G4LZ76_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4LZ76, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 213 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
1M48Very low49.7Very low238 Ų238135.7 Ų135.7100%1.17285%0.848SS**  0118.30-81.7171.1164.200107.1
2S43.4Very low50.3Low107 Ų107134.5 Ų134.575%0.74885%0.848SS**  trans52.6137.1148.5-46.70000120.2
3F40.5Very low50.4Low191 Ų191133.2 Ų133.284%0.83884%0.842SS**  cis-168.7159.9-16.1-121.2-81.1000106.1
4C41.7Very low49.9Very low105 Ų105140.6 Ų140.671%0.70985%0.846SS**  trans-36.8163170.4-57.60000115.9
5S49.4Very low50.4Low113 Ų113143 Ų14379%0.7985%0.851SS**  -171.5136.859.6-66.70000114.3
6S46.1Very low50.3Low121 Ų121145.1 Ų145.185%0.84685%0.849SS**  trans-70.7137.7159.3420000112
7S61.6Low50.3Low124 Ų124142.3 Ų142.387%0.86785%0.846SS**  trans-108.8134.316753.60000110.8
8S53Low50.4Low116 Ų116147.2 Ų147.281%0.81185%0.848SS**PPolyproline II helixtrans-100138.5-171.437.20000111.5
9C59.8Low50.2Low126 Ų126149.2 Ų149.285%0.85185%0.849SS**PPolyproline II helixtrans-88.6136.9166.5-68.20000110.5
10P57.1Low50.6Low127 Ų127150.7 Ų150.783%0.82585%0.848SS**PPolyproline II helixtrans-85.3136178.332.3-30.9000112.2
11S46.1Very low50.5Low125 Ų125148.2 Ų148.287%0.87485%0.847SS**PPolyproline II helixtrans-70.8132.2169.8-35.70000110.6
12S57.3Low50.8Low121 Ų121145.5 Ų145.585%0.84683%0.831SS**PPolyproline II helixtrans-100.7146.3174.9-139.90000111.7
13P51.4Low51Low118 Ų118150 Ų15077%0.76684%0.837SS**PPolyproline II helixtrans-99.4153.4-163.132.2-22.2000115.4
14R42.7Very low51.5Low237 Ų237152.4 Ų152.489%0.89484%0.841SS**  trans-41.2135164.1-89.3172.7161.8168.7-5.2113.5
15L58.6Low52.2Low176 Ų176155.7 Ų155.792%0.92185%0.846SS**  trans-112.7116.9155-83.2166.6000109.8
16Q48Very low51.8Low177 Ų177155.8 Ų155.883%0.82784%0.844SS**  trans-92.8162163-87.6-179.5-34.200109.5
17A51.1Low52.4Low97 Ų97156.9 Ų156.980%0.80285%0.845SS**  trans86.8135.2174.800000114.1
18R51.6Low51.5Low230 Ų230158.2 Ų158.287%0.86884%0.842SS**  cis-163.2132.233.9-151.3169.9177.9-179.4-1.2110.3
19E46.9Very low51.2Low185 Ų185155.8 Ų155.886%0.86484%0.835SS**  trans-70.2124.8169-173.4-178.8132.400110.2
20Q57.8Low50.6Low180 Ų180158.2 Ų158.284%0.84184%0.839SS**  trans-142.3110.8153.9-78.7-158.3-13.800110.2
21A48Very low49.8Very low99 Ų99160.3 Ų160.382%0.81884%0.843SS**  trans-68.2131.8169.100000110.7
22Q55.6Low49.7Very low180 Ų180157.2 Ų157.284%0.84183%0.831SS**  trans-134107.1157.2-158.5154.923.100110.7R24Q22-R24 PolarHBondContact O-N 3.37Å
23K46.4Very low49.2Very low202 Ų202161.2 Ų161.288%0.87883%0.833SS**  trans-43.9125166.2-86.7172.1166.9176.10111.2
24R51.9Low48.5Very low241 Ų241161.8 Ų161.891%0.90984%0.839SS**  trans-132.7126.6149.8-71.5-166.7175.3-155.9-0.1109.2Q22Q22-R24 PolarHBondContact O-N 3.37Å
25Q56.2Low48.3Very low175 Ų175159.2 Ų159.282%0.81883%0.834SS**  trans-74.8160.7-178.4-75.7-167.4-52.200111.8
26P40.7Very low47.4Very low115 Ų115156.7 Ų156.775%0.74783%0.83SS**  trans-74142.7-178.232-33.4000110.4
27V58.4Low46.7Very low144 Ų144157.1 Ų157.187%0.87383%0.829SS**  trans-112.9105.3168.9-152.80000106.5
28D43.5Very low46Very low151 Ų151159.1 Ų159.181%0.80783%0.831SS**  trans-74.5140.8170.1-74.9-47.2000110.3
29G45.5Very low45.4Very low65 Ų65153.6 Ų153.667%0.6783%0.828SS**  trans89.3110.3160.700000115.1
30L47.1Very low44.9Very low178 Ų178153.3 Ų153.393%0.93282%0.823SS**  179.8131.5104.7-89.8161.2000110.6
31D41.7Very low44Very low171 Ų171153 Ų15391%0.91482%0.822SS**  trans-47.9124172.2-150-1.4000111.6
32G44.3Very low43.6Very low60 Ų60157.4 Ų157.462%0.61983%0.826SS**  trans-179.881.5-17300000116.3C34G32-C34 PolarHBondContact O-N 3.29Å
33K45.1Very low42.7Very low204 Ų204158.6 Ų158.689%0.88783%0.831SS**  trans12.799.9152.5-72.4173.5176.4173.10116.2K35K33-K35 PolarHBondContact O-N 3.13Å; K33-K35 VanDerWaalsContact O-N 3.13Å
34C36.8Very low42.3Very low131 Ų131153.9 Ų153.989%0.88582%0.823SS**  trans-68.2108163.5-660000110.1G32G32-C34 PolarHBondContact O-N 3.29Å
35K40.4Very low41.5Very low182 Ų182146.3 Ų146.379%0.79181%0.807SS**  trans-83.8116.7157.6-79.1178.5175.2176.80107.6K33 F37K33-K35 PolarHBondContact O-N 3.13Å; K33-K35 VanDerWaalsContact O-N 3.13Å; K35-F37 PolarHBondContact O-N 3.42Å
36C38.8Very low40.6Very low123 Ų123148.1 Ų148.183%0.83181%0.806SS**  trans-70.2115167.4-62.70000108.9
37F33.9Very low40.7Very low187 Ų187152.5 Ų152.582%0.8281%0.808SS**  trans-79.5120.1162-91.4-95000108.2K35 S39K35-F37 PolarHBondContact O-N 3.42Å; F37-S39 PolarHBondContact O-N 2.81Å
38V35.7Very low40Very low139 Ų139152 Ų15284%0.84280%0.8SS**  trans-79.299166.3176.30000106.3
39S38Very low39.9Very low113 Ų113151.7 Ų151.779%0.7980%0.797SS**  trans-83123.6164.3-81.50000109.2F37F37-S39 PolarHBondContact O-N 2.81Å
40K37.3Very low39.6Very low179 Ų179152 Ų15278%0.77879%0.789SS**  trans-63.6154.8168.4-121174.2175.5-178.30109.5
41E38.6Very low39.4Very low175 Ų175149 Ų14982%0.81878%0.778SS**  trans80.292.9162.7-61.6165.9-176.400115.3
42E39.6Very low39.5Very low190 Ų190149.6 Ų149.689%0.88878%0.776SS**  -166.6102.3126.9-101.8173.6176.400107.6C44E42-C44 PolarHBondContact O-N 3.49Å
43E37.9Very low39.4Very low205 Ų205156.4 Ų156.496%0.95879%0.788SS**  trans-67.295.7172.3-75.8-176.912500108.9S45E43-S45 PolarHBondContact O-N 3.19Å; E43-S45 VanDerWaalsContact O-N 3.12Å
44C36.3Very low39.2Very low103 Ų103152.9 Ų152.970%0.69678%0.78SS**  trans-65111.2162.1-76.70000108.8E42 W46E42-C44 PolarHBondContact O-N 3.49Å; C44-W46 VanDerWaalsContact O-CD1 3.25Å; C44-W46 PolarHBondContact O-N 3.33Å
45S35.1Very low39.8Very low83 Ų83157.7 Ų157.758%0.5878%0.779SS**  trans-57.1100.1171.5177.90000110.7E43 R47E43-S45 PolarHBondContact O-N 3.19Å; E43-S45 VanDerWaalsContact O-N 3.12Å; S45-R47 PolarHBondContact O-N 2.81Å
46W38.4Very low40.1Very low212 Ų212154.7 Ų154.780%0.80378%0.778SS**  trans-81.716168-76.595.3000112.7C44C44-W46 VanDerWaalsContact O-CD1 3.25Å; C44-W46 PolarHBondContact O-N 3.33Å
47R42.1Very low40.7Very low208 Ų208156.8 Ų156.879%0.78578%0.78SS**THydrogen-bonded Turntrans-81.3-14.7-173.1-70.9-166.9-160.9-119.23.8115.2S45S45-R47 PolarHBondContact O-N 2.81Å
48D43.3Very low41.6Very low132 Ų132155.5 Ų155.571%0.70678%0.782SS**THydrogen-bonded Turntrans-97.14.6-168.3-65-36000115.5
49I41.4Very low42.3Very low145 Ų145158.6 Ų158.674%0.74479%0.787SS**SBendtrans-115.3-9.5-179.5-55.9175.3000112.6
50S40.3Very low42.6Very low72 Ų72156 Ų15650%0.50378%0.779SS.*SBendtrans-94.5-7.2-179.2-66.20000115E52S50-E52 VanDerWaalsContact C-N 3.28Å; S50-E52 PolarHBondContact O-N 2.87Å
51T42.4Very low42.7Very low115 Ų115155.2 Ų155.271%0.70678%0.783SS**THydrogen-bonded Turntrans-78.70.7-170.233.70000115.8
52E42.9Very low43.2Very low184 Ų184153.3 Ų153.386%0.8679%0.787SS**THydrogen-bonded Turntrans-102.3-2.3179.9-153.1151.617000114.5S50S50-E52 VanDerWaalsContact C-N 3.28Å; S50-E52 PolarHBondContact O-N 2.87Å
53F42.4Very low44Very low202 Ų202151.7 Ų151.789%0.88678%0.781SS**THydrogen-bonded Turntrans-119.5-5.5175.4-91-90.9000115.2R55F53-R55 PolarHBondContact O-N 3.39Å
54D41.5Very low45Very low131 Ų131147.1 Ų147.170%0.70177%0.769SS**  trans-95.452.2-179.9-77.6-36.3000113.1
55R50.4Low46Very low232 Ų232148.9 Ų148.988%0.87578%0.777SS**PPolyproline II helixtrans-82.2122.1161.1-93.9-171-171.3-174.84.1108.8F53 L57F53-R55 PolarHBondContact O-N 3.39Å; R55-L57 PolarHBondContact O-N 3.17Å; R55-L57 VanDerWaalsContact O-N 3.16Å
56P46.6Very low47Very low119 Ų119153 Ų15377%0.77379%0.787SS**PPolyproline II helixtrans-61.7120.8175.924.6-31000109.2N58P56-N58 PolarHBondContact O-N 3.41Å
57L50.1Low48.3Very low166 Ų166148.9 Ų148.987%0.86979%0.788SS**PPolyproline II helixtrans-67124.9161.8-75.4167.5000106.6R55 E59R55-L57 PolarHBondContact O-N 3.17Å; R55-L57 VanDerWaalsContact O-N 3.16Å; L57-E59 PolarHBondContact O-N 2.91Å
58N54.1Low48.9Very low161 Ų161146.5 Ų146.586%0.86179%0.789SS**PPolyproline II helixtrans-47.2125.7175.5-76.7-31.2000110.2P56 G60P56-N58 PolarHBondContact O-N 3.41Å; N58-G60 PolarHBondContact O-N 2.8Å
59E49.9Very low49.2Very low204 Ų204145.4 Ų145.495%0.95379%0.79SS**  trans-6397.5171.3-71.3174152.400108.7L57L57-E59 PolarHBondContact O-N 2.91Å
60G43.7Very low49.8Very low59 Ų59145.5 Ų145.561%0.60880%0.797SS**  trans-147108.9171.900000109N58N58-G60 PolarHBondContact O-N 2.8Å
61D39.8Very low49.8Very low161 Ų161146.6 Ų146.686%0.86181%0.805SS**  trans5968.7162.5-54.4-31.9000118.5M63D61-M63 PolarHBondContact O-N 3.12Å
62C48.7Very low50Low135 Ų135149.5 Ų149.591%0.91281%0.81SS**  trans-74.4103156.8-82.20000110.3
63M57Low50Low156 Ų156145.6 Ų145.677%0.76881%0.809SS**PPolyproline II helixtrans-62.2137.8168.5-77.7-62.4-56.700111.5D61 V65D61-M63 PolarHBondContact O-N 3.12Å; M63-V65 PolarHBondContact O-N 2.8Å
64P59.5Low50.5Low109 Ų109144.4 Ų144.471%0.70880%0.804SS**PPolyproline II helixtrans-65.7118.8174.426-34000110.8Q66P64-Q66 PolarHBondContact O-N 2.7Å
