A0A061IL22_CRIGR Loading...

Zinc finger protein

AlphaFold DB , UniProt , Accession A0A061IL22, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 386 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
1M39.1Very low42.6Very low234 Ų234139 Ų139100%1.15382%0.823SS**  0103.10-60.6163.3-175.300105.2
2I40Very low42.9Very low153 Ų153141.5 Ų141.579%0.78583%0.828SS**  cis77.8124.146.3-58.8179.4000112.5
3L44Very low43.3Very low172 Ų172139.9 Ų139.990%0.90183%0.825SS**  trans65.9147.9168.6-69.7158.4000117.2
4G36.2Very low43.1Very low60 Ų60140.6 Ų140.662%0.61982%0.822SS**  cis178.3129.9-5.800000114
5S45.7Very low43.1Very low115 Ų115142 Ų14280%0.80482%0.824SS**  trans23.6132.1136.9-49.30000122.8
6L46.5Very low43Very low161 Ų161148.4 Ų148.484%0.84383%0.83SS**  -175.9114.7125-99.4133.2000108.2
7S46.2Very low43.3Very low107 Ų107149.9 Ų149.975%0.74883%0.829SS**  73.914796.6-68.50000114.8
8R43.3Very low43.2Very low237 Ų237148.3 Ų148.389%0.89483%0.827SS**  cis-177.2149.2-0.7159180176.6-173.8-1.3105.8
9A38.5Very low43.3Very low92 Ų92147.1 Ų147.176%0.7683%0.826SS**  cis-153.7-179.87.300000110.8
10G36.5Very low43.6Very low69 Ų69147.7 Ų147.771%0.71183%0.825SS**  trans-139.1153.5154.200000110.4
11P52.3Low43.8Very low129 Ų129148.6 Ų148.684%0.83883%0.825SS**  trans-99.2135.6-179.97.413.2000113.4
12L46.2Very low43.9Very low169 Ų169145.6 Ų145.689%0.88581%0.808SS**  trans-96.3153.6156.1-67.8174.2000109.1
13P48.7Very low44.3Very low121 Ų121142.8 Ų142.879%0.78680%0.8SS**  -140.5172.2108.438.3-27.1000111.4
14L41Very low44.5Very low150 Ų150140.7 Ų140.779%0.78580%0.797SS**  cis168.7141.3-22.7-176.978.2000103.8
15L43Very low44.9Very low161 Ų161145 Ų14584%0.84380%0.802SS**  trans67.8133.1-178.6-47.9-178.5000114.2
16R40.3Very low44.6Very low244 Ų244144 Ų14492%0.92179%0.788SS**  -166.3159.150.2-173.4167.3172.1152.7-5.1110.6
17Q48.3Very low44.8Very low174 Ų174144.1 Ų144.181%0.81379%0.789SS**PPolyproline II helixtrans-64.5153.2-177.1-62.7157.1-28.300113.8
18P41.6Very low44.7Very low122 Ų122145.9 Ų145.979%0.79278%0.783SS**PPolyproline II helixtrans-81.5125163.632.3-30.7000111.1
19P45.4Very low44.6Very low124 Ų124142.9 Ų142.981%0.80578%0.779SS**PPolyproline II helixtrans-82149.3168.332.9-32.6000111.7
20I50.3Low44.8Very low159 Ų159145.9 Ų145.982%0.81578%0.781SS**PPolyproline II helixtrans-83.2142.2174.8-71.5169.3000110.1
21M46Very low45.1Very low167 Ų167148.3 Ų148.382%0.82378%0.777SS**  trans58.2121.6167-74.1-174.276.100120
22Q42.8Very low44.5Very low172 Ų172147.8 Ų147.880%0.80477%0.773SS**  -143.7149.6125.9-81.3-147.2-20.100111.7
23P48.1Very low43.9Very low93 Ų93147.4 Ų147.460%0.60477%0.765SS**PPolyproline II helixtrans-77.3169.9176.633-35.4000112.9
24P47.8Very low43.7Very low129 Ų129147.5 Ų147.584%0.83877%0.766SS**PPolyproline II helixtrans-73.5152.7-160.528.6-36.6000115.4
25M43.5Very low43.9Very low149 Ų149147.6 Ų147.673%0.73477%0.766SS**PPolyproline II helixtrans-76.3131.7-176.4-59.8-70.294.200113.7
26D41.3Very low43.7Very low95 Ų95146.2 Ų146.251%0.50876%0.755SS.*  trans49.973.4135.4-166-124.2000118.3K28D26-K28 PolarHBondContact O-N 3.47Å; D26-K28 WeakPolarHBondContact OD1-CD 3.32Å; D26-K28 VanDerWaalsContact OD1-CE 3.3Å; D26-K28 WeakPolarHBondContact OD1-CE 3.5Å; D26-K28 IonicContact OD1-NZ 3.73Å; D26-K28 PolarHBondContact OD1-NZ 3.11Å
27L49.3Very low43.7Very low163 Ų163139.8 Ų139.885%0.85375%0.745SS**  trans-75.4112.1151.9-18059.7000108.6Q29L27-Q29 PolarHBondContact O-N 3.33Å; L27-Q29 VanDerWaalsContact O-N 3.14Å
28K45.5Very low43.5Very low144 Ų144135 Ų13563%0.62674%0.735SS**  trans-47.9116.9-175.5-84.156.6176.8159.80111.7D26 I30D26-K28 PolarHBondContact O-N 3.47Å; D26-K28 WeakPolarHBondContact OD1-CD 3.32Å; D26-K28 VanDerWaalsContact OD1-CE 3.3Å; D26-K28 WeakPolarHBondContact OD1-CE 3.5Å; D26-K28 IonicContact OD1-NZ 3.73Å; D26-K28 PolarHBondContact OD1-NZ 3.11Å; K28-I30 PolarHBondContact O-N 3.4Å
29Q39.9Very low43.7Very low174 Ų174133.4 Ų133.481%0.81373%0.725SS**  trans-3.288.7152.6-59.5174.810.700114.7L27 L31L27-Q29 PolarHBondContact O-N 3.33Å; L27-Q29 VanDerWaalsContact O-N 3.14Å; Q29-L31 PolarHBondContact O-N 3.07Å
30I42.6Very low43.9Very low155 Ų155133.8 Ų133.880%0.79573%0.725SS**  trans-73.4110155.9-60.2170.8000105.2K28 P32K28-I30 PolarHBondContact O-N 3.4Å; I30-P32 WeakPolarHBondContact O-CD 3.38Å
31L42.4Very low43.7Very low120 Ų120131.1 Ų131.163%0.62871%0.712SS**  trans-47.9120.9176.3-72.5164.9000110.2Q29 F33Q29-L31 PolarHBondContact O-N 3.07Å; L31-F33 HydrophobicContact CB-CD2 4.3Å; L31-F33 HydrophobicContact CB-CE2 4.31Å; L31-F33 PolarHBondContact O-N 3.41Å
32P41.1Very low43.7Very low118 Ų118127.4 Ų127.477%0.76672%0.716SS**  trans-70.590160.130.1-30000106.6I30 P34I30-P32 WeakPolarHBondContact O-CD 3.38Å; P32-P34 VanDerWaalsContact O-CD 3.26Å; P32-P34 WeakPolarHBondContact O-CD 3.39Å; P32-P34 VanDerWaalsContact O-N 3.12Å
33F33.7Very low44.4Very low162 Ų162125.8 Ų125.871%0.71171%0.712SS**  trans-52.4119.8168.5-83.5-89.6000108L31 L35L31-F33 HydrophobicContact CB-CD2 4.3Å; L31-F33 HydrophobicContact CB-CE2 4.31Å; L31-F33 PolarHBondContact O-N 3.41Å; F33-L35 PolarHBondContact O-N 2.78Å
34P44.6Very low44.4Very low123 Ų123127.4 Ų127.480%0.79971%0.71SS**  trans-72.984.6168.1115.9000106.1P32 E36P32-P34 VanDerWaalsContact O-CD 3.26Å; P32-P34 WeakPolarHBondContact O-CD 3.39Å; P32-P34 VanDerWaalsContact O-N 3.12Å; P34-E36 PolarHBondContact O-N 2.96Å
35L43.8Very low44.8Very low152 Ų152127 Ų12780%0.79671%0.711SS**  trans-76.878.1172.3-14582000107.6F33 P37F33-L35 PolarHBondContact O-N 2.78Å; L35-P37 VanDerWaalsContact O-CD 3.23Å; L35-P37 WeakPolarHBondContact O-CD 3.41Å; L35-P37 VanDerWaalsContact O-N 3.09Å
36E40.2Very low45.5Very low132 Ų132124.7 Ų124.762%0.61770%0.701SS**  trans-46.3109.9170.5-135.3-68.1121.400108.3P34 A38P34-E36 PolarHBondContact O-N 2.96Å; E36-A38 PolarHBondContact O-N 2.77Å; E36-A38 WeakPolarHBondContact OE2-CA 3.5Å
37P40.3Very low46.5Very low108 Ų108126 Ų12670%0.70170%0.7SS**  trans-83.175.9177.233.9-29.8000107.2L35 P39L35-P37 VanDerWaalsContact O-CD 3.23Å; L35-P37 WeakPolarHBondContact O-CD 3.41Å; L35-P37 VanDerWaalsContact O-N 3.09Å; P37-P39 WeakPolarHBondContact O-CD 3.3Å
38A42.9Very low46.9Very low74 Ų74122.9 Ų122.961%0.61269%0.692SS**  trans-44.9107.8179.900000109.9E36 T40E36-A38 PolarHBondContact O-N 2.77Å; E36-A38 WeakPolarHBondContact OE2-CA 3.5Å; A38-T40 PolarHBondContact O-N 3.22Å
39P46.1Very low47.9Very low89 Ų89121 Ų12158%0.57869%0.693SS**  trans-76.2124.5-174.228.3-31.1000107.9P37 L41P37-P39 WeakPolarHBondContact O-CD 3.3Å; P39-L41 PolarHBondContact O-N 3.42Å
40T49.6Very low49.5Very low132 Ų132115 Ų11581%0.8167%0.665SS**SBendtrans-72.965.4167.655.70000110A38A38-T40 PolarHBondContact O-N 3.22Å
41L46.6Very low51.1Low103 Ų103111.7 Ų111.754%0.53965%0.649SS.*  trans-139.675.1169.9-73.2-179.5000107.5P39 L43P39-L41 PolarHBondContact O-N 3.42Å; L41-L43 PolarHBondContact O-N 3.04Å
42G46.2Very low52.7Low88 Ų88110.6 Ų110.691%0.90765%0.649SS**THydrogen-bonded Turntrans-69.747.4172.600000113.3
43L57.5Low54.3Low138 Ų138109.7 Ų109.772%0.72364%0.641SS**THydrogen-bonded Turntrans-125.2-20.1179.2-91.1161.8000113L41L41-L43 PolarHBondContact O-N 3.04Å
44F47.6Very low56Low127 Ų127107.1 Ų107.156%0.55763%0.632SS**  trans-142.192.9172.5-59.8-73.3000111.3N46 Y47F44-N46 PolarHBondContact O-N 2.85Å; F44-Y47 PolarHBondContact O-N 3Å
