A0A3Q0KCE4_SCHMA Loading...

Intraflagellar transport protein 43 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KCE4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 184 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
1M49.7Very low61.3Low241 Ų241161 Ų161100%1.18786%0.863SS**  0101.50-63.3-174.5-16100107.2
2Y60.3Low61.3Low248 Ų248160.3 Ų160.397%0.97386%0.856SS**PPolyproline II helixtrans-90.2127.7-178.9-85.4-83.9000110.5
3R58Low61Low241 Ų241156.5 Ų156.591%0.90985%0.85SS**PPolyproline II helixtrans-77.8146.1-175.9168.2-179.7-96.1-141.7-6.1110.1
4G56.7Low60.4Low70 Ų70150.1 Ų150.172%0.72284%0.839SS**PPolyproline II helixtrans-65.5165.1-173.400000116.5
5M66.5Low60Low196 Ų196148.7 Ų148.797%0.96684%0.843SS**  trans-128.5119.2158.2-89.8162.8163.400106.9
6A63.2Low60Low78 Ų78145.8 Ų145.865%0.64583%0.829SS**  trans-81.8174.5174.200000110.3
7D60.8Low60.4Low159 Ų159150.1 Ų150.185%0.8584%0.836SS**  trans81.4100.6153.8-51.1-25.5000117.6
8A63.6Low60.2Low101 Ų101151.3 Ų151.384%0.83583%0.832SS**  174.999.9107.200000109.2
9L67.6Low60.5Low174 Ų174148.7 Ų148.791%0.91183%0.833SS**  trans-84.1111.9157.4-75.9173.6000106.7
10D64.9Low60.8Low142 Ų142152.1 Ų152.176%0.75984%0.838SS**  trans-90.9121.1166.2-157.212.4000109.2
11V63.6Low61.1Low121 Ų121154.2 Ų154.273%0.73384%0.839SS**  trans-90.8108.7178.3167.60000106.6
12I60.6Low61.7Low152 Ų152146.3 Ų146.378%0.77982%0.819SS**  trans-110.193.8162.6-60.1-180000108.1
13S57.4Low61.8Low112 Ų112146.7 Ų146.778%0.78382%0.818SS**  trans-69.7128162.3160.80000109.7
14G52.7Low61.7Low67 Ų67146.8 Ų146.869%0.69182%0.819SS**  trans-177.972.3172.700000112.4T16G14-T16 PolarHBondContact O-N 3.43Å
15S54.4Low61.3Low129 Ų129147.7 Ų147.790%0.90282%0.819SS**  trans-78.5109166.6-90.90000110.3
16T60.9Low61Low101 Ų101147.3 Ų147.362%0.6282%0.815SS**  trans-135.3115.6159.955.50000109.7G14 F18G14-T16 PolarHBondContact O-N 3.43Å; T16-F18 WeakPolarHBondContact OG1-CE1 3.44Å; T16-F18 WeakPolarHBondContact OG1-CZ 3.07Å
17K65.3Low60.2Low219 Ų219154.6 Ų154.695%0.95283%0.826SS**  trans-85.6116.9175.931.6-177.9171.4-177.60108.3
18F56.7Low59.7Low173 Ų173156.1 Ų156.176%0.75983%0.83SS**  trans-121.6128.5167.96.8-94.6000110T16T16-F18 WeakPolarHBondContact OG1-CE1 3.44Å; T16-F18 WeakPolarHBondContact OG1-CZ 3.07Å
19A66Low58.9Low102 Ų102156.9 Ų156.984%0.84382%0.824SS**  trans-65.4137.8176.700000111K21A19-K21 PolarHBondContact O-N 3.2Å
20K67.4Low58.3Low216 Ų216158.8 Ų158.894%0.93983%0.825SS**  trans-73.2105.4-178.6-160.3157-177.3163.90109.7
21K66.6Low57.4Low197 Ų197159.9 Ų159.986%0.85783%0.826SS**  trans-97.4127.9166.3-164.882.2176.5-177.40108.3A19A19-K21 PolarHBondContact O-N 3.2Å
22G62.2Low57Low74 Ų74163.1 Ų163.176%0.76383%0.83SS**  trans-60.3147-175.500000113.8
23R62.3Low56.7Low256 Ų256161.6 Ų161.697%0.96682%0.823SS**  trans-99.4104177.1-64.2178.2179.4170.5-1.9109
24R56.1Low56.8Low244 Ų244163.7 Ų163.792%0.92183%0.826SS**  trans-147.1126.8162-163.7173-172.1174.82.1108.8
25A48.4Very low56.5Low88 Ų88166 Ų16673%0.72783%0.828SS**  trans75.9131.4179.400000113.4
26E60Low56.2Low188 Ų188167.9 Ų167.988%0.87983%0.827SS**  cis-153.4165.628.5-71-167.9159.500112
27R45.8Very low55.4Low232 Ų232171.5 Ų171.588%0.87584%0.841SS**  trans-103.8124.8-178.2-168.4-175.7-159.6141.31.6108.9
28M51.7Low54.4Low190 Ų190167.4 Ų167.494%0.93683%0.83SS**  trans-141.8133.6157.2-70.3-170.477.200110.1
29V47.3Very low53.6Low117 Ų117167.7 Ų167.771%0.70983%0.834SS**  trans-90.7149.1-168.1170.70000111.5
30K54.2Low52.5Low214 Ų214170.9 Ų170.993%0.9383%0.829SS**  trans-159.3145.9143.7-105.4172.1-171.7-175.90111.2
31E46.4Very low51.2Low165 Ų165165.8 Ų165.877%0.77182%0.82SS**  trans-115153.7-149.1170.7-178.5-164.100113.4
32K55.3Low50.4Low190 Ų190164.9 Ų164.983%0.82682%0.824SS**  trans-169.6108.8150.2-120.8170.4176.3168.50112.9
33D53.5Low49.6Very low119 Ų119172.3 Ų172.364%0.63683%0.829SS**  trans30.5126.8141.8-43.2-31.7000118.8
34D59.2Low48.5Very low156 Ų156169.1 Ų169.183%0.83482%0.822SS**  -174172.958.5-100.5-31.2000111.4
35P46.9Very low48Very low115 Ų115161.7 Ų161.775%0.74781%0.813SS**  -104.8145.3-129.138.5-35.7000117.1
36I47.1Very low47.9Very low170 Ų170163.8 Ų163.887%0.87281%0.812SS**  trans-136.5125.4157.5-59.3-179.5000109.1N38I36-N38 PolarHBondContact O-N 3.38Å
37L45.7Very low47Very low177 Ų177161.6 Ų161.693%0.92781%0.806SS**  trans-56.6118-176.6-61.4161.5000112.4
38N43.1Very low47Very low133 Ų133158.6 Ų158.671%0.71180%0.804SS**  trans-151129.1141.2-162.121.4000110.4I36 F40I36-N38 PolarHBondContact O-N 3.38Å; N38-F40 PolarHBondContact O-N 2.63Å
39E41Very low46.3Very low179 Ų179158.7 Ų158.784%0.83680%0.799SS**  trans-96.491.5-155.5179.6-175.6163.600110.9
40F42.2Very low46Very low168 Ų168159.1 Ų159.174%0.73780%0.802SS**  trans-157.265153.333.2-96.2000109.1N38 L42N38-F40 PolarHBondContact O-N 2.63Å; F40-L42 PolarHBondContact O-N 2.86Å
41S39.5Very low45.6Very low109 Ų109153.9 Ų153.976%0.76279%0.788SS**  trans-81.698167-77.40000109.3R43S41-R43 VanDerWaalsContact C-N 3.35Å; S41-R43 PolarHBondContact O-N 2.8Å
42L50.4Low45.6Very low178 Ų178153.9 Ų153.993%0.93279%0.794SS**  trans-65.2101.9158.5-75.4175.2000107.6F40 K44F40-L42 PolarHBondContact O-N 2.86Å; L42-K44 PolarHBondContact O-N 3.11Å
43R44.6Very low45.4Very low231 Ų231153.4 Ų153.487%0.87279%0.792SS**  trans-61.3122.6176.2-67.6-179.7177.9-170.1-0.8108.8S41 A45S41-R43 VanDerWaalsContact C-N 3.35Å; S41-R43 PolarHBondContact O-N 2.8Å; R43-A45 PolarHBondContact O-N 3.32Å