65V55.5Low50.6Low140 Ų140145.7 Ų145.785%0.84881%0.81SS**PPolyproline II helixtrans-73.4117.4169-1790000108.1M63M63-V65 PolarHBondContact O-N 2.8Å
66Q57.5Low50.6Low169 Ų169141.1 Ų141.179%0.7981%0.807SS**PPolyproline II helixtrans-67.3134.2172.1-68.6-165.8-8.500110.4P64 L68P64-Q66 PolarHBondContact O-N 2.7Å; Q66-L68 PolarHBondContact O-N 2.88Å
67P64.3Low51.1Low127 Ų127143.6 Ų143.683%0.82581%0.806SS**PPolyproline II helixtrans-62.9127.4174.1-18.530.1000111.2
68L54.5Low50.9Low157 Ų157142.4 Ų142.482%0.82280%0.796SS**PPolyproline II helixtrans-67.2144.9172.9-72.4171.6000111.2Q66 V70Q66-L68 PolarHBondContact O-N 2.88Å; L68-V70 PolarHBondContact O-N 3.49Å
69P50Low51Low110 Ų110139.5 Ų139.571%0.71479%0.785SS**PPolyproline II helixtrans-64.2130-177.124.1-32.5000112.2S71P69-S71 PolarHBondContact O-N 3.33Å
70V53.7Low51.3Low146 Ų146135.8 Ų135.889%0.88577%0.768SS**  trans-77.781.3-179.1-171.90000109.5L68L68-V70 PolarHBondContact O-N 3.49Å
71S41.4Very low52.1Low96 Ų96135.7 Ų135.767%0.67176%0.758SS**  trans-14392.1166.659.80000109.5P69P69-S71 PolarHBondContact O-N 3.33Å
72E46.9Very low53Low176 Ų176133.9 Ų133.982%0.82275%0.748SS**  trans140.259.8163.3-76.6-165.5152.400111.6K74E72-K74 VanDerWaalsContact C-N 3.27Å; E72-K74 PolarHBondContact O-N 3.23Å
73A42.2Very low53.3Low102 Ų102130.4 Ų130.484%0.84373%0.728SS**  trans-7578.8167.500000110.3
74K52.1Low53.5Low177 Ų177128.9 Ų128.977%0.7772%0.72SS**  trans-92.598.6162.7-85.3177.6-179.2164.80109.4E72 V76E72-K74 VanDerWaalsContact C-N 3.27Å; E72-K74 PolarHBondContact O-N 3.23Å; K74-V76 PolarHBondContact O-N 2.85Å
75L45.5Very low53.7Low158 Ų158127.6 Ų127.683%0.82771%0.707SS**  trans52.850.5153.1-143.7101000117.5K77L75-K77 PolarHBondContact O-N 2.83Å
76V49.1Very low53.9Low136 Ų136124.1 Ų124.182%0.82469%0.689SS**  trans-77.7105.4161178.90000107.8K74 H78K74-V76 PolarHBondContact O-N 2.85Å; V76-H78 PolarHBondContact O-N 3.49Å
77K56.7Low54.1Low170 Ų170119.9 Ų119.974%0.73967%0.674SS**  trans-56.6130.3170.7-82.1179.6174179.40109.2L75L75-K77 PolarHBondContact O-N 2.83Å
78H47.4Very low54.2Low141 Ų141123.4 Ų123.465%0.65367%0.671SS**  trans-46.6131.7179.3-118.1-81000111.8V76 H80 S81V76-H78 PolarHBondContact O-N 3.49Å; H78-H80 AromaticContact ND1-CD2 3.96Å; H78-H80 PolarHBondContact O-N 2.54Å; H78-S81 PolarHBondContact O-N 2.71Å; H78-S81 VanDerWaalsContact O-N 3.13Å; H78-S81 PolarHBondContact O-OG 3.3Å
79P55.2Low54.7Low100 Ų100120.1 Ų120.165%0.64966%0.658SS**THydrogen-bonded Turntrans-60.3-18.2-179.620.6-31.2000113.9S81 L82P79-S81 VanDerWaalsContact C-N 3.32Å; P79-S81 PolarHBondContact O-N 3.36Å; P79-L82 PolarHBondContact O-N 3.07Å
80H56.7Low55.4Low126 Ų126118 Ų11858%0.58365%0.646SS**Hα-helixtrans-62.7-33.2175.3-79.4-86.7000113.8H78 L82 A83 E84H78-H80 AromaticContact ND1-CD2 3.96Å; H78-H80 PolarHBondContact O-N 2.54Å; H80-L82 VanDerWaalsContact C-N 3.28Å; H80-L82 PolarHBondContact O-N 2.89Å; H80-A83 PolarHBondContact O-N 2.96Å; H80-E84 WeakPolarHBondContact O-CG 3.43Å; H80-E84 PolarHBondContact O-N 3.27Å
81S60.4Low56Low58 Ų58118.1 Ų118.141%0.40663%0.634SS.*Hα-helixtrans-70.8-20.8-176.965.40000114.2H78 P79 N85H78-S81 PolarHBondContact O-N 2.71Å; H78-S81 VanDerWaalsContact O-N 3.13Å; H78-S81 PolarHBondContact O-OG 3.3Å; P79-S81 VanDerWaalsContact C-N 3.32Å; P79-S81 PolarHBondContact O-N 3.36Å; S81-N85 PolarHBondContact O-N 3.31Å; S81-N85 PolarHBondContact O-ND2 3.39Å
82L57.8Low57.1Low123 Ų123117.6 Ų117.664%0.64463%0.63SS**Hα-helixtrans-81.1-43.9177.9-160.291.6000111.5P79 H80 E84 N85 S86P79-L82 PolarHBondContact O-N 3.07Å; H80-L82 VanDerWaalsContact C-N 3.28Å; H80-L82 PolarHBondContact O-N 2.89Å; L82-E84 VanDerWaalsContact C-N 3.29Å; L82-E84 PolarHBondContact O-N 3.33Å; L82-N85 PolarHBondContact O-N 3.04Å; L82-N85 PolarHBondContact O-OD1 3.47Å; L82-S86 PolarHBondContact O-N 2.95Å; L82-S86 VanDerWaalsContact O-N 3.08Å
83A56.9Low57.8Low61 Ų61111.5 Ų111.550%0.50461%0.61SS.*Hα-helixtrans-63-38.3176.900000111.6H80 S86 T87H80-A83 PolarHBondContact O-N 2.96Å; A83-S86 PolarHBondContact O-N 2.91Å; A83-T87 WeakPolarHBondContact O-CB 3.48Å; A83-T87 WeakPolarHBondContact O-CG2 3.2Å; A83-T87 PolarHBondContact O-N 2.56Å; A83-T87 PolarHBondContact O-OG1 2.82Å
84E60.9Low58.7Low125 Ų125110.3 Ų110.358%0.58459%0.592SS**Hα-helixtrans-68.2-37.8177.1-71.6175.1-178.300112.8H80 L82 S86 T87 R88H80-E84 WeakPolarHBondContact O-CG 3.43Å; H80-E84 PolarHBondContact O-N 3.27Å; L82-E84 VanDerWaalsContact C-N 3.29Å; L82-E84 PolarHBondContact O-N 3.33Å; E84-S86 VanDerWaalsContact C-N 3.34Å; E84-T87 WeakPolarHBondContact CA-OG1 3.27Å; E84-T87 PolarHBondContact O-OG1 3.35Å; E84-T87 VanDerWaalsContact O-OG1 3.07Å; E84-R88 WeakPolarHBondContact O-CB 3.3Å; E84-R88 PolarHBondContact O-N 2.99Å
85N63.2Low59.1Low81 Ų81106.4 Ų106.443%0.43358%0.584SS.*Hα-helixtrans-69.5-34.9176.678.133.3000111.9S81 L82 R88 T89S81-N85 PolarHBondContact O-N 3.31Å; S81-N85 PolarHBondContact O-ND2 3.39Å; L82-N85 PolarHBondContact O-N 3.04Å; L82-N85 PolarHBondContact O-OD1 3.47Å; N85-R88 PolarHBondContact O-N 3.13Å; N85-T89 VanDerWaalsContact O-CB 3.32Å; N85-T89 WeakPolarHBondContact O-CB 3.49Å; N85-T89 PolarHBondContact O-N 3.32Å; N85-T89 PolarHBondContact O-OG1 3.49Å
86S59.9Low59.5Low68 Ų68104.1 Ų104.148%0.47658%0.578SS.*Hα-helixtrans-73.7-42.8179.7-156.60000110L82 A83 E84 R88 T89 S90L82-S86 PolarHBondContact O-N 2.95Å; L82-S86 VanDerWaalsContact O-N 3.08Å; A83-S86 PolarHBondContact O-N 2.91Å; E84-S86 VanDerWaalsContact C-N 3.34Å; S86-R88 PolarHBondContact O-N 3.43Å; S86-T89 PolarHBondContact O-N 3.15Å; S86-S90 WeakPolarHBondContact O-CB 3.21Å; S86-S90 PolarHBondContact O-N 3.03Å; S86-S90 PolarHBondContact O-OG 3.15Å
87T62.6Low59.9Low79 Ų79102.6 Ų102.649%0.48556%0.563SS.*Hα-helixtrans-65.8-35.7173.748.70000112.4A83 E84 K91A83-T87 WeakPolarHBondContact O-CB 3.48Å; A83-T87 WeakPolarHBondContact O-CG2 3.2Å; A83-T87 PolarHBondContact O-N 2.56Å; A83-T87 PolarHBondContact O-OG1 2.82Å; E84-T87 WeakPolarHBondContact CA-OG1 3.27Å; E84-T87 PolarHBondContact O-OG1 3.35Å; E84-T87 VanDerWaalsContact O-OG1 3.07Å; T87-K91 WeakPolarHBondContact O-CB 3.3Å; T87-K91 WeakPolarHBondContact O-CG 3.44Å; T87-K91 PolarHBondContact O-N 2.97Å
88R65.1Low60Low201 Ų201101.1 Ų101.176%0.75856%0.562SS**Hα-helixtrans-69.1-38.6173.7-171.1175.9178.9-179.3-0.3112.4E84 N85 S86 S92E84-R88 WeakPolarHBondContact O-CB 3.3Å; E84-R88 PolarHBondContact O-N 2.99Å; N85-R88 PolarHBondContact O-N 3.13Å; S86-R88 PolarHBondContact O-N 3.43Å; R88-S92 VanDerWaalsContact O-CB 3.3Å; R88-S92 WeakPolarHBondContact O-CB 3.16Å; R88-S92 PolarHBondContact O-N 2.83Å
89T65.1Low60.6Low88 Ų8895.9 Ų95.954%0.5454%0.541SS..Hα-helixtrans-69.8-46.2176.9-54.50000110.8N85 S86 S92 A93N85-T89 VanDerWaalsContact O-CB 3.32Å; N85-T89 WeakPolarHBondContact O-CB 3.49Å; N85-T89 PolarHBondContact O-N 3.32Å; N85-T89 PolarHBondContact O-OG1 3.49Å; S86-T89 PolarHBondContact O-N 3.15Å; T89-S92 PolarHBondContact O-N 3.43Å; T89-A93 WeakPolarHBondContact O-CB 3.33Å; T89-A93 PolarHBondContact O-N 3.47Å
90S65.2Low61.2Low66 Ų6697.3 Ų97.346%0.46255%0.554SS.*Hα-helixtrans-62.8-43.1174.5-58.70000111.4S86 S92 A93 V94S86-S90 WeakPolarHBondContact O-CB 3.21Å; S86-S90 PolarHBondContact O-N 3.03Å; S86-S90 PolarHBondContact O-OG 3.15Å; S90-S92 PolarHBondContact O-N 3.08Å; S90-A93 PolarHBondContact O-N 3.4Å; S90-V94 VanDerWaalsContact O-CB 3.3Å; S90-V94 WeakPolarHBondContact O-CB 3.32Å; S90-V94 WeakPolarHBondContact O-CG2 3.2Å; S90-V94 PolarHBondContact O-N 3.44Å
91K65.4Low62.3Low149 Ų14993.7 Ų93.765%0.64854%0.539SS*.Hα-helixtrans-60.8-46.2173.1-79.9177.9178.6-178.80110.8T87 A93 V94 T95T87-K91 WeakPolarHBondContact O-CB 3.3Å; T87-K91 WeakPolarHBondContact O-CG 3.44Å; T87-K91 PolarHBondContact O-N 2.97Å; K91-A93 VanDerWaalsContact C-N 3.31Å; K91-A93 PolarHBondContact O-N 3.29Å; K91-V94 CarbonylContact O-C 3.54Å; K91-V94 PolarHBondContact O-N 2.84Å; K91-T95 WeakPolarHBondContact O-CA 3.37Å; K91-T95 WeakPolarHBondContact O-CB 3.32Å; K91-T95 PolarHBondContact O-N 3.24Å; K91-T95 PolarHBondContact O-OG1 3.31Å
92S65Low63.4Low84 Ų8495 Ų9559%0.58755%0.546SS*.Hα-helixtrans-65.3-32.5179.5-170.70000113.2R88 T89 S90 P96R88-S92 VanDerWaalsContact O-CB 3.3Å; R88-S92 WeakPolarHBondContact O-CB 3.16Å; R88-S92 PolarHBondContact O-N 2.83Å; T89-S92 PolarHBondContact O-N 3.43Å; S90-S92 PolarHBondContact O-N 3.08Å; S92-P96 WeakPolarHBondContact O-CD 3.35Å
93A61.4Low64.7Low49 Ų4994.7 Ų94.741%0.40554%0.541SS..Hα-helixtrans-72.7-34.2174.200000111.8T89 S90 K91T89-A93 WeakPolarHBondContact O-CB 3.33Å; T89-A93 PolarHBondContact O-N 3.47Å; S90-A93 PolarHBondContact O-N 3.4Å; K91-A93 VanDerWaalsContact C-N 3.31Å; K91-A93 PolarHBondContact O-N 3.29Å