45S57Low57.5Low122 Ų122103.8 Ų103.885%0.85360%0.604SS**THydrogen-bonded Turntrans-64.16.6-175.2-43.20000115.9
46N58Low58.7Low100 Ų10099.5 Ų99.554%0.53559%0.591SS.*THydrogen-bonded Turntrans-140.527.9-172.1-90.1-66.8000113.4F44 S48 T49 M50F44-N46 PolarHBondContact O-N 2.85Å; N46-S48 PolarHBondContact O-N 3.19Å; N46-T49 WeakPolarHBondContact CB-OG1 2.81Å; N46-T49 PolarHBondContact O-N 3.46Å; N46-T49 PolarHBondContact O-OG1 2.76Å; N46-T49 PolarHBondContact OD1-OG1 3.46Å; N46-M50 PolarHBondContact O-N 2.94Å
47Y62Low60.4Low121 Ų12197 Ų9748%0.47558%0.584SS.*THydrogen-bonded Turntrans-59.2-32.3176.5-174.2-103.2000112.9F44 T49 K55F44-Y47 PolarHBondContact O-N 3Å; Y47-T49 PolarHBondContact O-N 3.11Å; Y47-K55 HydrophobicContact CE2-CG 3.95Å; Y47-K55 WeakPolarHBondContact O-CE 3.38Å; Y47-K55 PolarHBondContact O-NZ 3.37Å
48S58.3Low61.8Low99 Ų9994.2 Ų94.269%0.69256%0.563SS**THydrogen-bonded Turntrans-65.2-38.6-179.8-153.60000112.6N46 K55N46-S48 PolarHBondContact O-N 3.19Å; S48-K55 PolarHBondContact O-NZ 3.39Å
49T66.2Low62.9Low104 Ų10494.1 Ų94.164%0.63856%0.558SS**THydrogen-bonded Turntrans-85.1-7.6-17647.90000114.9N46 Y47N46-T49 WeakPolarHBondContact CB-OG1 2.81Å; N46-T49 PolarHBondContact O-N 3.46Å; N46-T49 PolarHBondContact O-OG1 2.76Å; N46-T49 PolarHBondContact OD1-OG1 3.46Å; Y47-T49 PolarHBondContact O-N 3.11Å
50M73.1Confident63.7Low49 Ų4997.9 Ų97.924%0.24157%0.567CS.*SBendtrans-67.7145.6178.2-78-173.1167.300113.8N46 K55 L58N46-M50 PolarHBondContact O-N 2.94Å; M50-K55 HydrophobicContact CB-CD 4.5Å; M50-K55 HydrophobicContact CB-CG 4.03Å; M50-K55 WeakPolarHBondContact O-CD 3.14Å; M50-K55 WeakPolarHBondContact O-CE 3.18Å; M50-K55 PolarHBondContact O-NZ 2.93Å; M50-L58 HydrophobicContact SD-CD2 4.25Å
51D75.7Confident64.4Low84 Ų8496.1 Ų96.145%0.44956%0.557SS.*  trans-60.2146.8174.8-178-89000112.1V53 Q54 K55D51-V53 PolarHBondContact O-N 2.84Å; D51-V53 VanDerWaalsContact OD1-CB 3.28Å; D51-V53 WeakPolarHBondContact OD1-CB 3.38Å; D51-V53 WeakPolarHBondContact OD1-CG2 3.42Å; D51-V53 PolarHBondContact OD1-N 2.92Å; D51-Q54 HydrophobicContact CB-CG 4.48Å; D51-Q54 PolarHBondContact O-N 2.71Å; D51-Q54 VanDerWaalsContact O-N 3.12Å; D51-K55 PolarHBondContact O-N 3.33Å
52P76.9Confident65.2Low98 Ų9898.7 Ų98.764%0.63656%0.564SS**Hα-helixtrans-55-33.1179.1-27.136.7000114.4A56P52-A56 WeakPolarHBondContact O-CB 3.2Å; P52-A56 PolarHBondContact O-N 3.26Å
53V74.2Confident65.7Low99 Ų9997 Ų9760%0.655%0.546SS*.Hα-helixtrans-72.2-42.1178.4-1750000110.6D51 K55 A56 V57D51-V53 PolarHBondContact O-N 2.84Å; D51-V53 VanDerWaalsContact OD1-CB 3.28Å; D51-V53 WeakPolarHBondContact OD1-CB 3.38Å; D51-V53 WeakPolarHBondContact OD1-CG2 3.42Å; D51-V53 PolarHBondContact OD1-N 2.92Å; V53-K55 VanDerWaalsContact C-N 3.34Å; V53-K55 PolarHBondContact O-N 2.98Å; V53-A56 PolarHBondContact O-N 2.92Å; V53-V57 WeakPolarHBondContact O-CG2 3.5Å; V53-V57 PolarHBondContact O-N 3.45Å
54Q69.3Low65.7Low108 Ų10892.2 Ų92.251%0.50553%0.53SS..Hα-helixtrans-64-39.3174-72.1-176.1-58.900111.9D51 V57 L58D51-Q54 HydrophobicContact CB-CG 4.48Å; D51-Q54 PolarHBondContact O-N 2.71Å; D51-Q54 VanDerWaalsContact O-N 3.12Å; Q54-V57 PolarHBondContact O-N 3.32Å; Q54-L58 PolarHBondContact O-N 3.45Å
55K76.5Confident65.8Low53 Ų5390.2 Ų90.223%0.2353%0.53CS..Hα-helixtrans-61.7-43.4172.6-76.4168.6171.7148.40112.1Y47 S48 M50 D51 V53 S59Y47-K55 HydrophobicContact CE2-CG 3.95Å; Y47-K55 WeakPolarHBondContact O-CE 3.38Å; Y47-K55 PolarHBondContact O-NZ 3.37Å; S48-K55 PolarHBondContact O-NZ 3.39Å; M50-K55 HydrophobicContact CB-CD 4.5Å; M50-K55 HydrophobicContact CB-CG 4.03Å; M50-K55 WeakPolarHBondContact O-CD 3.14Å; M50-K55 WeakPolarHBondContact O-CE 3.18Å; M50-K55 PolarHBondContact O-NZ 2.93Å; D51-K55 PolarHBondContact O-N 3.33Å; V53-K55 VanDerWaalsContact C-N 3.34Å; V53-K55 PolarHBondContact O-N 2.98Å; K55-S59 VanDerWaalsContact O-CB 3.3Å; K55-S59 WeakPolarHBondContact O-CB 3.43Å; K55-S59 PolarHBondContact O-N 3.28Å
56A68.8Low65.5Low61 Ų6192 Ų9250%0.50453%0.53SS..Hα-helixtrans-64.1-44.2177.400000112.1P52 V53 S59 H60P52-A56 WeakPolarHBondContact O-CB 3.2Å; P52-A56 PolarHBondContact O-N 3.26Å; V53-A56 PolarHBondContact O-N 2.92Å; A56-S59 PolarHBondContact O-N 3.23Å; A56-H60 WeakPolarHBondContact O-CB 3.28Å; A56-H60 PolarHBondContact O-N 3.03Å
57V75.2Confident65.2Low79 Ų7993.2 Ų93.248%0.47954%0.535SS..Hα-helixtrans-63.2-48.2176.4171.10000111.2V53 Q54 S59 H60 T61V53-V57 WeakPolarHBondContact O-CG2 3.5Å; V53-V57 PolarHBondContact O-N 3.45Å; Q54-V57 PolarHBondContact O-N 3.32Å; V57-S59 VanDerWaalsContact C-N 3.32Å; V57-S59 PolarHBondContact O-N 3.46Å; V57-H60 PolarHBondContact O-N 2.96Å; V57-T61 WeakPolarHBondContact O-CB 3.43Å; V57-T61 PolarHBondContact O-N 3.12Å; V57-T61 PolarHBondContact O-OG1 2.97Å; V57-T61 VanDerWaalsContact O-OG1 3.11Å
58L69.9Low64.8Low50 Ų5096.8 Ų96.826%0.26255%0.553SS.*Hα-helixtrans-60.3-41.2176.7-101.165.4000112.3M50 Q54 H60 F62M50-L58 HydrophobicContact SD-CD2 4.25Å; Q54-L58 PolarHBondContact O-N 3.45Å; L58-H60 VanDerWaalsContact C-N 3.32Å; L58-H60 PolarHBondContact O-N 3.48Å; L58-F62 HydrophobicContact CG-CD2 4.32Å; L58-F62 WeakPolarHBondContact O-CB 3.33Å; L58-F62 PolarHBondContact O-N 3.28Å
59S65.3Low64.5Low72 Ų7298.1 Ų98.150%0.50356%0.557SS.*Hα-helixtrans-62.7-38177.1-171.30000112.6K55 A56 V57 G63K55-S59 VanDerWaalsContact O-CB 3.3Å; K55-S59 WeakPolarHBondContact O-CB 3.43Å; K55-S59 PolarHBondContact O-N 3.28Å; A56-S59 PolarHBondContact O-N 3.23Å; V57-S59 VanDerWaalsContact C-N 3.32Å; V57-S59 PolarHBondContact O-N 3.46Å; S59-G63 PolarHBondContact O-N 2.88Å
60H63.5Low64.1Low168 Ų168103 Ų10378%0.77857%0.569SS**Hα-helixtrans-78.8-37.5180-167.3-84.9000112.9A56 V57 L58A56-H60 WeakPolarHBondContact O-CB 3.28Å; A56-H60 PolarHBondContact O-N 3.03Å; V57-H60 PolarHBondContact O-N 2.96Å; L58-H60 VanDerWaalsContact C-N 3.32Å; L58-H60 PolarHBondContact O-N 3.48Å
61T65.3Low63.6Low95 Ų95108.4 Ų108.458%0.58359%0.587SS**Hα-helixtrans-78.1-38.6-178.3-60.60000113V57V57-T61 WeakPolarHBondContact O-CB 3.43Å; V57-T61 PolarHBondContact O-N 3.12Å; V57-T61 PolarHBondContact O-OG1 2.97Å; V57-T61 VanDerWaalsContact O-OG1 3.11Å
62F62.6Low63.1Low157 Ų157109.7 Ų109.769%0.68960%0.6SS**Hα-helixtrans-98.1-1.5-175.7-72.8-78.2000114.9L58L58-F62 HydrophobicContact CG-CD2 4.32Å; L58-F62 WeakPolarHBondContact O-CB 3.33Å; L58-F62 PolarHBondContact O-N 3.28Å
63G57.8Low62.8Low52 Ų52107.9 Ų107.954%0.53659%0.587SS.*THydrogen-bonded Turntrans55.769.9178.800000111.6S59S59-G63 PolarHBondContact O-N 2.88Å
64G56.7Low63.3Low38 Ų38105.7 Ų105.739%0.39257%0.572SS.*  trans-33.7129-166.500000114.9L66G64-L66 WeakPolarHBondContact O-CD2 3.23Å; G64-L66 PolarHBondContact O-N 2.72Å
65P49.1Very low64.4Low85 Ų85103.2 Ų103.255%0.55257%0.566SS**  trans-50.8124.3-162.6-30.234.1000114.1L67P65-L67 HydrophobicContact CB-CD1 4.29Å; P65-L67 HydrophobicContact CB-CG 3.89Å; P65-L67 PolarHBondContact O-N 2.97Å
66L50.2Low65.2Low161 Ų161100.7 Ų100.784%0.84356%0.555SS**  trans-70.638.6169.8-83.2-70.2000111.6G64 K68G64-L66 WeakPolarHBondContact O-CD2 3.23Å; G64-L66 PolarHBondContact O-N 2.72Å; L66-K68 PolarHBondContact O-N 2.82Å
67L52.5Low66.2Low124 Ų124104.3 Ų104.365%0.64957%0.566SS**  trans-63104.2164.5-67.5-177.8000106.8P65 T69P65-L67 HydrophobicContact CB-CD1 4.29Å; P65-L67 HydrophobicContact CB-CG 3.89Å; P65-L67 PolarHBondContact O-N 2.97Å; L67-T69 VanDerWaalsContact C-N 3.3Å; L67-T69 PolarHBondContact O-N 2.75Å