44K41Very low45.6Very low189 Ų189153.5 Ų153.582%0.82280%0.799SS**  trans-6095.5163.9-168.8172.2-175.8179.70108.3L42L42-K44 PolarHBondContact O-N 3.11Å
45A44.1Very low45.7Very low88 Ų88155 Ų15573%0.72780%0.801SS**  trans-93.1105.7163.500000107.1R43R43-A45 PolarHBondContact O-N 3.32Å
46N46.2Very low46.2Very low132 Ų132155.4 Ų155.471%0.70681%0.805SS**  trans-68.9154151.5-59.1-36.3000107.2
47D42Very low47.2Very low142 Ų142157.2 Ų157.276%0.75981%0.807SS**SBendtrans84.7122.2-179.8-74.1-37.2000118.1
48M46.7Very low48.2Very low169 Ų169156.8 Ų156.883%0.83380%0.803SS**  trans67.3102.2147.877.1-157.4156.400120.6
49K36.5Very low49Very low192 Ų192153.9 Ų153.984%0.83581%0.805SS**  65.5141.1129.3-163.1169.3177.7176.90118.1
50T39.8Very low49.7Very low125 Ų125148.4 Ų148.477%0.76780%0.796SS**  trans83132.4176.781.90000112.2
51T47.2Very low50.4Low104 Ų104152.7 Ų152.764%0.63881%0.808SS**  cis-158.6148.622.636.90000108.8F53T51-F53 PolarHBondContact O-N 3.31Å
52D46.6Very low50.9Low166 Ų166154 Ų15489%0.88881%0.806SS**  trans-56.2122.9176.4-58.6-50.2000112.7
53F49.5Very low50.9Low179 Ų179154.7 Ų154.779%0.78581%0.805SS**  trans-111129.4159.2-70.2-80.1000107.7T51 E55T51-F53 PolarHBondContact O-N 3.31Å; F53-E55 PolarHBondContact O-N 3.36Å
54P58.5Low51.1Low121 Ų121147.3 Ų147.379%0.78680%0.801SS**  trans-69.4134-17628.4-32.5000110.6C56P54-C56 PolarHBondContact O-N 2.99Å
55E62.1Low51.8Low189 Ų189147 Ų14788%0.88380%0.8SS**  trans-61.9119.2177.9-65.4178160.900110.7F53 K57F53-E55 PolarHBondContact O-N 3.36Å; E55-K57 PolarHBondContact O-N 2.94Å; E55-K57 VanDerWaalsContact O-N 3.09Å
56C56.3Low52.2Low123 Ų123150.1 Ų150.183%0.83180%0.803SS**  trans-60112.6168.4-64.20000109.5P54 I58P54-C56 PolarHBondContact O-N 2.99Å; C56-I58 PolarHBondContact O-N 3.1Å; C56-I58 VanDerWaalsContact O-N 3.16Å
57K68.5Low52.4Low208 Ų208148.7 Ų148.790%0.90480%0.803SS**  trans-61.8116.1172.8-82.716881.6170.50109.7E55 G59E55-K57 PolarHBondContact O-N 2.94Å; E55-K57 VanDerWaalsContact O-N 3.09Å; K57-G59 PolarHBondContact O-N 2.75Å; K57-G59 VanDerWaalsContact O-N 3.13Å
58I66.3Low52.6Low167 Ų167150.3 Ų150.386%0.85681%0.805SS**  trans-60.3108.5166.2-71.9156.7000107.9C56C56-I58 PolarHBondContact O-N 3.1Å; C56-I58 VanDerWaalsContact O-N 3.16Å
59G60.5Low52.8Low73 Ų73147.4 Ų147.475%0.75380%0.802SS**  trans-81.9109169.900000110.1K57K57-G59 PolarHBondContact O-N 2.75Å; K57-G59 VanDerWaalsContact O-N 3.13Å
60G56.4Low53.6Low63 Ų63144.2 Ų144.265%0.64980%0.798SS**  trans-108.2110.5173.200000110.7N62G60-N62 PolarHBondContact O-N 3.1Å
61W56.8Low54.2Low258 Ų258143.7 Ų143.798%0.97780%0.8SS**SBendtrans-84.717.8171.7-78.490.8000113.1
62N49.3Very low54.2Low136 Ų136148 Ų14873%0.72781%0.81SS**  trans-170.2103.8170.852.63.6000109.5G60G60-N62 PolarHBondContact O-N 3.1Å
63E51.2Low54.2Low193 Ų193143.6 Ų143.690%0.90280%0.803SS**  trans-160.286.4138.6-107.5176.1-142.700106.4K65E63-K65 PolarHBondContact O-N 3.02Å
64G48.5Very low53.7Low77 Ų77147.3 Ų147.379%0.79481%0.812SS**  trans-61.7107.3171.500000109.7
65K55Low53.1Low182 Ų182145.8 Ų145.879%0.79181%0.81SS**  trans-134.184.7141.7-63-174-173.6176.10106.9E63 S67E63-K65 PolarHBondContact O-N 3.02Å; K65-S67 VanDerWaalsContact C-N 3.27Å; K65-S67 PolarHBondContact O-N 2.93Å
66I52.1Low52.4Low154 Ų154146.2 Ų146.279%0.7981%0.812SS**  trans-51.598.2156.822.5165.6000107.2
67S50.8Low51.9Low102 Ų102149.1 Ų149.171%0.71381%0.813SS**  trans-109.8116.9168.7-71.80000107.1K65 S69K65-S67 VanDerWaalsContact C-N 3.27Å; K65-S67 PolarHBondContact O-N 2.93Å; S67-S69 PolarHBondContact O-N 2.67Å
68H46.7Very low51.1Low175 Ų175146.9 Ų146.981%0.8181%0.811SS**  trans-68.3109.3-171.4-49.8-91.1000110.9
69S50.9Low50.4Low108 Ų108144.4 Ų144.476%0.75581%0.809SS**  trans-170.679.4152.760.10000110.5S67S67-S69 PolarHBondContact O-N 2.67Å
70V52.4Low50.2Low126 Ų126147.5 Ų147.576%0.76481%0.807SS**  trans-93.695.5159.1-72.60000107.8F72V70-F72 HydrophobicContact CB-CE2 4.45Å; V70-F72 HydrophobicContact CG2-CE2 3.94Å; V70-F72 PolarHBondContact O-N 2.62Å
71S52.3Low50.2Low114 Ų114150.2 Ų150.280%0.79781%0.807SS**  trans-77107.8163.452.60000108G73S71-G73 PolarHBondContact O-N 2.73Å; S71-G73 VanDerWaalsContact O-N 3.15Å
72F47.5Very low50.2Low195 Ų195143.6 Ų143.686%0.85580%0.795SS**  trans-68.1104.9171.2-74.3-89000109.5V70V70-F72 HydrophobicContact CB-CE2 4.45Å; V70-F72 HydrophobicContact CG2-CE2 3.94Å; V70-F72 PolarHBondContact O-N 2.62Å
73G46.1Very low50.6Low72 Ų72141.4 Ų141.474%0.74279%0.789SS**  trans-82.9133.116800000110.3S71 A75S71-G73 PolarHBondContact O-N 2.73Å; S71-G73 VanDerWaalsContact O-N 3.15Å; G73-A75 PolarHBondContact O-N 3.39Å
74R39.1Very low50.7Low257 Ų257138 Ų13897%0.9777%0.771SS**  trans-60.2125.3178.9-64.8176.1-174.7-135.30.3111.1
75A45.6Very low51Low90 Ų90138 Ų13874%0.74476%0.763SS**  trans-150.6112.5158.800000108.6G73G73-A75 PolarHBondContact O-N 3.39Å
76E47.6Very low51Low197 Ų197137 Ų13792%0.92177%0.766SS**  trans48.5145.6153.5-75.6166.9154.500122.5
77E47.4Very low50.9Low184 Ų184138.6 Ų138.686%0.8676%0.762SS**SBendtrans-66163.4-166.7-76.8160.9133.300114.7
78D50.4Low50.8Low161 Ų161142.2 Ų142.286%0.86177%0.765SS**SBendtrans84.566.7167.8-64-12.5000119.9
79S52.2Low51.1Low115 Ų115143.2 Ų143.280%0.80477%0.77SS**  trans-165.714.4146.7-137.70000117.2D81S79-D81 PolarHBondContact O-N 3.16Å; S79-D81 VanDerWaalsContact O-N 3.13Å