94V61.1Low65.8Low76 Ų7695.3 Ų95.346%0.46153%0.533SS..Hα-helixtrans-87.5-21-179.8177.20000112.7S90 K91 M97 I98S90-V94 VanDerWaalsContact O-CB 3.3Å; S90-V94 WeakPolarHBondContact O-CB 3.32Å; S90-V94 WeakPolarHBondContact O-CG2 3.2Å; S90-V94 PolarHBondContact O-N 3.44Å; K91-V94 CarbonylContact O-C 3.54Å; K91-V94 PolarHBondContact O-N 2.84Å; V94-M97 CarbonylContact O-C 3.51Å; V94-M97 VanDerWaalsContact O-CA 3.3Å; V94-M97 WeakPolarHBondContact O-CA 3.5Å; V94-M97 WeakPolarHBondContact O-CB 3.2Å; V94-M97 PolarHBondContact O-N 2.69Å; V94-I98 HydrophobicContact CG1-CG1 4.12Å; V94-I98 WeakPolarHBondContact O-CG1 3.32Å; V94-I98 PolarHBondContact O-N 2.94Å; V94-I98 VanDerWaalsContact O-N 3.12Å
95T59.8Low66.7Low96 Ų9693.4 Ų93.459%0.58953%0.527SS*.G310 helixtrans-62.3-37-177-57.10000113.6K91 M97K91-T95 WeakPolarHBondContact O-CA 3.37Å; K91-T95 WeakPolarHBondContact O-CB 3.32Å; K91-T95 PolarHBondContact O-N 3.24Å; K91-T95 PolarHBondContact O-OG1 3.31Å; T95-M97 PolarHBondContact O-N 2.89Å
96P55.7Low67.6Low110 Ų11095.6 Ų95.671%0.71453%0.534SS*.G310 helixtrans-77.5-3169.129.6-32.3000113.7S92S92-P96 WeakPolarHBondContact O-CD 3.35Å
97M55.9Low68.7Low104 Ų10498.3 Ų98.351%0.51253%0.534SS..G310 helixtrans-114.73.8-172.3-62.4-171.7163.400114.6V94 T95 S99V94-M97 CarbonylContact O-C 3.51Å; V94-M97 VanDerWaalsContact O-CA 3.3Å; V94-M97 WeakPolarHBondContact O-CA 3.5Å; V94-M97 WeakPolarHBondContact O-CB 3.2Å; V94-M97 PolarHBondContact O-N 2.69Å; T95-M97 PolarHBondContact O-N 2.89Å; M97-S99 PolarHBondContact O-N 3.42Å
98I59.6Low69.4Low138 Ų13896.8 Ų96.871%0.70853%0.526SS*.  trans-76.968168.8-49.5174.7000107.7V94V94-I98 HydrophobicContact CG1-CG1 4.12Å; V94-I98 WeakPolarHBondContact O-CG1 3.32Å; V94-I98 PolarHBondContact O-N 2.94Å; V94-I98 VanDerWaalsContact O-N 3.12Å
99S59.4Low70Confident31 Ų3192.1 Ų92.122%0.21752%0.515CS..  trans-78.6141.8159.8106.60000107.6M97 N101 E104M97-S99 PolarHBondContact O-N 3.42Å; S99-N101 PolarHBondContact O-N 3.15Å; S99-N101 VanDerWaalsContact O-N 3.15Å; S99-N101 PolarHBondContact OG-N 3.41Å; S99-E104 WeakPolarHBondContact CB-OE2 2.92Å; S99-E104 WeakPolarHBondContact OG-CB 3.49Å; S99-E104 VanDerWaalsContact OG-CD 3.27Å; S99-E104 WeakPolarHBondContact OG-CG 3.35Å; S99-E104 PolarHBondContact OG-OE2 3.24Å
100S68.1Low70.8Confident130 Ų13093.8 Ų93.891%0.90952%0.521SS*.SBendtrans-74.39178.529.70000113
101N80.9Confident71.6Confident51 Ų5194.5 Ų94.527%0.27352%0.519SS..  trans-99.4118.5179.6175.84.5000110.5S99 E103 E104S99-N101 PolarHBondContact O-N 3.15Å; S99-N101 VanDerWaalsContact O-N 3.15Å; S99-N101 PolarHBondContact OG-N 3.41Å; N101-E103 PolarHBondContact ND2-OE2 2.89Å; N101-E103 PolarHBondContact O-N 3.15Å; N101-E103 WeakPolarHBondContact OD1-CB 3.36Å; N101-E103 WeakPolarHBondContact OD1-CG 3.44Å; N101-E103 PolarHBondContact OD1-N 3.33Å; N101-E103 PolarHBondContact OD1-OE2 3.23Å; N101-E104 HydrophobicContact CB-CG 3.96Å; N101-E104 PolarHBondContact O-N 3.2Å; N101-E104 VanDerWaalsContact O-N 3.08Å
102P82.3Confident72.1Confident86 Ų8691.6 Ų91.656%0.55851%0.511SS*.Hα-helixtrans-56.7-30.9178.624-34.8000113.6E104 I105 E106P102-E104 PolarHBondContact O-N 2.98Å; P102-I105 WeakPolarHBondContact O-CB 3.38Å; P102-I105 PolarHBondContact O-N 2.92Å; P102-E106 PolarHBondContact O-N 3.33Å
103E85Confident73Confident115 Ų11591.1 Ų91.154%0.53751%0.505SS..Hα-helixtrans-65.2-28.4179.3-59.7162.7167.500112.4N101 R107N101-E103 PolarHBondContact ND2-OE2 2.89Å; N101-E103 PolarHBondContact O-N 3.15Å; N101-E103 WeakPolarHBondContact OD1-CB 3.36Å; N101-E103 WeakPolarHBondContact OD1-CG 3.44Å; N101-E103 PolarHBondContact OD1-N 3.33Å; N101-E103 PolarHBondContact OD1-OE2 3.23Å; E103-R107 WeakPolarHBondContact O-CG 3.34Å; E103-R107 PolarHBondContact O-N 2.98Å; E103-R107 PolarHBondContact O-NH1 3.06Å
104E81.1Confident73.9Confident74 Ų7495.1 Ų95.135%0.34652%0.515SS..Hα-helixtrans-82.2-30.9177.9-43.9-153.1135.300111.6S99 N101 P102 R107 C108S99-E104 WeakPolarHBondContact CB-OE2 2.92Å; S99-E104 WeakPolarHBondContact OG-CB 3.49Å; S99-E104 VanDerWaalsContact OG-CD 3.27Å; S99-E104 WeakPolarHBondContact OG-CG 3.35Å; S99-E104 PolarHBondContact OG-OE2 3.24Å; N101-E104 HydrophobicContact CB-CG 3.96Å; N101-E104 PolarHBondContact O-N 3.2Å; N101-E104 VanDerWaalsContact O-N 3.08Å; P102-E104 PolarHBondContact O-N 2.98Å; E104-R107 PolarHBondContact O-N 3.38Å; E104-R107 IonicContact OE1-NH2 2.95Å; E104-R107 PolarHBondContact OE1-NH2 3.25Å; E104-C108 PolarHBondContact O-N 3.35Å; E104-C108 PolarHBondContact O-SG 3.41Å
105I79.7Confident74.7Confident86 Ų8697 Ų9744%0.44152%0.519SS..Hα-helixtrans-63.9-46.1172.6-60.4175.2000109.5P102 R107 C108 I109P102-I105 WeakPolarHBondContact O-CB 3.38Å; P102-I105 PolarHBondContact O-N 2.92Å; I105-R107 PolarHBondContact O-N 3.25Å; I105-C108 WeakPolarHBondContact O-CB 3.3Å; I105-C108 PolarHBondContact O-N 3.1Å; I105-C108 VanDerWaalsContact O-N 3.16Å; I105-I109 HydrophobicContact CG2-CD1 4.05Å; I105-I109 WeakPolarHBondContact O-CG1 3.48Å; I105-I109 PolarHBondContact O-N 3.15Å
106E81Confident75.8Confident127 Ų12799.6 Ų99.659%0.59352%0.518SS*.Hα-helixtrans-58.1-47175.5-73.2-177.4173.400111.5P102 C108 I109 D110P102-E106 PolarHBondContact O-N 3.33Å; E106-C108 VanDerWaalsContact C-N 3.31Å; E106-C108 PolarHBondContact O-N 3.35Å; E106-I109 WeakPolarHBondContact O-CB 3.14Å; E106-I109 PolarHBondContact O-N 3.31Å; E106-I109 VanDerWaalsContact O-N 3.09Å; E106-D110 PolarHBondContact O-N 3.09Å
107R83.1Confident77.2Confident124 Ų12499.3 Ų99.347%0.46851%0.51SS..Hα-helixtrans-59.5-39.4175-69.8-171.2-51-99.815.4112.8E103 E104 I105 I109 D110 D111E103-R107 WeakPolarHBondContact O-CG 3.34Å; E103-R107 PolarHBondContact O-N 2.98Å; E103-R107 PolarHBondContact O-NH1 3.06Å; E104-R107 PolarHBondContact O-N 3.38Å; E104-R107 IonicContact OE1-NH2 2.95Å; E104-R107 PolarHBondContact OE1-NH2 3.25Å; I105-R107 PolarHBondContact O-N 3.25Å; R107-I109 VanDerWaalsContact C-N 3.32Å; R107-I109 PolarHBondContact O-N 3.47Å; R107-D110 PolarHBondContact O-N 3.49Å; R107-D111 PolarHBondContact O-N 2.98Å; R107-D111 VanDerWaalsContact O-N 3.15Å
108C77.6Confident78.6Confident47 Ų4796.9 Ų96.932%0.31851%0.507SS..Hα-helixtrans-65.9-34.6176.4-69.50000112.5E104 I105 E106 D111 L112E104-C108 PolarHBondContact O-N 3.35Å; E104-C108 PolarHBondContact O-SG 3.41Å; I105-C108 WeakPolarHBondContact O-CB 3.3Å; I105-C108 PolarHBondContact O-N 3.1Å; I105-C108 VanDerWaalsContact O-N 3.16Å; E106-C108 VanDerWaalsContact C-N 3.31Å; E106-C108 PolarHBondContact O-N 3.35Å; C108-D111 PolarHBondContact O-N 3.32Å; C108-L112 PolarHBondContact O-N 3.34Å
109I78.2Confident80Confident103 Ų10398.3 Ų98.353%0.52851%0.508SS..Hα-helixtrans-68.1-41.1175.6-67.3166.6000110.1I105 E106 R107 D111 L112I105-I109 HydrophobicContact CG2-CD1 4.05Å; I105-I109 WeakPolarHBondContact O-CG1 3.48Å; I105-I109 PolarHBondContact O-N 3.15Å; E106-I109 WeakPolarHBondContact O-CB 3.14Å; E106-I109 PolarHBondContact O-N 3.31Å; E106-I109 VanDerWaalsContact O-N 3.09Å; R107-I109 VanDerWaalsContact C-N 3.32Å; R107-I109 PolarHBondContact O-N 3.47Å; I109-D111 PolarHBondContact O-N 2.96Å; I109-L112 WeakPolarHBondContact O-CB 3.49Å; I109-L112 PolarHBondContact O-N 3.16Å; I109-L112 VanDerWaalsContact O-N 3.1Å
110D82.1Confident81.1Confident123 Ų123100.2 Ų100.266%0.65852%0.516SS*.Hα-helixtrans-63.7-26.3176.1-72.6-22.7000113.2E106 R107 P113E106-D110 PolarHBondContact O-N 3.09Å; R107-D110 PolarHBondContact O-N 3.49Å; D110-P113 WeakPolarHBondContact O-CD 3.43Å
111D80.3Confident82Confident82 Ų8299.2 Ų99.244%0.43951%0.509SS..THydrogen-bonded Turntrans-84.9-10.8175.3-76.2-26.5000114R107 C108 I109 P113 Q114 H115R107-D111 PolarHBondContact O-N 2.98Å; R107-D111 VanDerWaalsContact O-N 3.15Å; C108-D111 PolarHBondContact O-N 3.32Å; I109-D111 PolarHBondContact O-N 2.96Å; D111-P113 VanDerWaalsContact C-N 3.33Å; D111-Q114 WeakPolarHBondContact O-CA 3.27Å; D111-Q114 VanDerWaalsContact O-CB 3.27Å; D111-Q114 WeakPolarHBondContact O-CB 3.27Å; D111-Q114 PolarHBondContact O-N 3.43Å; D111-Q114 PolarHBondContact OD1-NE2 3.3Å; D111-Q114 VanDerWaalsContact OD1-NE2 3.15Å; D111-H115 PolarHBondContact O-N 3.08Å
112L77.8Confident82.2Confident88 Ų88107.2 Ų107.246%0.46154%0.535SS..Hα-helixtrans-55.1-38.1178.8-168.267.4000114C108 I109 Q114 H115 R116C108-L112 PolarHBondContact O-N 3.34Å; I109-L112 WeakPolarHBondContact O-CB 3.49Å; I109-L112 PolarHBondContact O-N 3.16Å; I109-L112 VanDerWaalsContact O-N 3.1Å; L112-Q114 PolarHBondContact O-N 3.47Å; L112-H115 PolarHBondContact O-N 3.18Å; L112-R116 PolarHBondContact O-N 2.94Å
113P82.1Confident82.4Confident73 Ų73106.1 Ų106.147%0.47453%0.527SS..Hα-helixtrans-58.2-33.2171.9-23.635.3000113.2D110 D111 R116 N117D110-P113 WeakPolarHBondContact O-CD 3.43Å; D111-P113 VanDerWaalsContact C-N 3.33Å; P113-R116 PolarHBondContact O-N 3.44Å; P113-N117 PolarHBondContact O-N 2.94Å; P113-N117 PolarHBondContact O-ND2 2.84Å
