A0A087Y7G5_POEFO Loading...

Zinc finger, CCHC domain containing 24

AlphaFold DB , UniProt , Accession A0A087Y7G5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 240 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
1M39.3Very low37.7Very low250 Ų250137.7 Ų137.7100%1.23283%0.829SS**  0146.30-74.3-165.8175.100108.5
2S35.2Very low37.5Very low108 Ų108136.2 Ų136.276%0.75583%0.829SS**  trans-74.6171.2-163.6-52.70000117.3
3L38.8Very low37.6Very low146 Ų146134.2 Ų134.276%0.76482%0.817SS**  trans93.3109.7150.4-47-176.2000117.4
4L36.8Very low37.4Very low160 Ų160138.6 Ų138.684%0.83881%0.813SS**  65.5133.484.9-74.9161.4000111.6
5S38.1Very low37.6Very low106 Ų106139.3 Ų139.374%0.74181%0.805SS**  cis-179.4149.225.445.10000110.3
6A39.2Very low37.9Very low94 Ų94138.1 Ų138.178%0.77780%0.804SS**  trans177.481.3144.300000108.6
7I41Very low38.7Very low158 Ų158135.1 Ų135.181%0.8180%0.799SS**  10.5115111.231173.7000115.6
8D35.3Very low39.4Very low165 Ų165136.5 Ų136.588%0.88280%0.796SS**  trans-134.8145.6140.8-134.3-22.6000111.4
9T38.7Very low40Very low117 Ų117138.1 Ų138.172%0.71880%0.8SS**  trans-106126.3-153.8-64.70000110.2
10S35.9Very low40.6Very low116 Ų116138.6 Ų138.681%0.81180%0.799SS**  trans177.485.5136.8390000110.6
11A36.7Very low41.2Very low95 Ų95137.4 Ų137.479%0.78579%0.79SS**  trans-67.6132.5154.500000109.1
12S35.3Very low41.6Very low119 Ų119136.4 Ų136.483%0.83277%0.773SS**  trans-12988.7149.6-1650000108.1Y14S12-Y14 PolarHBondContact O-N 3.25Å
13V38.1Very low42.5Very low111 Ų111136.6 Ų136.667%0.67377%0.769SS**  trans-68.9111.11671730000106.6Q15V13-Q15 PolarHBondContact O-N 2.9Å
14Y35.3Very low43.1Very low196 Ų196137.2 Ų137.277%0.76976%0.762SS**  trans-71.5108.1171.8-161.3-98.7000108.8S12S12-Y14 PolarHBondContact O-N 3.25Å
15Q40.5Very low43.7Very low148 Ų148136.2 Ų136.269%0.69276%0.757SS**  trans-81.7143.5173.6-81.4-87-36.600110.6V13 A17V13-Q15 PolarHBondContact O-N 2.9Å; Q15-A17 PolarHBondContact O-N 3.24Å
16P42.8Very low44.2Very low120 Ų120135.9 Ų135.978%0.77976%0.755SS**  trans-88.397.4-176.834.4-29.4000110.4
17A51.2Low44.9Very low88 Ų88138.5 Ų138.573%0.72776%0.755SS**  trans-135.170.9173.100000111.2Q15Q15-A17 PolarHBondContact O-N 3.24Å
18Q51.2Low45.1Very low160 Ų160137.2 Ų137.275%0.74875%0.745SS**  trans-117.117.4171.6-71.1-165.8-700113.9
19L50.3Low45.3Very low167 Ų167136.6 Ų136.687%0.87474%0.742SS**SBendtrans-109.210.4-179.8-79172.8000115.5
20L53.3Low45.4Very low147 Ų147136 Ų13677%0.7774%0.74SS**SBendtrans-112.72.9179.7-72.8169.8000115.3W22L20-W22 VanDerWaalsContact C-N 3.31Å; L20-W22 PolarHBondContact O-N 2.87Å
21N53.2Low45.4Very low115 Ų115138.1 Ų138.162%0.61574%0.737SS**THydrogen-bonded Turntrans-77.1-16.7-177-151.87.6000113.8
22W46Very low45.5Very low229 Ų229141.8 Ų141.887%0.86774%0.738SS**THydrogen-bonded Turntrans-84.2-14.5-173.5-72.658.4000113.7L20L20-W22 VanDerWaalsContact C-N 3.31Å; L20-W22 PolarHBondContact O-N 2.87Å
23V55.4Low45.4Very low111 Ų111143.2 Ų143.267%0.67374%0.742SS**THydrogen-bonded Turntrans-90.8-22.2-178.1179.80000112.1
24Y50.2Low45.5Very low159 Ų159143.4 Ų143.462%0.62475%0.748SS**G310 helixtrans-88.3-19.6-171.1-165.7-100.3000114.8
25L49.7Very low45.5Very low139 Ų139138.6 Ų138.673%0.72875%0.749SS**G310 helixtrans-87.4-1.6-177.2-84.6148.1000114.6
26S47.9Very low45.1Very low99 Ų99141.2 Ų141.269%0.69276%0.758SS**G310 helixtrans-99.76.4-177.3-56.90000114.5
27L54.8Low44.8Very low149 Ų149143.2 Ų143.278%0.7876%0.763SS**SBendtrans-132.223.7-173.5-75.7172.3000115.8
28Q46.3Very low44.1Very low131 Ų131142.4 Ų142.461%0.61276%0.756SS**  trans-122101.1165-85.1110.729.800111.5
29D38.1Very low43.3Very low153 Ų153144.9 Ų144.982%0.81877%0.765SS**  trans-116.7122.5145.5-153.7-14.4000105.5
30P41.2Very low42.9Very low104 Ų104145.7 Ų145.768%0.67576%0.756SS**  -146.1136.6113.633.7-16000114.9
31H36.7Very low41.9Very low160 Ų160144.7 Ų144.774%0.74176%0.758SS**  trans45.9119.7133.4-69.9-78.3000122.1
32Q37.9Very low41Very low172 Ų172145.1 Ų145.180%0.80476%0.757SS**  trans57.1119.6136-62-158.442.700120.7
33T33.6Very low40.9Very low150 Ų150139 Ų13992%0.9275%0.746SS**  -155.8146123.437.80000111.7
34S41Very low39.5Very low114 Ų114140.9 Ų140.980%0.79775%0.752SS**  trans-75.2142.4-171.751.80000115.6
35A35.3Very low38.6Very low96 Ų96137.8 Ų137.879%0.79375%0.754SS**  trans-165.573.1154.400000113.1
36F31.8Very low37.6Very low202 Ų202135.7 Ų135.789%0.88675%0.751SS**  trans-165.576.9143.958.1-83.8000109.1A38F36-A38 PolarHBondContact O-N 3.25Å
37D36Very low36.7Very low163 Ų163139.2 Ų139.287%0.87276%0.756SS**  trans-84.295.5164.5-151.9-2.9000106.8
38A37.2Very low35.6Very low71 Ų71137.6 Ų137.659%0.58775%0.753SS**  trans-155.683.3173.400000108.3F36F36-A38 PolarHBondContact O-N 3.25Å
39F33.5Very low34.6Very low212 Ų212138.1 Ų138.193%0.9376%0.76SS**  trans172.480.7139.2-79.1-57.2000107.4
40R40.8Very low34.3Very low184 Ų184138.4 Ų138.469%0.69476%0.76SS**  trans-122.7123.5164.9-168179.5-162.7-176.15.3109.6E42R40-E42 WeakPolarHBondContact CD-OE1 3.45Å; R40-E42 IonicContact CZ-OE1 2.83Å; R40-E42 IonicContact CZ-OE2 3.75Å; R40-E42 IonicContact NE-OE1 3.13Å; R40-E42 PolarHBondContact NE-OE1 3.48Å; R40-E42 VanDerWaalsContact NE-OE1 3.13Å; R40-E42 IonicContact NH1-OE1 2.63Å; R40-E42 PolarHBondContact NH1-OE1 3.32Å; R40-E42 IonicContact NH2-OE1 3.49Å; R40-E42 PolarHBondContact NH2-OE1 3.27Å; R40-E42 IonicContact NH2-OE2 3.71Å
41P33.4Very low33.6Very low125 Ų125138.1 Ų138.181%0.81276%0.761SS**  trans-100.4131.4143.2-4.624000109.6
42E34.3Very low33.2Very low125 Ų125139.7 Ų139.758%0.58477%0.766SS**  trans-67.2174.7176.7-81.1-72.3162.800112.9R40R40-E42 WeakPolarHBondContact CD-OE1 3.45Å; R40-E42 IonicContact CZ-OE1 2.83Å; R40-E42 IonicContact CZ-OE2 3.75Å; R40-E42 IonicContact NE-OE1 3.13Å; R40-E42 PolarHBondContact NE-OE1 3.48Å; R40-E42 VanDerWaalsContact NE-OE1 3.13Å; R40-E42 IonicContact NH1-OE1 2.63Å; R40-E42 PolarHBondContact NH1-OE1 3.32Å; R40-E42 IonicContact NH2-OE1 3.49Å; R40-E42 PolarHBondContact NH2-OE1 3.27Å; R40-E42 IonicContact NH2-OE2 3.71Å
43P42.9Very low32.7Very low99 Ų99135.7 Ų135.764%0.64376%0.757SS**  trans-111.9170.2-133.941.9-30.8000113.6
44N27.6Very low32.4Very low151 Ų151138.2 Ų138.281%0.80776%0.755SS**  trans-157.9122146-120.1-4.5000114.1
45S30.1Very low32.1Very low94 Ų94138.9 Ų138.966%0.65775%0.754SS**  trans45.7135.714165.70000123.6
46S29.9Very low32.5Very low96 Ų96140 Ų14067%0.67175%0.753SS**  107.4114.5129.660.30000120.4
47H27.9Very low32.5Very low173 Ų173135.2 Ų135.280%0.80175%0.752SS**  trans61.2139.4139.2-74.1-91.9000117.9
48T31.9Very low32.3Very low115 Ų115132.2 Ų132.271%0.70675%0.75SS**  cis-171.3136.633.219.40000109.9
49D26.5Very low32.2Very low141 Ų141133.7 Ų133.775%0.75476%0.761SS**  49.9140.2128.3-74.7-42.1000126.5
50L30.4Very low32.4Very low159 Ų159131.6 Ų131.683%0.83276%0.76SS**  trans101.196147.2-68.1150.3000121.6
51S26.7Very low32.7Very low98 Ų98130.7 Ų130.769%0.68577%0.768SS**  46.8119.91151560000120.7
52F28.1Very low33.1Very low194 Ų194130.6 Ų130.685%0.85177%0.77SS**  178145.895.7-155.8-113.2000112.7
53S28.4Very low33.6Very low87 Ų87130.3 Ų130.361%0.60878%0.782SS**  trans-33.9150.2-174.653.80000124
54K26.7Very low33.6Very low204 Ų204129.8 Ų129.889%0.88778%0.781SS**  165.8129.4109.5-165.6167.5-174.7179.10113
55T34.3Very low34.5Very low127 Ų127129.8 Ų129.878%0.77978%0.78SS**  trans-107-179.5168.854.10000110.1
56P44.9Very low35.6Very low119 Ų119132.6 Ų132.677%0.77379%0.787SS**  cis-134.7-177.4-19.825-0.2000115.1
57A31Very low36.5Very low103 Ų103131.8 Ų131.885%0.85178%0.782SS**  trans87120.314600000122.8
58A30.9Very low37.8Very low100 Ų100128.3 Ų128.383%0.82677%0.769SS**  trans-167.6103.4146.400000107.8
59A36.2Very low38.9Very low101 Ų101132.1 Ų132.184%0.83577%0.772SS**  75.197.583.500000113.5L61A59-L61 PolarHBondContact O-N 3.09Å
60D38.2Very low40.3Very low168 Ų168131 Ų13190%0.89877%0.766SS**  trans-63.3117.1166.3-70.4-55.7000111.2
61L45.6Very low41.4Very low166 Ų166128.2 Ų128.287%0.86975%0.751SS**  trans-160.584.3164.8-159.471.1000112.9A59A59-L61 PolarHBondContact O-N 3.09Å
62S42Very low42.8Very low122 Ų122127.6 Ų127.685%0.85374%0.741SS**  trans-158.965.7159.864.10000114.5
63S44.7Very low44.5Very low119 Ų119124.6 Ų124.683%0.83273%0.727SS**SBendtrans-154.519.2165.656.70000116.7
64S43.1Very low45.6Very low88 Ų88127 Ų12762%0.61573%0.727SS**SBendtrans-116.32.5-178.2-61.20000116.2
65L46.3Very low47Very low152 Ų152123 Ų12380%0.79671%0.712SS**SBendtrans-97.1-13-173.6-68.6171.9000115.3
66N53.8Low47.9Very low152 Ų152122 Ų12281%0.81370%0.701SS**SBendtrans-91.2-12.5-177.2-77.3-32.7000115.1
67S48.5Very low48.2Very low80 Ų80121.5 Ų121.556%0.55969%0.688SS**Hα-helixtrans-89.4-21.3-176.7-159.10000114.1N71S67-N71 PolarHBondContact O-ND2 3.33Å
68N56.7Low49Very low99 Ų99125.6 Ų125.653%0.52968%0.682SS.*Hα-helixtrans-84.2-29.1-175.3-73.2-46.8000113.4N72N68-N72 WeakPolarHBondContact O-CB 3.49Å; N68-N72 PolarHBondContact O-N 3.19Å; N68-N72 PolarHBondContact O-ND2 3.25Å
69Y54.8Low49.8Very low196 Ų196125.1 Ų125.177%0.76967%0.665SS**Hα-helixtrans-72-41-177.2-108.1-90.8000113.2N72 F73Y69-N72 PolarHBondContact O-N 3.07Å; Y69-F73 PolarHBondContact O-N 3.1Å; Y69-F73 VanDerWaalsContact O-N 3.16Å