68K53.3Low67Low197 Ų197102.9 Ų102.986%0.85756%0.558SS**  trans-42.892.9175.1-65.6158.5-176.7166.80109.2L66 K70L66-K68 PolarHBondContact O-N 2.82Å; K68-K70 PolarHBondContact O-N 3.18Å
69T51.6Low67.9Low127 Ų127101.2 Ų101.278%0.77955%0.55SS*.  trans-60112174.951.50000105L67 R71L67-T69 VanDerWaalsContact C-N 3.3Å; L67-T69 PolarHBondContact O-N 2.75Å; T69-R71 PolarHBondContact O-N 2.8Å
70K58.1Low69.2Low205 Ų205105.9 Ų105.989%0.89156%0.564SS**  trans-63.394.2178.5-77.7178.5178.4172.50105.5K68 P72K68-K70 PolarHBondContact O-N 3.18Å; K70-P72 VanDerWaalsContact O-N 3.1Å
71R63.6Low70.4Confident164 Ų164101 Ų10162%0.61954%0.543SS*.  trans-44.2122.2-176.7-67.3-178.7-176.7161.70.8107T69 V73 N84T69-R71 PolarHBondContact O-N 2.8Å; R71-V73 WeakPolarHBondContact O-CG2 3.23Å; R71-V73 PolarHBondContact O-N 2.99Å; R71-N84 PolarHBondContact NH1-OD1 3.48Å
72P65.4Low71.7Confident110 Ų110105.3 Ų105.371%0.71455%0.548SS*.  trans-57.4111.4-172.120.9-32000108.1K70 I74K70-P72 VanDerWaalsContact O-N 3.1Å; P72-I74 VanDerWaalsContact C-N 3.27Å; P72-I74 PolarHBondContact O-N 2.96Å
73V70.3Confident73.1Confident60 Ų6098.8 Ų98.836%0.36452%0.52SS..  trans-83.780.1-168.4-161.70000108.5R71 S75 R82 F83R71-V73 WeakPolarHBondContact O-CG2 3.23Å; R71-V73 PolarHBondContact O-N 2.99Å; V73-S75 PolarHBondContact O-N 2.73Å; V73-R82 HydrophobicContact CB-CG 4.41Å; V73-R82 HydrophobicContact CG1-CG 3.34Å; V73-F83 VanDerWaalsContact CG1-O 3.23Å; V73-F83 WeakPolarHBondContact CG1-O 3.35Å
74I85.3Confident74.6Confident54 Ų54101 Ų10128%0.27752%0.519SS..  trans-59.2124.6-176.2-61.5155.6000109.2P72 F83 Q86 A89 Y93P72-I74 VanDerWaalsContact C-N 3.27Å; P72-I74 PolarHBondContact O-N 2.96Å; I74-F83 WeakPolarHBondContact O-CB 3.02Å; I74-F83 WeakPolarHBondContact O-CD2 3.32Å; I74-F83 PolarHBondContact O-N 2.89Å; I74-Q86 HydrophobicContact CD1-CB 3.93Å; I74-Q86 HydrophobicContact CD1-CG 4.26Å; I74-A89 HydrophobicContact CB-CB 4.06Å; I74-A89 HydrophobicContact CD1-CB 4.46Å; I74-A89 HydrophobicContact CG2-CB 3.55Å; I74-Y93 HydrophobicContact CG2-CE2 4.37Å
75S90.8Very high76.2Confident55 Ų55101.2 Ų101.239%0.38551%0.514SS..EExtended strand (participates in β ladder)trans-122.9144179.453.70000112.1V73 I81 Y93V73-S75 PolarHBondContact O-N 2.73Å; S75-I81 CarbonylContact C-O 3.55Å; S75-I81 VanDerWaalsContact CA-O 3.31Å; S75-I81 WeakPolarHBondContact CA-O 3.39Å; S75-Y93 PolarHBondContact O-OH 2.77Å; S75-Y93 VanDerWaalsContact O-OH 3.12Å
76C93.9Very high78.2Confident1 Ų1103 Ų1031%0.00752%0.516CS..EExtended strand (participates in β ladder)trans-96.4110.5174.9176.80000110.4V78 C79 Q80 I81 F83 H92 Y93 H98C76-V78 VanDerWaalsContact C-N 3.31Å; C76-V78 PolarHBondContact O-N 3.01Å; C76-C79 HydrophobicContact CB-CB 4.47Å; C76-C79 PolarHBondContact O-N 3.21Å; C76-Q80 VanDerWaalsContact O-CA 3.24Å; C76-Q80 WeakPolarHBondContact O-CA 2.85Å; C76-Q80 PolarHBondContact O-N 3.49Å; C76-I81 PolarHBondContact N-O 3.41Å; C76-I81 PolarHBondContact O-N 2.87Å; C76-F83 HydrophobicContact CB-CE2 4.19Å; C76-H92 PolarHBondContact SG-NE2 2.78Å; C76-H92 VanDerWaalsContact SG-NE2 3.39Å; C76-Y93 WeakPolarHBondContact CA-OH 3.08Å; C76-Y93 HydrophobicContact CB-CE1 3.96Å; C76-H98 PolarHBondContact SG-CE1 3.24Å; C76-H98 PolarHBondContact SG-ND1 3.26Å; C76-H98 VanDerWaalsContact SG-ND1 3.39Å
77N90.8Very high80.2Confident137 Ų13798.9 Ų98.973%0.73350%0.5SS*.THydrogen-bonded Turntrans-66-32.4-179-63.5-18.3000112.9
78V91.1Very high82Confident49 Ų4998 Ų9830%0.29749%0.493SS..THydrogen-bonded Turntrans-64-42.7178.9-176.90000111.6C76 R101 V102 I105C76-V78 VanDerWaalsContact C-N 3.31Å; C76-V78 PolarHBondContact O-N 3.01Å; V78-R101 HydrophobicContact CG1-CB 4.43Å; V78-R101 HydrophobicContact CG1-CG 4.04Å; V78-R101 VanDerWaalsContact O-CZ 3.25Å; V78-R101 PolarHBondContact O-NE 3.39Å; V78-R101 PolarHBondContact O-NH2 3Å; V78-R101 VanDerWaalsContact O-NH2 3.1Å; V78-V102 HydrophobicContact CG1-CG2 3.88Å; V78-V102 HydrophobicContact CG2-CG2 4.27Å; V78-I105 HydrophobicContact CG1-CD1 3.7Å
79C89.9Confident84Confident15 Ų1588.7 Ų88.710%0.10145%0.453CS..THydrogen-bonded Turntrans-100-10.6-176.8-650000113.8C76 I81 H92C76-C79 HydrophobicContact CB-CB 4.47Å; C76-C79 PolarHBondContact O-N 3.21Å; C79-I81 VanDerWaalsContact C-N 3.25Å; C79-I81 HydrophobicContact CB-CD1 3.96Å; C79-I81 HydrophobicContact CB-CG1 3.88Å; C79-I81 PolarHBondContact O-N 2.98Å; C79-H92 VanDerWaalsContact SG-CE1 3.51Å; C79-H92 PolarHBondContact SG-NE2 3.08Å; C79-H92 VanDerWaalsContact SG-NE2 3.42Å
80Q91.3Very high86Confident170 Ų17087.6 Ų87.679%0.79444%0.438SS*.THydrogen-bonded Turntrans53.937-170.7-59.3-179.1600113.6C76C76-Q80 VanDerWaalsContact O-CA 3.24Å; C76-Q80 WeakPolarHBondContact O-CA 2.85Å; C76-Q80 PolarHBondContact O-N 3.49Å
81I90.1Very high87.7Confident65 Ų6581.1 Ų81.133%0.33342%0.423SS..EExtended strand (participates in β ladder)trans-106.2136.5179-53.8178.9000109.5S75 C76 C79 F83S75-I81 CarbonylContact C-O 3.55Å; S75-I81 VanDerWaalsContact CA-O 3.31Å; S75-I81 WeakPolarHBondContact CA-O 3.39Å; C76-I81 PolarHBondContact N-O 3.41Å; C76-I81 PolarHBondContact O-N 2.87Å; C79-I81 VanDerWaalsContact C-N 3.25Å; C79-I81 HydrophobicContact CB-CD1 3.96Å; C79-I81 HydrophobicContact CB-CG1 3.88Å; C79-I81 PolarHBondContact O-N 2.98Å; I81-F83 HydrophobicContact CB-CE1 4.48Å; I81-F83 HydrophobicContact CB-CE2 4.14Å; I81-F83 HydrophobicContact CB-CZ 3.79Å; I81-F83 HydrophobicContact CG2-CD1 4.32Å; I81-F83 HydrophobicContact CG2-CE1 3.58Å; I81-F83 HydrophobicContact CG2-CE2 4.01Å; I81-F83 HydrophobicContact CG2-CZ 3.37Å
82R92.1Very high89.3Confident185 Ų18574.5 Ų74.570%0.69840%0.399SS*.EExtended strand (participates in β ladder)trans-113.3126.4-177.8-171.2170.1-151.4-168.96.7110.2V73V73-R82 HydrophobicContact CB-CG 4.41Å; V73-R82 HydrophobicContact CG1-CG 3.34Å
83F92.1Very high90.7Very high21 Ų2174 Ų749%0.09238%0.384CS..  trans-109.3141.5-172.8-58.7-74.7000112.1V73 I74 C76 I81 Q88 A89 H92V73-F83 VanDerWaalsContact CG1-O 3.23Å; V73-F83 WeakPolarHBondContact CG1-O 3.35Å; I74-F83 WeakPolarHBondContact O-CB 3.02Å; I74-F83 WeakPolarHBondContact O-CD2 3.32Å; I74-F83 PolarHBondContact O-N 2.89Å; C76-F83 HydrophobicContact CB-CE2 4.19Å; I81-F83 HydrophobicContact CB-CE1 4.48Å; I81-F83 HydrophobicContact CB-CE2 4.14Å; I81-F83 HydrophobicContact CB-CZ 3.79Å; I81-F83 HydrophobicContact CG2-CD1 4.32Å; I81-F83 HydrophobicContact CG2-CE1 3.58Å; I81-F83 HydrophobicContact CG2-CE2 4.01Å; I81-F83 HydrophobicContact CG2-CZ 3.37Å; F83-Q88 HydrophobicContact CB-CB 4.31Å; F83-Q88 HydrophobicContact CD1-CB 3.81Å; F83-Q88 HydrophobicContact CG-CB 4.35Å; F83-A89 HydrophobicContact CB-CB 4.13Å; F83-A89 HydrophobicContact CD2-CB 3.74Å; F83-A89 HydrophobicContact CE2-CB 4.48Å; F83-A89 HydrophobicContact CG-CB 4.03Å; F83-H92 HydrophobicContact CE1-CB 3.94Å; F83-H92 HydrophobicContact CE2-CB 3.9Å; F83-H92 AromaticContact CE2-CD2 3.86Å; F83-H92 AromaticContact CE2-CG 3.83Å; F83-H92 HydrophobicContact CZ-CB 3.37Å; F83-H92 AromaticContact CZ-CD2 3.78Å; F83-H92 AromaticContact CZ-CG 3.31Å; F83-H92 AromaticContact CZ-ND1 3.71Å
84N88.8Confident91.9Very high98 Ų9880.7 Ų80.752%0.52441%0.408SS..SBendtrans-87.3-13.8176-166-98.9000113.2R71R71-N84 PolarHBondContact NH1-OD1 3.48Å