114Q81.6Confident82.6Confident133 Ų133107.2 Ų107.262%0.62153%0.532SS*.Hα-helixtrans-67.9-44.7177.4-56.5-175.216.600110.7D111 L112 R116 N117 A118D111-Q114 WeakPolarHBondContact O-CA 3.27Å; D111-Q114 VanDerWaalsContact O-CB 3.27Å; D111-Q114 WeakPolarHBondContact O-CB 3.27Å; D111-Q114 PolarHBondContact O-N 3.43Å; D111-Q114 PolarHBondContact OD1-NE2 3.3Å; D111-Q114 VanDerWaalsContact OD1-NE2 3.15Å; L112-Q114 PolarHBondContact O-N 3.47Å; Q114-R116 VanDerWaalsContact C-N 3.33Å; Q114-R116 PolarHBondContact O-N 3.3Å; Q114-N117 CarbonylContact O-C 3.52Å; Q114-N117 PolarHBondContact O-N 3.03Å; Q114-N117 VanDerWaalsContact O-N 3.15Å; Q114-A118 PolarHBondContact O-N 3.46Å
115H77.8Confident82.9Confident115 Ų115106 Ų10653%0.53253%0.527SS..Hα-helixtrans-64.2-36.5177.6-173.8-85.5000112.4D111 L112 N117 A118D111-H115 PolarHBondContact O-N 3.08Å; L112-H115 PolarHBondContact O-N 3.18Å; H115-N117 VanDerWaalsContact C-N 3.26Å; H115-N117 PolarHBondContact O-N 2.95Å; H115-A118 PolarHBondContact O-N 3.45Å
116R82.4Confident83.3Confident152 Ų152102.8 Ų102.857%0.57451%0.513SS*.Hα-helixtrans-64.1-31.5175.3-75.4-175173.8-175.3-0.4113L112 P113 Q114 S127 A128L112-R116 PolarHBondContact O-N 2.94Å; P113-R116 PolarHBondContact O-N 3.44Å; Q114-R116 VanDerWaalsContact C-N 3.33Å; Q114-R116 PolarHBondContact O-N 3.3Å; R116-S127 PolarHBondContact O-N 3Å; R116-A128 WeakPolarHBondContact O-CB 3.47Å; R116-A128 PolarHBondContact O-N 3.43Å
117N86.3Confident83.3Confident103 Ų10399.5 Ų99.555%0.55150%0.504SS*.Hα-helixtrans-94.8-12.7-179-68.2-49.9000113.6P113 Q114 H115 K119 S126P113-N117 PolarHBondContact O-N 2.94Å; P113-N117 PolarHBondContact O-ND2 2.84Å; Q114-N117 CarbonylContact O-C 3.52Å; Q114-N117 PolarHBondContact O-N 3.03Å; Q114-N117 VanDerWaalsContact O-N 3.15Å; H115-N117 VanDerWaalsContact C-N 3.26Å; H115-N117 PolarHBondContact O-N 2.95Å; N117-K119 PolarHBondContact O-N 2.87Å; N117-S126 VanDerWaalsContact O-CB 3.27Å; N117-S126 WeakPolarHBondContact O-CB 3.34Å
118A85.2Confident83.3Confident53 Ų5394.7 Ų94.744%0.43849%0.49SS..SBendtrans-60.8134.1174.700000110.9Q114 H115 S126Q114-A118 PolarHBondContact O-N 3.46Å; H115-A118 PolarHBondContact O-N 3.45Å; A118-S126 WeakPolarHBondContact O-CA 3.47Å; A118-S126 WeakPolarHBondContact O-CB 3.44Å
119K87.7Confident83.7Confident169 Ų16998.1 Ų98.174%0.73550%0.5SS*.BIsolated β-bridgetrans-73.4129.1177.5-67.5-178.3-179.8178.90109.4N117N117-K119 PolarHBondContact O-N 2.87Å
120N83.1Confident83.9Confident70 Ų7096.4 Ų96.437%0.37449%0.492SS..PPolyproline II helixtrans-68.9131.1171.3-177.9-44.1000109.1R122 T123 H124 D125N120-R122 PolarHBondContact O-N 3.21Å; N120-R122 WeakPolarHBondContact OD1-CA 3.47Å; N120-R122 VanDerWaalsContact OD1-CB 3.27Å; N120-R122 WeakPolarHBondContact OD1-CB 3.16Å; N120-R122 PolarHBondContact OD1-N 3Å; N120-T123 WeakPolarHBondContact CB-OG1 3.35Å; N120-T123 PolarHBondContact O-N 3.42Å; N120-H124 WeakPolarHBondContact O-CA 3.41Å; N120-H124 PolarHBondContact O-N 2.85Å; N120-D125 WeakPolarHBondContact CB-O 3.39Å; N120-D125 PolarHBondContact N-O 3.49Å
121S86.7Confident83.8Confident109 Ų10997 Ų9776%0.76249%0.489SS*.THydrogen-bonded Turntrans-62.7-23.6-178.956.10000113.9
122R84.9Confident83.8Confident220 Ų220100.1 Ų100.183%0.8350%0.498SS*.THydrogen-bonded Turntrans-88.3-40.5-178.2-174.3179174.2-171-2.9113.1N120N120-R122 PolarHBondContact O-N 3.21Å; N120-R122 WeakPolarHBondContact OD1-CA 3.47Å; N120-R122 VanDerWaalsContact OD1-CB 3.27Å; N120-R122 WeakPolarHBondContact OD1-CB 3.16Å; N120-R122 PolarHBondContact OD1-N 3Å
123T86.6Confident83.8Confident62 Ų6298.7 Ų98.738%0.3850%0.496SS..THydrogen-bonded Turntrans-101.4-12.7-177.260.70000113.1N120 D125N120-T123 WeakPolarHBondContact CB-OG1 3.35Å; N120-T123 PolarHBondContact O-N 3.42Å; T123-D125 PolarHBondContact O-N 2.89Å; T123-D125 PolarHBondContact OG1-N 3.32Å
124H89.2Confident83.5Confident138 Ų13898.3 Ų98.364%0.63949%0.494SS*.SBendtrans58.65.6-169.7-61.5-80.3000115.1N120N120-H124 WeakPolarHBondContact O-CA 3.41Å; N120-H124 PolarHBondContact O-N 2.85Å
125D86.9Confident83.1Confident48 Ų4895.6 Ų95.626%0.25748%0.482SS..SBendtrans-105.2151.1177.7-73.7-40.2000111.2N120 T123 K129 L130N120-D125 WeakPolarHBondContact CB-O 3.39Å; N120-D125 PolarHBondContact N-O 3.49Å; T123-D125 PolarHBondContact O-N 2.89Å; T123-D125 PolarHBondContact OG1-N 3.32Å; D125-K129 HydrophobicContact CB-CD 4.32Å; D125-K129 VanDerWaalsContact OD1-CD 3.32Å; D125-K129 WeakPolarHBondContact OD1-CD 3.4Å; D125-K129 WeakPolarHBondContact OD1-CE 3.16Å; D125-K129 IonicContact OD1-NZ 2.69Å; D125-K129 PolarHBondContact OD1-NZ 3.4Å; D125-L130 HydrophobicContact CB-CD2 4.05Å; D125-L130 HydrophobicContact CB-CG 4.12Å
126S88.6Confident82.7Confident19 Ų1993.6 Ų93.613%0.13348%0.475CS..BIsolated β-bridgetrans-82.9152.5174.370.50000111.6N117 A118 A128 K129 L130N117-S126 VanDerWaalsContact O-CB 3.27Å; N117-S126 WeakPolarHBondContact O-CB 3.34Å; A118-S126 WeakPolarHBondContact O-CA 3.47Å; A118-S126 WeakPolarHBondContact O-CB 3.44Å; S126-A128 PolarHBondContact O-N 2.78Å; S126-K129 WeakPolarHBondContact O-CB 3.35Å; S126-K129 PolarHBondContact O-N 3.48Å; S126-K129 WeakPolarHBondContact OG-CB 3.49Å; S126-K129 PolarHBondContact OG-N 3.45Å; S126-L130 PolarHBondContact O-N 3.36Å
127S81.3Confident82.3Confident58 Ų5892.4 Ų92.441%0.40648%0.476SS..Hα-helixtrans-56.3-36.4175.3-610000111.9R116 L130 F131R116-S127 PolarHBondContact O-N 3Å; S127-L130 PolarHBondContact O-N 3.37Å; S127-F131 VanDerWaalsContact O-CB 3.3Å; S127-F131 WeakPolarHBondContact O-CB 3.3Å; S127-F131 PolarHBondContact O-N 2.99Å
128A83.3Confident81.3Confident23 Ų2390.5 Ų90.519%0.1947%0.468CS..Hα-helixtrans-63.4-40.4174.300000112.6R116 S126 K132R116-A128 WeakPolarHBondContact O-CB 3.47Å; R116-A128 PolarHBondContact O-N 3.43Å; S126-A128 PolarHBondContact O-N 2.78Å; A128-K132 WeakPolarHBondContact O-CB 3.48Å; A128-K132 VanDerWaalsContact O-CG 3.32Å; A128-K132 WeakPolarHBondContact O-CG 3.4Å; A128-K132 PolarHBondContact O-N 3.33Å
129K85.5Confident80.3Confident119 Ų11993.5 Ų93.552%0.51747%0.473SS..Hα-helixtrans-66.5-45.3176.8-173.2178.4171.6-1650111.2D125 S126 F131 K132 S133D125-K129 HydrophobicContact CB-CD 4.32Å; D125-K129 VanDerWaalsContact OD1-CD 3.32Å; D125-K129 WeakPolarHBondContact OD1-CD 3.4Å; D125-K129 WeakPolarHBondContact OD1-CE 3.16Å; D125-K129 IonicContact OD1-NZ 2.69Å; D125-K129 PolarHBondContact OD1-NZ 3.4Å; S126-K129 WeakPolarHBondContact O-CB 3.35Å; S126-K129 PolarHBondContact O-N 3.48Å; S126-K129 WeakPolarHBondContact OG-CB 3.49Å; S126-K129 PolarHBondContact OG-N 3.45Å; K129-F131 VanDerWaalsContact C-N 3.34Å; K129-F131 PolarHBondContact O-N 2.89Å; K129-K132 PolarHBondContact O-N 2.85Å; K129-S133 PolarHBondContact O-N 2.7Å; K129-S133 PolarHBondContact O-OG 2.78Å
130L83.2Confident79.1Confident67 Ų6788.5 Ų88.535%0.35145%0.454SS..Hα-helixtrans-64.3-38.2176.9-66.1177.8000112.3D125 S126 S127 S133 C134D125-L130 HydrophobicContact CB-CD2 4.05Å; D125-L130 HydrophobicContact CB-CG 4.12Å; S126-L130 PolarHBondContact O-N 3.36Å; S127-L130 PolarHBondContact O-N 3.37Å; L130-S133 WeakPolarHBondContact CA-OG 3.25Å; L130-S133 PolarHBondContact O-N 3.33Å; L130-S133 PolarHBondContact O-OG 2.79Å; L130-C134 WeakPolarHBondContact O-CB 3.18Å; L130-C134 PolarHBondContact O-N 3.03Å
131F80.4Confident78.1Confident137 Ų13790.1 Ų90.160%0.60147%0.466SS*.Hα-helixtrans-65.3-45.4175.4-175.7-98.2000111S127 K129 S133 C134 M135S127-F131 VanDerWaalsContact O-CB 3.3Å; S127-F131 WeakPolarHBondContact O-CB 3.3Å; S127-F131 PolarHBondContact O-N 2.99Å; K129-F131 VanDerWaalsContact C-N 3.34Å; K129-F131 PolarHBondContact O-N 2.89Å; F131-S133 PolarHBondContact O-N 2.83Å; F131-C134 PolarHBondContact O-N 3.35Å; F131-M135 HydrophobicContact CD1-CG 4.03Å; F131-M135 HydrophobicContact CE1-CG 3.64Å; F131-M135 HydrophobicContact CE1-SD 4.39Å; F131-M135 HydrophobicContact CE2-CG 4.24Å; F131-M135 HydrophobicContact CE2-SD 4.41Å; F131-M135 HydrophobicContact CG-CG 4.48Å; F131-M135 HydrophobicContact CZ-CG 3.76Å; F131-M135 HydrophobicContact CZ-SD 3.97Å; F131-M135 WeakPolarHBondContact O-CB 3.32Å; F131-M135 VanDerWaalsContact O-CG 3.25Å; F131-M135 WeakPolarHBondContact O-CG 3.5Å; F131-M135 PolarHBondContact O-N 3.37Å
132K80.1Confident76.7Confident147 Ų14791 Ų9164%0.63946%0.462SS*.Hα-helixtrans-60.3-45.2174.8-73.8177.7-178.6-174.50111.6A128 K129 M135 L136A128-K132 WeakPolarHBondContact O-CB 3.48Å; A128-K132 VanDerWaalsContact O-CG 3.32Å; A128-K132 WeakPolarHBondContact O-CG 3.4Å; A128-K132 PolarHBondContact O-N 3.33Å; K129-K132 PolarHBondContact O-N 2.85Å; K132-M135 PolarHBondContact O-N 3.42Å; K132-L136 WeakPolarHBondContact O-CB 3.25Å; K132-L136 VanDerWaalsContact O-CG 3.22Å; K132-L136 WeakPolarHBondContact O-CG 3.22Å; K132-L136 PolarHBondContact O-N 3.44Å