70L54.6Low50.4Low118 Ų118126.7 Ų126.762%0.61866%0.655SS**Hα-helixtrans-72.4-37179.3-61.8-172.6000112.1N72 F73 F74L70-N72 VanDerWaalsContact C-N 3.35Å; L70-N72 PolarHBondContact O-N 3.36Å; L70-F73 PolarHBondContact O-N 3.15Å; L70-F74 VanDerWaalsContact O-CD2 3.31Å; L70-F74 WeakPolarHBondContact O-CD2 3.49Å; L70-F74 PolarHBondContact O-N 3.03Å; L70-F74 VanDerWaalsContact O-N 3.16Å
71N54.2Low50.8Low99 Ų99122.7 Ų122.753%0.52965%0.645SS.*Hα-helixtrans-64.6-37.7174.9-88-65.5000112.5S67 Q75S67-N71 PolarHBondContact O-ND2 3.33Å; N71-Q75 WeakPolarHBondContact O-CB 3.37Å; N71-Q75 PolarHBondContact O-N 3.03Å; N71-Q75 VanDerWaalsContact O-N 3.07Å
72N55.3Low50.9Low86 Ų86121.6 Ų121.646%0.4664%0.64SS.*Hα-helixtrans-68.4-36.7175.4-83.1-72.4000112.4N68 Y69 L70 Q75 L76N68-N72 WeakPolarHBondContact O-CB 3.49Å; N68-N72 PolarHBondContact O-N 3.19Å; N68-N72 PolarHBondContact O-ND2 3.25Å; Y69-N72 PolarHBondContact O-N 3.07Å; L70-N72 VanDerWaalsContact C-N 3.35Å; L70-N72 PolarHBondContact O-N 3.36Å; N72-Q75 PolarHBondContact O-N 2.78Å; N72-L76 VanDerWaalsContact O-CD1 3.23Å; N72-L76 WeakPolarHBondContact O-CD1 3.27Å; N72-L76 PolarHBondContact O-N 2.86Å
73F64.6Low51.2Low130 Ų130122 Ų12257%0.5763%0.632SS**Hα-helixtrans-64.6-46.4177.5-174.5-99.6000112.4Y69 L70 Q75 L76 Q77Y69-F73 PolarHBondContact O-N 3.1Å; Y69-F73 VanDerWaalsContact O-N 3.16Å; L70-F73 PolarHBondContact O-N 3.15Å; F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 3.44Å; F73-L76 PolarHBondContact O-N 2.96Å; F73-Q77 PolarHBondContact O-N 3.25Å; F73-Q77 VanDerWaalsContact O-N 3.15Å
74F51.9Low51.3Low137 Ų137122.4 Ų122.460%0.60163%0.625SS**Hα-helixtrans-67.4-30.8175.7-79.4-72000112.9L70 R78L70-F74 VanDerWaalsContact O-CD2 3.31Å; L70-F74 WeakPolarHBondContact O-CD2 3.49Å; L70-F74 PolarHBondContact O-N 3.03Å; L70-F74 VanDerWaalsContact O-N 3.16Å; F74-R78 WeakPolarHBondContact O-CB 3.48Å; F74-R78 PolarHBondContact O-N 3.1Å; F74-R78 VanDerWaalsContact O-N 3.12Å
75Q55.1Low51.6Low121 Ų121123.8 Ų123.857%0.56563%0.626SS**Hα-helixtrans-70.3-41.1173-94.9-159.730.100113.1N71 N72 F73 Q77 R78 N79N71-Q75 WeakPolarHBondContact O-CB 3.37Å; N71-Q75 PolarHBondContact O-N 3.03Å; N71-Q75 VanDerWaalsContact O-N 3.07Å; N72-Q75 PolarHBondContact O-N 2.78Å; F73-Q75 VanDerWaalsContact C-N 3.32Å; F73-Q75 PolarHBondContact O-N 3.44Å; Q75-Q77 VanDerWaalsContact C-N 3.33Å; Q75-Q77 PolarHBondContact O-N 3.49Å; Q75-R78 PolarHBondContact O-N 2.97Å; Q75-N79 WeakPolarHBondContact O-CB 3.36Å; Q75-N79 PolarHBondContact O-N 3.32Å; Q75-N79 PolarHBondContact O-ND2 2.9Å
76L53.6Low51.4Low107 Ų107123 Ų12356%0.5663%0.627SS**Hα-helixtrans-63.6-41.2176.6-96.686.3000111.3N72 F73 R78 N79 E80N72-L76 VanDerWaalsContact O-CD1 3.23Å; N72-L76 WeakPolarHBondContact O-CD1 3.27Å; N72-L76 PolarHBondContact O-N 2.86Å; F73-L76 PolarHBondContact O-N 2.96Å; L76-R78 VanDerWaalsContact C-N 3.31Å; L76-R78 PolarHBondContact O-N 3.38Å; L76-N79 PolarHBondContact O-N 3.09Å; L76-E80 PolarHBondContact O-N 2.87Å
77Q51Low51Low108 Ų108126.8 Ų126.851%0.50563%0.631SS.*Hα-helixtrans-66.6-32.4177.3-147.6171.328.100112.6F73 Q75 A81F73-Q77 PolarHBondContact O-N 3.25Å; F73-Q77 VanDerWaalsContact O-N 3.15Å; Q75-Q77 VanDerWaalsContact C-N 3.33Å; Q75-Q77 PolarHBondContact O-N 3.49Å; Q77-A81 PolarHBondContact O-N 2.89Å
78R48.1Very low50.6Low188 Ų188130.9 Ų130.971%0.70964%0.639SS**Hα-helixtrans-73.2-34.8173.7-168.2179.4-170.6125.10.8112.8F74 Q75 L76 A81 L82F74-R78 WeakPolarHBondContact O-CB 3.48Å; F74-R78 PolarHBondContact O-N 3.1Å; F74-R78 VanDerWaalsContact O-N 3.12Å; Q75-R78 PolarHBondContact O-N 2.97Å; L76-R78 VanDerWaalsContact C-N 3.31Å; L76-R78 PolarHBondContact O-N 3.38Å; R78-A81 PolarHBondContact O-N 2.97Å; R78-L82 PolarHBondContact O-N 2.89Å
79N47.5Very low50.1Low91 Ų91133.5 Ų133.549%0.48765%0.653SS.*Hα-helixtrans-73-32.9177.1-77.8-45.9000112.1Q75 L76 A81 L82 N83Q75-N79 WeakPolarHBondContact O-CB 3.36Å; Q75-N79 PolarHBondContact O-N 3.32Å; Q75-N79 PolarHBondContact O-ND2 2.9Å; L76-N79 PolarHBondContact O-N 3.09Å; N79-A81 VanDerWaalsContact C-N 3.3Å; N79-A81 PolarHBondContact O-N 3.14Å; N79-L82 PolarHBondContact O-N 3.25Å; N79-N83 VanDerWaalsContact O-CB 3.29Å; N79-N83 WeakPolarHBondContact O-CB 3.37Å; N79-N83 PolarHBondContact O-N 2.93Å
80E49.8Very low49.4Very low134 Ų134131 Ų13163%0.62666%0.658SS**Hα-helixtrans-68.8-27.1173.3-74.1179.816200113.2L76L76-E80 PolarHBondContact O-N 2.87Å
81A46.1Very low48.9Very low83 Ų83129.7 Ų129.769%0.68666%0.658SS**THydrogen-bonded Turntrans-78.4-16.4175.200000114.1Q77 R78 N79Q77-A81 PolarHBondContact O-N 2.89Å; R78-A81 PolarHBondContact O-N 2.97Å; N79-A81 VanDerWaalsContact C-N 3.3Å; N79-A81 PolarHBondContact O-N 3.14Å
82L48.4Very low48.9Very low143 Ų143130.8 Ų130.875%0.74967%0.671SS**THydrogen-bonded Turntrans-105.8-9.9178.1-68176.2000113.6R78 N79R78-L82 PolarHBondContact O-N 2.89Å; N79-L82 PolarHBondContact O-N 3.25Å
83N47.1Very low48.7Very low131 Ų131137.3 Ų137.370%0.70169%0.691SS**SBendtrans-101.65.3-172.8-153.7-2.5000114.6N79N79-N83 VanDerWaalsContact O-CB 3.29Å; N79-N83 WeakPolarHBondContact O-CB 3.37Å; N79-N83 PolarHBondContact O-N 2.93Å
84N46.7Very low47.9Very low127 Ų127133.6 Ų133.668%0.67969%0.689SS**SBendtrans-121.391.9177.3-77.4-54.7000112.2
85N49.4Very low48Very low117 Ų117130.5 Ų130.563%0.62668%0.684SS**SBendtrans72.464.5156-65.7-72.1000119.3
86V43Very low48.2Very low135 Ų135131.1 Ų131.182%0.81869%0.691SS**SBendtrans-122.833.1155-163.10000111.8
87Y44.9Very low48.5Very low232 Ų232131.1 Ų131.191%0.9169%0.692SS**  trans-131.956.2164-70.8-76.6000110.2
88K40.9Very low49.3Very low166 Ų166131.3 Ų131.372%0.72270%0.696SS**SBendtrans-124.993.6158-76.3-168.3178.8177.70108.8
89N44.4Very low50.4Low155 Ų155127.2 Ų127.283%0.82969%0.687SS**  trans37.786.5146.5-59-60.9000115.4S91N89-S91 PolarHBondContact O-N 3.25Å; N89-S91 VanDerWaalsContact O-N 3.1Å
90V41.7Very low51.6Low144 Ų144126.7 Ų126.787%0.87369%0.687SS**  trans-77.395.1163.1-176.50000107.7
91S43.5Very low52.5Low89 Ų89125.1 Ų125.162%0.62268%0.683SS**  trans-70.8138.4160.7179.20000108.8N89 Y93N89-S91 PolarHBondContact O-N 3.25Å; N89-S91 VanDerWaalsContact O-N 3.1Å; S91-Y93 PolarHBondContact O-N 3.08Å
92P53.6Low53.9Low122 Ų122123.1 Ų123.179%0.79267%0.67SS**SBendtrans-78.27.2-166.2-9.327000115.1
93Y51.5Low55.3Low223 Ų223120.9 Ų120.988%0.87566%0.659SS**  trans-135.993.6-176-109.3-99.5000110.2S91S91-Y93 PolarHBondContact O-N 3.08Å
94G46.9Very low56.6Low52 Ų52118.8 Ų118.854%0.53665%0.648SS.*  trans-176.572-179.800000113.6N98G94-N98 PolarHBondContact O-ND2 3.49Å
95S54.6Low57.9Low72 Ų72115.5 Ų115.550%0.50363%0.634SS.*  87.1113.9112.5-166.30000114.2N97 N98S95-N97 PolarHBondContact O-N 3.37Å; S95-N97 PolarHBondContact OG-ND2 3.08Å; S95-N98 PolarHBondContact O-N 3.43Å; S95-N98 VanDerWaalsContact O-N 3.15Å; S95-N98 PolarHBondContact O-ND2 3.34Å
96L60.1Low59.3Low134 Ų134114.1 Ų114.170%0.70263%0.627SS**THydrogen-bonded Turntrans-54.2-13.5-179.7-60.2-178.1000114.5N98 I99 V100L96-N98 VanDerWaalsContact C-N 3.25Å; L96-N98 PolarHBondContact O-N 2.91Å; L96-I99 HydrophobicContact CD2-CD1 3.93Å; L96-I99 WeakPolarHBondContact O-CB 3.1Å; L96-I99 PolarHBondContact O-N 3.46Å; L96-I99 VanDerWaalsContact O-N 3.09Å; L96-V100 PolarHBondContact O-N 3.25Å
97N59.8Low60.9Low108 Ų108111.7 Ų111.758%0.57861%0.612SS**Hα-helixtrans-58.4-37.4174.8-60.4-19.4000111.8S95 I99 V100 D101S95-N97 PolarHBondContact O-N 3.37Å; S95-N97 PolarHBondContact OG-ND2 3.08Å; N97-I99 PolarHBondContact O-N 3.22Å; N97-V100 PolarHBondContact O-N 3.46Å; N97-D101 PolarHBondContact O-N 2.89Å
98N66.4Low62.1Low112 Ų112105.7 Ų105.760%0.59960%0.596SS**Hα-helixtrans-64.7-26.6177.4-69.2-66.8000113.1G94 S95 L96 G102G94-N98 PolarHBondContact O-ND2 3.49Å; S95-N98 PolarHBondContact O-N 3.43Å; S95-N98 VanDerWaalsContact O-N 3.15Å; S95-N98 PolarHBondContact O-ND2 3.34Å; L96-N98 VanDerWaalsContact C-N 3.25Å; L96-N98 PolarHBondContact O-N 2.91Å; N98-G102 PolarHBondContact O-N 2.76Å; N98-G102 VanDerWaalsContact O-N 3.1Å
99I71.3Confident63.4Low101 Ų101102.9 Ų102.952%0.51859%0.585SS.*Hα-helixtrans-77.7-43.7178.6-56.8175.3000109.6L96 N97 D101 G102 L103L96-I99 HydrophobicContact CD2-CD1 3.93Å; L96-I99 WeakPolarHBondContact O-CB 3.1Å; L96-I99 PolarHBondContact O-N 3.46Å; L96-I99 VanDerWaalsContact O-N 3.09Å; N97-I99 PolarHBondContact O-N 3.22Å; I99-D101 VanDerWaalsContact C-N 3.34Å; I99-D101 PolarHBondContact O-N 3.37Å; I99-G102 PolarHBondContact O-N 3.25Å; I99-L103 HydrophobicContact CG2-CD1 4.05Å; I99-L103 HydrophobicContact CG2-CG 4.34Å; I99-L103 WeakPolarHBondContact O-CB 3.45Å; I99-L103 VanDerWaalsContact O-CG 3.27Å; I99-L103 WeakPolarHBondContact O-CG 3.42Å; I99-L103 PolarHBondContact O-N 3.41Å
100V73.6Confident64.5Low81 Ų81102 Ų10249%0.49157%0.574SS.*Hα-helixtrans-62-44177.2170.20000110.9L96 N97 G102 L103 N104L96-V100 PolarHBondContact O-N 3.25Å; N97-V100 PolarHBondContact O-N 3.46Å; V100-G102 VanDerWaalsContact C-N 3.33Å; V100-G102 PolarHBondContact O-N 3.09Å; V100-L103 PolarHBondContact O-N 3.25Å; V100-N104 WeakPolarHBondContact O-CB 3.4Å; V100-N104 VanDerWaalsContact O-CG 3.29Å; V100-N104 PolarHBondContact O-N 3.21Å; V100-N104 PolarHBondContact O-ND2 2.94Å