80L56.1Low51.3Low138 Ų138144.3 Ų144.372%0.72376%0.763SS**THydrogen-bonded Turntrans-90.760.9-170.6-61.7178.7000114.1K84L80-K84 WeakPolarHBondContact O-CD 3.46Å; L80-K84 WeakPolarHBondContact O-CE 3.38Å; L80-K84 PolarHBondContact O-NZ 3.09Å
81D55.9Low51.3Low120 Ų120141 Ų14164%0.64275%0.745SS**THydrogen-bonded Turntrans-122.4-12175.3-78.9-21.6000116S79 K84S79-D81 PolarHBondContact O-N 3.16Å; S79-D81 VanDerWaalsContact O-N 3.13Å; D81-K84 IonicContact OD1-NZ 3.19Å; D81-K84 PolarHBondContact OD1-NZ 2.99Å
82V57.4Low51.8Low119 Ų119143.2 Ų143.272%0.72175%0.749SS**Hα-helixtrans-80.7-36.1175.8-179.50000112.2K84 A85V82-K84 VanDerWaalsContact C-N 3.26Å; V82-K84 PolarHBondContact O-N 2.81Å; V82-A85 PolarHBondContact O-N 2.9Å
83C58.1Low52.6Low90 Ų90141.4 Ų141.461%0.60874%0.743SS**Hα-helixtrans-75.7-12.1-179.9-61.70000113.9
84K52.9Low53.5Low122 Ų122144.6 Ų144.653%0.5374%0.738SS.*Hα-helixtrans-86.6-26.5174.9-64.4178.1-168.4148.50112L80 D81 V82 L86 R87L80-K84 WeakPolarHBondContact O-CD 3.46Å; L80-K84 WeakPolarHBondContact O-CE 3.38Å; L80-K84 PolarHBondContact O-NZ 3.09Å; D81-K84 IonicContact OD1-NZ 3.19Å; D81-K84 PolarHBondContact OD1-NZ 2.99Å; V82-K84 VanDerWaalsContact C-N 3.26Å; V82-K84 PolarHBondContact O-N 2.81Å; K84-L86 VanDerWaalsContact C-N 3.28Å; K84-L86 PolarHBondContact O-N 3.29Å; K84-R87 PolarHBondContact O-N 2.91Å; K84-R87 VanDerWaalsContact O-N 3.09Å
85A53.9Low55Low76 Ų76138.6 Ų138.663%0.62873%0.725SS**Hα-helixtrans-70.2-20.2-179.500000114.1V82V82-A85 PolarHBondContact O-N 2.9Å
86L55Low56.6Low162 Ų162142.5 Ų142.585%0.84873%0.728SS**THydrogen-bonded Turntrans-89.1-5.2172.1-65.3177.7000113.5K84 K88K84-L86 VanDerWaalsContact C-N 3.28Å; K84-L86 PolarHBondContact O-N 3.29Å; L86-K88 PolarHBondContact O-N 3.27Å
87R50Low58.2Low188 Ų188140.3 Ų140.371%0.70972%0.721SS**  trans-96.541.2171.6-66.2-168.4176.1104.8-3.8110.7K84 E89K84-R87 PolarHBondContact O-N 2.91Å; K84-R87 VanDerWaalsContact O-N 3.09Å; R87-E89 PolarHBondContact O-N 3.46Å; R87-E89 VanDerWaalsContact O-N 3.12Å
88K50.4Low59.9Low177 Ų177136.8 Ų136.877%0.7771%0.714SS**  trans-68113.9167.6-169.8156.1-177.7176.70106.2L86 E90L86-K88 PolarHBondContact O-N 3.27Å; K88-E90 PolarHBondContact O-N 3.06Å
89E52.3Low61.5Low197 Ų197137.1 Ų137.192%0.92171%0.714SS**  trans-54.778.5170.5-64.4170.2163.200108.9R87R87-E89 PolarHBondContact O-N 3.46Å; R87-E89 VanDerWaalsContact O-N 3.12Å
90E54Low62.9Low130 Ų130137.2 Ų137.261%0.60771%0.709SS**  trans-106.6102.1165.2-172.7160.8-145.400104.7K88K88-E90 PolarHBondContact O-N 3.06Å
91S52.6Low64.1Low56 Ų56135.8 Ų135.839%0.39271%0.708SS.*  trans13.5115.3167.6-118.40000116.5E93 E94S91-E93 VanDerWaalsContact CB-CG 3.47Å; S91-E93 PolarHBondContact O-N 3.08Å; S91-E93 WeakPolarHBondContact OG-CG 3.12Å; S91-E93 PolarHBondContact OG-OE1 3.49Å; S91-E94 PolarHBondContact O-N 2.85Å
92D63.4Low65.4Low162 Ų162136.3 Ų136.387%0.86671%0.711SS**THydrogen-bonded Turntrans-53.2-4.7172.2-82.7-28.4000114.6
93E64.5Low66.4Low156 Ų156137.7 Ų137.773%0.72971%0.714SS**THydrogen-bonded Turntrans-89.3-11.5175.848.8-173.5163.100114.5S91S91-E93 VanDerWaalsContact CB-CG 3.47Å; S91-E93 PolarHBondContact O-N 3.08Å; S91-E93 WeakPolarHBondContact OG-CG 3.12Å; S91-E93 PolarHBondContact OG-OE1 3.49Å
94E64.5Low66.9Low139 Ų139138.6 Ų138.665%0.6572%0.721SS**SBendtrans-101.6-5.4177.2-70-175.9172.400114.1S91S91-E94 PolarHBondContact O-N 2.85Å
95L70.4Confident67.5Low132 Ų132137.8 Ų137.869%0.69173%0.731SS**  trans-103.417.5-179-62.3177.2000113.7I97L95-I97 PolarHBondContact O-N 2.92Å
96E80.4Confident67.9Low171 Ų171138.8 Ų138.880%0.79973%0.729SS**  trans-74.591.4175.9-166.9155.9-158.800110.4P98E96-P98 WeakPolarHBondContact O-CD 3.37Å
97I80.9Confident68Low151 Ų151139 Ų13977%0.77473%0.726SS**PPolyproline II helixtrans-59.6121.5173-57.4173000107.9L95 I99L95-I97 PolarHBondContact O-N 2.92Å; I97-I99 PolarHBondContact O-N 3.49Å
98P82.3Confident68.5Low110 Ų110139.1 Ų139.171%0.71473%0.734SS**PPolyproline II helixtrans-63137.3179.825.7-33.7000110.8E96 V100E96-P98 WeakPolarHBondContact O-CD 3.37Å; P98-V100 PolarHBondContact O-N 3.42Å
99I84.6Confident68.7Low168 Ų168138.4 Ų138.486%0.86273%0.734SS**PPolyproline II helixtrans-65.2119.9179-61.6167.3000109I97I97-I99 PolarHBondContact O-N 3.49Å
100V81.7Confident68.9Low117 Ų117134.2 Ų134.271%0.70973%0.726SS**PPolyproline II helixtrans-62.6126.4172.3178.10000108.5P98 D102P98-V100 PolarHBondContact O-N 3.42Å; V100-D102 PolarHBondContact O-N 3.3Å
101P82.1Confident69.1Low108 Ų108134.1 Ų134.170%0.70173%0.734SS**PPolyproline II helixtrans-65.5135.9176.425.6-32.1000110.6
102D82.6Confident69.4Low131 Ų131135 Ų13570%0.70175%0.745SS**PPolyproline II helixtrans-66.4136.2178.5-70.1-31.9000111.3V100 S104V100-D102 PolarHBondContact O-N 3.3Å; D102-S104 PolarHBondContact O-N 3.39Å; D102-S104 VanDerWaalsContact O-N 3.08Å
103L77.9Confident69.3Low148 Ų148136.8 Ų136.878%0.77575%0.745SS**G310 helixtrans-72.86.2179.1-63.2176.9000114S105 V106L103-S105 VanDerWaalsContact C-N 3.3Å; L103-S105 PolarHBondContact O-N 3.43Å; L103-V106 PolarHBondContact O-N 3.26Å
104S69.8Low69.3Low110 Ų110138.1 Ų138.177%0.76975%0.751SS**G310 helixtrans-71.9-20.3-177.261.40000113.9D102D102-S104 PolarHBondContact O-N 3.39Å; D102-S104 VanDerWaalsContact O-N 3.08Å
105S63.5Low69.3Low104 Ų104133.6 Ų133.673%0.72774%0.742SS**G310 helixtrans-96.9-7.2177.2660000114L103 E107L103-S105 VanDerWaalsContact C-N 3.3Å; L103-S105 PolarHBondContact O-N 3.43Å; S105-E107 PolarHBondContact O-N 3.17Å