133S76.8Confident75.4Confident58 Ų5887.5 Ų87.541%0.40645%0.453SS..Hα-helixtrans-66.5-38.8178.266.70000112.2K129 L130 F131 L136 Q137K129-S133 PolarHBondContact O-N 2.7Å; K129-S133 PolarHBondContact O-OG 2.78Å; L130-S133 WeakPolarHBondContact CA-OG 3.25Å; L130-S133 PolarHBondContact O-N 3.33Å; L130-S133 PolarHBondContact O-OG 2.79Å; F131-S133 PolarHBondContact O-N 2.83Å; S133-L136 PolarHBondContact O-N 3.15Å; S133-Q137 VanDerWaalsContact O-CB 3.25Å; S133-Q137 WeakPolarHBondContact O-CB 3.36Å; S133-Q137 PolarHBondContact O-N 3.13Å
134C76.8Confident73.8Confident65 Ų6590.6 Ų90.644%0.43947%0.466SS..Hα-helixtrans-66-43.7176.4-175.60000111.4L130 F131 Q137 T138L130-C134 WeakPolarHBondContact O-CB 3.18Å; L130-C134 PolarHBondContact O-N 3.03Å; F131-C134 PolarHBondContact O-N 3.35Å; C134-Q137 PolarHBondContact O-N 3.31Å; C134-T138 WeakPolarHBondContact O-CB 3.11Å; C134-T138 PolarHBondContact O-N 2.88Å; C134-T138 PolarHBondContact O-OG1 3Å
135M72.2Confident72.4Confident76 Ų7685.4 Ų85.437%0.37445%0.445SS..Hα-helixtrans-61.4-46.8174.2-74-62-67.900110.8F131 K132 T138 H139F131-M135 HydrophobicContact CD1-CG 4.03Å; F131-M135 HydrophobicContact CE1-CG 3.64Å; F131-M135 HydrophobicContact CE1-SD 4.39Å; F131-M135 HydrophobicContact CE2-CG 4.24Å; F131-M135 HydrophobicContact CE2-SD 4.41Å; F131-M135 HydrophobicContact CG-CG 4.48Å; F131-M135 HydrophobicContact CZ-CG 3.76Å; F131-M135 HydrophobicContact CZ-SD 3.97Å; F131-M135 WeakPolarHBondContact O-CB 3.32Å; F131-M135 VanDerWaalsContact O-CG 3.25Å; F131-M135 WeakPolarHBondContact O-CG 3.5Å; F131-M135 PolarHBondContact O-N 3.37Å; K132-M135 PolarHBondContact O-N 3.42Å; M135-T138 PolarHBondContact O-N 3.01Å; M135-H139 WeakPolarHBondContact CE-NE2 3.32Å; M135-H139 WeakPolarHBondContact O-CB 3.47Å; M135-H139 PolarHBondContact O-CD2 2.77Å; M135-H139 PolarHBondContact O-N 3.37Å
136L70.4Confident71.4Confident72 Ų7284.1 Ų84.138%0.37744%0.44SS..Hα-helixtrans-59-49.6174.5-71.8172.6000110.7K132 S133 T138 H139 L140 L174K132-L136 WeakPolarHBondContact O-CB 3.25Å; K132-L136 VanDerWaalsContact O-CG 3.22Å; K132-L136 WeakPolarHBondContact O-CG 3.22Å; K132-L136 PolarHBondContact O-N 3.44Å; S133-L136 PolarHBondContact O-N 3.15Å; L136-T138 PolarHBondContact O-N 3.04Å; L136-H139 PolarHBondContact O-N 3.12Å; L136-L140 HydrophobicContact CB-CD1 4.28Å; L136-L140 WeakPolarHBondContact O-CB 3.02Å; L136-L140 WeakPolarHBondContact O-CD1 3.32Å; L136-L140 WeakPolarHBondContact O-CG 3.13Å; L136-L140 PolarHBondContact O-N 3.08Å; L136-L174 HydrophobicContact CD2-CD2 3.69Å
137Q72.8Confident70.8Confident127 Ų12787.9 Ų87.959%0.59346%0.455SS*.Hα-helixtrans-59.9-44.5178.9-173.5177.61200111.7S133 C134 L140 V141S133-Q137 VanDerWaalsContact O-CB 3.25Å; S133-Q137 WeakPolarHBondContact O-CB 3.36Å; S133-Q137 PolarHBondContact O-N 3.13Å; C134-Q137 PolarHBondContact O-N 3.31Å; Q137-L140 PolarHBondContact O-N 3.13Å; Q137-V141 HydrophobicContact CG-CG2 4Å; Q137-V141 WeakPolarHBondContact O-CB 3.33Å; Q137-V141 WeakPolarHBondContact O-CG2 3.18Å; Q137-V141 PolarHBondContact O-N 2.66Å
138T66.6Low70.9Confident63 Ų6385.2 Ų85.239%0.38744%0.437SS..Hα-helixtrans-67.7-40.7-179.2-49.40000110.8C134 M135 L136 N142C134-T138 WeakPolarHBondContact O-CB 3.11Å; C134-T138 PolarHBondContact O-N 2.88Å; C134-T138 PolarHBondContact O-OG1 3Å; M135-T138 PolarHBondContact O-N 3.01Å; L136-T138 PolarHBondContact O-N 3.04Å; T138-N142 VanDerWaalsContact O-CB 3.26Å; T138-N142 WeakPolarHBondContact O-CB 3.23Å; T138-N142 PolarHBondContact O-N 2.62Å
139H62.8Low70.9Confident116 Ų11689.8 Ų89.854%0.53745%0.449SS..Hα-helixtrans-70.2-34175.5-74.5-58.3000112.9M135 L136 K143M135-H139 WeakPolarHBondContact CE-NE2 3.32Å; M135-H139 WeakPolarHBondContact O-CB 3.47Å; M135-H139 PolarHBondContact O-CD2 2.77Å; M135-H139 PolarHBondContact O-N 3.37Å; L136-H139 PolarHBondContact O-N 3.12Å; H139-K143 WeakPolarHBondContact O-CB 3.16Å; H139-K143 PolarHBondContact O-N 3.38Å
140L62.8Low71Confident65 Ų6584.4 Ų84.434%0.3443%0.425SS..Hα-helixtrans-74.5-40.3177.3-74.3167.8000112.7L136 Q137 K143 I161L136-L140 HydrophobicContact CB-CD1 4.28Å; L136-L140 WeakPolarHBondContact O-CB 3.02Å; L136-L140 WeakPolarHBondContact O-CD1 3.32Å; L136-L140 WeakPolarHBondContact O-CG 3.13Å; L136-L140 PolarHBondContact O-N 3.08Å; Q137-L140 PolarHBondContact O-N 3.13Å; L140-K143 VanDerWaalsContact O-O 3.05Å; L140-I161 HydrophobicContact CD1-CD1 4.37Å; L140-I161 HydrophobicContact CD2-CB 4.41Å; L140-I161 HydrophobicContact CD2-CD1 3.4Å; L140-I161 HydrophobicContact CD2-CG1 4.35Å; L140-I161 HydrophobicContact CD2-CG2 3.37Å
141V61.2Low71Confident103 Ų10385.8 Ų85.862%0.62443%0.427SS*.Hα-helixtrans-77.3-39-177.6172.20000110.9Q137Q137-V141 HydrophobicContact CG-CG2 4Å; Q137-V141 WeakPolarHBondContact O-CB 3.33Å; Q137-V141 WeakPolarHBondContact O-CG2 3.18Å; Q137-V141 PolarHBondContact O-N 2.66Å
142N58.2Low71.2Confident129 Ų12983.9 Ų83.969%0.6942%0.418SS*.Hα-helixtrans-88.6-11.6-177.3-67.7-13.9000113.9T138T138-N142 VanDerWaalsContact O-CB 3.26Å; T138-N142 WeakPolarHBondContact O-CB 3.23Å; T138-N142 PolarHBondContact O-N 2.62Å
143K57.8Low71.4Confident145 Ų14582.2 Ų82.263%0.6343%0.425SS*.THydrogen-bonded Turntrans-129.9103.5178.5-145.3171.4-172.8171.20106.1H139 L140 S145H139-K143 WeakPolarHBondContact O-CB 3.16Å; H139-K143 PolarHBondContact O-N 3.38Å; L140-K143 VanDerWaalsContact O-O 3.05Å; K143-S145 WeakPolarHBondContact O-CB 3.2Å; K143-S145 PolarHBondContact O-N 3.01Å
144I53.2Low71.9Confident127 Ų12783.2 Ų83.265%0.65143%0.426SS*.THydrogen-bonded Turntrans-42.484.1175.1-52.1163.8000108.3F199I144-F199 HydrophobicContact CG2-CE2 4.44Å; I144-F199 HydrophobicContact CG2-CZ 4.02Å; I144-F199 WeakPolarHBondContact O-CE1 3.26Å; I144-F199 WeakPolarHBondContact O-CZ 3.23Å
145S60.4Low72.2Confident30 Ų3089.4 Ų89.421%0.2144%0.441CS..  trans-104.989.2-177.6-157.10000103.7K143 E147 I161 I162K143-S145 WeakPolarHBondContact O-CB 3.2Å; K143-S145 PolarHBondContact O-N 3.01Å; S145-E147 PolarHBondContact O-N 2.85Å; S145-I161 WeakPolarHBondContact OG-CG2 3.03Å; S145-I162 PolarHBondContact OG-N 3.18Å; S145-I162 PolarHBondContact OG-O 3.23Å
146S65.9Low73Confident20 Ų2091.1 Ų91.114%0.1445%0.448CS..PPolyproline II helixtrans-54135.2171.251.50000106.4L148 F199S146-L148 WeakPolarHBondContact O-CG 3.46Å; S146-L148 PolarHBondContact O-N 2.81Å; S146-L148 VanDerWaalsContact O-N 3.1Å; S146-F199 VanDerWaalsContact CB-CE2 3.46Å; S146-F199 VanDerWaalsContact OG-CE2 3.26Å; S146-F199 WeakPolarHBondContact OG-CE2 3.15Å; S146-F199 WeakPolarHBondContact OG-CZ 3.31Å
147E75.5Confident73.8Confident99 Ų9991.2 Ų91.246%0.46345%0.454SS..PPolyproline II helixtrans-53.4118.5161.5-174.8-173.1146.300108.4S145 T159 N192S145-E147 PolarHBondContact O-N 2.85Å; E147-T159 VanDerWaalsContact CD-CG2 3.44Å; E147-T159 HydrophobicContact CG-CG2 3.2Å; E147-T159 WeakPolarHBondContact OE1-CG2 3.07Å; E147-N192 PolarHBondContact O-ND2 3.24Å
148L82.4Confident74.6Confident2 Ų286.6 Ų86.61%0.0143%0.431CS..EExtended strand (participates in β ladder)trans-103.7143.3-179.6-64.4162.3000109.5S146 T159 G160 I162 V191S146-L148 WeakPolarHBondContact O-CG 3.46Å; S146-L148 PolarHBondContact O-N 2.81Å; S146-L148 VanDerWaalsContact O-N 3.1Å; L148-T159 WeakPolarHBondContact O-CA 3.03Å; L148-G160 PolarHBondContact N-O 3.24Å; L148-G160 PolarHBondContact O-N 2.63Å; L148-I162 HydrophobicContact CD1-CB 4.27Å; L148-I162 HydrophobicContact CD1-CD1 3.26Å; L148-I162 HydrophobicContact CD1-CG1 3.29Å; L148-V191 HydrophobicContact CD2-CB 3.86Å; L148-V191 HydrophobicContact CD2-CG1 3.85Å; L148-V191 HydrophobicContact CD2-CG2 3.58Å
149R85Confident75.7Confident119 Ų11985.2 Ų85.245%0.44942%0.423SS..EExtended strand (participates in β ladder)trans-103.7126.7168-68.6-178.7-178-1722.5108.9F158 K190 N192R149-F158 WeakPolarHBondContact CA-O 3.19Å; R149-K190 PolarHBondContact N-O 2.9Å; R149-K190 VanDerWaalsContact N-O 3.11Å; R149-K190 PolarHBondContact O-N 2.92Å; R149-K190 VanDerWaalsContact O-O 3.05Å; R149-N192 WeakPolarHBondContact CD-OD1 3.45Å
150Y85.7Confident77Confident5 Ų579.7 Ų79.72%0.0240%0.398CS..EExtended strand (participates in β ladder)trans-129.9154.1175.372.6-82.8000109.7F158 I173 D175 L189Y150-F158 HydrophobicContact CD1-CB 4.01Å; Y150-F158 HydrophobicContact CD2-CB 4.44Å; Y150-F158 HydrophobicContact CE1-CB 3.48Å; Y150-F158 VanDerWaalsContact CE1-CB 3.48Å; Y150-F158 HydrophobicContact CE2-CB 3.99Å; Y150-F158 HydrophobicContact CG-CB 4.45Å; Y150-F158 VanDerWaalsContact CZ-CB 3.48Å; Y150-F158 PolarHBondContact N-O 3.39Å; Y150-F158 PolarHBondContact O-N 3.23Å; Y150-I173 HydrophobicContact CD1-CG2 4.29Å; Y150-I173 HydrophobicContact CE1-CG2 4Å; Y150-D175 PolarHBondContact OH-OD2 3.09Å; Y150-L189 HydrophobicContact CG-CD2 4.44Å
151Y83.9Confident78.3Confident97 Ų9777.7 Ų77.738%0.3839%0.387SS..EExtended strand (participates in β ladder)trans-105.6129.2-179.1-65.8-95.2000108.6Y155 P157 K190Y151-Y155 WeakPolarHBondContact CD1-O 3.33Å; Y151-P157 HydrophobicContact CD1-CB 4.33Å; Y151-P157 HydrophobicContact CE1-CB 3.91Å; Y151-K190 HydrophobicContact CE2-CD 3.91Å; Y151-K190 HydrophobicContact CE2-CG 4.36Å