101D69.3Low65.6Low100 Ų10099.1 Ų99.154%0.53556%0.56SS.*Hα-helixtrans-66.5-36.8177.3-65.1-32.4000111.7N97 I99 S105N97-D101 PolarHBondContact O-N 2.89Å; I99-D101 VanDerWaalsContact C-N 3.34Å; I99-D101 PolarHBondContact O-N 3.37Å; D101-S105 WeakPolarHBondContact O-CB 3.32Å; D101-S105 PolarHBondContact O-N 2.87Å
102G74.9Confident66.3Low41 Ų41101.3 Ų101.342%0.42357%0.565SS.*Hα-helixtrans-64.6-38.5172.200000113.5N98 I99 V100 L106N98-G102 PolarHBondContact O-N 2.76Å; N98-G102 VanDerWaalsContact O-N 3.1Å; I99-G102 PolarHBondContact O-N 3.25Å; V100-G102 VanDerWaalsContact C-N 3.33Å; V100-G102 PolarHBondContact O-N 3.09Å; G102-L106 WeakPolarHBondContact O-CB 3.34Å; G102-L106 PolarHBondContact O-N 3.27Å
103L77.9Confident66.6Low97 Ų97101.5 Ų101.551%0.50856%0.559SS.*Hα-helixtrans-75.1-34.3178-69.3175.7000112.6I99 V100 L106 T107I99-L103 HydrophobicContact CG2-CD1 4.05Å; I99-L103 HydrophobicContact CG2-CG 4.34Å; I99-L103 WeakPolarHBondContact O-CB 3.45Å; I99-L103 VanDerWaalsContact O-CG 3.27Å; I99-L103 WeakPolarHBondContact O-CG 3.42Å; I99-L103 PolarHBondContact O-N 3.41Å; V100-L103 PolarHBondContact O-N 3.25Å; L103-L106 PolarHBondContact O-N 3.11Å; L103-T107 WeakPolarHBondContact O-CB 3.17Å; L103-T107 PolarHBondContact O-N 3.24Å; L103-T107 PolarHBondContact O-OG1 3.48Å
104N74.3Confident66.9Low87 Ų8795.8 Ų95.847%0.46555%0.551SS.*Hα-helixtrans-64.8-47.6171.9-74.2-30.1000110.5V100 L106 T107 D108V100-N104 WeakPolarHBondContact O-CB 3.4Å; V100-N104 VanDerWaalsContact O-CG 3.29Å; V100-N104 PolarHBondContact O-N 3.21Å; V100-N104 PolarHBondContact O-ND2 2.94Å; N104-L106 VanDerWaalsContact C-N 3.31Å; N104-L106 PolarHBondContact O-N 3.48Å; N104-T107 WeakPolarHBondContact O-CB 3.32Å; N104-T107 PolarHBondContact O-N 2.86Å; N104-T107 VanDerWaalsContact O-N 3.14Å; N104-D108 PolarHBondContact O-N 3.38Å
105S74.9Confident67Low57 Ų57101.6 Ų101.640%0.39957%0.569SS.*Hα-helixtrans-59.2-41.7174.61740000111.7D101 D108 H109D101-S105 WeakPolarHBondContact O-CB 3.32Å; D101-S105 PolarHBondContact O-N 2.87Å; S105-D108 PolarHBondContact O-N 2.94Å; S105-H109 PolarHBondContact O-CD2 2.93Å; S105-H109 PolarHBondContact O-N 2.92Å; S105-H109 VanDerWaalsContact O-N 3.08Å
106L76.9Confident66.6Low89 Ų89103.3 Ų103.347%0.46658%0.581SS.*Hα-helixtrans-66-38.2176.5-169.862.4000112.3G102 L103 N104 H109 F110G102-L106 WeakPolarHBondContact O-CB 3.34Å; G102-L106 PolarHBondContact O-N 3.27Å; L103-L106 PolarHBondContact O-N 3.11Å; N104-L106 VanDerWaalsContact C-N 3.31Å; N104-L106 PolarHBondContact O-N 3.48Å; L106-H109 PolarHBondContact O-N 3.36Å; L106-F110 HydrophobicContact CD1-CD2 4.21Å; L106-F110 HydrophobicContact CD1-CE2 4Å; L106-F110 HydrophobicContact CD2-CE2 4.3Å; L106-F110 HydrophobicContact CG-CD2 3.95Å; L106-F110 HydrophobicContact CG-CE2 3.9Å; L106-F110 WeakPolarHBondContact O-CD2 3.28Å; L106-F110 PolarHBondContact O-N 3.5Å
107T77.8Confident66.1Low84 Ų84102.1 Ų102.152%0.51558%0.584SS.*Hα-helixtrans-65.2-39.1177.4-61.50000112L103 N104 H109 F110 S111L103-T107 WeakPolarHBondContact O-CB 3.17Å; L103-T107 PolarHBondContact O-N 3.24Å; L103-T107 PolarHBondContact O-OG1 3.48Å; N104-T107 WeakPolarHBondContact O-CB 3.32Å; N104-T107 PolarHBondContact O-N 2.86Å; N104-T107 VanDerWaalsContact O-N 3.14Å; T107-H109 VanDerWaalsContact C-N 3.34Å; T107-F110 PolarHBondContact O-N 3.48Å; T107-S111 PolarHBondContact O-N 3.06Å; T107-S111 VanDerWaalsContact O-N 3.08Å; T107-S111 PolarHBondContact O-OG 3.46Å
108D70.1Confident65.5Low105 Ų105103 Ų10356%0.56159%0.585SS**Hα-helixtrans-64.2-41.2173.5-70.6-28.4000110.9N104 S105 F110 S111 D112N104-D108 PolarHBondContact O-N 3.38Å; S105-D108 PolarHBondContact O-N 2.94Å; D108-F110 PolarHBondContact O-N 3.32Å; D108-S111 WeakPolarHBondContact O-CB 3.14Å; D108-S111 PolarHBondContact O-N 3.46Å; D108-D112 PolarHBondContact O-N 3.17Å
109H68.5Low64.5Low107 Ų107103.7 Ų103.750%0.49560%0.595SS.*Hα-helixtrans-67.9-32.6175.1-69.3-52.9000113.8S105 L106 T107 S111 D112 L113S105-H109 PolarHBondContact O-CD2 2.93Å; S105-H109 PolarHBondContact O-N 2.92Å; S105-H109 VanDerWaalsContact O-N 3.08Å; L106-H109 PolarHBondContact O-N 3.36Å; T107-H109 VanDerWaalsContact C-N 3.34Å; H109-S111 VanDerWaalsContact C-N 3.32Å; H109-D112 PolarHBondContact O-N 3.19Å; H109-L113 PolarHBondContact O-N 2.74Å
110F66.8Low63.3Low138 Ų138108.9 Ų108.961%0.60561%0.608SS**Hα-helixtrans-69.4-31.4173.1-94.9-79.9000112.6L106 T107 D108 D112 L113L106-F110 HydrophobicContact CD1-CD2 4.21Å; L106-F110 HydrophobicContact CD1-CE2 4Å; L106-F110 HydrophobicContact CD2-CE2 4.3Å; L106-F110 HydrophobicContact CG-CD2 3.95Å; L106-F110 HydrophobicContact CG-CE2 3.9Å; L106-F110 WeakPolarHBondContact O-CD2 3.28Å; L106-F110 PolarHBondContact O-N 3.5Å; T107-F110 PolarHBondContact O-N 3.48Å; D108-F110 PolarHBondContact O-N 3.32Å; F110-D112 PolarHBondContact O-N 3.21Å; F110-L113 PolarHBondContact O-N 2.82Å
111S65.9Low62.1Low82 Ų82113.5 Ų113.557%0.57362%0.622SS**Hα-helixtrans-65.9-30175.8-580000112T107 D108 H109T107-S111 PolarHBondContact O-N 3.06Å; T107-S111 VanDerWaalsContact O-N 3.08Å; T107-S111 PolarHBondContact O-OG 3.46Å; D108-S111 WeakPolarHBondContact O-CB 3.14Å; D108-S111 PolarHBondContact O-N 3.46Å; H109-S111 VanDerWaalsContact C-N 3.32Å
112D58Low61.1Low136 Ų136114.5 Ų114.573%0.72763%0.634SS**Hα-helixtrans-80.2-16177-78.9-20.1000114.2D108 H109 F110D108-D112 PolarHBondContact O-N 3.17Å; H109-D112 PolarHBondContact O-N 3.19Å; F110-D112 PolarHBondContact O-N 3.21Å
113L59.2Low60.2Low125 Ų125120.1 Ų120.165%0.65465%0.654SS**THydrogen-bonded Turntrans-90.72.1-179.6-70.3170.5000114H109 F110 L115H109-L113 PolarHBondContact O-N 2.74Å; F110-L113 PolarHBondContact O-N 2.82Å; L113-L115 PolarHBondContact O-N 3.46Å
114S57.2Low59.7Low103 Ų103123.2 Ų123.272%0.7266%0.663SS**SBendtrans-69.992.7170.7-178.70000110.2S116S114-S116 PolarHBondContact O-N 3.12Å
115L49.4Very low59.7Low174 Ų174129.4 Ų129.491%0.91168%0.68SS**  trans-54.796-178.1-64.2170.9000113.5L113L113-L115 PolarHBondContact O-N 3.46Å
116S46.3Very low60.2Low108 Ų108127.4 Ų127.476%0.75567%0.666SS**  trans-129.299149164.80000107.1S114 E118S114-S116 PolarHBondContact O-N 3.12Å; S116-E118 PolarHBondContact O-N 3.29Å
117S49.6Very low60.7Low110 Ų110127 Ų12777%0.76967%0.669SS**  trans-54.9105.3175.6520000111.8
118E46.7Very low60.7Low126 Ų126128.3 Ų128.359%0.58968%0.679SS**SBendtrans177.3139.6139.5-147.860.4-154.700109.5S116 R120S116-E118 PolarHBondContact O-N 3.29Å; E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 HydrophobicContact CB-CG 4.15Å; E118-R120 HydrophobicContact CG-CG 4.29Å; E118-R120 PolarHBondContact O-N 3.41Å
119P46.1Very low61.6Low126 Ų126130 Ų13082%0.81869%0.688SS**  trans-7383.217530.5-34000110
120R45.9Very low62.7Low210 Ų210127.3 Ų127.379%0.79267%0.673SS**  trans-112.5114.2175.8-67.1-163-152.4153.88.8111.1E118E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 HydrophobicContact CB-CG 4.15Å; E118-R120 HydrophobicContact CG-CG 4.29Å; E118-R120 PolarHBondContact O-N 3.41Å
121K48.7Very low63.9Low179 Ų179124.3 Ų124.378%0.77866%0.663SS**  trans2.4136.5151.9-66.8171.7179.7175.30115.5N123K121-N123 PolarHBondContact O-N 3.02Å; K121-N123 VanDerWaalsContact O-N 3.17Å
122P48.5Very low65Low120 Ų120120.4 Ų120.478%0.77964%0.636SS**SBendtrans-48.7125-177.621.4-33.2000110.4K124P122-K124 PolarHBondContact O-N 3.25Å
123N55.4Low66.5Low160 Ų160120.2 Ų120.286%0.85663%0.631SS**  trans-43.8103.3-177.8-100.2-52.4000110.4K121 R125K121-N123 PolarHBondContact O-N 3.02Å; K121-N123 VanDerWaalsContact O-N 3.17Å; N123-R125 VanDerWaalsContact C-N 3.33Å; N123-R125 PolarHBondContact O-N 2.93Å
124K66.9Low67.8Low161 Ų161118.4 Ų118.470%0.762%0.621SS**  trans-72.394.3173.7-63.9-174-179.3-168.90106.5P122 Y141P122-K124 PolarHBondContact O-N 3.25Å; K124-Y141 HydrophobicContact CB-CE2 4.38Å; K124-Y141 WeakPolarHBondContact O-CE2 3.15Å
125R75.1Confident69.4Low217 Ų217114.2 Ų114.282%0.81959%0.592SS**PPolyproline II helixtrans-63.9137.9165.6-67.5-174.2-178.2176.71.6107.7N123N123-R125 VanDerWaalsContact C-N 3.33Å; N123-R125 PolarHBondContact O-N 2.93Å
126P85.9Confident71.4Confident15 Ų15113 Ų11310%0.09758%0.579CS.*PPolyproline II helixtrans-57.6153.8175.8-16.324.3000111.5Y130 Y141P126-Y130 HydrophobicContact CB-CD1 3.41Å; P126-Y130 VanDerWaalsContact CB-CD1 3.41Å; P126-Y130 HydrophobicContact CB-CE1 4.27Å; P126-Y130 HydrophobicContact CB-CG 3.75Å; P126-Y130 HydrophobicContact CG-CD1 3.84Å; P126-Y130 HydrophobicContact CG-CE1 4.32Å; P126-Y141 HydrophobicContact CB-CD1 4.11Å; P126-Y141 HydrophobicContact CB-CE1 3.75Å; P126-Y141 HydrophobicContact CB-CE2 4.28Å; P126-Y141 HydrophobicContact CG-CD1 3.86Å; P126-Y141 HydrophobicContact CG-CD2 3.81Å; P126-Y141 HydrophobicContact CG-CE1 3.93Å; P126-Y141 HydrophobicContact CG-CE2 3.91Å; P126-Y141 HydrophobicContact CG-CG 3.79Å