85S90Very high92.4Very high42 Ų4279.1 Ų79.129%0.29441%0.405SS..SBendtrans-135.5142-178.6179.30000110.9S87 Q88 A89S85-S87 VanDerWaalsContact C-N 3.32Å; S85-S87 PolarHBondContact O-N 2.84Å; S85-S87 PolarHBondContact OG-N 2.87Å; S85-S87 PolarHBondContact OG-OG 3.41Å; S85-Q88 PolarHBondContact O-N 3.29Å; S85-Q88 VanDerWaalsContact O-N 3.15Å; S85-A89 PolarHBondContact O-N 2.6Å
86Q91.2Very high92.6Very high124 Ų12481.7 Ų81.758%0.57942%0.415SS*.Hα-helixtrans-55.7-44.5172.8177.1175.2-21.800112I74 Q88 A89 E90I74-Q86 HydrophobicContact CD1-CB 3.93Å; I74-Q86 HydrophobicContact CD1-CG 4.26Å; Q86-Q88 PolarHBondContact O-N 2.89Å; Q86-A89 WeakPolarHBondContact O-CA 3.48Å; Q86-A89 WeakPolarHBondContact O-CB 3.43Å; Q86-A89 PolarHBondContact O-N 3.17Å; Q86-E90 HydrophobicContact CG-CG 4.28Å; Q86-E90 VanDerWaalsContact CG-OE1 3.26Å; Q86-E90 WeakPolarHBondContact CG-OE1 3.3Å; Q86-E90 PolarHBondContact NE2-OE1 3.31Å; Q86-E90 WeakPolarHBondContact O-CG 3.44Å; Q86-E90 PolarHBondContact O-N 2.9Å
87S92.6Very high92.5Very high74 Ų7491.6 Ų91.652%0.51745%0.452SS..Hα-helixtrans-60.4-29.3178.457.20000113.9S85 A91S85-S87 VanDerWaalsContact C-N 3.32Å; S85-S87 PolarHBondContact O-N 2.84Å; S85-S87 PolarHBondContact OG-N 2.87Å; S85-S87 PolarHBondContact OG-OG 3.41Å; S87-A91 VanDerWaalsContact O-CB 3.3Å; S87-A91 WeakPolarHBondContact O-CB 3.37Å; S87-A91 PolarHBondContact O-N 2.87Å; S87-A91 VanDerWaalsContact O-N 3.17Å
88Q91Very high92.8Very high105 Ų10586 Ų8649%0.49142%0.421SS..Hα-helixtrans-76-36.7174.6-65.3175.93000111.6F83 S85 Q86 H92F83-Q88 HydrophobicContact CB-CB 4.31Å; F83-Q88 HydrophobicContact CD1-CB 3.81Å; F83-Q88 HydrophobicContact CG-CB 4.35Å; S85-Q88 PolarHBondContact O-N 3.29Å; S85-Q88 VanDerWaalsContact O-N 3.15Å; Q86-Q88 PolarHBondContact O-N 2.89Å; Q88-H92 WeakPolarHBondContact O-CB 3.17Å; Q88-H92 PolarHBondContact O-N 2.82Å
89A93.5Very high92.9Very high2 Ų286.1 Ų86.12%0.01743%0.428CS..Hα-helixtrans-67-46.217500000111.3I74 F83 S85 Q86 A91 H92 Y93I74-A89 HydrophobicContact CB-CB 4.06Å; I74-A89 HydrophobicContact CD1-CB 4.46Å; I74-A89 HydrophobicContact CG2-CB 3.55Å; F83-A89 HydrophobicContact CB-CB 4.13Å; F83-A89 HydrophobicContact CD2-CB 3.74Å; F83-A89 HydrophobicContact CE2-CB 4.48Å; F83-A89 HydrophobicContact CG-CB 4.03Å; S85-A89 PolarHBondContact O-N 2.6Å; Q86-A89 WeakPolarHBondContact O-CA 3.48Å; Q86-A89 WeakPolarHBondContact O-CB 3.43Å; Q86-A89 PolarHBondContact O-N 3.17Å; A89-A91 PolarHBondContact O-N 2.85Å; A89-H92 WeakPolarHBondContact O-CA 3.14Å; A89-H92 WeakPolarHBondContact O-CB 3.45Å; A89-H92 PolarHBondContact O-N 3.18Å; A89-H92 VanDerWaalsContact O-N 3.11Å; A89-Y93 HydrophobicContact CB-CD2 4.41Å; A89-Y93 HydrophobicContact CB-CE2 4.19Å; A89-Y93 WeakPolarHBondContact O-CD2 3.28Å; A89-Y93 PolarHBondContact O-N 2.82Å
90E93.5Very high93.2Very high103 Ų10393.9 Ų93.948%0.48146%0.455SS..Hα-helixtrans-59.5-47.2176.6-71170.217900112Q86 H92 Y93 K94Q86-E90 HydrophobicContact CG-CG 4.28Å; Q86-E90 VanDerWaalsContact CG-OE1 3.26Å; Q86-E90 WeakPolarHBondContact CG-OE1 3.3Å; Q86-E90 PolarHBondContact NE2-OE1 3.31Å; Q86-E90 WeakPolarHBondContact O-CG 3.44Å; Q86-E90 PolarHBondContact O-N 2.9Å; E90-H92 PolarHBondContact O-N 3.4Å; E90-Y93 PolarHBondContact O-N 2.76Å; E90-K94 WeakPolarHBondContact O-CB 3.24Å; E90-K94 PolarHBondContact O-N 3.34Å
91A95.3Very high93.2Very high69 Ų6991.5 Ų91.557%0.5744%0.439SS*.Hα-helixtrans-62.5-31.217500000112.7S87 A89 G95S87-A91 VanDerWaalsContact O-CB 3.3Å; S87-A91 WeakPolarHBondContact O-CB 3.37Å; S87-A91 PolarHBondContact O-N 2.87Å; S87-A91 VanDerWaalsContact O-N 3.17Å; A89-A91 PolarHBondContact O-N 2.85Å; A91-G95 PolarHBondContact O-N 2.93Å
92H95.9Very high93.4Very high25 Ų2590.3 Ų90.312%0.11643%0.434CS..Hα-helixtrans-70.3-50.9173174.779.9000112.2C76 C79 F83 Q88 A89 E90 K94 G95 H98C76-H92 PolarHBondContact SG-NE2 2.78Å; C76-H92 VanDerWaalsContact SG-NE2 3.39Å; C79-H92 VanDerWaalsContact SG-CE1 3.51Å; C79-H92 PolarHBondContact SG-NE2 3.08Å; C79-H92 VanDerWaalsContact SG-NE2 3.42Å; F83-H92 HydrophobicContact CE1-CB 3.94Å; F83-H92 HydrophobicContact CE2-CB 3.9Å; F83-H92 AromaticContact CE2-CD2 3.86Å; F83-H92 AromaticContact CE2-CG 3.83Å; F83-H92 HydrophobicContact CZ-CB 3.37Å; F83-H92 AromaticContact CZ-CD2 3.78Å; F83-H92 AromaticContact CZ-CG 3.31Å; F83-H92 AromaticContact CZ-ND1 3.71Å; Q88-H92 WeakPolarHBondContact O-CB 3.17Å; Q88-H92 PolarHBondContact O-N 2.82Å; A89-H92 WeakPolarHBondContact O-CA 3.14Å; A89-H92 WeakPolarHBondContact O-CB 3.45Å; A89-H92 PolarHBondContact O-N 3.18Å; A89-H92 VanDerWaalsContact O-N 3.11Å; E90-H92 PolarHBondContact O-N 3.4Å; H92-K94 VanDerWaalsContact C-N 3.34Å; H92-K94 PolarHBondContact O-N 3.3Å; H92-G95 WeakPolarHBondContact O-CA 3.31Å; H92-G95 PolarHBondContact O-N 2.84Å; H92-H98 AromaticContact CD2-ND1 3.72Å; H92-H98 AromaticContact NE2-CG 3.84Å; H92-H98 AromaticContact NE2-ND1 3.18Å; H92-H98 PolarHBondContact NE2-ND1 3.49Å; H92-H98 VanDerWaalsContact NE2-ND1 3.18Å; H92-H98 WeakPolarHBondContact O-CB 3.44Å
93Y95.3Very high93.5Very high99 Ų9989.1 Ų89.139%0.38843%0.434SS..Hα-helixtrans-62-39.7-178.5-73.2-61.8000112.2I74 S75 C76 A89 E90 G95 H98I74-Y93 HydrophobicContact CG2-CE2 4.37Å; S75-Y93 PolarHBondContact O-OH 2.77Å; S75-Y93 VanDerWaalsContact O-OH 3.12Å; C76-Y93 WeakPolarHBondContact CA-OH 3.08Å; C76-Y93 HydrophobicContact CB-CE1 3.96Å; A89-Y93 HydrophobicContact CB-CD2 4.41Å; A89-Y93 HydrophobicContact CB-CE2 4.19Å; A89-Y93 WeakPolarHBondContact O-CD2 3.28Å; A89-Y93 PolarHBondContact O-N 2.82Å; E90-Y93 PolarHBondContact O-N 2.76Å; Y93-G95 PolarHBondContact O-N 3.45Å; Y93-H98 AromaticContact CD1-CE1 3.67Å; Y93-H98 AromaticContact CD1-NE2 3.65Å; Y93-H98 AromaticContact CE1-CE1 3.9Å; Y93-H98 PolarHBondContact O-CD2 3.05Å
94K95.1Very high93.5Very high202 Ų20290.3 Ų90.388%0.87845%0.452SS*.THydrogen-bonded Turntrans-77.2-3.3173.2-159.7171.8-177.8176.60113.4E90 H92E90-K94 WeakPolarHBondContact O-CB 3.24Å; E90-K94 PolarHBondContact O-N 3.34Å; H92-K94 VanDerWaalsContact C-N 3.34Å; H92-K94 PolarHBondContact O-N 3.3Å
95G95.7Very high93.6Very high21 Ų2189.5 Ų89.522%0.21645%0.447CS..SBendtrans-80.5137.9-174.800000113.8A91 H92 Y93 R97 H98 A99A91-G95 PolarHBondContact O-N 2.93Å; H92-G95 WeakPolarHBondContact O-CA 3.31Å; H92-G95 PolarHBondContact O-N 2.84Å; Y93-G95 PolarHBondContact O-N 3.45Å; G95-R97 PolarHBondContact O-N 3.45Å; G95-H98 WeakPolarHBondContact O-CB 3.44Å; G95-H98 PolarHBondContact O-N 2.65Å; G95-A99 PolarHBondContact O-N 3.45Å; G95-A99 VanDerWaalsContact O-N 3.17Å
96N95.9Very high93.4Very high109 Ų10993 Ų9358%0.58346%0.459SS*.Hα-helixtrans-57.6-25.1-180-157.6-0.8000113.4R100N96-R100 VanDerWaalsContact O-CG 3.24Å; N96-R100 WeakPolarHBondContact O-CG 3.43Å; N96-R100 PolarHBondContact O-N 3.23Å
97R92.4Very high93Very high208 Ų20890 Ų9079%0.78546%0.455SS*.Hα-helixtrans-68.7-39.5173.8-171.9-176.4-70.4-179.5-2.1112.3G95 R101G95-R97 PolarHBondContact O-N 3.45Å; R97-R101 PolarHBondContact O-N 3.06Å
