3169.7-177.2179.50111.7R182 R183 R184 R189 K190R182-K186 WeakPolarHBondContact O-CD 3.3Å; R182-K186 WeakPolarHBondContact O-CG 3.34Å; R182-K186 PolarHBondContact O-N 3.42Å; R182-K186 VanDerWaalsContact O-N 3.12Å; R183-K186 WeakPolarHBondContact O-CB 3.44Å; R183-K186 PolarHBondContact O-N 2.93Å; R183-K186 VanDerWaalsContact O-N 3.08Å; R184-K186 VanDerWaalsContact C-N 3.3Å; R184-K186 PolarHBondContact O-N 2.95Å; K186-R189 PolarHBondContact O-N 3.19Å; K186-K190 WeakPolarHBondContact O-CG 3.04Å; K186-K190 PolarHBondContact O-N 3.49Å
187E95.5Very high94.4Very high125 Ų125104.3 Ų104.358%0.58453%0.525SS*.Hα-helixtrans-62.3-46.6177-72.3166.4-169.900111.3R183 R184 R189 K190 A191R183-E187 WeakPolarHBondContact O-CG 3.47Å; R183-E187 PolarHBondContact O-N 2.87Å; R184-E187 PolarHBondContact O-N 3.4Å; E187-R189 PolarHBondContact O-N 3.09Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 3.41Å; E187-A191 PolarHBondContact O-N 2.86Å
188L95.1Very high94.2Very high114 Ų114108.5 Ų108.560%0.59755%0.546SS*.Hα-helixtrans-58.5-46.2175.4-72.3171.4000112R184 K190 A191 L192R184-L188 WeakPolarHBondContact O-CB 3.42Å; R184-L188 VanDerWaalsContact O-CG 3.3Å; R184-L188 WeakPolarHBondContact O-CG 3.49Å; R184-L188 PolarHBondContact O-N 3.1Å; L188-K190 VanDerWaalsContact C-N 3.32Å; L188-K190 PolarHBondContact O-N 2.67Å; L188-A191 PolarHBondContact O-N 2.99Å; L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.03Å
189R96.3Very high94Very high183 Ų183109.3 Ų109.369%0.69155%0.552SS**Hα-helixtrans-60.9-39.5176.7-75.5175.9-171.9167.44112.5S185 K186 E187 A193S185-R189 VanDerWaalsContact O-CG 3.29Å; S185-R189 WeakPolarHBondContact O-CG 3.17Å; S185-R189 PolarHBondContact O-N 3.44Å; S185-R189 VanDerWaalsContact O-N 3.08Å; K186-R189 PolarHBondContact O-N 3.19Å; E187-R189 PolarHBondContact O-N 3.09Å; R189-A193 WeakPolarHBondContact O-CB 3.35Å; R189-A193 PolarHBondContact O-N 3.11Å; R189-A193 VanDerWaalsContact O-N 3.09Å
190K96.8Very high93.8Very high150 Ų150111.6 Ų111.665%0.65256%0.562SS**Hα-helixtrans-65-46.2176.1-72.9174-180-176.90111.3K186 E187 L188 L192 A193 T194K186-K190 WeakPolarHBondContact O-CG 3.04Å; K186-K190 PolarHBondContact O-N 3.49Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 3.41Å; L188-K190 VanDerWaalsContact C-N 3.32Å; L188-K190 PolarHBondContact O-N 2.67Å; K190-L192 VanDerWaalsContact C-N 3.32Å; K190-L192 PolarHBondContact O-N 3.34Å; K190-A193 PolarHBondContact O-N 2.82Å; K190-T194 WeakPolarHBondContact O-CG2 3.13Å; K190-T194 PolarHBondContact O-N 3.11Å; K190-T194 VanDerWaalsContact O-N 3.11Å; K190-T194 PolarHBondContact O-OG1 3.44Å
191A95.5Very high93.7Very high55 Ų55117.5 Ų117.546%0.45559%0.592SS.*Hα-helixtrans-60-42.9178.700000111.8E187 L188 A193 T194 T195E187-A191 PolarHBondContact O-N 2.86Å; L188-A191 PolarHBondContact O-N 2.99Å; A191-A193 PolarHBondContact O-N 2.87Å; A191-T194 WeakPolarHBondContact CA-OG1 3.48Å; A191-T194 PolarHBondContact O-N 3.44Å; A191-T194 PolarHBondContact O-OG1 2.79Å; A191-T195 PolarHBondContact O-OG1 3.23Å
192L94.8Very high93.5Very high129 Ų129120.9 Ų120.968%0.67561%0.608SS**Hα-helixtrans-64.2-39175.9-68.6175.5000112.5L188 K190 T194 T195L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.03Å; K190-L192 VanDerWaalsContact C-N 3.32Å; K190-L192 PolarHBondContact O-N 3.34Å; L192-T194 VanDerWaalsContact C-N 3.29Å; L192-T194 PolarHBondContact O-N 2.7Å; L192-T195 PolarHBondContact O-N 3.3Å; L192-T195 PolarHBondContact O-OG1 3Å
193A93.4Very high93.2Very high85 Ų85119.6 Ų119.670%0.70261%0.614SS**Hα-helixtrans-72.2-19.4179.400000114.2R189 K190 A191R189-A193 WeakPolarHBondContact O-CB 3.35Å; R189-A193 PolarHBondContact O-N 3.11Å; R189-A193 VanDerWaalsContact O-N 3.09Å; K190-A193 PolarHBondContact O-N 2.82Å; A191-A193 PolarHBondContact O-N 2.87Å
194T89.3Confident93Very high125 Ų125116.5 Ų116.577%0.76762%0.616SS**THydrogen-bonded Turntrans-87.1-4.8176.848.60000114.1K190 A191 L192K190-T194 WeakPolarHBondContact O-CG2 3.13Å; K190-T194 PolarHBondContact O-N 3.11Å; K190-T194 VanDerWaalsContact O-N 3.11Å; K190-T194 PolarHBondContact O-OG1 3.44Å; A191-T194 WeakPolarHBondContact CA-OG1 3.48Å; A191-T194 PolarHBondContact O-N 3.44Å; A191-T194 PolarHBondContact O-OG1 2.79Å; L192-T194 VanDerWaalsContact C-N 3.29Å; L192-T194 PolarHBondContact O-N 2.7Å
195T71Confident92.8Very high168 Ų168119.5 Ų119.5100%1.03164%0.644SS**  trans-98.70177.220000110.6A191 L192A191-T195 PolarHBondContact O-OG1 3.23Å; L192-T195 PolarHBondContact O-N 3.3Å; L192-T195 PolarHBondContact O-OG1 3Å

Retrieved 195 of 195 residues in 388.1 ms (Link to these results)