106V63.2Low69.5Low98 Ų98132.1 Ų132.159%0.59475%0.749SS**SBendtrans-79.3105165.9178.20000104.6L103 E108L103-V106 PolarHBondContact O-N 3.26Å; V106-E108 PolarHBondContact O-N 3.03Å; V106-E108 VanDerWaalsContact O-N 3.17Å
107E57.6Low69.4Low166 Ų166130.7 Ų130.778%0.77675%0.751SS**  trans-39.8128.5168.9-72.7173.8141.400107.6S105 Q109S105-E107 PolarHBondContact O-N 3.17Å; E107-Q109 PolarHBondContact O-N 2.59Å
108E59.2Low69.3Low191 Ų191127.4 Ų127.489%0.89375%0.747SS**  trans-52.885159.9-74.8178.4161.700105.6V106 S110V106-E108 PolarHBondContact O-N 3.03Å; V106-E108 VanDerWaalsContact O-N 3.17Å; E108-S110 PolarHBondContact O-N 3.07Å
109Q56.2Low68.9Low162 Ų162127.6 Ų127.676%0.75775%0.748SS**  trans-6093.2156.4-89.9-176.750.800101.3E107 V111E107-Q109 PolarHBondContact O-N 2.59Å; Q109-V111 PolarHBondContact O-N 3.24Å
110S55.4Low68.5Low108 Ų108125.4 Ų125.476%0.75575%0.748SS**  trans-52.178.8165.4172.10000104.8E108 A112E108-S110 PolarHBondContact O-N 3.07Å; S110-A112 PolarHBondContact O-N 3.29Å
111V58.9Low67.9Low128 Ų128124.6 Ų124.678%0.77674%0.743SS**  trans-57.491.4159.3-88.30000101.6Q109 F113Q109-V111 PolarHBondContact O-N 3.24Å; V111-F113 PolarHBondContact O-N 3.37Å
112A57.7Low67.4Low75 Ų75126.1 Ų126.162%0.6275%0.75SS**  trans-43.4112.2178.100000104.5S110 Q114S110-A112 PolarHBondContact O-N 3.29Å; A112-Q114 PolarHBondContact O-N 3.41Å
113F62.6Low66.5Low199 Ų199126.9 Ų126.987%0.87375%0.752SS**  trans-6876.9-177.7-178.2-94.5000105.5V111 G115V111-F113 PolarHBondContact O-N 3.37Å; F113-G115 PolarHBondContact O-N 3.41Å
114Q63.6Low66.1Low184 Ų184126.4 Ų126.486%0.8675%0.751SS**  trans-78.773.5174.9-141.9170.51200103.5A112 A116A112-Q114 PolarHBondContact O-N 3.41Å; Q114-A116 PolarHBondContact O-N 3.08Å; Q114-A116 VanDerWaalsContact O-N 3.11Å
115G64.9Low66.3Low44 Ų44129.9 Ų129.945%0.45475%0.752SS.*PPolyproline II helixtrans-52.1121.1-176.200000108.8F113 V117F113-G115 PolarHBondContact O-N 3.41Å; G115-V117 PolarHBondContact O-N 3.4Å
116A74.9Confident66.9Low101 Ų101132.6 Ų132.684%0.83576%0.757SS**PPolyproline II helixtrans-59.5128.617600000109.2Q114 A118Q114-A116 PolarHBondContact O-N 3.08Å; Q114-A116 VanDerWaalsContact O-N 3.11Å; A116-A118 PolarHBondContact O-N 2.96Å
117V78.8Confident67.6Low141 Ų141130.8 Ų130.886%0.85575%0.747SS**PPolyproline II helixtrans-67.6120.9172.8174.70000108.1G115G115-V117 PolarHBondContact O-N 3.4Å
118A78.1Confident68.9Low82 Ų82125.1 Ų125.168%0.67873%0.728SS**PPolyproline II helixtrans-66.9134.8176.100000110.5A116 S120A116-A118 PolarHBondContact O-N 2.96Å; A118-S120 PolarHBondContact O-N 3.46Å
119P74.8Confident70Confident114 Ų114125.4 Ų125.474%0.7472%0.723SS**PPolyproline II helixtrans-63.5128.9174.225.2-32000110.1V121P119-V121 PolarHBondContact O-N 3.26Å
120S74.7Confident71.4Confident122 Ų122120.7 Ų120.785%0.85371%0.707SS**  trans-76.287.9173.665.30000109.5A118 V122A118-S120 PolarHBondContact O-N 3.46Å; S120-V122 PolarHBondContact O-N 3.29Å
121V70.1Confident72.6Confident101 Ų101120.2 Ų120.261%0.61269%0.693SS**  trans-71.9120.9168.7175.80000107.6P119 I123P119-V121 PolarHBondContact O-N 3.26Å; V121-I123 PolarHBondContact O-N 3.32Å
122V70.6Confident73.8Confident140 Ų140118.5 Ų118.585%0.84868%0.679SS**  trans-55.3107.1165.5-107.30000106.5S120 N124S120-V122 PolarHBondContact O-N 3.29Å; V122-N124 PolarHBondContact O-N 3.29Å; V122-N124 VanDerWaalsContact O-N 3.1Å
123I64.7Low74.8Confident147 Ų147117.7 Ų117.775%0.75467%0.669SS**  trans-22.3110.1-177.7-61.1157.7000110.4V121 K125V121-I123 PolarHBondContact O-N 3.32Å; I123-K125 PolarHBondContact O-N 3.01Å
124N67.9Low75.7Confident138 Ų138113.8 Ų113.874%0.73865%0.653SS**  trans-5297.4163.7-85.13.2000106.2V122 I126V122-N124 PolarHBondContact O-N 3.29Å; V122-N124 VanDerWaalsContact O-N 3.1Å; N124-I126 PolarHBondContact O-N 3.47Å; N124-I126 VanDerWaalsContact O-N 3.1Å
125K75.6Confident76Confident183 Ų183108.4 Ų108.480%0.79663%0.63SS**  trans-61.7118.6174.6-66.4-178.9179.7179.60105I123 P127I123-K125 PolarHBondContact O-N 3.01Å; K125-P127 WeakPolarHBondContact O-CD 3.46Å; K125-P127 VanDerWaalsContact O-N 3.12Å
126I75.1Confident76.2Confident161 Ų161111.6 Ų111.683%0.82664%0.636SS**  trans-63.4112172.1-59.3162.7000104.7N124 A128N124-I126 PolarHBondContact O-N 3.47Å; N124-I126 VanDerWaalsContact O-N 3.1Å; I126-A128 PolarHBondContact O-N 3.5Å
127P78.4Confident75.9Confident60 Ų60110 Ų11039%0.3962%0.618SS.*  trans-60.3136.7-176.1-22.534.7000109.6K125 E131 L132K125-P127 WeakPolarHBondContact O-CD 3.46Å; K125-P127 VanDerWaalsContact O-N 3.12Å; P127-E131 WeakPolarHBondContact CA-OE2 3.41Å; P127-E131 HydrophobicContact CB-CB 4.38Å; P127-L132 HydrophobicContact CB-CD1 4.49Å; P127-L132 HydrophobicContact CB-CD2 3.58Å; P127-L132 HydrophobicContact CB-CG 3.77Å; P127-L132 HydrophobicContact CG-CD2 3.99Å
128A83.9Confident75.4Confident46 Ų46108.8 Ų108.838%0.3861%0.606SS.*  trans-68.6155.2173.400000109.9I126 S130 E131 L132I126-A128 PolarHBondContact O-N 3.5Å; A128-S130 PolarHBondContact O-N 3.03Å; A128-S130 VanDerWaalsContact O-N 3.09Å; A128-E131 HydrophobicContact CB-CG 4.32Å; A128-E131 PolarHBondContact N-OE2 3.49Å; A128-E131 WeakPolarHBondContact O-CB 3.34Å; A128-E131 PolarHBondContact O-N 3.11Å; A128-L132 PolarHBondContact O-N 2.99Å
129Y83.1Confident74.7Confident198 Ų198112 Ų11278%0.77661%0.607SS**Hα-helixtrans-51.3-37.3176.6176.1-99.2000112.6E131 L132 S133Y129-E131 PolarHBondContact O-N 3.13Å; Y129-L132 PolarHBondContact O-N 3.12Å; Y129-S133 WeakPolarHBondContact O-CB 3.39Å; Y129-S133 PolarHBondContact O-N 3.03Å; Y129-S133 PolarHBondContact O-OG 3.24Å