152K85.1Confident79.6Confident96 Ų9674.5 Ų74.542%0.41737%0.366SS..  trans-78.4172.3168-177177.3-177.6-175.60109D154 Y155 Q156 F158K152-D154 VanDerWaalsContact CB-OD1 3.23Å; K152-D154 WeakPolarHBondContact CB-OD1 3.33Å; K152-D154 PolarHBondContact O-N 2.88Å; K152-Y155 PolarHBondContact O-N 3.02Å; K152-Q156 PolarHBondContact N-O 3.35Å; K152-F158 HydrophobicContact CB-CD2 3.84Å; K152-F158 HydrophobicContact CB-CE2 3.68Å; K152-F158 HydrophobicContact CD-CE2 3.77Å; K152-F158 HydrophobicContact CD-CZ 4.17Å; K152-F158 HydrophobicContact CG-CE2 4.4Å
153S84.4Confident81.1Confident113 Ų11371.9 Ų71.979%0.7935%0.351SS*.THydrogen-bonded Turntrans-56.3-20.9-179.252.60000114.4Y155S153-Y155 VanDerWaalsContact C-N 3.31Å
154D87.1Confident82.5Confident78 Ų7869.9 Ų69.942%0.41734%0.344SS..THydrogen-bonded Turntrans-87.97.2176.651.712.2000113.3K152 Q156K152-D154 VanDerWaalsContact CB-OD1 3.23Å; K152-D154 WeakPolarHBondContact CB-OD1 3.33Å; K152-D154 PolarHBondContact O-N 2.88Å; D154-Q156 PolarHBondContact O-N 2.81Å; D154-Q156 VanDerWaalsContact O-N 3.1Å; D154-Q156 WeakPolarHBondContact OD1-CB 3.12Å; D154-Q156 PolarHBondContact OD1-N 3.1Å
155Y82.6Confident84.2Confident196 Ų19669.1 Ų69.177%0.76933%0.333SS*.  trans6012.6-175.5-56.7-89000114.3Y151 K152 S153Y151-Y155 WeakPolarHBondContact CD1-O 3.33Å; K152-Y155 PolarHBondContact O-N 3.02Å; S153-Y155 VanDerWaalsContact C-N 3.31Å
156Q88.3Confident85.4Confident111 Ų11171.2 Ų71.252%0.51934%0.344SS..  trans-75126.5172.5-172.5167.87.500108.5K152 D154 F158K152-Q156 PolarHBondContact N-O 3.35Å; D154-Q156 PolarHBondContact O-N 2.81Å; D154-Q156 VanDerWaalsContact O-N 3.1Å; D154-Q156 WeakPolarHBondContact OD1-CB 3.12Å; D154-Q156 PolarHBondContact OD1-N 3.1Å; Q156-F158 HydrophobicContact CB-CD2 4.5Å; Q156-F158 HydrophobicContact CB-CE2 3.86Å; Q156-F158 HydrophobicContact CG-CE2 3.96Å; Q156-F158 HydrophobicContact CG-CZ 4.31Å; Q156-F158 VanDerWaalsContact O-CD2 3.28Å; Q156-F158 WeakPolarHBondContact O-CD2 3.4Å; Q156-F158 PolarHBondContact O-N 3.19Å
157P87.1Confident86Confident75 Ų7572.8 Ų72.849%0.48736%0.364SS..EExtended strand (participates in β ladder)trans-71.9129.6174.629-32.3000109.1Y151Y151-P157 HydrophobicContact CD1-CB 4.33Å; Y151-P157 HydrophobicContact CE1-CB 3.91Å
158F89.7Confident86.6Confident29 Ų2971.1 Ų71.113%0.12737%0.373CS..EExtended strand (participates in β ladder)trans-113.1149.1171.8-75.9-91.8000109.8R149 Y150 K152 Q156 D175R149-F158 WeakPolarHBondContact CA-O 3.19Å; Y150-F158 HydrophobicContact CD1-CB 4.01Å; Y150-F158 HydrophobicContact CD2-CB 4.44Å; Y150-F158 HydrophobicContact CE1-CB 3.48Å; Y150-F158 VanDerWaalsContact CE1-CB 3.48Å; Y150-F158 HydrophobicContact CE2-CB 3.99Å; Y150-F158 HydrophobicContact CG-CB 4.45Å; Y150-F158 VanDerWaalsContact CZ-CB 3.48Å; Y150-F158 PolarHBondContact N-O 3.39Å; Y150-F158 PolarHBondContact O-N 3.23Å; K152-F158 HydrophobicContact CB-CD2 3.84Å; K152-F158 HydrophobicContact CB-CE2 3.68Å; K152-F158 HydrophobicContact CD-CE2 3.77Å; K152-F158 HydrophobicContact CD-CZ 4.17Å; K152-F158 HydrophobicContact CG-CE2 4.4Å; Q156-F158 HydrophobicContact CB-CD2 4.5Å; Q156-F158 HydrophobicContact CB-CE2 3.86Å; Q156-F158 HydrophobicContact CG-CE2 3.96Å; Q156-F158 HydrophobicContact CG-CZ 4.31Å; Q156-F158 VanDerWaalsContact O-CD2 3.28Å; Q156-F158 WeakPolarHBondContact O-CD2 3.4Å; Q156-F158 PolarHBondContact O-N 3.19Å; F158-D175 VanDerWaalsContact CD1-OD2 3.23Å; F158-D175 WeakPolarHBondContact CD1-OD2 3.44Å
159T90.3Very high86.9Confident35 Ų3574.6 Ų74.622%0.21539%0.388CS..EExtended strand (participates in β ladder)trans-103.1126.4175.3-62.30000109E147 L148 L176E147-T159 VanDerWaalsContact CD-CG2 3.44Å; E147-T159 HydrophobicContact CG-CG2 3.2Å; E147-T159 WeakPolarHBondContact OE1-CG2 3.07Å; L148-T159 WeakPolarHBondContact O-CA 3.03Å; T159-L176 HydrophobicContact CG2-CD1 3.81Å; T159-L176 PolarHBondContact O-N 3.47Å; T159-L176 VanDerWaalsContact O-N 3.13Å
160G90.9Very high87.3Confident0 Ų072.5 Ų72.50%038%0.384CS..EExtended strand (participates in β ladder)trans-146.9171.4-178.400000113.5L148 L174L148-G160 PolarHBondContact N-O 3.24Å; L148-G160 PolarHBondContact O-N 2.63Å; G160-L174 CarbonylContact C-O 3.57Å; G160-L174 WeakPolarHBondContact CA-O 3.17Å
161I89.7Confident87.6Confident22 Ų2272.3 Ų72.311%0.11338%0.384CS..EExtended strand (participates in β ladder)trans-126.7130.8-176.3-63.2-169000108.3L140 S145 I163 I173 L174 L176L140-I161 HydrophobicContact CD1-CD1 4.37Å; L140-I161 HydrophobicContact CD2-CB 4.41Å; L140-I161 HydrophobicContact CD2-CD1 3.4Å; L140-I161 HydrophobicContact CD2-CG1 4.35Å; L140-I161 HydrophobicContact CD2-CG2 3.37Å; S145-I161 WeakPolarHBondContact OG-CG2 3.03Å; I161-I163 PolarHBondContact O-N 3.35Å; I161-I173 CarbonylContact O-C 3.53Å; I161-I173 VanDerWaalsContact O-CA 3.32Å; I161-I173 WeakPolarHBondContact O-CA 3.28Å; I161-L174 PolarHBondContact N-O 2.82Å; I161-L174 PolarHBondContact O-N 2.8Å; I161-L176 HydrophobicContact CD1-CD1 4.1Å; I161-L176 HydrophobicContact CD1-CD2 3.65Å; I161-L176 HydrophobicContact CD1-CG 4.29Å; I161-L176 HydrophobicContact CG1-CD1 4.16Å; I161-L176 HydrophobicContact CG1-CD2 3.89Å; I161-L176 HydrophobicContact CG1-CG 4.17Å
162I88.9Confident88Confident37 Ų3771.6 Ų71.619%0.1938%0.383CS..EExtended strand (participates in β ladder)trans-69.6120.1172.9-73163.5000108.6S145 L148 V171 I173 L189S145-I162 PolarHBondContact OG-N 3.18Å; S145-I162 PolarHBondContact OG-O 3.23Å; L148-I162 HydrophobicContact CD1-CB 4.27Å; L148-I162 HydrophobicContact CD1-CD1 3.26Å; L148-I162 HydrophobicContact CD1-CG1 3.29Å; I162-V171 HydrophobicContact CD1-CB 4.41Å; I162-V171 HydrophobicContact CD1-CG1 4.29Å; I162-V171 HydrophobicContact CD1-CG2 4.3Å; I162-V171 HydrophobicContact CG1-CB 4.21Å; I162-V171 HydrophobicContact CG1-CG2 4.09Å; I162-V171 HydrophobicContact CG2-CB 4.37Å; I162-I173 HydrophobicContact CG1-CG1 4.21Å; I162-L189 HydrophobicContact CD1-CD1 4.38Å
163I89.6Confident88.3Confident74 Ų7467 Ų6738%0.37936%0.363SS..EExtended strand (participates in β ladder)trans-98.1-26.5173.856.5168.4000112I161 K172 L174 A181I161-I163 PolarHBondContact O-N 3.35Å; I163-K172 HydrophobicContact CD1-CB 4.44Å; I163-K172 HydrophobicContact CD1-CD 3.92Å; I163-K172 HydrophobicContact CD1-CG 3.94Å; I163-K172 HydrophobicContact CG1-CB 4.02Å; I163-K172 HydrophobicContact CG1-CD 4.37Å; I163-K172 HydrophobicContact CG1-CG 4.05Å; I163-K172 WeakPolarHBondContact CG1-O 3.41Å; I163-K172 PolarHBondContact N-O 2.88Å; I163-L174 HydrophobicContact CD1-CB 4.46Å; I163-L174 HydrophobicContact CG2-CB 3.61Å; I163-L174 HydrophobicContact CG2-CD2 4.34Å; I163-A181 HydrophobicContact CD1-CB 4.14Å
164H87.5Confident88.7Confident102 Ų10263 Ų6347%0.47233%0.332SS..EExtended strand (participates in β ladder)trans-157.6147.6-176.8-171.372.7000111.6T166 V171 K172H164-T166 PolarHBondContact CD2-OG1 3.2Å; H164-V171 CarbonylContact O-C 3.54Å; H164-V171 WeakPolarHBondContact O-CA 3.44Å; H164-K172 HydrophobicContact CB-CB 4.02Å; H164-K172 PolarHBondContact N-O 3.11Å; H164-K172 PolarHBondContact O-N 2.81Å
165R87.3Confident88.8Confident112 Ų11259.3 Ų59.342%0.42331%0.312SS..EExtended strand (participates in β ladder)trans-104.7118167.9-64.5-173.7123.8179.74.9108.2M170 V171R165-M170 CarbonylContact C-O 3.58Å; R165-V171 HydrophobicContact CB-CG1 4.41Å; R165-V171 HydrophobicContact CG-CG1 3.89Å
166T85.5Confident89.1Confident73 Ų7353.4 Ų53.445%0.44829%0.294SS..  trans-10468.2-175.6-39.20000110.1H164 M170H164-T166 PolarHBondContact CD2-OG1 3.2Å; T166-M170 PolarHBondContact N-O 2.98Å; T166-M170 VanDerWaalsContact O-CB 3.31Å; T166-M170 WeakPolarHBondContact O-CB 3.15Å
167G79.8Confident89.1Confident54 Ų5453.8 Ų53.856%0.55730%0.299SS*.SBendtrans83.6161.3-176.100000113.7K169 M170G167-K169 VanDerWaalsContact C-N 3.33Å; G167-K169 PolarHBondContact O-N 3.29Å; G167-M170 PolarHBondContact O-N 3.49Å
168G87.5Confident89.3Confident64 Ų6454.6 Ų54.666%0.6630%0.3SS*.THydrogen-bonded Turntrans-36.2-50.1-155.400000117.5
169K90Very high89.2Confident75 Ų7559.8 Ų59.833%0.32632%0.324SS..THydrogen-bonded Turntrans-118.313.6-176.8-57.1-172.1-179.8-174.20114.5G167 H185 V186G167-K169 VanDerWaalsContact C-N 3.33Å; G167-K169 PolarHBondContact O-N 3.29Å; K169-H185 WeakPolarHBondContact CB-NE2 3.42Å; K169-H185 CarbonylContact O-C 3.49Å; K169-H185 VanDerWaalsContact O-CA 3.31Å; K169-H185 WeakPolarHBondContact O-CA 3.35Å; K169-H185 PolarHBondContact O-CD2 2.86Å; K169-V186 WeakPolarHBondContact O-CG2 3.38Å; K169-V186 PolarHBondContact O-N 2.75Å