127P86.4Confident73.5Confident81 Ų81111.9 Ų111.953%0.52657%0.565SS.*PPolyproline II helixtrans-51.9151.6170.4-25.634.3000112N129 Y130P127-N129 PolarHBondContact O-N 2.93Å; P127-Y130 WeakPolarHBondContact O-CB 3.49Å; P127-Y130 PolarHBondContact O-N 3.26Å
128P78.8Confident75.5Confident111 Ų111113 Ų11372%0.72156%0.556SS**THydrogen-bonded Turntrans-62.5-18.4-172.821.3-32000115.1
129N88.1Confident77.5Confident141 Ų141109.7 Ų109.775%0.75456%0.555SS**THydrogen-bonded Turntrans-97.7-0.6175.2-75.5-9.1000114P127P127-N129 PolarHBondContact O-N 2.93Å
130Y90.9Very high79.7Confident50 Ų50105.1 Ų105.120%0.19652%0.523CS..  trans-75.7126.8173.8178.3-92.5000110.4P126 P127 H133 H140 Y141P126-Y130 HydrophobicContact CB-CD1 3.41Å; P126-Y130 VanDerWaalsContact CB-CD1 3.41Å; P126-Y130 HydrophobicContact CB-CE1 4.27Å; P126-Y130 HydrophobicContact CB-CG 3.75Å; P126-Y130 HydrophobicContact CG-CD1 3.84Å; P126-Y130 HydrophobicContact CG-CE1 4.32Å; P127-Y130 WeakPolarHBondContact O-CB 3.49Å; P127-Y130 PolarHBondContact O-N 3.26Å; Y130-H133 AromaticContact CE2-CD2 3.83Å; Y130-H133 AromaticContact CE2-NE2 3.79Å; Y130-H133 AromaticContact CZ-CD2 3.91Å; Y130-H140 VanDerWaalsContact CE1-O 3.28Å; Y130-H140 WeakPolarHBondContact CE1-O 3.37Å; Y130-Y141 HydrophobicContact CD1-CD1 4.31Å; Y130-Y141 AromaticContact CE1-CD1 3.84Å; Y130-Y141 HydrophobicContact CE1-CD1 3.84Å; Y130-Y141 HydrophobicContact CE1-CE1 4.48Å; Y130-Y141 HydrophobicContact CE2-CD1 4.4Å; Y130-Y141 AromaticContact CZ-CD1 3.88Å
131L92.7Very high81.8Confident75 Ų7598.8 Ų98.839%0.39350%0.5SS..BIsolated β-bridgetrans-104.7135.1169.1-59.3175.9000108.5H133 K138L131-H133 PolarHBondContact O-CD2 2.67Å; L131-H133 PolarHBondContact O-N 3.07Å; L131-K138 HydrophobicContact CD2-CB 4.48Å; L131-K138 HydrophobicContact CD2-CD 4.3Å; L131-K138 HydrophobicContact CD2-CG 3.36Å
132C88.8Confident83.7Confident0 Ų094 Ų940%048%0.482CS..  trans-57.9125.9172.1173.10000109.8L134 C135 F136 N137 H140C132-L134 PolarHBondContact O-N 3.35Å; C132-L134 VanDerWaalsContact O-N 3.09Å; C132-L134 PolarHBondContact SG-N 3.45Å; C132-C135 VanDerWaalsContact SG-SG 3.65Å; C132-F136 WeakPolarHBondContact O-CA 3.42Å; C132-F136 PolarHBondContact O-N 2.84Å; C132-N137 WeakPolarHBondContact CB-O 3.29Å; C132-N137 PolarHBondContact N-O 3.34Å; C132-H140 WeakPolarHBondContact CB-NE2 3.46Å; C132-H140 PolarHBondContact SG-NE2 3.16Å
133H89.8Confident85.2Confident133 Ų13397.2 Ų97.262%0.61648%0.484SS*.THydrogen-bonded Turntrans-72.4-4-176.7-69.7-131.6000113.5Y130 L131 I142Y130-H133 AromaticContact CE2-CD2 3.83Å; Y130-H133 AromaticContact CE2-NE2 3.79Å; Y130-H133 AromaticContact CZ-CD2 3.91Å; L131-H133 PolarHBondContact O-CD2 2.67Å; L131-H133 PolarHBondContact O-N 3.07Å; H133-I142 HydrophobicContact CB-CD1 4.16Å
134L87.1Confident86.6Confident87 Ų8794.9 Ų94.946%0.45547%0.471SS..THydrogen-bonded Turntrans-96.7-47.7176.4-176.963.8000112.4C132 I142 C145 A148C132-L134 PolarHBondContact O-N 3.35Å; C132-L134 VanDerWaalsContact O-N 3.09Å; C132-L134 PolarHBondContact SG-N 3.45Å; L134-I142 HydrophobicContact CB-CD1 4.16Å; L134-I142 HydrophobicContact CB-CG1 3.99Å; L134-C145 HydrophobicContact CD2-CB 4.3Å; L134-A148 VanDerWaalsContact CD2-CA 3.46Å; L134-A148 HydrophobicContact CD2-CB 3.74Å
135C89.6Confident87.6Confident15 Ų1587.6 Ų87.610%0.10144%0.44CS..THydrogen-bonded Turntrans-112.5-2.5-17568.30000114.2C132 N137 H140 C145 Q147C132-C135 VanDerWaalsContact SG-SG 3.65Å; C135-N137 PolarHBondContact O-N 2.9Å; C135-N137 VanDerWaalsContact O-N 3.09Å; C135-N137 PolarHBondContact O-ND2 3.2Å; C135-H140 PolarHBondContact SG-CE1 3.4Å; C135-H140 PolarHBondContact SG-NE2 3.15Å; C135-C145 PolarHBondContact SG-SG 2.73Å; C135-Q147 HydrophobicContact CB-CB 4.18Å; C135-Q147 HydrophobicContact CB-CG 4.17Å
136F92.3Very high88Confident148 Ų14882.6 Ų82.665%0.64944%0.436SS*.  trans57.518.8-176.9-58-84.6000115.2C132C132-F136 WeakPolarHBondContact O-CA 3.42Å; C132-F136 PolarHBondContact O-N 2.84Å
137N90.1Very high87.7Confident84 Ų8487.8 Ų87.845%0.44946%0.459SS..  trans-95.5151.4176-65.1-53.7000112.5C132 C135C132-N137 WeakPolarHBondContact CB-O 3.29Å; C132-N137 PolarHBondContact N-O 3.34Å; C135-N137 PolarHBondContact O-N 2.9Å; C135-N137 VanDerWaalsContact O-N 3.09Å; C135-N137 PolarHBondContact O-ND2 3.2Å
138K91.4Very high87.5Confident135 Ų13585.5 Ų85.559%0.58745%0.447SS*.BIsolated β-bridgetrans-75.8163.4174.9-64.6-178.8-179.5-163.30111.6L131L131-K138 HydrophobicContact CD2-CB 4.48Å; L131-K138 HydrophobicContact CD2-CD 4.3Å; L131-K138 HydrophobicContact CD2-CG 3.36Å
139G89.8Confident87.2Confident56 Ų5691.3 Ų91.358%0.57745%0.454SS*.SBendtrans98.3-11.8163.400000117.1
140H90.9Very high86.2Confident30 Ų3090 Ų9014%0.13945%0.453CS..SBendtrans-141.4151.3178.161.3-89000111.6Y130 C132 C135 D144 C145Y130-H140 VanDerWaalsContact CE1-O 3.28Å; Y130-H140 WeakPolarHBondContact CE1-O 3.37Å; C132-H140 WeakPolarHBondContact CB-NE2 3.46Å; C132-H140 PolarHBondContact SG-NE2 3.16Å; C135-H140 PolarHBondContact SG-CE1 3.4Å; C135-H140 PolarHBondContact SG-NE2 3.15Å; H140-D144 HydrophobicContact CB-CB 4.45Å; H140-C145 WeakPolarHBondContact CD2-CA 3.38Å; H140-C145 PolarHBondContact NE2-SG 3.5Å
141Y91.1Very high84.8Confident77 Ų7797.2 Ų97.230%0.30249%0.486SS..  trans-75.2155.6168.7-74-65.2000110K124 P126 Y130 K143 D144 C145K124-Y141 HydrophobicContact CB-CE2 4.38Å; K124-Y141 WeakPolarHBondContact O-CE2 3.15Å; P126-Y141 HydrophobicContact CB-CD1 4.11Å; P126-Y141 HydrophobicContact CB-CE1 3.75Å; P126-Y141 HydrophobicContact CB-CE2 4.28Å; P126-Y141 HydrophobicContact CG-CD1 3.86Å; P126-Y141 HydrophobicContact CG-CD2 3.81Å; P126-Y141 HydrophobicContact CG-CE1 3.93Å; P126-Y141 HydrophobicContact CG-CE2 3.91Å; P126-Y141 HydrophobicContact CG-CG 3.79Å; Y130-Y141 HydrophobicContact CD1-CD1 4.31Å; Y130-Y141 AromaticContact CE1-CD1 3.84Å; Y130-Y141 HydrophobicContact CE1-CD1 3.84Å; Y130-Y141 HydrophobicContact CE1-CE1 4.48Å; Y130-Y141 HydrophobicContact CE2-CD1 4.4Å; Y130-Y141 AromaticContact CZ-CD1 3.88Å; Y141-K143 PolarHBondContact O-N 3.15Å; Y141-D144 CarbonylContact O-C 3.6Å; Y141-D144 PolarHBondContact O-N 3.38Å; Y141-C145 PolarHBondContact O-N 3.03Å
142I87.3Confident83.1Confident79 Ų7995.7 Ų95.741%0.40549%0.488SS..G310 helixtrans-49.5-29176-171.8170.7000114.1H133 L134 D144 C145H133-I142 HydrophobicContact CB-CD1 4.16Å; L134-I142 HydrophobicContact CB-CD1 4.16Å; L134-I142 HydrophobicContact CB-CG1 3.99Å; I142-D144 VanDerWaalsContact C-N 3.3Å; I142-D144 PolarHBondContact O-N 2.94Å; I142-C145 WeakPolarHBondContact O-CB 3.38Å; I142-C145 PolarHBondContact O-N 3.21Å
143K81.5Confident82.1Confident187 Ų187105.5 Ų105.581%0.81353%0.534SS*.G310 helixtrans-68-29.5178-61.3-179.7-177.81780113.4Y141Y141-K143 PolarHBondContact O-N 3.15Å
144D84.1Confident81.4Confident110 Ų110100.3 Ų100.359%0.58852%0.516SS*.G310 helixtrans-109.220.7-175.4-44.4-55000110.3H140 Y141 I142 P146H140-D144 HydrophobicContact CB-CB 4.45Å; Y141-D144 CarbonylContact O-C 3.6Å; Y141-D144 PolarHBondContact O-N 3.38Å; I142-D144 VanDerWaalsContact C-N 3.3Å; I142-D144 PolarHBondContact O-N 2.94Å; D144-P146 WeakPolarHBondContact O-CD 2.9Å
145C87.4Confident81.3Confident8 Ų8101.4 Ų101.45%0.05452%0.522CS..  trans-71.1123.5-177-175.60000110.3L134 C135 H140 Y141 I142 Q147 A148L134-C145 HydrophobicContact CD2-CB 4.3Å; C135-C145 PolarHBondContact SG-SG 2.73Å; H140-C145 WeakPolarHBondContact CD2-CA 3.38Å; H140-C145 PolarHBondContact NE2-SG 3.5Å; Y141-C145 PolarHBondContact O-N 3.03Å; I142-C145 WeakPolarHBondContact O-CB 3.38Å; I142-C145 PolarHBondContact O-N 3.21Å; C145-Q147 PolarHBondContact O-N 3.34Å; C145-A148 HydrophobicContact CB-CB 3.95Å; C145-A148 WeakPolarHBondContact O-CA 3.47Å; C145-A148 WeakPolarHBondContact O-CB 3.1Å; C145-A148 PolarHBondContact O-N 2.79Å
146P83.8Confident81Confident113 Ų113101.1 Ų101.173%0.73452%0.52SS*.THydrogen-bonded Turntrans-67.3-21.4178.527.6-35.1000112.4D144D144-P146 WeakPolarHBondContact O-CD 2.9Å
147Q80.8Confident80.6Confident124 Ų12498 Ų9858%0.57951%0.514SS*.THydrogen-bonded Turntrans-86.5-7.4171.1-61.9-172.3-8.600112.8C135 C145 R149C135-Q147 HydrophobicContact CB-CB 4.18Å; C135-Q147 HydrophobicContact CB-CG 4.17Å; C145-Q147 PolarHBondContact O-N 3.34Å; Q147-R149 PolarHBondContact O-N 3.44Å; Q147-R149 VanDerWaalsContact O-N 3.11Å
148A81.3Confident80.4Confident32 Ų3296.1 Ų96.126%0.26450%0.501SS..SBendtrans-63.4119.817000000107.5L134 C145 P150L134-A148 VanDerWaalsContact CD2-CA 3.46Å; L134-A148 HydrophobicContact CD2-CB 3.74Å; C145-A148 HydrophobicContact CB-CB 3.95Å; C145-A148 WeakPolarHBondContact O-CA 3.47Å; C145-A148 WeakPolarHBondContact O-CB 3.1Å; C145-A148 PolarHBondContact O-N 2.79Å; A148-P150 VanDerWaalsContact O-N 3.16Å
149R73.6Confident80.2Confident233 Ų23393.8 Ų93.888%0.87949%0.492SS*.PPolyproline II helixtrans-53.8127.6160.4-63.6-172.7-161.5-148.23.3105.5Q147 K151Q147-R149 PolarHBondContact O-N 3.44Å; Q147-R149 VanDerWaalsContact O-N 3.11Å; R149-K151 PolarHBondContact O-N 3.02Å
150P66.1Low79.9Confident113 Ų11392.4 Ų92.473%0.73448%0.478SS*.PPolyproline II helixtrans-48.4135.6169.320-29.2000106.2A148 G152A148-P150 VanDerWaalsContact O-N 3.16Å; P150-G152 VanDerWaalsContact C-N 3.32Å; P150-G152 WeakPolarHBondContact O-CA 3.4Å; P150-G152 PolarHBondContact O-N 3.43Å