130S84.8Confident74.1Confident62 Ų62107.8 Ų107.843%0.43459%0.585SS.*Hα-helixtrans-65.2-35.3176.554.20000113.7A128 S133 Q134A128-S130 PolarHBondContact O-N 3.03Å; A128-S130 VanDerWaalsContact O-N 3.09Å; S130-S133 PolarHBondContact O-OG 2.86Å; S130-Q134 WeakPolarHBondContact O-CG 2.96Å; S130-Q134 PolarHBondContact O-N 3.06Å; S130-Q134 PolarHBondContact O-NE2 3.39Å
131E81.8Confident73.4Confident99 Ų99107.1 Ų107.146%0.46358%0.575SS.*Hα-helixtrans-73.6-47.1177.2-63.2172.216400109.2P127 A128 Y129 S133 Q134 D135P127-E131 WeakPolarHBondContact CA-OE2 3.41Å; P127-E131 HydrophobicContact CB-CB 4.38Å; A128-E131 HydrophobicContact CB-CG 4.32Å; A128-E131 PolarHBondContact N-OE2 3.49Å; A128-E131 WeakPolarHBondContact O-CB 3.34Å; A128-E131 PolarHBondContact O-N 3.11Å; Y129-E131 PolarHBondContact O-N 3.13Å; E131-S133 VanDerWaalsContact C-N 3.29Å; E131-S133 PolarHBondContact O-N 3.12Å; E131-Q134 PolarHBondContact O-N 2.98Å; E131-Q134 VanDerWaalsContact O-N 3.08Å; E131-D135 PolarHBondContact O-N 3.05Å
132L83.2Confident73Confident91 Ų91106 Ų10648%0.47657%0.566SS.*Hα-helixtrans-57-40.2175.2-65.5174.8000112.8P127 A128 Y129 Q134 D135 L136P127-L132 HydrophobicContact CB-CD1 4.49Å; P127-L132 HydrophobicContact CB-CD2 3.58Å; P127-L132 HydrophobicContact CB-CG 3.77Å; P127-L132 HydrophobicContact CG-CD2 3.99Å; A128-L132 PolarHBondContact O-N 2.99Å; Y129-L132 PolarHBondContact O-N 3.12Å; L132-Q134 VanDerWaalsContact C-N 3.27Å; L132-Q134 PolarHBondContact O-N 3.16Å; L132-D135 PolarHBondContact O-N 3Å; L132-L136 PolarHBondContact O-N 2.95Å; L132-L136 VanDerWaalsContact O-N 3.16Å
133S80Confident72.6Confident58 Ų58103 Ų10341%0.40655%0.549SS..Hα-helixtrans-66.5-28.9179.869.40000113.4Y129 S130 E131 P137Y129-S133 WeakPolarHBondContact O-CB 3.39Å; Y129-S133 PolarHBondContact O-N 3.03Å; Y129-S133 PolarHBondContact O-OG 3.24Å; S130-S133 PolarHBondContact O-OG 2.86Å; E131-S133 VanDerWaalsContact C-N 3.29Å; E131-S133 PolarHBondContact O-N 3.12Å; S133-P137 VanDerWaalsContact O-CD 3.26Å; S133-P137 WeakPolarHBondContact O-CD 3.46Å
134Q80Confident72.4Confident117 Ų117100.2 Ų100.255%0.54754%0.535SS..Hα-helixtrans-81.3-32.6177.2-71.2170.662.300111S130 E131 L132 P137 N138S130-Q134 WeakPolarHBondContact O-CG 2.96Å; S130-Q134 PolarHBondContact O-N 3.06Å; S130-Q134 PolarHBondContact O-NE2 3.39Å; E131-Q134 PolarHBondContact O-N 2.98Å; E131-Q134 VanDerWaalsContact O-N 3.08Å; L132-Q134 VanDerWaalsContact C-N 3.27Å; L132-Q134 PolarHBondContact O-N 3.16Å; Q134-P137 WeakPolarHBondContact O-CD 3.33Å; Q134-P137 WeakPolarHBondContact O-CG 3.26Å; Q134-N138 VanDerWaalsContact O-CG 3.29Å; Q134-N138 PolarHBondContact O-ND2 3.44Å
135D71.7Confident72.2Confident71 Ų7196 Ų9638%0.3851%0.512SS..Hα-helixtrans-74.7-25.5-180-69.2-14.6000112.7E131 L132 N138 H139E131-D135 PolarHBondContact O-N 3.05Å; L132-D135 PolarHBondContact O-N 3Å; D135-N138 PolarHBondContact O-N 3.45Å; D135-H139 WeakPolarHBondContact O-CB 3.5Å; D135-H139 PolarHBondContact O-N 3.3Å; D135-H139 IonicContact OD1-CD2 3.76Å
136L69.1Low71.7Confident111 Ų11194.5 Ų94.558%0.58151%0.513SS*.Hα-helixtrans-59.2-52.4-179.5-165.773.9000113.7L132 N138 G140 L142L132-L136 PolarHBondContact O-N 2.95Å; L132-L136 VanDerWaalsContact O-N 3.16Å; L136-N138 VanDerWaalsContact C-N 3.33Å; L136-G140 WeakPolarHBondContact O-CA 3.29Å; L136-G140 PolarHBondContact O-N 3.15Å; L136-L142 HydrophobicContact CD2-CD1 4.34Å; L136-L142 HydrophobicContact CG-CD1 3.92Å
137P67.8Low71.3Confident68 Ų6889.8 Ų89.844%0.44251%0.505SS..Hα-helixtrans-71.3-27.3175.628.1-35.6000113.2S133 Q134 P143S133-P137 VanDerWaalsContact O-CD 3.26Å; S133-P137 WeakPolarHBondContact O-CD 3.46Å; Q134-P137 WeakPolarHBondContact O-CD 3.33Å; Q134-P137 WeakPolarHBondContact O-CG 3.26Å; P137-P143 WeakPolarHBondContact O-CG 3.33Å
138N67.1Low71.2Confident115 Ų11593.7 Ų93.762%0.61552%0.522SS*.Hα-helixtrans-88.7-30.8-171-67.8-22.1000113.9Q134 D135 L136Q134-N138 VanDerWaalsContact O-CG 3.29Å; Q134-N138 PolarHBondContact O-ND2 3.44Å; D135-N138 PolarHBondContact O-N 3.45Å; L136-N138 VanDerWaalsContact C-N 3.33Å
139H63.9Low70.8Confident150 Ų15095.2 Ų95.269%0.69452%0.523SS*.Hα-helixtrans-124.2-9.6-175.3-62.3-59000113.5D135D135-H139 WeakPolarHBondContact O-CB 3.5Å; D135-H139 PolarHBondContact O-N 3.3Å; D135-H139 IonicContact OD1-CD2 3.76Å
140G62.9Low70.7Confident26 Ų2690.6 Ų90.627%0.26851%0.512SS..SBendtrans-66.3157.3171.700000111.2L136 L142 P143L136-G140 WeakPolarHBondContact O-CA 3.29Å; L136-G140 PolarHBondContact O-N 3.15Å; G140-L142 PolarHBondContact O-N 3.17Å; G140-P143 WeakPolarHBondContact O-CD 3.45Å
141T60Low70.6Confident107 Ų10791.2 Ų91.266%0.65651%0.51SS*.SBendtrans-68.710164.850.60000112.3L144 L145T141-L144 WeakPolarHBondContact O-CB 3.19Å; T141-L144 PolarHBondContact O-N 3.47Å; T141-L145 WeakPolarHBondContact O-CG 3.13Å; T141-L145 PolarHBondContact O-N 3.4Å
142L60.8Low70.8Confident78 Ų7895.1 Ų95.141%0.40852%0.52SS..Hα-helixtrans-61.4-40.7178.4-58.4-177.3000113.2L136 G140 L144 L145 D146L136-L142 HydrophobicContact CD2-CD1 4.34Å; L136-L142 HydrophobicContact CG-CD1 3.92Å; G140-L142 PolarHBondContact O-N 3.17Å; L142-L144 VanDerWaalsContact C-N 3.25Å; L142-L144 PolarHBondContact O-N 3.29Å; L142-L145 HydrophobicContact CD2-CD1 3.91Å; L142-L145 WeakPolarHBondContact O-CA 3.13Å; L142-L145 VanDerWaalsContact O-CB 3.29Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 2.98Å; L142-D146 PolarHBondContact O-N 3.04Å