98H95.8Very high92.4Very high20 Ų2089.5 Ų89.59%0.09346%0.455CS..Hα-helixtrans-69.5-50.7176.8-179.582.7000110.2C76 H92 Y93 G95 R100 R101 V102C76-H98 PolarHBondContact SG-CE1 3.24Å; C76-H98 PolarHBondContact SG-ND1 3.26Å; C76-H98 VanDerWaalsContact SG-ND1 3.39Å; H92-H98 AromaticContact CD2-ND1 3.72Å; H92-H98 AromaticContact NE2-CG 3.84Å; H92-H98 AromaticContact NE2-ND1 3.18Å; H92-H98 PolarHBondContact NE2-ND1 3.49Å; H92-H98 VanDerWaalsContact NE2-ND1 3.18Å; H92-H98 WeakPolarHBondContact O-CB 3.44Å; Y93-H98 AromaticContact CD1-CE1 3.67Å; Y93-H98 AromaticContact CD1-NE2 3.65Å; Y93-H98 AromaticContact CE1-CE1 3.9Å; Y93-H98 PolarHBondContact O-CD2 3.05Å; G95-H98 WeakPolarHBondContact O-CB 3.44Å; G95-H98 PolarHBondContact O-N 2.65Å; H98-R100 VanDerWaalsContact C-N 3.33Å; H98-R100 PolarHBondContact O-N 3.36Å; H98-R101 PolarHBondContact O-N 2.78Å; H98-V102 VanDerWaalsContact NE2-CG2 3.34Å; H98-V102 WeakPolarHBondContact NE2-CG2 3.26Å; H98-V102 WeakPolarHBondContact O-CG2 3.47Å; H98-V102 PolarHBondContact O-N 3.24Å
99A94.4Very high91.6Very high52 Ų5292.3 Ų92.343%0.4347%0.466SS..Hα-helixtrans-54.2-43179.200000113.5G95 R101 K103G95-A99 PolarHBondContact O-N 3.45Å; G95-A99 VanDerWaalsContact O-N 3.17Å; A99-R101 VanDerWaalsContact C-N 3.35Å; A99-R101 PolarHBondContact O-N 2.83Å; A99-K103 WeakPolarHBondContact O-CB 3.47Å; A99-K103 PolarHBondContact O-N 3.19Å
100R94.5Very high90.2Very high177 Ų17797.9 Ų97.967%0.66850%0.5SS*.Hα-helixtrans-62.7-37.9175.2-73173.2-172.7-154-0.8113.1N96 H98 G104N96-R100 VanDerWaalsContact O-CG 3.24Å; N96-R100 WeakPolarHBondContact O-CG 3.43Å; N96-R100 PolarHBondContact O-N 3.23Å; H98-R100 VanDerWaalsContact C-N 3.33Å; H98-R100 PolarHBondContact O-N 3.36Å; R100-G104 PolarHBondContact O-N 3.15Å
101R92.9Very high88.6Confident121 Ų121103.9 Ų103.946%0.45752%0.518SS..Hα-helixtrans-74.4-40-179.8-170.6166.1168.1151.7-7.1111.6V78 R97 H98 A99 G104 I105V78-R101 HydrophobicContact CG1-CB 4.43Å; V78-R101 HydrophobicContact CG1-CG 4.04Å; V78-R101 VanDerWaalsContact O-CZ 3.25Å; V78-R101 PolarHBondContact O-NE 3.39Å; V78-R101 PolarHBondContact O-NH2 3Å; V78-R101 VanDerWaalsContact O-NH2 3.1Å; R97-R101 PolarHBondContact O-N 3.06Å; H98-R101 PolarHBondContact O-N 2.78Å; A99-R101 VanDerWaalsContact C-N 3.35Å; A99-R101 PolarHBondContact O-N 2.83Å; R101-G104 PolarHBondContact O-N 3.37Å; R101-I105 HydrophobicContact CG-CD1 3.88Å; R101-I105 WeakPolarHBondContact O-CD1 3.26Å; R101-I105 VanDerWaalsContact O-CG1 3.3Å; R101-I105 WeakPolarHBondContact O-CG1 3.38Å; R101-I105 PolarHBondContact O-N 3.38Å
102V94.1Very high87Confident39 Ų39103.9 Ų103.924%0.23653%0.525CS..Hα-helixtrans-56.7-56.8171174.90000110.1V78 H98 G104 I105 E106V78-V102 HydrophobicContact CG1-CG2 3.88Å; V78-V102 HydrophobicContact CG2-CG2 4.27Å; H98-V102 VanDerWaalsContact NE2-CG2 3.34Å; H98-V102 WeakPolarHBondContact NE2-CG2 3.26Å; H98-V102 WeakPolarHBondContact O-CG2 3.47Å; H98-V102 PolarHBondContact O-N 3.24Å; V102-G104 VanDerWaalsContact C-N 3.28Å; V102-G104 PolarHBondContact O-N 2.86Å; V102-I105 PolarHBondContact O-N 3.12Å; V102-E106 HydrophobicContact CG1-CG 4.3Å; V102-E106 WeakPolarHBondContact O-CG 3.17Å; V102-E106 PolarHBondContact O-N 2.89Å
103K93.4Very high84.8Confident161 Ų161113.4 Ų113.470%0.756%0.56SS**Hα-helixtrans-59.1-35.4-178.8-171.5168.9-176171.30113.6A99 A107A99-K103 WeakPolarHBondContact O-CB 3.47Å; A99-K103 PolarHBondContact O-N 3.19Å; K103-A107 WeakPolarHBondContact O-CB 3.4Å; K103-A107 PolarHBondContact O-N 3.4Å; K103-A107 VanDerWaalsContact O-N 3.1Å
104G92.9Very high82.3Confident45 Ų45116.9 Ų116.946%0.46458%0.579SS.*Hα-helixtrans-68.7-37.3174.700000113.6R100 R101 V102 A108R100-G104 PolarHBondContact O-N 3.15Å; R101-G104 PolarHBondContact O-N 3.37Å; V102-G104 VanDerWaalsContact C-N 3.28Å; V102-G104 PolarHBondContact O-N 2.86Å; G104-A108 PolarHBondContact O-N 2.83Å
105I89.1Confident79.8Confident81 Ų81112.3 Ų112.342%0.41557%0.57SS.*Hα-helixtrans-73.5-39.1177-70.1161.8000110.8V78 R101 V102 A108 K109V78-I105 HydrophobicContact CG1-CD1 3.7Å; R101-I105 HydrophobicContact CG-CD1 3.88Å; R101-I105 WeakPolarHBondContact O-CD1 3.26Å; R101-I105 VanDerWaalsContact O-CG1 3.3Å; R101-I105 WeakPolarHBondContact O-CG1 3.38Å; R101-I105 PolarHBondContact O-N 3.38Å; V102-I105 PolarHBondContact O-N 3.12Å; I105-A108 PolarHBondContact O-N 2.79Å; I105-K109 VanDerWaalsContact O-CB 3.31Å; I105-K109 WeakPolarHBondContact O-CB 3.45Å; I105-K109 PolarHBondContact O-N 3.46Å
106E87.3Confident77Confident117 Ų117116.4 Ų116.455%0.54760%0.595SS.*Hα-helixtrans-61-45.6174.2-69.2172138.900111.3V102 A108 K109 T110V102-E106 HydrophobicContact CG1-CG 4.3Å; V102-E106 WeakPolarHBondContact O-CG 3.17Å; V102-E106 PolarHBondContact O-N 2.89Å; E106-A108 VanDerWaalsContact C-N 3.26Å; E106-A108 PolarHBondContact O-N 3.26Å; E106-K109 PolarHBondContact O-N 2.79Å; E106-T110 PolarHBondContact O-N 3.31Å; E106-T110 PolarHBondContact O-OG1 3.42Å
107A82.8Confident74.6Confident60 Ų60117.3 Ų117.350%0.49661%0.605SS.*Hα-helixtrans-66.4-22.8176.300000114.3K103 T110K103-A107 WeakPolarHBondContact O-CB 3.4Å; K103-A107 PolarHBondContact O-N 3.4Å; K103-A107 VanDerWaalsContact O-N 3.1Å; A107-T110 PolarHBondContact O-OG1 2.78Å
108A79.1Confident72.1Confident64 Ų64118 Ų11853%0.52961%0.607SS.*Hα-helixtrans-83.2-38.5171.600000111.8G104 I105 E106 T110 R111G104-A108 PolarHBondContact O-N 2.83Å; I105-A108 PolarHBondContact O-N 2.79Å; E106-A108 VanDerWaalsContact C-N 3.26Å; E106-A108 PolarHBondContact O-N 3.26Å; A108-T110 VanDerWaalsContact C-N 3.31Å; A108-T110 PolarHBondContact O-N 3.21Å; A108-R111 PolarHBondContact O-N 3.24Å; A108-R111 VanDerWaalsContact O-N 3.17Å
109K74.9Confident69.2Low163 Ų163125.9 Ų125.971%0.70964%0.644SS**Hα-helixtrans-70.3-25.3-175.7-167162.3-176.7174.30113.3I105 E106 R111I105-K109 VanDerWaalsContact O-CB 3.31Å; I105-K109 WeakPolarHBondContact O-CB 3.45Å; I105-K109 PolarHBondContact O-N 3.46Å; E106-K109 PolarHBondContact O-N 2.79Å; K109-R111 PolarHBondContact O-N 3.45Å
110T63.3Low67Low119 Ų119129 Ų12973%0.7366%0.662SS**THydrogen-bonded Turntrans-72-11.9172.7520000114.4E106 A107 A108E106-T110 PolarHBondContact O-N 3.31Å; E106-T110 PolarHBondContact O-OG1 3.42Å; A107-T110 PolarHBondContact O-OG1 2.78Å; A108-T110 VanDerWaalsContact C-N 3.31Å; A108-T110 PolarHBondContact O-N 3.21Å
111R61Low64.2Low229 Ų229125.4 Ų125.486%0.86467%0.671SS**THydrogen-bonded Turntrans-98.91.8177.1-64.7-174.1174.7-164-4114.3A108 K109A108-R111 PolarHBondContact O-N 3.24Å; A108-R111 VanDerWaalsContact O-N 3.17Å; K109-R111 PolarHBondContact O-N 3.45Å
112G60.2Low62Low69 Ų69126.7 Ų126.771%0.71169%0.687SS**SBendtrans-130.722.4-170.100000115
113R50.7Low59.9Low226 Ų226130.5 Ų130.585%0.85371%0.712SS**  trans-125.863.8176.7-162.1-173.9-176-132.80.2111.8
114E43.1Very low57.1Low172 Ų172126.7 Ų126.780%0.80471%0.711SS**  trans-64133.5154.1-72-58.2116.600108.9S116E114-S116 PolarHBondContact O-N 3.35Å; E114-S116 VanDerWaalsContact O-N 3.11Å
115P42.5Very low55.5Low105 Ų105130.4 Ų130.468%0.68273%0.727SS**  trans-7995.1179.131.5-32.6000110.2V117P115-V117 VanDerWaalsContact C-N 3.32Å; P115-V117 PolarHBondContact O-N 3.43Å
116S36.8Very low52.7Low107 Ų107131.6 Ų131.675%0.74875%0.749SS**  trans-65.791.8167.3175.50000110.2E114 R118E114-S116 PolarHBondContact O-N 3.35Å; E114-S116 VanDerWaalsContact O-N 3.11Å; S116-R118 PolarHBondContact O-N 3.32Å; S116-R118 VanDerWaalsContact O-N 3.12Å
117V45.9Very low50Low128 Ų128129 Ų12978%0.77675%0.754SS**  trans-58.9109.7164.2173.90000108.6P115P115-V117 VanDerWaalsContact C-N 3.32Å; P115-V117 PolarHBondContact O-N 3.43Å
118R38.5Very low47.6Very low223 Ų223131.9 Ų131.984%0.84277%0.77SS**  trans-141.892.9152.4-71-159.9175.8175.4-0.2108.9S116S116-R118 PolarHBondContact O-N 3.32Å; S116-R118 VanDerWaalsContact O-N 3.12Å