151K60.8Low79.6Confident203 Ų203100.7 Ų100.788%0.88351%0.513SS*.SBendtrans-41.9108.5169.2-72-85-176.5176.60104.5R149R149-K151 PolarHBondContact O-N 3.02Å
152G58.3Low79.4Confident42 Ų42104.9 Ų104.943%0.43353%0.533SS..  trans-51.2150.7-164.500000109P150 G154P150-G152 VanDerWaalsContact C-N 3.32Å; P150-G152 WeakPolarHBondContact O-CA 3.4Å; P150-G152 PolarHBondContact O-N 3.43Å; G152-G154 PolarHBondContact O-N 2.83Å; G152-G154 VanDerWaalsContact O-O 3.13Å
153E67.9Low79.5Confident207 Ų207106 Ų10697%0.96753%0.533SS*.SBendtrans-46.5-11.7-176.1-60.6167.4-166.900115.2
154G75.3Confident79.9Confident23 Ų2397.1 Ų97.124%0.23749%0.494CS..SBendtrans-79.1150.9177.300000116.1G152 T156 Q159 N185G152-G154 PolarHBondContact O-N 2.83Å; G152-G154 VanDerWaalsContact O-O 3.13Å; G154-T156 PolarHBondContact O-N 2.85Å; G154-Q159 VanDerWaalsContact CA-NE2 3.35Å; G154-N185 WeakPolarHBondContact CA-OD1 3.25Å
155L83Confident80.2Confident111 Ų11196.5 Ų96.558%0.58149%0.486SS*.SBendtrans-73.3-6.7-174.7-59174.3000113.7N185 Y198L155-N185 PolarHBondContact N-OD1 3.48Å; L155-Y198 HydrophobicContact CB-CD1 4.02Å; L155-Y198 HydrophobicContact CB-CE1 3.79Å; L155-Y198 HydrophobicContact CD1-CE1 3.87Å; L155-Y198 HydrophobicContact CD1-CE2 4.3Å; L155-Y198 VanDerWaalsContact CD1-OH 3.25Å; L155-Y198 WeakPolarHBondContact CD1-OH 3.23Å; L155-Y198 HydrophobicContact CG-CE1 4.49Å
156T85.3Confident80.6Confident9 Ų996.2 Ų96.26%0.05548%0.484CS..SBendtrans-129.9154.1-174.866.20000113G154 Y158 Q159 A184 N185 Y198 P199 Q202G154-T156 PolarHBondContact O-N 2.85Å; T156-Y158 VanDerWaalsContact C-N 3.32Å; T156-Y158 PolarHBondContact O-N 3.21Å; T156-Y158 PolarHBondContact OG1-O 2.92Å; T156-Q159 PolarHBondContact O-NE2 3.1Å; T156-A184 WeakPolarHBondContact OG1-CA 3.42Å; T156-N185 PolarHBondContact OG1-N 3.16Å; T156-Y198 HydrophobicContact CG2-CD1 3.69Å; T156-Y198 HydrophobicContact CG2-CE1 4.5Å; T156-Y198 HydrophobicContact CG2-CG 4.5Å; T156-P199 HydrophobicContact CG2-CG 3.94Å; T156-Q202 PolarHBondContact OG1-OE1 2.79Å
157P83.8Confident81.1Confident82 Ų8292.4 Ų92.453%0.53246%0.456SS..SBendtrans-61.4-34.8-179.9-25.234.7000114.8P199P157-P199 VanDerWaalsContact CD-O 3.3Å; P157-P199 WeakPolarHBondContact CD-O 3.24Å
158Y83.9Confident81.8Confident44 Ų4486.6 Ų86.617%0.17343%0.429CS..  trans-90.9133.5175.7177.9-103.4000110.1T156 G160 K162 C164 A184 Q202T156-Y158 VanDerWaalsContact C-N 3.32Å; T156-Y158 PolarHBondContact O-N 3.21Å; T156-Y158 PolarHBondContact OG1-O 2.92Å; Y158-G160 VanDerWaalsContact CE1-CA 3.45Å; Y158-G160 WeakPolarHBondContact CE1-O 3.45Å; Y158-G160 WeakPolarHBondContact OH-CA 3.28Å; Y158-K162 WeakPolarHBondContact CE1-O 3.3Å; Y158-K162 PolarHBondContact OH-N 3.47Å; Y158-K162 VanDerWaalsContact OH-N 3.15Å; Y158-K162 PolarHBondContact OH-O 2.81Å; Y158-C164 HydrophobicContact CD1-CB 4.47Å; Y158-A184 HydrophobicContact CD1-CB 4.2Å; Y158-A184 WeakPolarHBondContact O-CA 3.49Å; Y158-A184 VanDerWaalsContact O-CB 3.25Å; Y158-A184 WeakPolarHBondContact O-CB 3.26Å; Y158-Q202 VanDerWaalsContact CB-OE1 3.23Å
159Q88.4Confident82.5Confident87 Ų8790 Ų9041%0.40744%0.438SS..  trans-12420.8-178.9-65.3-59.2-41.600112G154 T156 N185G154-Q159 VanDerWaalsContact CA-NE2 3.35Å; T156-Q159 PolarHBondContact O-NE2 3.1Å; Q159-N185 PolarHBondContact NE2-OD1 2.88Å; Q159-N185 PolarHBondContact OE1-ND2 3.23Å; Q159-N185 PolarHBondContact OE1-OD1 3.32Å
160G84.2Confident83.6Confident27 Ų2779 Ų7928%0.27840%0.397SS..SBendtrans-93.7177.6178.300000113.2Y158 A184Y158-G160 VanDerWaalsContact CE1-CA 3.45Å; Y158-G160 WeakPolarHBondContact CE1-O 3.45Å; Y158-G160 WeakPolarHBondContact OH-CA 3.28Å; G160-A184 WeakPolarHBondContact O-CB 3.41Å
161K84Confident85Confident203 Ų20377.3 Ų77.388%0.88339%0.386SS*.SBendtrans-91.7-13.4-175.2-60-179.2-179.2-177.50114.6W183K161-W183 WeakPolarHBondContact O-CZ3 3.44Å
162K86.4Confident86.7Confident166 Ų16674.4 Ų74.472%0.72237%0.373SS*.SBendtrans-91.7156.3-175.9-67-174.9177.3179.70111Y158Y158-K162 WeakPolarHBondContact CE1-O 3.3Å; Y158-K162 PolarHBondContact OH-N 3.47Å; Y158-K162 VanDerWaalsContact OH-N 3.15Å; Y158-K162 PolarHBondContact OH-O 2.81Å
163R89.1Confident88.5Confident103 Ų10374.1 Ų74.139%0.38936%0.364SS..  trans-60.5147.8167.4-67.2-175.8-173.4-170.4-2.5110.2W183 L205R163-W183 HydrophobicContact CG-CD2 4.04Å; R163-W183 HydrophobicContact CG-CE3 4.15Å; R163-W183 HydrophobicContact CG-CH2 3.47Å; R163-W183 VanDerWaalsContact CG-CH2 3.47Å; R163-W183 HydrophobicContact CG-CZ2 3.33Å; R163-W183 HydrophobicContact CG-CZ3 3.86Å; R163-L205 HydrophobicContact CB-CD1 4.09Å
164C89.8Confident89.9Confident0 Ų070.6 Ų70.60%035%0.346CS..EExtended strand (participates in β ladder)trans-140.3163.6176.962.70000110.9Y158 G166 G180 S182 R203Y158-C164 HydrophobicContact CD1-CB 4.47Å; C164-G166 PolarHBondContact O-N 3.16Å; C164-G180 CarbonylContact O-C 3.52Å; C164-S182 PolarHBondContact N-O 3.49Å; C164-S182 WeakPolarHBondContact O-CB 3.44Å; C164-S182 PolarHBondContact O-N 3.49Å; C164-S182 VanDerWaalsContact O-N 3.12Å; C164-S182 PolarHBondContact SG-O 3.3Å; C164-R203 CarbonylContact C-O 3.55Å; C164-R203 WeakPolarHBondContact CA-O 3.44Å; C164-R203 VanDerWaalsContact CB-O 3.24Å; C164-R203 WeakPolarHBondContact CB-O 3.36Å
165F92.1Very high90.8Very high97 Ų9773.4 Ų73.443%0.42535%0.349SS..EExtended strand (participates in β ladder)trans-76.5116.1167.6-90.3-68000109.9S179 Q202 R203 L205F165-S179 CarbonylContact C-O 3.59Å; F165-S179 WeakPolarHBondContact CA-O 3.19Å; F165-Q202 CarbonylContact O-C 3.49Å; F165-Q202 VanDerWaalsContact O-CA 3.26Å; F165-Q202 WeakPolarHBondContact O-CA 3.38Å; F165-R203 PolarHBondContact N-O 3.28Å; F165-R203 PolarHBondContact O-N 3.31Å; F165-L205 HydrophobicContact CD2-CD2 3.5Å; F165-L205 HydrophobicContact CD2-CG 3.66Å; F165-L205 HydrophobicContact CE2-CD2 3.18Å; F165-L205 HydrophobicContact CE2-CG 3.91Å; F165-L205 HydrophobicContact CG-CD2 4.44Å; F165-L205 HydrophobicContact CG-CG 4.41Å; F165-L205 HydrophobicContact CZ-CD2 3.9Å
166G93.9Very high91.4Very high1 Ų175.1 Ų75.11%0.0135%0.352CS..EExtended strand (participates in β ladder)trans-98.8135.4173.600000111.9C164 Y168 M178 S179 S182 K201C164-G166 PolarHBondContact O-N 3.16Å; G166-Y168 WeakPolarHBondContact O-CD2 3.31Å; G166-Y168 WeakPolarHBondContact O-CE2 3.46Å; G166-M178 VanDerWaalsContact O-CA 3.32Å; G166-M178 WeakPolarHBondContact O-CA 3.25Å; G166-S179 PolarHBondContact N-O 3.36Å; G166-S179 PolarHBondContact O-N 3.19Å; G166-S182 VanDerWaalsContact N-CB 3.34Å; G166-K201 CarbonylContact C-O 3.58Å; G166-K201 WeakPolarHBondContact CA-O 3.38Å
167E94.4Very high91.9Very high33 Ų3376.3 Ų76.315%0.15436%0.355CS..EExtended strand (participates in β ladder)trans-101128.2167.1-64.1175.8-150.500109.1M178 P199 H200 K201 R203E167-M178 HydrophobicContact CG-CG 4.16Å; E167-M178 HydrophobicContact CG-SD 4.32Å; E167-P199 CarbonylContact O-C 3.53Å; E167-P199 VanDerWaalsContact O-CA 3.24Å; E167-P199 WeakPolarHBondContact O-CA 3.27Å; E167-H200 VanDerWaalsContact C-ND1 3.33Å; E167-H200 VanDerWaalsContact CB-CE1 3.49Å; E167-H200 WeakPolarHBondContact CB-CE1 3.23Å; E167-H200 PolarHBondContact O-CE1 3.12Å; E167-H200 PolarHBondContact O-N 3.46Å; E167-H200 PolarHBondContact O-ND1 3.03Å; E167-H200 IonicContact OE2-NE2 3.98Å; E167-K201 HydrophobicContact CB-CB 4.2Å; E167-K201 HydrophobicContact CG-CB 4.46Å; E167-K201 PolarHBondContact N-O 3.48Å; E167-K201 WeakPolarHBondContact OE2-CD 3.33Å; E167-K201 IonicContact OE2-NZ 3.21Å; E167-K201 PolarHBondContact OE2-NZ 2.94Å; E167-R203 IonicContact OE1-CZ 3.47Å; E167-R203 IonicContact OE1-NE 3.43Å; E167-R203 PolarHBondContact OE1-NE 2.7Å; E167-R203 IonicContact OE1-NH2 2.79Å; E167-R203 PolarHBondContact OE1-NH2 3.44Å
168Y95.6Very high92.3Very high2 Ų278.9 Ų78.91%0.00836%0.362CS..EExtended strand (participates in β ladder)trans-119.2149.2-173.6-63.3-99.4000110.8G166 K176 W177 S182 Q188 V197 P199G166-Y168 WeakPolarHBondContact O-CD2 3.31Å; G166-Y168 WeakPolarHBondContact O-CE2 3.46Å; Y168-K176 VanDerWaalsContact O-CA 3.28Å; Y168-K176 WeakPolarHBondContact O-CA 3.49Å; Y168-W177 VanDerWaalsContact CB-CD2 3.49Å; Y168-W177 VanDerWaalsContact CB-CZ2 3.43Å; Y168-W177 AromaticContact CD1-CZ2 3.94Å; Y168-W177 HydrophobicContact CD1-CZ2 3.94Å; Y168-W177 AromaticContact CD2-CD1 3.87Å; Y168-W177 AromaticContact CD2-NE1 3.57Å; Y168-W177 HydrophobicContact CG-CD2 4.28Å; Y168-W177 AromaticContact CG-CE2 3.59Å; Y168-W177 AromaticContact CG-CZ2 3.84Å; Y168-W177 HydrophobicContact CG-CZ2 3.84Å; Y168-W177 AromaticContact CG-NE1 3.46Å; Y168-W177 PolarHBondContact N-O 3.45Å; Y168-W177 PolarHBondContact O-N 2.95Å; Y168-S182 WeakPolarHBondContact OH-CB 3.32Å; Y168-S182 PolarHBondContact OH-OG 3Å; Y168-Q188 HydrophobicContact CD1-CB 4.33Å; Y168-Q188 HydrophobicContact CE1-CB 3.84Å; Y168-Q188 HydrophobicContact CE1-CG 3.91Å; Y168-Q188 PolarHBondContact OH-NE2 2.91Å; Y168-V197 HydrophobicContact CD1-CG1 4.4Å; Y168-V197 VanDerWaalsContact CD1-O 3.23Å; Y168-V197 WeakPolarHBondContact CD1-O 3.41Å; Y168-V197 VanDerWaalsContact CE1-O 3.27Å; Y168-V197 WeakPolarHBondContact CE1-O 3.12Å; Y168-P199 HydrophobicContact CD1-CB 4.13Å; Y168-P199 HydrophobicContact CD2-CB 4.48Å; Y168-P199 HydrophobicContact CE1-CB 3.8Å; Y168-P199 HydrophobicContact CE1-CG 4.09Å; Y168-P199 HydrophobicContact CE2-CB 4.14Å; Y168-P199 HydrophobicContact CG-CB 4.46Å