143P61.9Low70.9Confident77 Ų7795 Ų9550%0.552%0.523SS..Hα-helixtrans-65.4-27175.6-22.135.7000113.5P137 G140 L145 D146P137-P143 WeakPolarHBondContact O-CG 3.33Å; G140-P143 WeakPolarHBondContact O-CD 3.45Å; P143-L145 PolarHBondContact O-N 3.09Å; P143-D146 PolarHBondContact O-N 3.46Å
144L60.5Low71.2Confident88 Ų8897.7 Ų97.746%0.46153%0.532SS..Hα-helixtrans-67.7-26.1172.8-177.866.1000111.4T141 L142 D148 I149T141-L144 WeakPolarHBondContact O-CB 3.19Å; T141-L144 PolarHBondContact O-N 3.47Å; L142-L144 VanDerWaalsContact C-N 3.25Å; L142-L144 PolarHBondContact O-N 3.29Å; L144-D148 HydrophobicContact CD1-CB 4.43Å; L144-I149 HydrophobicContact CD2-CD1 3.98Å; L144-I149 HydrophobicContact CG-CD1 3.77Å; L144-I149 HydrophobicContact CG-CG1 4.45Å
145L64.1Low71.4Confident50 Ų5096.5 Ų96.526%0.26253%0.533SS..Hα-helixtrans-82.8-23.3179-62.6160.2000112.3T141 L142 P143 G147 I149 L151T141-L145 WeakPolarHBondContact O-CG 3.13Å; T141-L145 PolarHBondContact O-N 3.4Å; L142-L145 HydrophobicContact CD2-CD1 3.91Å; L142-L145 WeakPolarHBondContact O-CA 3.13Å; L142-L145 VanDerWaalsContact O-CB 3.29Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 2.98Å; P143-L145 PolarHBondContact O-N 3.09Å; L145-G147 VanDerWaalsContact C-N 3.29Å; L145-G147 PolarHBondContact O-N 3.01Å; L145-I149 HydrophobicContact CD2-CB 4.25Å; L145-I149 HydrophobicContact CD2-CD1 4.13Å; L145-I149 HydrophobicContact CD2-CG2 4.22Å; L145-L151 HydrophobicContact CB-CD1 4.4Å; L145-L151 HydrophobicContact CD2-CD1 4.15Å; L145-L151 HydrophobicContact CD2-CD2 3.82Å; L145-L151 HydrophobicContact CD2-CG 4.11Å
146D64.6Low72.2Confident151 Ų151101.2 Ų101.281%0.80755%0.55SS**THydrogen-bonded Turntrans-81.98.3-173.6-96.4-3.6000115.4L142 P143L142-D146 PolarHBondContact O-N 3.04Å; P143-D146 PolarHBondContact O-N 3.46Å
147G68.7Low73Confident63 Ų63101.9 Ų101.965%0.64956%0.555SS**THydrogen-bonded Turntrans-164.9-35.2177.500000116.2L145L145-G147 VanDerWaalsContact C-N 3.29Å; L145-G147 PolarHBondContact O-N 3.01Å
148D74.5Confident74.1Confident142 Ų142104.6 Ų104.676%0.75956%0.564SS**THydrogen-bonded Turntrans-96.9-25.3-171.9-67.1-21.9000113.4L144L144-D148 HydrophobicContact CD1-CB 4.43Å
149I77.2Confident75.1Confident77 Ų77106 Ų10640%0.39557%0.565SS.*  trans-113.2114.2-174.6-57.7175.8000110.4L144 L145 L151L144-I149 HydrophobicContact CD2-CD1 3.98Å; L144-I149 HydrophobicContact CG-CD1 3.77Å; L144-I149 HydrophobicContact CG-CG1 4.45Å; L145-I149 HydrophobicContact CD2-CB 4.25Å; L145-I149 HydrophobicContact CD2-CD1 4.13Å; L145-I149 HydrophobicContact CD2-CG2 4.22Å; I149-L151 HydrophobicContact CG2-CD2 4.4Å; I149-L151 PolarHBondContact O-N 3.28Å
150N80.1Confident76.2Confident102 Ų102101.1 Ų101.155%0.54555%0.548SS..  trans-77.691.3175.3-172.4-3.2000111.6R152 V153N150-R152 PolarHBondContact O-N 3.36Å; N150-R152 VanDerWaalsContact O-N 3.12Å; N150-R152 WeakPolarHBondContact OD1-CB 3.32Å; N150-R152 WeakPolarHBondContact OD1-CG 3.42Å; N150-R152 PolarHBondContact OD1-N 3.25Å; N150-R152 VanDerWaalsContact OD1-N 3.11Å; N150-V153 PolarHBondContact O-N 3.46Å
151L83.4Confident77.3Confident74 Ų74107.6 Ų107.639%0.38757%0.572SS.*THydrogen-bonded Turntrans-61.9-15.7176.4-72.7-179.4000114.6L145 I149 V153 L154 T155L145-L151 HydrophobicContact CB-CD1 4.4Å; L145-L151 HydrophobicContact CD2-CD1 4.15Å; L145-L151 HydrophobicContact CD2-CD2 3.82Å; L145-L151 HydrophobicContact CD2-CG 4.11Å; I149-L151 HydrophobicContact CG2-CD2 4.4Å; I149-L151 PolarHBondContact O-N 3.28Å; L151-V153 PolarHBondContact O-N 2.9Å; L151-L154 HydrophobicContact CD2-CD1 3.93Å; L151-L154 PolarHBondContact O-N 3.15Å; L151-T155 PolarHBondContact O-N 2.82Å; L151-T155 PolarHBondContact O-OG1 2.94Å; L151-T155 VanDerWaalsContact O-OG1 3.12Å
152R84.9Confident78.5Confident182 Ų182106.7 Ų106.769%0.68757%0.57SS**Hα-helixtrans-58.4-26.5-179.3-61.2176.1176-173.3-1112.5N150 K156N150-R152 PolarHBondContact O-N 3.36Å; N150-R152 VanDerWaalsContact O-N 3.12Å; N150-R152 WeakPolarHBondContact OD1-CB 3.32Å; N150-R152 WeakPolarHBondContact OD1-CG 3.42Å; N150-R152 PolarHBondContact OD1-N 3.25Å; N150-R152 VanDerWaalsContact OD1-N 3.11Å; R152-K156 WeakPolarHBondContact O-CB 3.5Å; R152-K156 WeakPolarHBondContact O-CD 3.21Å; R152-K156 WeakPolarHBondContact O-CG 3.44Å; R152-K156 PolarHBondContact O-N 3.42Å
153V86Confident79.7Confident89 Ų89109 Ų10954%0.53958%0.579SS.*Hα-helixtrans-67.3-43.1176.5-179.90000111.1N150 L151 N157N150-V153 PolarHBondContact O-N 3.46Å; L151-V153 PolarHBondContact O-N 2.9Å; V153-N157 PolarHBondContact O-ND2 3.12Å
154L85.2Confident80.7Confident114 Ų114110.9 Ų110.960%0.59758%0.583SS**Hα-helixtrans-66.2-50.7175.4-64.6177.5000109.6L151 K156 N157 L158L151-L154 HydrophobicContact CD2-CD1 3.93Å; L151-L154 PolarHBondContact O-N 3.15Å; L154-K156 PolarHBondContact O-N 2.97Å; L154-N157 CarbonylContact O-C 3.55Å; L154-N157 PolarHBondContact O-N 3.15Å; L154-L158 WeakPolarHBondContact O-CG 3.5Å; L154-L158 PolarHBondContact O-N 3.41Å; L154-L158 VanDerWaalsContact O-N 3.15Å
155T85.4Confident82Confident92 Ų92113.5 Ų113.556%0.56459%0.594SS**Hα-helixtrans-57.9-34-178.7-44.40000113.3L151 N157 L158L151-T155 PolarHBondContact O-N 2.82Å; L151-T155 PolarHBondContact O-OG1 2.94Å; L151-T155 VanDerWaalsContact O-OG1 3.12Å; T155-N157 VanDerWaalsContact C-N 3.28Å; T155-N157 PolarHBondContact O-N 3.29Å; T155-L158 PolarHBondContact O-N 2.88Å