119E35.7Very low45.5Very low186 Ų186134.9 Ų134.987%0.86978%0.782SS**  trans-61.2152165.3-171.6147.260.900110.2
120S49.1Very low44.3Very low116 Ų116132.7 Ų132.781%0.81179%0.785SS**  trans-125.8121179-61.90000109.7
121A35.9Very low43.6Very low102 Ų102132.3 Ų132.384%0.84378%0.784SS**  trans-152.7129.816500000110.1
122D45.3Very low42.2Very low149 Ų149127.3 Ų127.380%0.79778%0.784SS**  trans-72.5175.9180-119-114.3000112
123P50.7Low40.9Very low118 Ų118127.5 Ų127.577%0.76679%0.786SS**  cis-153.1154.242.540.6-17000122.7
124A35Very low40Very low82 Ų82124.9 Ų124.968%0.67879%0.789SS**  trans76.1176.9138.100000121.2
125P58.1Low39.6Very low122 Ų122120 Ų12079%0.79279%0.785SS**  -139.3-166.8-91.643.7-24.3000116.8
126A31.8Very low39.3Very low106 Ų106122.2 Ų122.288%0.87680%0.796SS**  trans83.2143.7173.600000117.2
127G28.8Very low39.3Very low63 Ų63121 Ų12165%0.64979%0.793SS**  cis173.9161.6-7.500000112
128S32.9Very low39.2Very low121 Ų121121 Ų12185%0.84680%0.796SS**  trans63.6145.1167.9-48.80000117.3
129T35.8Very low39.2Very low127 Ų127121.2 Ų121.278%0.77980%0.796SS**  cis-166.6153.8-5.414.30000108.1
130P48.9Very low40.3Very low117 Ų117117.3 Ų117.376%0.7679%0.787SS**  trans-83.6-178.4165.139-36.1000110.8
131P49.2Very low39.4Very low110 Ų110118.4 Ų118.471%0.71479%0.788SS**  cis-145.3-171.818.345.1-25000118.2
132S32Very low39.2Very low124 Ų124118 Ų11887%0.86778%0.779SS**  trans77.9134.5152.5-64.30000121.2
133G31.2Very low38.9Very low74 Ų74119.4 Ų119.476%0.76378%0.783SS**  trans159.898.9175.700000110.7
134D33.3Very low38.1Very low171 Ų171122.9 Ų122.991%0.91479%0.789SS**  trans-67.8160.2-168.7-60.5-101.6000116.2
135G34.1Very low38.1Very low69 Ų69126.6 Ų126.671%0.71180%0.798SS**  trans135113.213900000118.7
136V35.2Very low36.7Very low152 Ų152123.7 Ų123.792%0.92179%0.79SS**  trans75115.9148.8-174.10000118.4
137A38.2Very low36.9Very low81 Ų81127.4 Ų127.467%0.66979%0.794SS**  trans-84.8168.216700000111.2
138P43.1Very low37Very low129 Ų129127.9 Ų127.984%0.83880%0.799SS**  -141.5172.478.232.7-13.6000115.8
139R38.4Very low37.5Very low226 Ų226128.3 Ų128.385%0.85380%0.799SS**  trans-96.2-158.5172.5-49.5176.581.4-12710.5109.7
140P59.9Low37.6Very low105 Ų105126.6 Ų126.668%0.68280%0.798SS**  -130155.7-114.237.8-17.8000116.4
141V29.8Very low37.3Very low138 Ų138127.3 Ų127.384%0.83680%0.803SS**  trans-148.9135.7157.1-79.10000107.5
142S32.1Very low36.3Very low93 Ų93125.5 Ų125.565%0.6580%0.804SS**  cis82.411035.7-162.90000114.2
143M39Very low36.4Very low180 Ų180125.3 Ų125.389%0.88780%0.803SS**  trans63.3129.2160.1-62174.1171.600118.9
144E32.3Very low37.2Very low191 Ų191127.6 Ų127.689%0.89380%0.804SS**  -168.2-171.694.575.4167.6128.400114.1
145N35.4Very low37Very low159 Ų159129 Ų12985%0.8581%0.805SS**  trans-88.7160.3-174.6-73.9-32.8000113.6
146G29.8Very low37Very low62 Ų62135 Ų13564%0.63981%0.811SS**  trans168.3107.4158.800000110.1
147L34.4Very low37.2Very low183 Ų183136.8 Ų136.896%0.95881%0.81SS**  53112.883.5-68.9162.2000112.3
148G32.3Very low37.6Very low73 Ų73138.5 Ų138.575%0.75381%0.814SS**  trans-74.3-167.4178.900000113.7
149P43.9Very low36.8Very low131 Ų131136 Ų13685%0.85181%0.812SS**  -142.8179.657.138.7-20.2000115.9
150A37.1Very low36.4Very low90 Ų90131 Ų13174%0.74481%0.812SS**  trans-81.5160.7163.800000111.1
151P42Very low35.7Very low133 Ų133132 Ų13286%0.86482%0.818SS**  -147.9163.4101.537.8-22.2000115.8
152G28.1Very low35.8Very low72 Ų72130.7 Ų130.774%0.74282%0.815SS**  trans170.1132.2169.500000114
153S34.3Very low36.7Very low120 Ų120132 Ų13284%0.83982%0.821SS**  trans-170.4165.3179.1-82.80000108.2
154P48.5Very low37.1Very low121 Ų121128.6 Ų128.679%0.78681%0.812SS**  cis-132.1175.1-2537.4-21000113.1
155E30Very low37Very low201 Ų201124.3 Ų124.394%0.93980%0.804SS**  trans-106.6157.7167.2-96-175.880.600113.4
156K33.4Very low36.8Very low195 Ų195122.9 Ų122.985%0.84880%0.8SS**  trans-95.8155.7-178.2-68.1176.5174.71770111.7
157Q39.4Very low36.8Very low190 Ų190125.5 Ų125.589%0.88881%0.809SS**  176.3169.6117.8-93.2-146.6-72.700113.4
158P46.3Very low36.8Very low117 Ų117126.4 Ų126.476%0.7681%0.808SS**  trans-117.1178.2-14344.3-38000117.4
159G27.1Very low36.9Very low77 Ų77128.3 Ų128.379%0.79481%0.81SS**  trans175.9134.2163.200000115.2
160S29.9Very low36.3Very low121 Ų121125.8 Ų125.885%0.84681%0.808SS**  trans-81.4-170.9-179.7-41.70000113.1
161P45Very low36.2Very low125 Ų125130.9 Ų130.981%0.81282%0.816SS**  cis-136.3-177.4-3.339.5-19.1000116.7
162S31.7Very low35.6Very low110 Ų110128.1 Ų128.177%0.76981%0.812SS**  trans-71.4174.6172.6-310000113.4
163P49.7Very low35.8Very low120 Ų120131.3 Ų131.378%0.77982%0.817SS**  -150.2-14659.735.4-8.3000114
164P48.2Very low35.8Very low109 Ų109132.6 Ų132.671%0.70882%0.819SS**  -123.2173.5-75.336.3-20.6000114.5
165S30.7Very low35Very low101 Ų101134.8 Ų134.871%0.70682%0.817SS**  161.5125.4119.8-70.70000116.2
166V31.6Very low35Very low129 Ų129129 Ų12978%0.78281%0.811SS**  trans52.9122.5140.1-48.30000124.1
167S29.9Very low35Very low117 Ų117127.4 Ų127.482%0.81881%0.807SS**  52.9118.3128.7-51.70000122.1
168E33.6Very low34.5Very low202 Ų202122.4 Ų122.494%0.94481%0.806SS**  -154.7152.1102.1-162.51628800110.6
169S34.6Very low33.7Very low113 Ų113120 Ų12079%0.7980%0.803SS**  trans-115.7126.2178.5-177.80000109.8
170G31.1Very low34Very low78 Ų78123.1 Ų123.180%0.80481%0.807SS**  trans-146102.917700000110.7
171Q36.1Very low34.5Very low198 Ų198122.7 Ų122.793%0.92580%0.801SS**  trans-76141.9175.7-69170.7-47.100110.7
172G28.6Very low34.2Very low75 Ų75121 Ų12177%0.77380%0.797SS**  trans-16867179.200000112.6
173V31.9Very low34.6Very low139 Ų139121.7 Ų121.784%0.84280%0.8SS**  trans-81.9122173.9176.50000109.7
174T34Very low33.9Very low146 Ų146120.4 Ų120.490%0.89680%0.799SS**  trans-131.3137.5150.551.90000109.1
175K32.2Very low33.2Very low168 Ų168121 Ų12173%0.7381%0.805SS**  trans-118133.3-179.1179.4-168.8173.1-155.10107.6E177K175-E177 WeakPolarHBondContact CE-OE2 3.44Å; K175-E177 IonicContact NZ-OE2 2.66Å; K175-E177 PolarHBondContact NZ-OE2 3.22Å
176G30.7Very low33.6Very low80 Ų80124.3 Ų124.383%0.82582%0.815SS**  trans-143.7130.6172.500000109.8
177E32Very low34.4Very low160 Ų160123.8 Ų123.875%0.74881%0.814SS**  trans-108.9159-169.1-69177.651.600113.4K175K175-E177 WeakPolarHBondContact CE-OE2 3.44Å; K175-E177 IonicContact NZ-OE2 2.66Å; K175-E177 PolarHBondContact NZ-OE2 3.22Å
178G28.8Very low34.9Very low85 Ų85122.3 Ų122.388%0.87682%0.817SS**  trans97.2132.4158.800000116.5
179G29.8Very low35.1Very low67 Ų67116 Ų11669%0.69181%0.806SS**  cis172.2144.5-10.400000114.7
180T32.8Very low35.6Very low143 Ų143113.7 Ų113.788%0.87779%0.79SS**  trans71.5165.7152-12.40000117
181P41.8Very low36.5Very low111 Ų111118.9 Ų118.972%0.72179%0.79SS**  -128169.8-90.843.7-30.8000117.6
182A37.4Very low37.5Very low89 Ų89117.3 Ų117.374%0.73678%0.783SS**  trans11.4154.9151.500000122.6
183P41.2Very low38.8Very low126 Ų126120 Ų12082%0.81878%0.775SS**  -132.6157.994.338.1-31.1000116.2
184A34Very low40.1Very low93 Ų93119.2 Ų119.277%0.76976%0.762SS**  trans57.9104.1160.100000119.6
185S33.7Very low41.3Very low120 Ų120116.8 Ų116.884%0.83974%0.741SS**  trans-160.3122.5155.8-75.60000111.6
186L40.5Very low42.5Very low172 Ų172114.3 Ų114.390%0.90173%0.73SS**  trans-159.5154.6153.5-82.9-170.9000108.3
187P47.9Very low43.6Very low118 Ų118113.2 Ų113.277%0.76671%0.713SS**SBendcis-127.4168.4-9.938.6-23.6000114.3