170M93.1Very high89.2Confident74 Ų7459.5 Ų59.537%0.36532%0.324SS..EExtended strand (participates in β ladder)trans-112.6135.8179.7-70.6-64.9-69.200110.3R165 T166 G167 R184 H185R165-M170 CarbonylContact C-O 3.58Å; T166-M170 PolarHBondContact N-O 2.98Å; T166-M170 VanDerWaalsContact O-CB 3.31Å; T166-M170 WeakPolarHBondContact O-CB 3.15Å; G167-M170 PolarHBondContact O-N 3.49Å; M170-R184 WeakPolarHBondContact CA-O 3.3Å; M170-H185 HydrophobicContact SD-CB 4.11Å
171V90.9Very high89.2Confident1 Ų161.7 Ų61.71%0.00634%0.342CS..EExtended strand (participates in β ladder)trans-131.9149176-55.60000110.7I162 H164 R165 I173 S183 R184 V186 L189I162-V171 HydrophobicContact CD1-CB 4.41Å; I162-V171 HydrophobicContact CD1-CG1 4.29Å; I162-V171 HydrophobicContact CD1-CG2 4.3Å; I162-V171 HydrophobicContact CG1-CB 4.21Å; I162-V171 HydrophobicContact CG1-CG2 4.09Å; I162-V171 HydrophobicContact CG2-CB 4.37Å; H164-V171 CarbonylContact O-C 3.54Å; H164-V171 WeakPolarHBondContact O-CA 3.44Å; R165-V171 HydrophobicContact CB-CG1 4.41Å; R165-V171 HydrophobicContact CG-CG1 3.89Å; V171-I173 HydrophobicContact CG2-CD1 3.95Å; V171-I173 HydrophobicContact CG2-CG1 3.82Å; V171-S183 CarbonylContact O-C 3.54Å; V171-S183 VanDerWaalsContact O-CA 3.3Å; V171-S183 WeakPolarHBondContact O-CA 3.5Å; V171-R184 PolarHBondContact N-O 3.05Å; V171-R184 PolarHBondContact O-N 2.93Å; V171-V186 HydrophobicContact CG1-CG2 3.86Å; V171-L189 HydrophobicContact CG2-CD1 3.41Å; V171-L189 VanDerWaalsContact CG2-CD1 3.41Å
172K92.7Very high89.2Confident83 Ų8363.3 Ų63.336%0.36135%0.349SS..EExtended strand (participates in β ladder)trans-98.4121.3170.4-160.8177.2-179.5175.10108I163 H164 A181 H182I163-K172 HydrophobicContact CD1-CB 4.44Å; I163-K172 HydrophobicContact CD1-CD 3.92Å; I163-K172 HydrophobicContact CD1-CG 3.94Å; I163-K172 HydrophobicContact CG1-CB 4.02Å; I163-K172 HydrophobicContact CG1-CD 4.37Å; I163-K172 HydrophobicContact CG1-CG 4.05Å; I163-K172 WeakPolarHBondContact CG1-O 3.41Å; I163-K172 PolarHBondContact N-O 2.88Å; H164-K172 HydrophobicContact CB-CB 4.02Å; H164-K172 PolarHBondContact N-O 3.11Å; H164-K172 PolarHBondContact O-N 2.81Å; K172-A181 HydrophobicContact CG-CB 4.38Å; K172-H182 CarbonylContact C-O 3.38Å; K172-H182 WeakPolarHBondContact CA-O 3.47Å
173I91.2Very high89.3Confident0 Ų064.6 Ų64.60%036%0.361CS..EExtended strand (participates in β ladder)trans-110.9132.9-176.6-59.1172000107.4Y150 I161 I162 V171 A181 H182 R184 L189Y150-I173 HydrophobicContact CD1-CG2 4.29Å; Y150-I173 HydrophobicContact CE1-CG2 4Å; I161-I173 CarbonylContact O-C 3.53Å; I161-I173 VanDerWaalsContact O-CA 3.32Å; I161-I173 WeakPolarHBondContact O-CA 3.28Å; I162-I173 HydrophobicContact CG1-CG1 4.21Å; V171-I173 HydrophobicContact CG2-CD1 3.95Å; V171-I173 HydrophobicContact CG2-CG1 3.82Å; I173-A181 CarbonylContact O-C 3.54Å; I173-A181 VanDerWaalsContact O-CA 3.28Å; I173-A181 WeakPolarHBondContact O-CA 3.23Å; I173-H182 PolarHBondContact N-O 3.1Å; I173-H182 PolarHBondContact O-N 3.27Å; I173-R184 HydrophobicContact CD1-CB 4Å; I173-R184 HydrophobicContact CD1-CG 4.15Å; I173-L189 HydrophobicContact CD1-CD1 3.86Å; I173-L189 HydrophobicContact CD1-CD2 3.22Å; I173-L189 HydrophobicContact CD1-CG 4.18Å
174L92Very high89.4Confident27 Ų2764 Ų6414%0.14135%0.354CS..EExtended strand (participates in β ladder)trans-91119.4166.3-177.469.6000107.7L136 G160 I161 I163 H179 S180L136-L174 HydrophobicContact CD2-CD2 3.69Å; G160-L174 CarbonylContact C-O 3.57Å; G160-L174 WeakPolarHBondContact CA-O 3.17Å; I161-L174 PolarHBondContact N-O 2.82Å; I161-L174 PolarHBondContact O-N 2.8Å; I163-L174 HydrophobicContact CD1-CB 4.46Å; I163-L174 HydrophobicContact CG2-CB 3.61Å; I163-L174 HydrophobicContact CG2-CD2 4.34Å; L174-H179 WeakPolarHBondContact CD1-O 3.28Å; L174-S180 WeakPolarHBondContact CA-O 3.26Å
175D90.5Very high89.6Confident1 Ų161.8 Ų61.81%0.00534%0.344CS..EExtended strand (participates in β ladder)trans-72135.8172.1-166.8-59.9000109.7Y150 F158 D177 D178 H179 S180Y150-D175 PolarHBondContact OH-OD2 3.09Å; F158-D175 VanDerWaalsContact CD1-OD2 3.23Å; F158-D175 WeakPolarHBondContact CD1-OD2 3.44Å; D175-D177 WeakPolarHBondContact OD1-CB 3.32Å; D175-D177 PolarHBondContact OD1-N 2.86Å; D175-D178 WeakPolarHBondContact CB-OD1 3.33Å; D175-D178 PolarHBondContact OD1-N 3.31Å; D175-H179 WeakPolarHBondContact O-CA 3.36Å; D175-H179 PolarHBondContact O-N 3.2Å; D175-H179 VanDerWaalsContact O-N 3.15Å; D175-S180 PolarHBondContact N-O 3.25Å
176L88.9Confident89.7Confident72 Ų7257.4 Ų57.438%0.37733%0.329SS..THydrogen-bonded Turntrans-81.7-23-177.4-68-174.5000113.7T159 I161T159-L176 HydrophobicContact CG2-CD1 3.81Å; T159-L176 PolarHBondContact O-N 3.47Å; T159-L176 VanDerWaalsContact O-N 3.13Å; I161-L176 HydrophobicContact CD1-CD1 4.1Å; I161-L176 HydrophobicContact CD1-CD2 3.65Å; I161-L176 HydrophobicContact CD1-CG 4.29Å; I161-L176 HydrophobicContact CG1-CD1 4.16Å; I161-L176 HydrophobicContact CG1-CD2 3.89Å; I161-L176 HydrophobicContact CG1-CG 4.17Å
177D88.4Confident89.8Confident119 Ų11959.3 Ų59.364%0.63634%0.337SS*.THydrogen-bonded Turntrans-81.7-53.9-177.3-66.8-36.9000110.2D175 H179D175-D177 WeakPolarHBondContact OD1-CB 3.32Å; D175-D177 PolarHBondContact OD1-N 2.86Å; D177-H179 PolarHBondContact O-ND1 3.39Å
178D90Very high90.3Very high93 Ų9361.7 Ų61.750%0.49733%0.333SS..THydrogen-bonded Turntrans-100-3.6-175.175.14.2000114.1D175 S180D175-D178 WeakPolarHBondContact CB-OD1 3.33Å; D175-D178 PolarHBondContact OD1-N 3.31Å; D178-S180 PolarHBondContact O-N 2.9Å; D178-S180 VanDerWaalsContact O-N 3.13Å; D178-S180 WeakPolarHBondContact OD1-CA 3.21Å; D178-S180 WeakPolarHBondContact OD1-CB 2.92Å; D178-S180 PolarHBondContact OD1-N 2.74Å; D178-S180 PolarHBondContact OD1-OG 2.88Å; D178-S180 PolarHBondContact OD2-OG 3.18Å; D178-S180 VanDerWaalsContact OD2-OG 3.08Å
179H87.8Confident90.3Very high137 Ų13759.7 Ų59.763%0.63431%0.307SS*.  trans58.319.3-177.6-53.569.8000113.5L174 D175 D177L174-H179 WeakPolarHBondContact CD1-O 3.28Å; D175-H179 WeakPolarHBondContact O-CA 3.36Å; D175-H179 PolarHBondContact O-N 3.2Å; D175-H179 VanDerWaalsContact O-N 3.15Å; D177-H179 PolarHBondContact O-ND1 3.39Å
180S90.5Very high90Very high30 Ų3062.3 Ų62.321%0.2132%0.319CS..  trans-83.4151.6177.577.50000110.5L174 D175 D178 H182L174-S180 WeakPolarHBondContact CA-O 3.26Å; D175-S180 PolarHBondContact N-O 3.25Å; D178-S180 PolarHBondContact O-N 2.9Å; D178-S180 VanDerWaalsContact O-N 3.13Å; D178-S180 WeakPolarHBondContact OD1-CA 3.21Å; D178-S180 WeakPolarHBondContact OD1-CB 2.92Å; D178-S180 PolarHBondContact OD1-N 2.74Å; D178-S180 PolarHBondContact OD1-OG 2.88Å; D178-S180 PolarHBondContact OD2-OG 3.18Å; D178-S180 VanDerWaalsContact OD2-OG 3.08Å; S180-H182 PolarHBondContact OG-CE1 3.16Å; S180-H182 PolarHBondContact OG-NE2 3.22Å
181A90.7Very high89.2Confident46 Ų4661.4 Ų61.438%0.3832%0.318SS..EExtended strand (participates in β ladder)trans-108.5129.1177.900000110.5I163 K172 I173I163-A181 HydrophobicContact CD1-CB 4.14Å; K172-A181 HydrophobicContact CG-CB 4.38Å; I173-A181 CarbonylContact O-C 3.54Å; I173-A181 VanDerWaalsContact O-CA 3.28Å; I173-A181 WeakPolarHBondContact O-CA 3.23Å
182H90.3Very high88.1Confident55 Ų5563.9 Ų63.926%0.25533%0.331SS..EExtended strand (participates in β ladder)trans-130.3138.1-175.4-64.9-33.9000111.5K172 I173 S180K172-H182 CarbonylContact C-O 3.38Å; K172-H182 WeakPolarHBondContact CA-O 3.47Å; I173-H182 PolarHBondContact N-O 3.1Å; I173-H182 PolarHBondContact O-N 3.27Å; S180-H182 PolarHBondContact OG-CE1 3.16Å; S180-H182 PolarHBondContact OG-NE2 3.22Å
183S91.5Very high86.5Confident64 Ų6469.3 Ų69.345%0.44836%0.358SS..EExtended strand (participates in β ladder)trans-86.5129.8170.2-60.30000109.8V171V171-S183 CarbonylContact O-C 3.54Å; V171-S183 VanDerWaalsContact O-CA 3.3Å; V171-S183 WeakPolarHBondContact O-CA 3.5Å
184R91.7Very high84.9Confident61 Ų6173.3 Ų73.323%0.2340%0.399CS..EExtended strand (participates in β ladder)trans-136.8153.7179-65.9-65.6-179.4-93.5-3.6110.6M170 V171 I173 L189M170-R184 WeakPolarHBondContact CA-O 3.3Å; V171-R184 PolarHBondContact N-O 3.05Å; V171-R184 PolarHBondContact O-N 2.93Å; I173-R184 HydrophobicContact CD1-CB 4Å; I173-R184 HydrophobicContact CD1-CG 4.15Å; R184-L189 HydrophobicContact CB-CD2 4.19Å
185H91.6Very high83.1Confident56 Ų5673.7 Ų73.726%0.25941%0.409SS..EExtended strand (participates in β ladder)trans-76.8143.1171.6-163.9-94.1000109.4K169 M170 D187 Q188K169-H185 WeakPolarHBondContact CB-NE2 3.42Å; K169-H185 CarbonylContact O-C 3.49Å; K169-H185 VanDerWaalsContact O-CA 3.31Å; K169-H185 WeakPolarHBondContact O-CA 3.35Å; K169-H185 PolarHBondContact O-CD2 2.86Å; M170-H185 HydrophobicContact SD-CB 4.11Å; H185-D187 IonicContact CE1-OD1 3.57Å; H185-D187 PolarHBondContact CE1-OD1 3.32Å; H185-D187 IonicContact CE1-OD2 3.03Å; H185-D187 PolarHBondContact CE1-OD2 2.64Å; H185-D187 WeakPolarHBondContact ND1-CB 3.39Å; H185-D187 PolarHBondContact ND1-N 2.8Å; H185-D187 IonicContact ND1-OD1 3.3Å; H185-D187 IonicContact ND1-OD2 3.49Å; H185-D187 PolarHBondContact ND1-OD2 2.82Å; H185-D187 PolarHBondContact O-N 2.94Å; H185-Q188 HydrophobicContact CB-CG 4.32Å; H185-Q188 WeakPolarHBondContact O-CB 3.39Å; H185-Q188 PolarHBondContact O-N 2.91Å