156K87.3Confident83.1Confident170 Ų170119.9 Ų119.974%0.73962%0.622SS**Hα-helixtrans-68.8-24.7176.7-80.6173.6179.3-1700114.3R152 L154R152-K156 WeakPolarHBondContact O-CB 3.5Å; R152-K156 WeakPolarHBondContact O-CD 3.21Å; R152-K156 WeakPolarHBondContact O-CG 3.44Å; R152-K156 PolarHBondContact O-N 3.42Å; L154-K156 PolarHBondContact O-N 2.97Å
157N86.8Confident84Confident125 Ų125119.1 Ų119.167%0.66862%0.616SS**THydrogen-bonded Turntrans-105.86.7-178.6-62.7-42.9000111.9V153 L154 T155V153-N157 PolarHBondContact O-ND2 3.12Å; L154-N157 CarbonylContact O-C 3.55Å; L154-N157 PolarHBondContact O-N 3.15Å; T155-N157 VanDerWaalsContact C-N 3.28Å; T155-N157 PolarHBondContact O-N 3.29Å
158L89.9Confident84.8Confident124 Ų124124.2 Ų124.265%0.64963%0.629SS**PPolyproline II helixtrans-78135.3171.9-69.5179.2000109.3L154 T155L154-L158 WeakPolarHBondContact O-CG 3.5Å; L154-L158 PolarHBondContact O-N 3.41Å; L154-L158 VanDerWaalsContact O-N 3.15Å; T155-L158 PolarHBondContact O-N 2.88Å
159F88.3Confident85.3Confident144 Ų144124.2 Ų124.263%0.63262%0.624SS**PPolyproline II helixtrans-64.6147.1164.6-67.7-77.5000109.8E163 L164F159-E163 WeakPolarHBondContact CA-OE2 3.37Å; F159-E163 HydrophobicContact CB-CB 4.03Å; F159-E163 HydrophobicContact CD1-CB 4.26Å; F159-L164 HydrophobicContact CB-CD1 4.48Å; F159-L164 HydrophobicContact CB-CD2 3.94Å; F159-L164 HydrophobicContact CB-CG 3.94Å; F159-L164 HydrophobicContact CD2-CD2 4.45Å; F159-L164 HydrophobicContact CG-CD2 4.49Å
160S87.6Confident85.6Confident49 Ų49126.8 Ų126.834%0.34364%0.644SS.*PPolyproline II helixtrans-64154.5171.460.40000110.6S162 E163 L164S160-S162 PolarHBondContact O-N 3.37Å; S160-S162 VanDerWaalsContact O-N 3.15Å; S160-S162 PolarHBondContact OG-OG 2.98Å; S160-E163 PolarHBondContact N-OE2 3.44Å; S160-E163 WeakPolarHBondContact O-CB 3.06Å; S160-E163 PolarHBondContact O-N 2.78Å; S160-E163 WeakPolarHBondContact OG-CG 3.34Å; S160-E163 PolarHBondContact OG-N 3.45Å; S160-E163 PolarHBondContact OG-OE2 3.29Å; S160-L164 PolarHBondContact O-N 3.18Å
161E86.8Confident85.8Confident161 Ų161131.2 Ų131.275%0.75265%0.653SS**G310 helixtrans-55-36177.5-175.9177.3176.700111.8E163 L164 Q165E161-E163 VanDerWaalsContact C-N 3.32Å; E161-E163 PolarHBondContact O-N 3.36Å; E161-L164 PolarHBondContact O-N 3.39Å; E161-Q165 PolarHBondContact O-N 3.45Å
162S85.5Confident85.7Confident88 Ų88129.2 Ų129.262%0.61565%0.645SS**G310 helixtrans-64.8-29.2174.841.30000114.6S160S160-S162 PolarHBondContact O-N 3.37Å; S160-S162 VanDerWaalsContact O-N 3.15Å; S160-S162 PolarHBondContact OG-OG 2.98Å
163E85.3Confident85.9Confident128 Ų128128.2 Ų128.260%0.59864%0.641SS**G310 helixtrans-83.3-15.5177.8-73.6163161.600112.4F159 S160 E161F159-E163 WeakPolarHBondContact CA-OE2 3.37Å; F159-E163 HydrophobicContact CB-CB 4.03Å; F159-E163 HydrophobicContact CD1-CB 4.26Å; S160-E163 PolarHBondContact N-OE2 3.44Å; S160-E163 WeakPolarHBondContact O-CB 3.06Å; S160-E163 PolarHBondContact O-N 2.78Å; S160-E163 WeakPolarHBondContact OG-CG 3.34Å; S160-E163 PolarHBondContact OG-N 3.45Å; S160-E163 PolarHBondContact OG-OE2 3.29Å; E161-E163 VanDerWaalsContact C-N 3.32Å; E161-E163 PolarHBondContact O-N 3.36Å
164L83.7Confident85.8Confident115 Ų115130.4 Ų130.460%0.60265%0.65SS**SBendtrans-95.5-5.5177.3-66.1174.8000113.1F159 S160 E161 E166F159-L164 HydrophobicContact CB-CD1 4.48Å; F159-L164 HydrophobicContact CB-CD2 3.94Å; F159-L164 HydrophobicContact CB-CG 3.94Å; F159-L164 HydrophobicContact CD2-CD2 4.45Å; F159-L164 HydrophobicContact CG-CD2 4.49Å; S160-L164 PolarHBondContact O-N 3.18Å; E161-L164 PolarHBondContact O-N 3.39Å; L164-E166 PolarHBondContact O-N 3.37Å
165Q86.5Confident85.5Confident144 Ų144131.8 Ų131.867%0.67365%0.652SS**  trans-71.699.5175.3-77.1-177.11.600109.6E161E161-Q165 PolarHBondContact O-N 3.45Å
166E86.5Confident85.2Confident183 Ų183131.1 Ų131.186%0.85564%0.644SS**  trans-66.8146.9166.2-65.8178.1-175.600109.7L164 D168L164-E166 PolarHBondContact O-N 3.37Å; E166-D168 PolarHBondContact O-N 3.49Å
167I85.2Confident84.6Confident135 Ų135128.4 Ų128.469%0.69263%0.633SS**  trans-67.4127.7175.5-56.9168.5000107.2E169I167-E169 VanDerWaalsContact C-N 3.26Å; I167-E169 HydrophobicContact CB-CG 4.07Å; I167-E169 HydrophobicContact CG2-CG 3.54Å; I167-E169 PolarHBondContact O-N 3.29Å
168D85.3Confident84.2Confident170 Ų170125.1 Ų125.191%0.90962%0.62SS**  trans-73.583.4175.9-167.414.7000109.4E166E166-D168 PolarHBondContact O-N 3.49Å
169E83.6Confident83.5Confident143 Ų143125.5 Ų125.567%0.66862%0.618SS**  trans-101.3140.9177-61.6-169.5174.400110.7I167 W171I167-E169 VanDerWaalsContact C-N 3.26Å; I167-E169 HydrophobicContact CB-CG 4.07Å; I167-E169 HydrophobicContact CG2-CG 3.54Å; I167-E169 PolarHBondContact O-N 3.29Å; E169-W171 PolarHBondContact O-N 2.7Å; E169-W171 VanDerWaalsContact O-N 3.12Å
170T83.9Confident82.6Confident131 Ų131124.6 Ų124.680%0.80462%0.619SS**  trans-67.8112.8173.952.70000109.8S172T170-S172 PolarHBondContact O-N 3.06Å
171W84.1Confident81.8Confident195 Ų195130.2 Ų130.274%0.73964%0.637SS**  trans-59.1125.8175.268.2-79.6000110.8E169 W173E169-W171 PolarHBondContact O-N 2.7Å; E169-W171 VanDerWaalsContact O-N 3.12Å; W171-W173 AromaticContact CZ3-CE2 3.91Å; W171-W173 HydrophobicContact CZ3-CZ2 4.26Å; W171-W173 AromaticContact CZ3-NE1 3.63Å
172S83Confident81.2Confident32 Ų32127.9 Ų127.922%0.22463%0.634CS.*  trans-125141.9169.399.20000109.3T170 D174 F175 L176T170-S172 PolarHBondContact O-N 3.06Å; S172-D174 PolarHBondContact O-N 2.68Å; S172-D174 PolarHBondContact OG-N 2.74Å; S172-F175 PolarHBondContact O-N 3.12Å; S172-F175 WeakPolarHBondContact OG-CD2 2.96Å; S172-F175 PolarHBondContact OG-N 3.09Å; S172-L176 PolarHBondContact O-N 3.13Å