188G40.8Very low44.8Very low86 Ų86112.7 Ų112.789%0.88771%0.708SS**  trans81.494.8147.900000118
189G37Very low46.2Very low69 Ų69116.4 Ų116.471%0.71170%0.696SS**  trans177.3121.3167.100000111.5K191G189-K191 PolarHBondContact O-N 3.45Å; G189-K191 VanDerWaalsContact O-N 3.12Å
190S44.3Very low48Very low64 Ų64116.5 Ų116.545%0.44868%0.68SS.*  trans-57.3108.7179.65.30000111E192 E193 E194S190-E192 PolarHBondContact O-N 3.45Å; S190-E192 VanDerWaalsContact O-N 3.08Å; S190-E193 WeakPolarHBondContact O-CB 3.37Å; S190-E193 PolarHBondContact O-N 3.49Å; S190-E193 PolarHBondContact OG-OE2 3.11Å; S190-E194 PolarHBondContact O-N 3.2Å
191K51.3Low50.4Low188 Ų188111.9 Ų111.982%0.81765%0.65SS**Hα-helixtrans-57.3-25.4175.8-74.5-176.8175.3178.70113G189 E193 E195G189-K191 PolarHBondContact O-N 3.45Å; G189-K191 VanDerWaalsContact O-N 3.12Å; K191-E193 VanDerWaalsContact C-N 3.32Å; K191-E195 PolarHBondContact O-N 3.31Å
192E56.3Low52.5Low165 Ų165112.8 Ų112.877%0.77164%0.64SS**Hα-helixtrans-66-30.8173.5-62.7162.5-133.800113S190 K196S190-E192 PolarHBondContact O-N 3.45Å; S190-E192 VanDerWaalsContact O-N 3.08Å; E192-K196 VanDerWaalsContact O-CB 3.3Å; E192-K196 WeakPolarHBondContact O-CB 3.39Å; E192-K196 PolarHBondContact O-N 3.16Å; E192-K196 VanDerWaalsContact O-N 3.11Å
193E57.1Low55Low132 Ų132108.8 Ų108.862%0.61761%0.606SS**Hα-helixtrans-81.4-36.9-177.8-165.7177156.700111.8S190 K191 K196 A197S190-E193 WeakPolarHBondContact O-CB 3.37Å; S190-E193 PolarHBondContact O-N 3.49Å; S190-E193 PolarHBondContact OG-OE2 3.11Å; K191-E193 VanDerWaalsContact C-N 3.32Å; E193-K196 CarbonylContact O-C 3.56Å; E193-K196 WeakPolarHBondContact O-CB 3.49Å; E193-K196 PolarHBondContact O-N 3.19Å; E193-A197 WeakPolarHBondContact O-CB 3.3Å; E193-A197 PolarHBondContact O-N 3.1Å
194E58Low57.1Low121 Ų121106 Ų10657%0.56559%0.594SS**Hα-helixtrans-68.3-34.9174.3-161.8-170.9120.700111.8S190 A197 K198S190-E194 PolarHBondContact O-N 3.2Å; E194-A197 PolarHBondContact O-N 3.32Å; E194-K198 WeakPolarHBondContact O-CD 3.37Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 2.86Å; E194-K198 VanDerWaalsContact O-N 3.11Å; E194-K198 WeakPolarHBondContact OE1-CE 3.37Å; E194-K198 IonicContact OE1-NZ 2.61Å; E194-K198 PolarHBondContact OE1-NZ 3.29Å
195E59Low59.6Low96 Ų96104.2 Ų104.245%0.44957%0.571SS.*Hα-helixtrans-68.8-38171.5-139.7-136.1131.600111.5K191 A197 K198 R199K191-E195 PolarHBondContact O-N 3.31Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 2.77Å; E195-K198 PolarHBondContact O-N 3.41Å; E195-R199 WeakPolarHBondContact O-CG 3.37Å; E195-R199 PolarHBondContact O-N 3.39Å; E195-R199 IonicContact OE1-CZ 2.75Å; E195-R199 IonicContact OE1-NE 2.6Å; E195-R199 PolarHBondContact OE1-NE 2.85Å; E195-R199 IonicContact OE1-NH2 3.1Å; E195-R199 PolarHBondContact OE1-NH2 3.01Å; E195-R199 IonicContact OE2-NH2 2.67Å; E195-R199 PolarHBondContact OE2-NH2 3.48Å
196K57.6Low62.1Low116 Ų116100.1 Ų100.150%0.50454%0.542SS..Hα-helixtrans-66.3-33.8174-167.5173.9-173.4179.90112.7E192 E193 R199 L200 N211E192-K196 VanDerWaalsContact O-CB 3.3Å; E192-K196 WeakPolarHBondContact O-CB 3.39Å; E192-K196 PolarHBondContact O-N 3.16Å; E192-K196 VanDerWaalsContact O-N 3.11Å; E193-K196 CarbonylContact O-C 3.56Å; E193-K196 WeakPolarHBondContact O-CB 3.49Å; E193-K196 PolarHBondContact O-N 3.19Å; K196-R199 CarbonylContact O-C 3.57Å; K196-R199 PolarHBondContact O-N 3.49Å; K196-L200 PolarHBondContact O-N 3.21Å; K196-L200 VanDerWaalsContact O-N 3.15Å; K196-N211 VanDerWaalsContact CE-OD1 3.25Å; K196-N211 WeakPolarHBondContact CE-OD1 3.26Å
197A54.5Low64.4Low56 Ų5699.9 Ų99.946%0.46353%0.534SS..Hα-helixtrans-65.3-38.3171.300000111.9E193 E194 E195 R199 L200E193-A197 WeakPolarHBondContact O-CB 3.3Å; E193-A197 PolarHBondContact O-N 3.1Å; E194-A197 PolarHBondContact O-N 3.32Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 2.77Å; A197-R199 VanDerWaalsContact C-N 3.34Å; A197-L200 WeakPolarHBondContact O-CB 3.04Å; A197-L200 PolarHBondContact O-N 3.42Å
198K56.6Low66.2Low150 Ų15097.1 Ų97.165%0.65252%0.515SS*.Hα-helixtrans-71.8-26173.6-68.2162.3-170.6168.80113E194 E195 L200E194-K198 WeakPolarHBondContact O-CD 3.37Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 2.86Å; E194-K198 VanDerWaalsContact O-N 3.11Å; E194-K198 WeakPolarHBondContact OE1-CE 3.37Å; E194-K198 IonicContact OE1-NZ 2.61Å; E194-K198 PolarHBondContact OE1-NZ 3.29Å; E195-K198 PolarHBondContact O-N 3.41Å; K198-L200 VanDerWaalsContact C-N 3.34Å
199R59.4Low68.5Low163 Ų16395.7 Ų95.762%0.61550%0.495SS*.THydrogen-bonded Turntrans-86.55.2170.9-65.3179.3-173.5-155.18.6113.8E195 K196 A197 L201E195-R199 WeakPolarHBondContact O-CG 3.37Å; E195-R199 PolarHBondContact O-N 3.39Å; E195-R199 IonicContact OE1-CZ 2.75Å; E195-R199 IonicContact OE1-NE 2.6Å; E195-R199 PolarHBondContact OE1-NE 2.85Å; E195-R199 IonicContact OE1-NH2 3.1Å; E195-R199 PolarHBondContact OE1-NH2 3.01Å; E195-R199 IonicContact OE2-NH2 2.67Å; E195-R199 PolarHBondContact OE2-NH2 3.48Å; K196-R199 CarbonylContact O-C 3.57Å; K196-R199 PolarHBondContact O-N 3.49Å; A197-R199 VanDerWaalsContact C-N 3.34Å; R199-L201 PolarHBondContact O-N 3.39Å
200L66.4Low71Confident69 Ų6993.6 Ų93.636%0.36147%0.468SS..  trans-68.7116.2169.1-70.8179.9000109.8K196 A197 K198 Y202 A209 N211K196-L200 PolarHBondContact O-N 3.21Å; K196-L200 VanDerWaalsContact O-N 3.15Å; A197-L200 WeakPolarHBondContact O-CB 3.04Å; A197-L200 PolarHBondContact O-N 3.42Å; K198-L200 VanDerWaalsContact C-N 3.34Å; L200-Y202 PolarHBondContact O-N 2.88Å; L200-A209 HydrophobicContact CB-CB 4.41Å; L200-N211 HydrophobicContact CD2-CB 4.45Å
201L83.2Confident73Confident45 Ų4594.9 Ų94.924%0.23647%0.47CS..EExtended strand (participates in β ladder)trans-87.4109.5-171.2-77.4145.2000109.3R199 V210 S212 L213 L216R199-L201 PolarHBondContact O-N 3.39Å; L201-V210 HydrophobicContact CB-CG2 4.19Å; L201-V210 PolarHBondContact N-O 3.35Å; L201-V210 WeakPolarHBondContact O-CG2 3.49Å; L201-V210 PolarHBondContact O-N 3.32Å; L201-S212 VanDerWaalsContact CD1-C 3.43Å; L201-L213 HydrophobicContact CD1-CB 4.17Å; L201-L213 HydrophobicContact CD1-CD2 3.62Å; L201-L213 HydrophobicContact CD1-CG 3.65Å; L201-L213 HydrophobicContact CD2-CD2 3.61Å; L201-L213 HydrophobicContact CG-CD2 4.25Å; L201-L216 HydrophobicContact CB-CB 3.88Å; L201-L216 HydrophobicContact CB-CD2 3.78Å; L201-L216 HydrophobicContact CB-CG 4.23Å; L201-L216 HydrophobicContact CD2-CD2 3.98Å; L201-L216 HydrophobicContact CG-CD2 4.47Å
202Y87.3Confident74.6Confident130 Ų13088 Ų8851%0.5145%0.445SS..EExtended strand (participates in β ladder)trans-97.2122.1-169.9175.9-108.9000112.3L200 A204 K207 A209L200-Y202 PolarHBondContact O-N 2.88Å; Y202-A204 HydrophobicContact CD1-CB 4.31Å; Y202-A204 HydrophobicContact CE1-CB 3.89Å; Y202-A204 PolarHBondContact O-N 3.34Å; Y202-K207 HydrophobicContact CE2-CB 4.33Å; Y202-A209 HydrophobicContact CD2-CB 4.37Å
203C88.5Confident76.1Confident5 Ų585.3 Ų85.33%0.03444%0.436CS..EExtended strand (participates in β ladder)trans-83.3102.2169.21750000110.6L205 C206 K207 V208 L216 H219 H225C203-L205 PolarHBondContact O-N 3.49Å; C203-C206 PolarHBondContact O-N 3.17Å; C203-C206 PolarHBondContact SG-N 2.9Å; C203-K207 VanDerWaalsContact O-CA 3.25Å; C203-K207 WeakPolarHBondContact O-CA 3.25Å; C203-K207 PolarHBondContact O-N 3.4Å; C203-V208 PolarHBondContact N-O 3.18Å; C203-V208 PolarHBondContact O-N 3.35Å; C203-L216 HydrophobicContact CB-CD1 4.03Å; C203-H219 PolarHBondContact SG-NE2 3.11Å; C203-H225 PolarHBondContact SG-CE1 3.38Å; C203-H225 PolarHBondContact SG-ND1 3.03Å