186V88.7Confident81.3Confident20 Ų2080.2 Ų80.212%0.12144%0.444CS..G310 helixtrans-54-40.2178.8165.30000111.2K169 V171 Q188 L189 F201K169-V186 WeakPolarHBondContact O-CG2 3.38Å; K169-V186 PolarHBondContact O-N 2.75Å; V171-V186 HydrophobicContact CG1-CG2 3.86Å; V186-Q188 PolarHBondContact O-N 2.98Å; V186-Q188 VanDerWaalsContact O-N 3.07Å; V186-L189 WeakPolarHBondContact O-CB 3.31Å; V186-L189 WeakPolarHBondContact O-CG 3.43Å; V186-L189 PolarHBondContact O-N 3.45Å; V186-F201 HydrophobicContact CB-CE1 4.38Å; V186-F201 HydrophobicContact CG1-CD1 4.33Å; V186-F201 HydrophobicContact CG1-CE1 3.34Å; V186-F201 HydrophobicContact CG1-CZ 3.78Å; V186-F201 HydrophobicContact CG2-CE1 4.09Å
187D88.7Confident79.6Confident113 Ų11382.2 Ų82.260%0.60446%0.464SS*.G310 helixtrans-63.6-14.8-179.7-55.1-3.7000113.8H185 L189H185-D187 IonicContact CE1-OD1 3.57Å; H185-D187 PolarHBondContact CE1-OD1 3.32Å; H185-D187 IonicContact CE1-OD2 3.03Å; H185-D187 PolarHBondContact CE1-OD2 2.64Å; H185-D187 WeakPolarHBondContact ND1-CB 3.39Å; H185-D187 PolarHBondContact ND1-N 2.8Å; H185-D187 IonicContact ND1-OD1 3.3Å; H185-D187 IonicContact ND1-OD2 3.49Å; H185-D187 PolarHBondContact ND1-OD2 2.82Å; H185-D187 PolarHBondContact O-N 2.94Å; D187-L189 VanDerWaalsContact C-N 3.33Å
188Q89.3Confident77.8Confident104 Ų10483.3 Ų83.349%0.48647%0.47SS..G310 helixtrans-87.3-5.2175.3-63.3178-26.100112.8H185 V186H185-Q188 HydrophobicContact CB-CG 4.32Å; H185-Q188 WeakPolarHBondContact O-CB 3.39Å; H185-Q188 PolarHBondContact O-N 2.91Å; V186-Q188 PolarHBondContact O-N 2.98Å; V186-Q188 VanDerWaalsContact O-N 3.07Å
189L87.6Confident76.1Confident22 Ų2281.2 Ų81.212%0.11546%0.456CS..EExtended strand (participates in β ladder)trans-100.6134-174.4-48-179000109.9Y150 I162 V171 I173 R184 V186 D187Y150-L189 HydrophobicContact CG-CD2 4.44Å; I162-L189 HydrophobicContact CD1-CD1 4.38Å; V171-L189 HydrophobicContact CG2-CD1 3.41Å; V171-L189 VanDerWaalsContact CG2-CD1 3.41Å; I173-L189 HydrophobicContact CD1-CD1 3.86Å; I173-L189 HydrophobicContact CD1-CD2 3.22Å; I173-L189 HydrophobicContact CD1-CG 4.18Å; R184-L189 HydrophobicContact CB-CD2 4.19Å; V186-L189 WeakPolarHBondContact O-CB 3.31Å; V186-L189 WeakPolarHBondContact O-CG 3.43Å; V186-L189 PolarHBondContact O-N 3.45Å; D187-L189 VanDerWaalsContact C-N 3.33Å
190K83.8Confident74.1Confident130 Ų13077.5 Ų77.557%0.56546%0.455SS*.EExtended strand (participates in β ladder)trans-105106.6164.9-63.7-165.4-173.6176.10107.4R149 Y151 N192R149-K190 PolarHBondContact N-O 2.9Å; R149-K190 VanDerWaalsContact N-O 3.11Å; R149-K190 PolarHBondContact O-N 2.92Å; R149-K190 VanDerWaalsContact O-O 3.05Å; Y151-K190 HydrophobicContact CE2-CD 3.91Å; Y151-K190 HydrophobicContact CE2-CG 4.36Å; K190-N192 PolarHBondContact O-N 3.07Å
191V76.4Confident72.3Confident56 Ų5678.3 Ų78.334%0.33946%0.455SS..EExtended strand (participates in β ladder)trans-67.7125.3168.5-169.40000106.7L148 E193 F199 F201L148-V191 HydrophobicContact CD2-CB 3.86Å; L148-V191 HydrophobicContact CD2-CG1 3.85Å; L148-V191 HydrophobicContact CD2-CG2 3.58Å; V191-E193 PolarHBondContact O-N 3.49Å; V191-E193 VanDerWaalsContact O-N 3.09Å; V191-F199 HydrophobicContact CG1-CD2 4.27Å; V191-F199 HydrophobicContact CG1-CE2 4.3Å; V191-F201 HydrophobicContact CG2-CE2 4.4Å
192N67.8Low70.4Confident53 Ų5381.3 Ų81.328%0.28347%0.465SS..  trans-63.3115.9172.1-68.7-47.2000107.1E147 R149 K190 G194 G195E147-N192 PolarHBondContact O-ND2 3.24Å; R149-N192 WeakPolarHBondContact CD-OD1 3.45Å; K190-N192 PolarHBondContact O-N 3.07Å; N192-G194 PolarHBondContact O-N 3Å; N192-G195 PolarHBondContact O-N 3.38Å
193E59.7Low68.4Low197 Ų19786.2 Ų86.292%0.92149%0.488SS*.THydrogen-bonded Turntrans-64.64.9-177-160.4169.4-171.200113.7V191V191-E193 PolarHBondContact O-N 3.49Å; V191-E193 VanDerWaalsContact O-N 3.09Å
194G56.8Low66.4Low84 Ų8486.9 Ų86.987%0.86649%0.492SS*.THydrogen-bonded Turntrans-90.56.1178.300000115.3N192N192-G194 PolarHBondContact O-N 3Å
195G53.6Low64.2Low35 Ų3589.7 Ų89.736%0.36151%0.511SS..SBendtrans-124.8131.617300000109.6N192 S197N192-G195 PolarHBondContact O-N 3.38Å; G195-S197 PolarHBondContact O-N 3.25Å
196D52.8Low62.2Low137 Ų13790.9 Ų90.973%0.73352%0.519SS*.  trans-23.6113.4-176.5-62.3-43.2000113N198D196-N198 PolarHBondContact O-N 2.79Å
197S53.4Low59.8Low115 Ų11594.6 Ų94.680%0.80454%0.537SS*.SBendtrans-62.712.8179.658.90000114.1G195 F199G195-S197 PolarHBondContact O-N 3.25Å; S197-F199 PolarHBondContact O-N 2.94Å
198N51.3Low57.8Low141 Ų14194.8 Ų94.875%0.75455%0.545SS*.  trans-79.221.1170.6-86.9-9.8000113.2D196 G200D196-N198 PolarHBondContact O-N 2.79Å; N198-G200 VanDerWaalsContact C-N 3.28Å; N198-G200 PolarHBondContact O-N 3.3Å
199F53.6Low55.7Low49 Ų4996 Ų9622%0.21556%0.555CS.*  trans-57107.8150.3-76-84.3000105.8I144 S146 V191 S197 F201I144-F199 HydrophobicContact CG2-CE2 4.44Å; I144-F199 HydrophobicContact CG2-CZ 4.02Å; I144-F199 WeakPolarHBondContact O-CE1 3.26Å; I144-F199 WeakPolarHBondContact O-CZ 3.23Å; S146-F199 VanDerWaalsContact CB-CE2 3.46Å; S146-F199 VanDerWaalsContact OG-CE2 3.26Å; S146-F199 WeakPolarHBondContact OG-CE2 3.15Å; S146-F199 WeakPolarHBondContact OG-CZ 3.31Å; V191-F199 HydrophobicContact CG1-CD2 4.27Å; V191-F199 HydrophobicContact CG1-CE2 4.3Å; S197-F199 PolarHBondContact O-N 2.94Å; F199-F201 HydrophobicContact CB-CD2 3.73Å; F199-F201 HydrophobicContact CB-CE2 4.09Å; F199-F201 PolarHBondContact O-N 2.76Å
200G46.7Very low53.7Low59 Ų5999.7 Ų99.761%0.60858%0.583SS**  trans-61.659164.200000110.5N198 D202N198-G200 VanDerWaalsContact C-N 3.28Å; N198-G200 PolarHBondContact O-N 3.3Å; G200-D202 PolarHBondContact O-N 2.91Å
201F52.6Low51.9Low47 Ų4799.4 Ų99.421%0.20659%0.592CS.*  trans-60.284.6138.3-76.1-77.6000104.5V186 V191 F199 H203V186-F201 HydrophobicContact CB-CE1 4.38Å; V186-F201 HydrophobicContact CG1-CD1 4.33Å; V186-F201 HydrophobicContact CG1-CE1 3.34Å; V186-F201 HydrophobicContact CG1-CZ 3.78Å; V186-F201 HydrophobicContact CG2-CE1 4.09Å; V191-F201 HydrophobicContact CG2-CE2 4.4Å; F199-F201 HydrophobicContact CB-CD2 3.73Å; F199-F201 HydrophobicContact CB-CE2 4.09Å; F199-F201 PolarHBondContact O-N 2.76Å; F201-H203 PolarHBondContact O-N 2.76Å
202D50.6Low50.8Low110 Ų110106 Ų10659%0.58862%0.619SS**  trans-49.699.5157.4-126-28.8000105.2G200 S204 L205G200-D202 PolarHBondContact O-N 2.91Å; D202-S204 WeakPolarHBondContact CB-OG 3.13Å; D202-S204 PolarHBondContact O-N 3.03Å; D202-S204 PolarHBondContact OD1-OG 3.03Å; D202-L205 PolarHBondContact O-N 3Å
203H49.3Very low49.6Very low158 Ų158114.1 Ų114.173%0.73166%0.662SS**G310 helixtrans-57.4-16.6177.8-76.9-72.5000110.6F201 L205 I206F201-H203 PolarHBondContact O-N 2.76Å; H203-L205 PolarHBondContact O-N 3.29Å; H203-I206 PolarHBondContact O-N 3.23Å
204S47.9Very low49.1Very low77 Ų77110 Ų11054%0.53865%0.649SS.*G310 helixtrans-58.7-15.2170.448.30000115.1D202D202-S204 WeakPolarHBondContact CB-OG 3.13Å; D202-S204 PolarHBondContact O-N 3.03Å; D202-S204 PolarHBondContact OD1-OG 3.03Å
205L45.4Very low48.7Very low121 Ų121111.4 Ų111.463%0.63464%0.638SS**G310 helixtrans-106.72.5177.5-64.3178.6000114.8D202 H203D202-L205 PolarHBondContact O-N 3Å; H203-L205 PolarHBondContact O-N 3.29Å
206I49.4Very low48.4Very low81 Ų81115.6 Ų115.642%0.41565%0.653SS.*SBendtrans-95.3-11.7-178.7-62.3176.3000112H203H203-I206 PolarHBondContact O-N 3.23Å
207N39.1Very low48.1Very low97 Ų97114.4 Ų114.452%0.51965%0.649SS.*  trans-130.6102.6178.5-165.24.2000112.4D209N207-D209 PolarHBondContact O-N 3.07Å; N207-D209 PolarHBondContact OD1-N 3.47Å
208P46.2Very low47.8Very low118 Ų118114.3 Ų114.377%0.76664%0.639SS**SBendtrans-79.72.4170.331.9-32.1000113.9
209D46.2Very low47.6Very low129 Ų129112.5 Ų112.569%0.6963%0.631SS**  trans-112.219.9-169.1-79.9-28.4000115.7N207 V211N207-D209 PolarHBondContact O-N 3.07Å; N207-D209 PolarHBondContact OD1-N 3.47Å; D209-V211 PolarHBondContact O-N 2.95Å
210S45Very low47.1Very low100 Ų100117.1 Ų117.170%0.69966%0.661SS**  trans-79.477.1164.464.40000110.1E212S210-E212 PolarHBondContact O-N 3.29Å
211V46.9Very low47.2Very low124 Ų124121.5 Ų121.575%0.75267%0.665SS**  trans-61.2109.3159.1171.60000106.9D209 N213D209-V211 PolarHBondContact O-N 2.95Å; V211-N213 PolarHBondContact O-N 3.18Å
212E52.2Low46.7Very low194 Ų194127.8 Ų127.891%0.90770%0.703SS**  trans-56.7122159.6-81.2-178.7130.100107.9S210S210-E212 PolarHBondContact O-N 3.29Å
213N42.3Very low46.4Very low224 Ų224129.4 Ų129.4100%1.19871%0.714SS**  trans-100.10167-178.382.1000109.3V211V211-N213 PolarHBondContact O-N 3.18Å

Retrieved 213 of 213 residues in 47.4 ms (Link to these results)