173W88.6Confident80.5Confident160 Ų160130.6 Ų130.661%0.60664%0.641SS**Hα-helixtrans-58.5-34.8176.6-75.5109.5000111.9W171 F175 L176 F177W171-W173 AromaticContact CZ3-CE2 3.91Å; W171-W173 HydrophobicContact CZ3-CZ2 4.26Å; W171-W173 AromaticContact CZ3-NE1 3.63Å; W173-F175 PolarHBondContact O-N 3.06Å; W173-L176 HydrophobicContact CE3-CD1 4.2Å; W173-L176 HydrophobicContact CZ3-CD1 4.47Å; W173-L176 PolarHBondContact O-N 3.26Å; W173-F177 HydrophobicContact CB-CE2 4.29Å; W173-F177 HydrophobicContact CD2-CE2 4.46Å; W173-F177 AromaticContact CE3-CE2 3.71Å; W173-F177 HydrophobicContact CE3-CE2 3.71Å; W173-F177 HydrophobicContact CE3-CZ 4Å; W173-F177 HydrophobicContact CZ3-CE2 4.46Å; W173-F177 HydrophobicContact CZ3-CZ 4.32Å; W173-F177 WeakPolarHBondContact O-CD2 3.46Å; W173-F177 PolarHBondContact O-N 3.22Å
174D83.2Confident78.7Confident135 Ų135137 Ų13772%0.72267%0.667SS**Hα-helixtrans-63.5-39.3-179.8-61.3-40.4000112.2S172 S178S172-D174 PolarHBondContact O-N 2.68Å; S172-D174 PolarHBondContact OG-N 2.74Å; D174-S178 WeakPolarHBondContact O-CB 3.27Å; D174-S178 PolarHBondContact O-N 3.31Å
175F78.9Confident78.5Confident143 Ų143138.1 Ų138.163%0.62767%0.67SS**Hα-helixtrans-69.9-44.1177.2-72.6-61.4000111.9S172 W173 F177 S178 E179S172-F175 PolarHBondContact O-N 3.12Å; S172-F175 WeakPolarHBondContact OG-CD2 2.96Å; S172-F175 PolarHBondContact OG-N 3.09Å; W173-F175 PolarHBondContact O-N 3.06Å; F175-F177 PolarHBondContact O-N 3.3Å; F175-S178 PolarHBondContact O-N 3.35Å; F175-S178 PolarHBondContact O-OG 3.37Å; F175-E179 PolarHBondContact O-N 3.33Å
176L79.4Confident78.1Confident79 Ų79137.8 Ų137.841%0.41467%0.67SS.*Hα-helixtrans-58.9-44.2179.7-69.7171.7000112.7S172 W173 S178 L180S172-L176 PolarHBondContact O-N 3.13Å; W173-L176 HydrophobicContact CE3-CD1 4.2Å; W173-L176 HydrophobicContact CZ3-CD1 4.47Å; W173-L176 PolarHBondContact O-N 3.26Å; L176-S178 VanDerWaalsContact C-N 3.31Å; L176-S178 PolarHBondContact O-N 3.5Å; L176-L180 WeakPolarHBondContact O-CG 3.47Å; L176-L180 PolarHBondContact O-N 3.36Å
177F74.6Confident77.6Confident113 Ų113135.3 Ų135.350%0.49666%0.66SS.*Hα-helixtrans-73.7-23.5177.8-68.7-62.6000113.2W173 F175 K181W173-F177 HydrophobicContact CB-CE2 4.29Å; W173-F177 HydrophobicContact CD2-CE2 4.46Å; W173-F177 AromaticContact CE3-CE2 3.71Å; W173-F177 HydrophobicContact CE3-CE2 3.71Å; W173-F177 HydrophobicContact CE3-CZ 4Å; W173-F177 HydrophobicContact CZ3-CE2 4.46Å; W173-F177 HydrophobicContact CZ3-CZ 4.32Å; W173-F177 WeakPolarHBondContact O-CD2 3.46Å; W173-F177 PolarHBondContact O-N 3.22Å; F175-F177 PolarHBondContact O-N 3.3Å; F177-K181 WeakPolarHBondContact O-CD 3.07Å; F177-K181 VanDerWaalsContact O-CG 3.27Å; F177-K181 WeakPolarHBondContact O-CG 3.46Å; F177-K181 PolarHBondContact O-N 3.35Å
178S77.6Confident77.1Confident56 Ų56135.3 Ų135.339%0.39266%0.658SS.*Hα-helixtrans-73.5-42176.475.60000111.9D174 F175 L176 K181 T182D174-S178 WeakPolarHBondContact O-CB 3.27Å; D174-S178 PolarHBondContact O-N 3.31Å; F175-S178 PolarHBondContact O-N 3.35Å; F175-S178 PolarHBondContact O-OG 3.37Å; L176-S178 VanDerWaalsContact C-N 3.31Å; L176-S178 PolarHBondContact O-N 3.5Å; S178-K181 WeakPolarHBondContact O-CB 3.43Å; S178-K181 PolarHBondContact O-N 3.14Å; S178-K181 VanDerWaalsContact O-N 3.11Å; S178-T182 PolarHBondContact O-N 3.25Å; S178-T182 PolarHBondContact O-OG1 3.19Å
179E75.9Confident76.6Confident132 Ų132133.1 Ų133.162%0.61764%0.642SS**Hα-helixtrans-68.2-37.7-179.5-164.7169-164.800111.9F175 K181 T182 L183F175-E179 PolarHBondContact O-N 3.33Å; E179-K181 PolarHBondContact O-N 3.47Å; E179-T182 WeakPolarHBondContact CA-OG1 3.49Å; E179-T182 PolarHBondContact O-N 3.35Å; E179-T182 PolarHBondContact O-OG1 3.11Å; E179-L183 PolarHBondContact O-N 2.84Å
180L68.7Low76.2Confident125 Ų125132.5 Ų132.565%0.65464%0.64SS**Hα-helixtrans-65.3-23.5172.7-69.2177.6000113.6L176L176-L180 WeakPolarHBondContact O-CG 3.47Å; L176-L180 PolarHBondContact O-N 3.36Å
181K72.6Confident75.6Confident167 Ų167132.6 Ų132.673%0.72663%0.629SS**Hα-helixtrans-81.7-27.7177.4-74.7171.1-174.8175.70112.8F177 S178 E179F177-K181 WeakPolarHBondContact O-CD 3.07Å; F177-K181 VanDerWaalsContact O-CG 3.27Å; F177-K181 WeakPolarHBondContact O-CG 3.46Å; F177-K181 PolarHBondContact O-N 3.35Å; S178-K181 WeakPolarHBondContact O-CB 3.43Å; S178-K181 PolarHBondContact O-N 3.14Å; S178-K181 VanDerWaalsContact O-N 3.11Å; E179-K181 PolarHBondContact O-N 3.47Å
182T74.2Confident75Confident112 Ų112127.8 Ų127.869%0.68762%0.62SS**Hα-helixtrans-81.5-16.8177.838.50000113.4S178 E179 K184S178-T182 PolarHBondContact O-N 3.25Å; S178-T182 PolarHBondContact O-OG1 3.19Å; E179-T182 WeakPolarHBondContact CA-OG1 3.49Å; E179-T182 PolarHBondContact O-N 3.35Å; E179-T182 PolarHBondContact O-OG1 3.11Å; T182-K184 PolarHBondContact O-N 2.89Å; T182-K184 VanDerWaalsContact O-N 3.14Å
183L68.9Low74.3Confident144 Ų144135.8 Ų135.875%0.75465%0.653SS**  trans-83.681.4174.3-131.9132.8000109.7E179E179-L183 PolarHBondContact O-N 2.84Å
184K49.3Very low73Confident263 Ų263133.5 Ų133.5100%1.14366%0.657SS**  trans-138.80175.3-129.3-176.3-171.6172.20110.3T182T182-K184 PolarHBondContact O-N 2.89Å; T182-K184 VanDerWaalsContact O-N 3.14Å

Retrieved 184 of 184 residues in 113.1 ms (Link to these results)