169K96.9Very high92.6Very high105 Ų10578 Ų7846%0.45736%0.363SS..EExtended strand (participates in β ladder)trans-142.7112.7172.9-177.4-178.2179.5-173.70109R175 K176 V197K169-R175 CarbonylContact C-O 3.46Å; K169-R175 WeakPolarHBondContact CA-O 3.46Å; K169-K176 HydrophobicContact CB-CG 4.32Å; K169-K176 HydrophobicContact CG-CG 4.1Å; K169-V197 WeakPolarHBondContact O-CG1 3.21Å
170C96.8Very high92.7Very high0 Ų075.2 Ų75.20%036%0.357CS..  trans-64.9128.1179.6-179.10000110.3K172 C173 K174 R175 W177 C190 V197C170-K172 VanDerWaalsContact C-N 3.31Å; C170-K172 PolarHBondContact O-N 3.22Å; C170-K172 PolarHBondContact SG-N 3.39Å; C170-C173 VanDerWaalsContact CB-SG 3.56Å; C170-C173 PolarHBondContact SG-N 2.84Å; C170-K174 WeakPolarHBondContact O-CA 3.13Å; C170-K174 PolarHBondContact O-N 2.83Å; C170-R175 PolarHBondContact N-O 2.86Å; C170-W177 HydrophobicContact CB-CH2 4.11Å; C170-W177 HydrophobicContact CB-CZ3 3.78Å; C170-C190 HydrophobicContact CB-CB 4.24Å; C170-V197 HydrophobicContact CB-CG2 4.35Å
171P96Very high92.9Very high78 Ų7876.3 Ų76.351%0.50636%0.356SS..THydrogen-bonded Turntrans-69.4-29.4178.527.1-34.1000112.5K174 I195P171-K174 WeakPolarHBondContact O-CE 3.43Å; P171-K174 PolarHBondContact O-NZ 3.01Å; P171-I195 HydrophobicContact CG-CD1 3.77Å
172K96Very high93.3Very high142 Ų14266.6 Ų66.662%0.61731%0.314SS*.THydrogen-bonded Turntrans-78.9-68.5179.1-69.1-174.9179.2-179.10112C170 C193 I195C170-K172 VanDerWaalsContact C-N 3.31Å; C170-K172 PolarHBondContact O-N 3.22Å; C170-K172 PolarHBondContact SG-N 3.39Å; K172-C193 HydrophobicContact CB-CB 4.35Å; K172-C193 HydrophobicContact CD-CB 4.28Å; K172-I195 HydrophobicContact CB-CD1 4.27Å; K172-I195 HydrophobicContact CD-CD1 3.8Å; K172-I195 HydrophobicContact CD-CG1 4.44Å; K172-I195 HydrophobicContact CD-CG2 4.11Å; K172-I195 HydrophobicContact CG-CD1 3.77Å
173C96.1Very high93.5Very high36 Ų3662.5 Ų62.524%0.24329%0.294CS..THydrogen-bonded Turntrans-900.3-174.268.30000115.4C170 R175 K192 C193C170-C173 VanDerWaalsContact CB-SG 3.56Å; C170-C173 PolarHBondContact SG-N 2.84Å; C173-R175 PolarHBondContact O-N 2.74Å; C173-K192 HydrophobicContact CB-CD 3.94Å; C173-K192 HydrophobicContact CB-CG 4.39Å; C173-C193 VanDerWaalsContact CB-SG 3.52Å; C173-C193 VanDerWaalsContact SG-SG 3.64Å
174K96.3Very high93.5Very high133 Ų13358.6 Ų58.658%0.57828%0.284SS*.  trans60.63.6-179.8-48.1-54.1-175-168.20116C170 P171 K176C170-K174 WeakPolarHBondContact O-CA 3.13Å; C170-K174 PolarHBondContact O-N 2.83Å; P171-K174 WeakPolarHBondContact O-CE 3.43Å; P171-K174 PolarHBondContact O-NZ 3.01Å; K174-K176 PolarHBondContact O-N 2.86Å
175R94.8Very high93.5Very high82 Ų8261.6 Ų61.631%0.30930%0.3SS..  trans-54.3138172.9-165.4-177.98490.2-3.5109.8K169 C170 C173 W177K169-R175 CarbonylContact C-O 3.46Å; K169-R175 WeakPolarHBondContact CA-O 3.46Å; C170-R175 PolarHBondContact N-O 2.86Å; C173-R175 PolarHBondContact O-N 2.74Å; R175-W177 HydrophobicContact CG-CE3 4.49Å; R175-W177 WeakPolarHBondContact O-CZ3 3.42Å
176K96.4Very high93.3Very high148 Ų14861.5 Ų61.564%0.64330%0.302SS*.EExtended strand (participates in β ladder)trans-111.3145172.7-61.6177.5-174.7173.90109.2Y168 K169 K174Y168-K176 VanDerWaalsContact O-CA 3.28Å; Y168-K176 WeakPolarHBondContact O-CA 3.49Å; K169-K176 HydrophobicContact CB-CG 4.32Å; K169-K176 HydrophobicContact CG-CG 4.1Å; K174-K176 PolarHBondContact O-N 2.86Å
177W95.3Very high93.2Very high33 Ų3362.2 Ų62.213%0.12531%0.309CS..EExtended strand (participates in β ladder)trans-153.3165173.466.1101.2000110.2Y168 C170 R175 C190 V197Y168-W177 VanDerWaalsContact CB-CD2 3.49Å; Y168-W177 VanDerWaalsContact CB-CZ2 3.43Å; Y168-W177 AromaticContact CD1-CZ2 3.94Å; Y168-W177 HydrophobicContact CD1-CZ2 3.94Å; Y168-W177 AromaticContact CD2-CD1 3.87Å; Y168-W177 AromaticContact CD2-NE1 3.57Å; Y168-W177 HydrophobicContact CG-CD2 4.28Å; Y168-W177 AromaticContact CG-CE2 3.59Å; Y168-W177 AromaticContact CG-CZ2 3.84Å; Y168-W177 HydrophobicContact CG-CZ2 3.84Å; Y168-W177 AromaticContact CG-NE1 3.46Å; Y168-W177 PolarHBondContact N-O 3.45Å; Y168-W177 PolarHBondContact O-N 2.95Å; C170-W177 HydrophobicContact CB-CH2 4.11Å; C170-W177 HydrophobicContact CB-CZ3 3.78Å; R175-W177 HydrophobicContact CG-CE3 4.49Å; R175-W177 WeakPolarHBondContact O-CZ3 3.42Å; W177-C190 HydrophobicContact CH2-CB 3.95Å; W177-V197 HydrophobicContact CH2-CB 3.75Å; W177-V197 HydrophobicContact CH2-CG1 3.79Å; W177-V197 HydrophobicContact CH2-CG2 3.9Å; W177-V197 HydrophobicContact CZ2-CB 4.02Å; W177-V197 HydrophobicContact CZ2-CG1 4.25Å
178M92.8Very high93.2Very high136 Ų13662.6 Ų62.667%0.6731%0.311SS*.EExtended strand (participates in β ladder)trans-121.4149.2174.2-58.3-171.4-64.800108.8G166 E167G166-M178 VanDerWaalsContact O-CA 3.32Å; G166-M178 WeakPolarHBondContact O-CA 3.25Å; E167-M178 HydrophobicContact CG-CG 4.16Å; E167-M178 HydrophobicContact CG-SD 4.32Å
179S89.5Confident93.2Very high27 Ų2767.6 Ų67.619%0.18934%0.335CS..EExtended strand (participates in β ladder)trans-145.3133.6174.5-178.50000110.2F165 G166 N181 Q188F165-S179 CarbonylContact C-O 3.59Å; F165-S179 WeakPolarHBondContact CA-O 3.19Å; G166-S179 PolarHBondContact N-O 3.36Å; G166-S179 PolarHBondContact O-N 3.19Å; S179-N181 PolarHBondContact O-N 2.77Å; S179-N181 PolarHBondContact OG-N 3.37Å; S179-N181 VanDerWaalsContact OG-N 3.16Å; S179-Q188 PolarHBondContact OG-NE2 2.89Å
180G90.2Very high93.1Very high28 Ų2862.6 Ų62.629%0.28931%0.313SS..EExtended strand (participates in β ladder)trans-76.1-6.4170.300000113.5C164 S182 L205C164-G180 CarbonylContact O-C 3.52Å; G180-S182 PolarHBondContact O-N 3.19Å; G180-L205 WeakPolarHBondContact O-CD1 3.43Å
181N89.3Confident93Very high49 Ų4968.2 Ų68.226%0.26234%0.342SS..EExtended strand (participates in β ladder)trans-100.550.5176.4-166.931000110.9S179 W183 Q188S179-N181 PolarHBondContact O-N 2.77Å; S179-N181 PolarHBondContact OG-N 3.37Å; S179-N181 VanDerWaalsContact OG-N 3.16Å; N181-W183 PolarHBondContact OD1-NE1 3.34Å; N181-Q188 PolarHBondContact O-NE2 3.19Å
182S91.1Very high92.8Very high0 Ų072 Ų720%035%0.35CS..EExtended strand (participates in β ladder)trans-99.6134.5175.3-159.60000110.4C164 G166 Y168 G180 Q202C164-S182 PolarHBondContact N-O 3.49Å; C164-S182 WeakPolarHBondContact O-CB 3.44Å; C164-S182 PolarHBondContact O-N 3.49Å; C164-S182 VanDerWaalsContact O-N 3.12Å; C164-S182 PolarHBondContact SG-O 3.3Å; G166-S182 VanDerWaalsContact N-CB 3.34Å; Y168-S182 WeakPolarHBondContact OH-CB 3.32Å; Y168-S182 PolarHBondContact OH-OG 3Å; G180-S182 PolarHBondContact O-N 3.19Å; S182-Q202 PolarHBondContact OG-NE2 3.4Å
183W90.9Very high92.7Very high79 Ų7966.9 Ų66.930%0.29933%0.332SS..  trans-122.2159.7-179.3-63.494.2000110.8K161 R163 N181 N185 M186 Q202K161-W183 WeakPolarHBondContact O-CZ3 3.44Å; R163-W183 HydrophobicContact CG-CD2 4.04Å; R163-W183 HydrophobicContact CG-CE3 4.15Å; R163-W183 HydrophobicContact CG-CH2 3.47Å; R163-W183 VanDerWaalsContact CG-CH2 3.47Å; R163-W183 HydrophobicContact CG-CZ2 3.33Å; R163-W183 HydrophobicContact CG-CZ3 3.86Å; N181-W183 PolarHBondContact OD1-NE1 3.34Å; W183-N185 PolarHBondContact O-N 3.48Å; W183-M186 HydrophobicContact CB-CB 4.23Å; W183-M186 HydrophobicContact CB-CG 4.25Å; W183-M186 HydrophobicContact CB-SD 4.04Å; W183-M186 HydrophobicContact CG-SD 4.38Å; W183-Q202 PolarHBondContact O-NE2 2.95Å
184A90.1Very high92.6Very high22 Ų2271.1 Ų71.118%0.18235%0.348CS..THydrogen-bonded Turntrans-60.9135.6169.800000109.9T156 Y158 G160 M186T156-A184 WeakPolarHBondContact OG1-CA 3.42Å; Y158-A184 HydrophobicContact CD1-CB 4.2Å; Y158-A184 WeakPolarHBondContact O-CA 3.49Å; Y158-A184 VanDerWaalsContact O-CB 3.25Å; Y158-A184 WeakPolarHBondContact O-CB 3.26Å; G160-A184 WeakPolarHBondContact O-CB 3.41Å; A184-M186 PolarHBondContact O-N 2.76Å; A184-M186 VanDerWaalsContact O-N 3.1Å
185N88.3Confident92.5Very high63 Ų6366.4 Ų66.434%0.33733%0.329SS..THydrogen-bonded Turntrans63.512.8173.3-53.1-39.3000115.8G154 L155 T156 Q159 W183G154-N185 WeakPolarHBondContact CA-OD1 3.25Å; L155-N185 PolarHBondContact N-OD1 3.48Å; T156-N185 PolarHBondContact OG1-N 3.16Å; Q159-N185 PolarHBondContact NE2-OD1 2.88Å; Q159-N185 PolarHBondContact OE1-ND2 3.23Å; Q159-N185 PolarHBondContact OE1-OD1 3.32Å; W183-N185 PolarHBondContact O-N 3.48Å
186M88.3Confident92.5Very high94 Ų9466.6 Ų66.646%0.46334%0.336SS..  trans-116.5140.6175.9-59.2-173.783.400111.1W183 A184W183-M186 HydrophobicContact CB-CB 4.23Å; W183-M186 HydrophobicContact CB-CG 4.25Å; W183-M186 HydrophobicContact CB-SD 4.04Å; W183-M186 HydrophobicContact CG-SD 4.38Å; A184-M186 PolarHBondContact O-N 2.76Å; A184-M186 VanDerWaalsContact O-N 3.1Å
187G91.9Very high92.5Very high16 Ų1659.8 Ų59.817%0.16531%0.307CS..  trans-98.9-179.2170.600000111.5N196 V197G187-N196 WeakPolarHBondContact CA-OD1 3.4Å; G187-V197 CarbonylContact C-O 3.6Å; G187-V197 WeakPolarHBondContact CA-O 3.24Å
188Q94.1Very high92.5Very high42 Ų4262.6 Ų62.620%0.19632%0.318CS..EExtended strand (participates in β ladder)trans-126.5146170-73.5-176.91.600109.4Y168 S179 N181 C190 N196 V197Y168-Q188 HydrophobicContact CD1-CB 4.33Å; Y168-Q188 HydrophobicContact CE1-CB 3.84Å; Y168-Q188 HydrophobicContact CE1-CG 3.91Å; Y168-Q188 PolarHBondContact OH-NE2 2.91Å; S179-Q188 PolarHBondContact OG-NE2 2.89Å; N181-Q188 PolarHBondContact O-NE2 3.19Å; Q188-C190 PolarHBondContact O-N 3.43Å; Q188-N196 PolarHBondContact N-OD1 2.99Å; Q188-V197 PolarHBondContact N-O 3.36Å; Q188-V197 PolarHBondContact O-N 2.87Å
189E95.6Very high92.5Very high107 Ų10756.3 Ų56.350%0.529%0.287SS..EExtended strand (participates in β ladder)trans-68.5129.7176.5-168.5-179.588.700111.3I191 H194 I195E189-I191 PolarHBondContact O-N 3.45Å; E189-H194 HydrophobicContact CG-CB 4.42Å; E189-H194 IonicContact OE1-CE1 3.74Å; E189-H194 IonicContact OE1-CG 3.7Å; E189-H194 IonicContact OE1-ND1 2.76Å; E189-H194 PolarHBondContact OE1-ND1 3.45Å; E189-I195 WeakPolarHBondContact CA-O 3.28Å
190C95.9Very high92.6Very high0 Ų059.4 Ų59.40%030%0.299CS..  trans-73113.3169.3-179.70000110.6C170 W177 Q188 K192 C193 H194 I195 V197C170-C190 HydrophobicContact CB-CB 4.24Å; W177-C190 HydrophobicContact CH2-CB 3.95Å; Q188-C190 PolarHBondContact O-N 3.43Å; C190-K192 PolarHBondContact O-N 2.87Å; C190-C193 HydrophobicContact CB-CB 4.27Å; C190-C193 PolarHBondContact O-N 3.39Å; C190-H194 WeakPolarHBondContact O-CA 3.49Å; C190-H194 PolarHBondContact O-N 2.6Å; C190-I195 HydrophobicContact CB-CG1 4.3Å; C190-I195 PolarHBondContact N-O 2.91Å; C190-V197 HydrophobicContact CB-CG2 4.04Å
191I93.4Very high92.7Very high118 Ų11863.2 Ų63.261%0.60531%0.307SS*.THydrogen-bonded Turntrans-51.3-20.4178.266.6174.1000116.6E189E189-I191 PolarHBondContact O-N 3.45Å
192K92.6Very high92.7Very high156 Ų15661.9 Ų61.968%0.67830%0.299SS*.THydrogen-bonded Turntrans-97.3-28.5179.5-179.2170-179.4177.10112.8C173 C190C173-K192 HydrophobicContact CB-CD 3.94Å; C173-K192 HydrophobicContact CB-CG 4.39Å; C190-K192 PolarHBondContact O-N 2.87Å
193C93.2Very high92.6Very high35 Ų3568.4 Ų68.424%0.23632%0.324CS..THydrogen-bonded Turntrans-117.3-9.2-170.1-66.30000113.3K172 C173 C190 I195K172-C193 HydrophobicContact CB-CB 4.35Å; K172-C193 HydrophobicContact CD-CB 4.28Å; C173-C193 VanDerWaalsContact CB-SG 3.52Å; C173-C193 VanDerWaalsContact SG-SG 3.64Å; C190-C193 HydrophobicContact CB-CB 4.27Å; C190-C193 PolarHBondContact O-N 3.39Å; C193-I195 HydrophobicContact CB-CG1 3.89Å; C193-I195 PolarHBondContact O-N 3.37Å
194H95Very high92.4Very high126 Ų12668.9 Ų68.958%0.58334%0.337SS*.  trans45.745.4-175.1-57.7-70.9000112.4E189 C190E189-H194 HydrophobicContact CG-CB 4.42Å; E189-H194 IonicContact OE1-CE1 3.74Å; E189-H194 IonicContact OE1-CG 3.7Å; E189-H194 IonicContact OE1-ND1 2.76Å; E189-H194 PolarHBondContact OE1-ND1 3.45Å; C190-H194 WeakPolarHBondContact O-CA 3.49Å; C190-H194 PolarHBondContact O-N 2.6Å
195I94Very high91.8Very high34 Ų3471.3 Ų71.317%0.17435%0.347CS..  trans-118.6145173.258.6162.6000109.3P171 K172 E189 C190 C193 V197P171-I195 HydrophobicContact CG-CD1 3.77Å; K172-I195 HydrophobicContact CB-CD1 4.27Å; K172-I195 HydrophobicContact CD-CD1 3.8Å; K172-I195 HydrophobicContact CD-CG1 4.44Å; K172-I195 HydrophobicContact CD-CG2 4.11Å; K172-I195 HydrophobicContact CG-CD1 3.77Å; E189-I195 WeakPolarHBondContact CA-O 3.28Å; C190-I195 HydrophobicContact CB-CG1 4.3Å; C190-I195 PolarHBondContact N-O 2.91Å; C193-I195 HydrophobicContact CB-CG1 3.89Å; C193-I195 PolarHBondContact O-N 3.37Å; I195-V197 HydrophobicContact CD1-CG2 4.14Å; I195-V197 HydrophobicContact CG1-CG2 3.98Å; I195-V197 PolarHBondContact O-N 3.49Å
196N95.6Very high91Very high85 Ų8576.8 Ų76.846%0.45537%0.371SS..EExtended strand (participates in β ladder)trans-66.9126.6171-173.136.3000110.4G187 Q188 Y198G187-N196 WeakPolarHBondContact CA-OD1 3.4Å; Q188-N196 PolarHBondContact N-OD1 2.99Å; N196-Y198 PolarHBondContact ND2-OH 3.47Å
197V95.3Very high89.7Confident6 Ų680.6 Ų80.64%0.03639%0.385CS..EExtended strand (participates in β ladder)trans-124.3121.3-179.5179.70000109.2Y168 K169 C170 W177 G187 Q188 C190 I195Y168-V197 HydrophobicContact CD1-CG1 4.4Å; Y168-V197 VanDerWaalsContact CD1-O 3.23Å; Y168-V197 WeakPolarHBondContact CD1-O 3.41Å; Y168-V197 VanDerWaalsContact CE1-O 3.27Å; Y168-V197 WeakPolarHBondContact CE1-O 3.12Å; K169-V197 WeakPolarHBondContact O-CG1 3.21Å; C170-V197 HydrophobicContact CB-CG2 4.35Å; W177-V197 HydrophobicContact CH2-CB 3.75Å; W177-V197 HydrophobicContact CH2-CG1 3.79Å; W177-V197 HydrophobicContact CH2-CG2 3.9Å; W177-V197 HydrophobicContact CZ2-CB 4.02Å; W177-V197 HydrophobicContact CZ2-CG1 4.25Å; G187-V197 CarbonylContact C-O 3.6Å; G187-V197 WeakPolarHBondContact CA-O 3.24Å; Q188-V197 PolarHBondContact N-O 3.36Å; Q188-V197 PolarHBondContact O-N 2.87Å; C190-V197 HydrophobicContact CB-CG2 4.04Å; I195-V197 HydrophobicContact CD1-CG2 4.14Å; I195-V197 HydrophobicContact CG1-CG2 3.98Å; I195-V197 PolarHBondContact O-N 3.49Å
198Y95Very high87.9Confident91 Ų9185 Ų8536%0.35741%0.41SS..  trans-77.7145.5175.4-67.3-77.8000111.8L155 T156 N196L155-Y198 HydrophobicContact CB-CD1 4.02Å; L155-Y198 HydrophobicContact CB-CE1 3.79Å; L155-Y198 HydrophobicContact CD1-CE1 3.87Å; L155-Y198 HydrophobicContact CD1-CE2 4.3Å; L155-Y198 VanDerWaalsContact CD1-OH 3.25Å; L155-Y198 WeakPolarHBondContact CD1-OH 3.23Å; L155-Y198 HydrophobicContact CG-CE1 4.49Å; T156-Y198 HydrophobicContact CG2-CD1 3.69Å; T156-Y198 HydrophobicContact CG2-CE1 4.5Å; T156-Y198 HydrophobicContact CG2-CG 4.5Å; N196-Y198 PolarHBondContact ND2-OH 3.47Å
199P93.9Very high85.8Confident4 Ų491.3 Ų91.33%0.02645%0.445CS..EExtended strand (participates in β ladder)trans-67.7135.6174.929.1-34000110.3T156 P157 E167 Y168 Q202T156-P199 HydrophobicContact CG2-CG 3.94Å; P157-P199 VanDerWaalsContact CD-O 3.3Å; P157-P199 WeakPolarHBondContact CD-O 3.24Å; E167-P199 CarbonylContact O-C 3.53Å; E167-P199 VanDerWaalsContact O-CA 3.24Å; E167-P199 WeakPolarHBondContact O-CA 3.27Å; Y168-P199 HydrophobicContact CD1-CB 4.13Å; Y168-P199 HydrophobicContact CD2-CB 4.48Å; Y168-P199 HydrophobicContact CE1-CB 3.8Å; Y168-P199 HydrophobicContact CE1-CG 4.09Å; Y168-P199 HydrophobicContact CE2-CB 4.14Å; Y168-P199 HydrophobicContact CG-CB 4.46Å; P199-Q202 HydrophobicContact CB-CG 3.78Å; P199-Q202 VanDerWaalsContact CG-CD 3.43Å; P199-Q202 HydrophobicContact CG-CG 3.64Å
200H92.1Very high84Confident93 Ų9389.8 Ų89.843%0.43146%0.458SS..EExtended strand (participates in β ladder)trans-89.1-16.7177.568.3-74000112.5E167E167-H200 VanDerWaalsContact C-ND1 3.33Å; E167-H200 VanDerWaalsContact CB-CE1 3.49Å; E167-H200 WeakPolarHBondContact CB-CE1 3.23Å; E167-H200 PolarHBondContact O-CE1 3.12Å; E167-H200 PolarHBondContact O-N 3.46Å; E167-H200 PolarHBondContact O-ND1 3.03Å; E167-H200 IonicContact OE2-NE2 3.98Å
201K90.5Very high81.9Confident107 Ų10796.5 Ų96.547%0.46549%0.493SS..EExtended strand (participates in β ladder)trans-140.6143.4168.5-56.9-177.4-160.2155.30108.7G166 E167G166-K201 CarbonylContact C-O 3.58Å; G166-K201 WeakPolarHBondContact CA-O 3.38Å; E167-K201 HydrophobicContact CB-CB 4.2Å; E167-K201 HydrophobicContact CG-CB 4.46Å; E167-K201 PolarHBondContact N-O 3.48Å; E167-K201 WeakPolarHBondContact OE2-CD 3.33Å; E167-K201 IonicContact OE2-NZ 3.21Å; E167-K201 PolarHBondContact OE2-NZ 2.94Å
202Q91Very high80Confident21 Ų2194.5 Ų94.510%0.09848%0.484CS..EExtended strand (participates in β ladder)trans-134.6127.8173.5-77.2174.6-5800108.5T156 Y158 F165 S182 W183 P199T156-Q202 PolarHBondContact OG1-OE1 2.79Å; Y158-Q202 VanDerWaalsContact CB-OE1 3.23Å; F165-Q202 CarbonylContact O-C 3.49Å; F165-Q202 VanDerWaalsContact O-CA 3.26Å; F165-Q202 WeakPolarHBondContact O-CA 3.38Å; S182-Q202 PolarHBondContact OG-NE2 3.4Å; W183-Q202 PolarHBondContact O-NE2 2.95Å; P199-Q202 HydrophobicContact CB-CG 3.78Å; P199-Q202 VanDerWaalsContact CG-CD 3.43Å; P199-Q202 HydrophobicContact CG-CG 3.64Å
203R88.9Confident78.2Confident137 Ų13792.9 Ų92.952%0.51749%0.487SS..EExtended strand (participates in β ladder)trans-119.4125.5180-71-175.9-81.7159.3-5.9108.6C164 F165 E167 L205C164-R203 CarbonylContact C-O 3.55Å; C164-R203 WeakPolarHBondContact CA-O 3.44Å; C164-R203 VanDerWaalsContact CB-O 3.24Å; C164-R203 WeakPolarHBondContact CB-O 3.36Å; F165-R203 PolarHBondContact N-O 3.28Å; F165-R203 PolarHBondContact O-N 3.31Å; E167-R203 IonicContact OE1-CZ 3.47Å; E167-R203 IonicContact OE1-NE 3.43Å; E167-R203 PolarHBondContact OE1-NE 2.7Å; E167-R203 IonicContact OE1-NH2 2.79Å; E167-R203 PolarHBondContact OE1-NH2 3.44Å; R203-L205 PolarHBondContact O-N 3.18Å
204P86.3Confident76.2Confident89 Ų8992.3 Ų92.358%0.57848%0.483SS*.EExtended strand (participates in β ladder)trans-49.9139.9174-26.635.2000111.1E206P204-E206 PolarHBondContact O-N 3.48Å
205L77.6Confident74.1Confident73 Ų7390.7 Ų90.738%0.38248%0.479SS..  trans-74.7112168.9-83.1134000107.8R163 F165 G180 R203R163-L205 HydrophobicContact CB-CD1 4.09Å; F165-L205 HydrophobicContact CD2-CD2 3.5Å; F165-L205 HydrophobicContact CD2-CG 3.66Å; F165-L205 HydrophobicContact CE2-CD2 3.18Å; F165-L205 HydrophobicContact CE2-CG 3.91Å; F165-L205 HydrophobicContact CG-CD2 4.44Å; F165-L205 HydrophobicContact CG-CG 4.41Å; F165-L205 HydrophobicContact CZ-CD2 3.9Å; G180-L205 WeakPolarHBondContact O-CD1 3.43Å; R203-L205 PolarHBondContact O-N 3.18Å
206E71.4Confident72.1Confident179 Ų17995.1 Ų95.184%0.83650%0.498SS*.PPolyproline II helixtrans-75.9122.1162.6-70.3178.4-174.600107.2P204 P208P204-E206 PolarHBondContact O-N 3.48Å; E206-P208 VanDerWaalsContact O-CD 3.28Å; E206-P208 WeakPolarHBondContact O-CD 3.15Å
207K59.9Low70.1Confident174 Ų17495.2 Ų95.276%0.75751%0.506SS*.PPolyproline II helixtrans-79.6116.2167.4-64.4-173.9179.5-169.60105.9D209K207-D209 PolarHBondContact O-N 3.4Å
208P54.3Low68.1Low107 Ų107101.1 Ų101.170%0.69553%0.531SS*.PPolyproline II helixtrans-57.7125159.324.1-28.9000106.7E206 G210E206-P208 VanDerWaalsContact O-CD 3.28Å; E206-P208 WeakPolarHBondContact O-CD 3.15Å; P208-G210 PolarHBondContact O-N 2.97Å
209D51.5Low66Low176 Ų176105.7 Ų105.794%0.94156%0.556SS**THydrogen-bonded Turntrans-63.3105.7179.8-155.717.2000107.9K207K207-D209 PolarHBondContact O-N 3.4Å
210G57.4Low64.1Low74 Ų74109.4 Ų109.476%0.76357%0.573SS**THydrogen-bonded Turntrans92.846168.200000118.9P208P208-G210 PolarHBondContact O-N 2.97Å
211L50.8Low62.7Low141 Ų141107.8 Ų107.874%0.73857%0.571SS**  trans-137.167.6161.5-162.666.5000111.6V213L211-V213 HydrophobicContact CD1-CG2 3.78Å; L211-V213 HydrophobicContact CG-CG2 4.02Å; L211-V213 PolarHBondContact O-N 3.03Å
212D53.8Low61.1Low76 Ų76110.1 Ų110.141%0.40658%0.583SS.*  trans-83.293.3164.9-172.117.7000108.4S214D212-S214 WeakPolarHBondContact OD1-CB 3.05Å; D212-S214 PolarHBondContact OD1-N 3.28Å
213V55.7Low59.4Low123 Ų123116.8 Ų116.875%0.74561%0.614SS**  trans-118.737.4162.9-146.50000109.5L211L211-V213 HydrophobicContact CD1-CG2 3.78Å; L211-V213 HydrophobicContact CG-CG2 4.02Å; L211-V213 PolarHBondContact O-N 3.03Å
214S50.3Low57.8Low22 Ų22116 Ų11615%0.15462%0.619CS.*SBendtrans-89.9122.6171.6-780000107.5D212 Q216 I239 V240D212-S214 WeakPolarHBondContact OD1-CB 3.05Å; D212-S214 PolarHBondContact OD1-N 3.28Å; S214-Q216 PolarHBondContact O-N 3.43Å; S214-I239 VanDerWaalsContact CB-C 3.47Å; S214-I239 WeakPolarHBondContact OG-CG2 3.45Å; S214-V240 CarbonylContact C-O 3.32Å; S214-V240 WeakPolarHBondContact CA-O 3.27Å; S214-V240 WeakPolarHBondContact CB-O 3.06Å; S214-V240 VanDerWaalsContact CB-OXT 3.27Å; S214-V240 WeakPolarHBondContact CB-OXT 3.44Å; S214-V240 WeakPolarHBondContact OG-CA 3.13Å; S214-V240 PolarHBondContact OG-N 2.9Å; S214-V240 PolarHBondContact OG-O 3.17Å; S214-V240 PolarHBondContact OG-OXT 2.77Å
215D50.3Low56.5Low93 Ų93112.6 Ų112.650%0.49760%0.598SS.*  trans-69.1104.4-172.2-162-20.4000108.1S217 K218 V240D215-S217 VanDerWaalsContact CG-OG 3.25Å; D215-S217 PolarHBondContact O-N 3.41Å; D215-S217 PolarHBondContact OD1-OG 3.5Å; D215-K218 PolarHBondContact O-N 2.88Å; D215-V240 PolarHBondContact N-O 2.97Å
216Q52.8Low55.7Low126 Ų126116.9 Ų116.959%0.58962%0.616SS**THydrogen-bonded Turntrans-58.8-7.3-175.8-60.5178.98.800113.2S214S214-Q216 PolarHBondContact O-N 3.43Å
217S53.1Low54.7Low88 Ų88113 Ų11362%0.61560%0.596SS**THydrogen-bonded Turntrans-88.2-9.417669.20000114.6D215 E219D215-S217 VanDerWaalsContact CG-OG 3.25Å; D215-S217 PolarHBondContact O-N 3.41Å; D215-S217 PolarHBondContact OD1-OG 3.5Å; S217-E219 PolarHBondContact O-N 3.36Å
218K53.7Low54.2Low129 Ų129113.8 Ų113.856%0.56160%0.599SS**SBendtrans-78.4112.2-179.6-84.6-178.6-179.5164.70111.7D215 H220D215-K218 PolarHBondContact O-N 2.88Å; K218-H220 PolarHBondContact O-N 3.06Å
219E51.5Low53.8Low188 Ų188113.8 Ų113.888%0.87960%0.602SS**  trans-56.7128.8174.2-66-170.316900111.6S217S217-E219 PolarHBondContact O-N 3.36Å
220H53.4Low53.1Low81 Ų81110.3 Ų110.338%0.37558%0.584SS.*  trans-59.5129.8175.1165.165.9000110.5K218 Q222 C225K218-H220 PolarHBondContact O-N 3.06Å; H220-Q222 VanDerWaalsContact C-N 3.31Å; H220-Q222 PolarHBondContact O-N 3.32Å; H220-C225 WeakPolarHBondContact NE2-CB 3.43Å; H220-C225 PolarHBondContact NE2-SG 3.09Å
221P62.3Low52.6Low60 Ų60113.7 Ų113.739%0.3958%0.584SS.*  trans-71.486.5176.726.7-32.5000111H223 L224P221-H223 PolarHBondContact O-N 2.79Å; P221-L224 HydrophobicContact CB-CD1 4.21Å; P221-L224 HydrophobicContact CG-CD1 4.34Å; P221-L224 PolarHBondContact O-N 3Å; P221-L224 VanDerWaalsContact O-N 3.09Å
222Q57.1Low52.3Low156 Ų156113.8 Ų113.873%0.72958%0.576SS**G310 helixtrans-58.2-31.6-176.7-71.9176.55.500113.2H220 L224 C225H220-Q222 VanDerWaalsContact C-N 3.31Å; H220-Q222 PolarHBondContact O-N 3.32Å; Q222-L224 PolarHBondContact O-N 2.99Å; Q222-C225 PolarHBondContact O-N 3.22Å
223H54.9Low51.9Low161 Ų161113.3 Ų113.375%0.74558%0.578SS**G310 helixtrans-63.1-8.7177.974.5-82000114.2P221P221-H223 PolarHBondContact O-N 2.79Å
224L56.5Low51.4Low120 Ų120113.9 Ų113.963%0.62858%0.576SS**G310 helixtrans-111.23.4177.7-57.8175.8000112.8P221 Q222P221-L224 HydrophobicContact CB-CD1 4.21Å; P221-L224 HydrophobicContact CG-CD1 4.34Å; P221-L224 PolarHBondContact O-N 3Å; P221-L224 VanDerWaalsContact O-N 3.09Å; Q222-L224 PolarHBondContact O-N 2.99Å
225C59.3Low50.9Low18 Ų18119.8 Ų119.812%0.12260%0.601CS.*  trans-119.8109.2-172.6-167.40000110.9H220 Q222 K227H220-C225 WeakPolarHBondContact NE2-CB 3.43Å; H220-C225 PolarHBondContact NE2-SG 3.09Å; Q222-C225 PolarHBondContact O-N 3.22Å; C225-K227 VanDerWaalsContact C-N 3.26Å; C225-K227 PolarHBondContact O-N 2.69Å
226E60.4Low50.9Low163 Ų163121 Ų12176%0.76260%0.604SS**  trans-85.59.2-177.2-65.6178.7169.300113.7F228E226-F228 VanDerWaalsContact C-N 3.28Å; E226-F228 PolarHBondContact O-N 2.85Å
227K49.6Very low50.3Low98 Ų98117.9 Ų117.943%0.42660%0.596SS.*  trans-84.176.5172.1-162.5-178-179-173.70109C225 S229C225-K227 VanDerWaalsContact C-N 3.26Å; C225-K227 PolarHBondContact O-N 2.69Å; K227-S229 PolarHBondContact O-N 2.95Å
228F49.5Very low49.7Very low189 Ų189115.7 Ų115.783%0.82958%0.58SS**  trans-72.3126.4171.1-92.3-91.8000110.1E226E226-F228 VanDerWaalsContact C-N 3.28Å; E226-F228 PolarHBondContact O-N 2.85Å
229S44.9Very low49.1Very low108 Ų108114.4 Ų114.476%0.75558%0.579SS**SBendtrans7262.6161.2-165.40000117.8K227K227-S229 PolarHBondContact O-N 2.95Å
230D38.3Very low48.4Very low103 Ų103111.3 Ų111.355%0.55157%0.572SS**  trans-147.1144.5147.6-74.5-49.3000109Y232 C233D230-Y232 HydrophobicContact CB-CD2 4.07Å; D230-Y232 PolarHBondContact O-N 3.28Å; D230-C233 PolarHBondContact O-N 2.76Å
231D45.4Very low48.2Very low145 Ų145112.8 Ų112.878%0.77558%0.582SS**G310 helixtrans-50.1-4.4178.8-67.6-40000115.6C233 L234D231-C233 VanDerWaalsContact C-N 3.25Å; D231-C233 PolarHBondContact O-N 3.48Å; D231-L234 PolarHBondContact O-N 3.39Å
232Y45Very low47.5Very low142 Ų142115.6 Ų115.656%0.55759%0.592SS**G310 helixtrans-63.7-17.6171.4-84-86.9000115.6D230 L234D230-Y232 HydrophobicContact CB-CD2 4.07Å; D230-Y232 PolarHBondContact O-N 3.28Å; Y232-L234 VanDerWaalsContact C-N 3.34Å
233C45.8Very low46.9Very low67 Ų67113.3 Ų113.345%0.45358%0.584SS.*G310 helixtrans-73.5-25177.4-76.50000113D230 D231D230-C233 PolarHBondContact O-N 2.76Å; D231-C233 VanDerWaalsContact C-N 3.25Å; D231-C233 PolarHBondContact O-N 3.48Å
234L44.7Very low46.5Very low134 Ų134110.5 Ų110.570%0.70258%0.575SS**THydrogen-bonded Turntrans-79-25.8-179.2-78.9160000113.1D231 Y232 H236 S237D231-L234 PolarHBondContact O-N 3.39Å; Y232-L234 VanDerWaalsContact C-N 3.34Å; L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 2.63Å; L234-S237 PolarHBondContact O-OG 3.49Å
235E41.3Very low45.8Very low146 Ų146109.9 Ų109.968%0.68257%0.572SS**THydrogen-bonded Turntrans-82-8.9-176.3-145.9-179.9-163.800113.7
236H49.3Very low44.9Very low119 Ų119116.1 Ų116.155%0.55160%0.602SS**THydrogen-bonded Turntrans-119.820.7-177.7-69.684.2000113L234 S238L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 2.63Å; H236-S238 PolarHBondContact O-N 3.13Å
237S41Very low43.8Very low60 Ų60112.7 Ų112.742%0.4259%0.59SS.*THydrogen-bonded Turntrans-71.3-10.5171.856.50000113.4L234L234-S237 PolarHBondContact O-OG 3.49Å
238S39.2Very low43.4Very low42 Ų42113.8 Ų113.829%0.29460%0.603SS.*THydrogen-bonded Turntrans-92.40.3-167.7-53.80000116.9H236H236-S238 PolarHBondContact O-N 3.13Å
239I41.9Very low42.9Very low103 Ų103107.6 Ų107.653%0.52858%0.584SS.*  trans-141.276.2-176.2-43.8179000113.5S214S214-I239 VanDerWaalsContact CB-C 3.47Å; S214-I239 WeakPolarHBondContact OG-CG2 3.45Å
240V37.7Very low42.7Very low122 Ų122107.5 Ų107.574%0.73957%0.568SS**  trans-119.90148.6-171.10000113.7S214 D215S214-V240 CarbonylContact C-O 3.32Å; S214-V240 WeakPolarHBondContact CA-O 3.27Å; S214-V240 WeakPolarHBondContact CB-O 3.06Å; S214-V240 VanDerWaalsContact CB-OXT 3.27Å; S214-V240 WeakPolarHBondContact CB-OXT 3.44Å; S214-V240 WeakPolarHBondContact OG-CA 3.13Å; S214-V240 PolarHBondContact OG-N 2.9Å; S214-V240 PolarHBondContact OG-O 3.17Å; S214-V240 PolarHBondContact OG-OXT 2.77Å; D215-V240 PolarHBondContact N-O 2.97Å

Retrieved 240 of 240 residues in 47.8 ms (Link to these results)