204A86Confident77.5Confident67 Ų6782.8 Ų82.855%0.55443%0.432SS*.THydrogen-bonded Turntrans-64.8-19.7177.900000114.7Y202Y202-A204 HydrophobicContact CD1-CB 4.31Å; Y202-A204 HydrophobicContact CE1-CB 3.89Å; Y202-A204 PolarHBondContact O-N 3.34Å
205L86.3Confident78.9Confident57 Ų5781.7 Ų81.730%0.29843%0.427SS..THydrogen-bonded Turntrans-80.3-39.2178.4-62.4-176.2000112.7C203 I228 L229C203-L205 PolarHBondContact O-N 3.49Å; L205-I228 HydrophobicContact CB-CG2 4.47Å; L205-L229 HydrophobicContact CD1-CB 3.99Å; L205-L229 HydrophobicContact CD1-CD1 3.89Å; L205-L229 HydrophobicContact CD1-CG 3.9Å
206C85.9Confident80.4Confident33 Ų3378.6 Ų78.622%0.22341%0.413CS..THydrogen-bonded Turntrans-103-7.5-178.8-57.80000113.6C203 V208 H219C203-C206 PolarHBondContact O-N 3.17Å; C203-C206 PolarHBondContact SG-N 2.9Å; C206-V208 VanDerWaalsContact C-N 3.33Å; C206-V208 HydrophobicContact CB-CG2 4.12Å; C206-V208 PolarHBondContact O-N 3.48Å; C206-H219 PolarHBondContact SG-NE2 3.47Å; C206-H219 VanDerWaalsContact SG-NE2 3.45Å
207K88.5Confident81.9Confident168 Ų16877.9 Ų77.973%0.7341%0.412SS*.THydrogen-bonded Turntrans5639.4-173.3-53.8-170.4178.6-177.20114.3Y202 C203Y202-K207 HydrophobicContact CE2-CB 4.33Å; C203-K207 VanDerWaalsContact O-CA 3.25Å; C203-K207 WeakPolarHBondContact O-CA 3.25Å; C203-K207 PolarHBondContact O-N 3.4Å
208V87.3Confident83.6Confident60 Ų6078.2 Ų78.236%0.36442%0.415SS..EExtended strand (participates in β ladder)trans-113.9128.5178.9-175.80000109.4C203 C206 V210C203-V208 PolarHBondContact N-O 3.18Å; C203-V208 PolarHBondContact O-N 3.35Å; C206-V208 VanDerWaalsContact C-N 3.33Å; C206-V208 HydrophobicContact CB-CG2 4.12Å; C206-V208 PolarHBondContact O-N 3.48Å; V208-V210 HydrophobicContact CG1-CG1 4Å
209A88.1Confident85.4Confident56 Ų5673.3 Ų73.346%0.46339%0.394SS..EExtended strand (participates in β ladder)trans-94136.7167.500000109.7L200 Y202L200-A209 HydrophobicContact CB-CB 4.41Å; Y202-A209 HydrophobicContact CD2-CB 4.37Å
210V88.9Confident86.8Confident24 Ų2468.7 Ų68.715%0.14538%0.382CS..EExtended strand (participates in β ladder)trans-129.7157.2178.3-60.90000111.8L201 V208 Q215 L216L201-V210 HydrophobicContact CB-CG2 4.19Å; L201-V210 PolarHBondContact N-O 3.35Å; L201-V210 WeakPolarHBondContact O-CG2 3.49Å; L201-V210 PolarHBondContact O-N 3.32Å; V208-V210 HydrophobicContact CG1-CG1 4Å; V210-Q215 HydrophobicContact CB-CB 4Å; V210-Q215 HydrophobicContact CG2-CB 4.03Å; V210-L216 HydrophobicContact CG2-CB 3.64Å; V210-L216 HydrophobicContact CG2-CD1 4.16Å
211N86.5Confident87.9Confident92 Ų9273 Ų7349%0.49240%0.398SS..SBendtrans-85.6-10.1-165.1-147.6-92.9000114.2K196 L200 Q215K196-N211 VanDerWaalsContact CE-OD1 3.25Å; K196-N211 WeakPolarHBondContact CE-OD1 3.26Å; L200-N211 HydrophobicContact CD2-CB 4.45Å; N211-Q215 VanDerWaalsContact N-OE1 3.09Å
212S86.1Confident88.3Confident44 Ų4472.1 Ų72.131%0.30840%0.399SS..SBendtrans-146.4150.6-174.4174.90000112.6L201 S214 Q215 L216L201-S212 VanDerWaalsContact CD1-C 3.43Å; S212-S214 VanDerWaalsContact C-N 3.3Å; S212-S214 PolarHBondContact O-N 3.26Å; S212-S214 PolarHBondContact OG-N 3.27Å; S212-S214 PolarHBondContact OG-OG 3.06Å; S212-Q215 WeakPolarHBondContact O-CB 3.4Å; S212-Q215 PolarHBondContact O-N 3.01Å; S212-Q215 VanDerWaalsContact O-N 3.1Å; S212-L216 PolarHBondContact O-N 3.3Å
213L86.1Confident88.4Confident108 Ų10871.4 Ų71.457%0.56541%0.408SS*.Hα-helixtrans-54.5-45.6171.2-79.7172.3000111.6L201 Q215 L216 E217L201-L213 HydrophobicContact CD1-CB 4.17Å; L201-L213 HydrophobicContact CD1-CD2 3.62Å; L201-L213 HydrophobicContact CD1-CG 3.65Å; L201-L213 HydrophobicContact CD2-CD2 3.61Å; L201-L213 HydrophobicContact CG-CD2 4.25Å; L213-Q215 VanDerWaalsContact C-N 3.26Å; L213-Q215 PolarHBondContact O-N 3.04Å; L213-L216 PolarHBondContact O-N 3.44Å; L213-L216 VanDerWaalsContact O-N 3.07Å; L213-E217 WeakPolarHBondContact O-CB 3.25Å; L213-E217 WeakPolarHBondContact O-CG 3.3Å; L213-E217 PolarHBondContact O-N 3.03Å
214S87.6Confident88.3Confident78 Ų7879.7 Ų79.755%0.54544%0.444SS..Hα-helixtrans-62.1-33.117857.70000112.9S212 A218S212-S214 VanDerWaalsContact C-N 3.3Å; S212-S214 PolarHBondContact O-N 3.26Å; S212-S214 PolarHBondContact OG-N 3.27Å; S212-S214 PolarHBondContact OG-OG 3.06Å; S214-A218 VanDerWaalsContact O-CB 3.24Å; S214-A218 WeakPolarHBondContact O-CB 3.16Å; S214-A218 PolarHBondContact O-N 3.17Å
215Q87.9Confident88.5Confident99 Ų9976.6 Ų76.646%0.46342%0.418SS..Hα-helixtrans-72.8-37.7174-68.1173.8-5.100111.8V210 N211 S212 L213 H219V210-Q215 HydrophobicContact CB-CB 4Å; V210-Q215 HydrophobicContact CG2-CB 4.03Å; N211-Q215 VanDerWaalsContact N-OE1 3.09Å; S212-Q215 WeakPolarHBondContact O-CB 3.4Å; S212-Q215 PolarHBondContact O-N 3.01Å; S212-Q215 VanDerWaalsContact O-N 3.1Å; L213-Q215 VanDerWaalsContact C-N 3.26Å; L213-Q215 PolarHBondContact O-N 3.04Å; Q215-H219 VanDerWaalsContact O-CB 3.26Å; Q215-H219 WeakPolarHBondContact O-CB 3.46Å; Q215-H219 PolarHBondContact O-N 3.47Å
216L89.6Confident88.6Confident30 Ų3079.3 Ų79.316%0.15743%0.428CS..Hα-helixtrans-67.9-44175.8-17766.7000110.2L201 C203 V210 S212 L213 H219 N220L201-L216 HydrophobicContact CB-CB 3.88Å; L201-L216 HydrophobicContact CB-CD2 3.78Å; L201-L216 HydrophobicContact CB-CG 4.23Å; L201-L216 HydrophobicContact CD2-CD2 3.98Å; L201-L216 HydrophobicContact CG-CD2 4.47Å; C203-L216 HydrophobicContact CB-CD1 4.03Å; V210-L216 HydrophobicContact CG2-CB 3.64Å; V210-L216 HydrophobicContact CG2-CD1 4.16Å; S212-L216 PolarHBondContact O-N 3.3Å; L213-L216 PolarHBondContact O-N 3.44Å; L213-L216 VanDerWaalsContact O-N 3.07Å; L216-H219 WeakPolarHBondContact O-CB 3.45Å; L216-H219 PolarHBondContact O-N 3.46Å; L216-N220 VanDerWaalsContact CD1-ND2 3.32Å; L216-N220 WeakPolarHBondContact CD1-ND2 3.34Å; L216-N220 WeakPolarHBondContact CG-ND2 3.42Å; L216-N220 PolarHBondContact O-N 2.91Å; L216-N220 PolarHBondContact O-ND2 2.99Å
217E88.6Confident88.7Confident101 Ų10181.3 Ų81.347%0.47244%0.439SS..Hα-helixtrans-62.7-44.7177.2-74.5-178.3-158.300112.2L213 H219 N220 K221L213-E217 WeakPolarHBondContact O-CB 3.25Å; L213-E217 WeakPolarHBondContact O-CG 3.3Å; L213-E217 PolarHBondContact O-N 3.03Å; E217-H219 VanDerWaalsContact C-N 3.31Å; E217-H219 PolarHBondContact O-N 3.36Å; E217-N220 PolarHBondContact O-N 3.25Å; E217-K221 WeakPolarHBondContact O-CB 3.37Å; E217-K221 VanDerWaalsContact O-CG 3.24Å; E217-K221 WeakPolarHBondContact O-CG 3.49Å; E217-K221 PolarHBondContact O-N 3.38Å
218A91.8Very high88.6Confident64 Ų6476.7 Ų76.753%0.52942%0.421SS..Hα-helixtrans-61.8-38.8173.300000111.8S214 G222S214-A218 VanDerWaalsContact O-CB 3.24Å; S214-A218 WeakPolarHBondContact O-CB 3.16Å; S214-A218 PolarHBondContact O-N 3.17Å; A218-G222 PolarHBondContact O-N 2.93Å
219H92.8Very high88.5Confident46 Ų4677.3 Ų77.321%0.21342%0.422CS..Hα-helixtrans-62.1-48.4173.117391.3000111.8C203 C206 Q215 L216 E217 K221 G222 H225C203-H219 PolarHBondContact SG-NE2 3.11Å; C206-H219 PolarHBondContact SG-NE2 3.47Å; C206-H219 VanDerWaalsContact SG-NE2 3.45Å; Q215-H219 VanDerWaalsContact O-CB 3.26Å; Q215-H219 WeakPolarHBondContact O-CB 3.46Å; Q215-H219 PolarHBondContact O-N 3.47Å; L216-H219 WeakPolarHBondContact O-CB 3.45Å; L216-H219 PolarHBondContact O-N 3.46Å; E217-H219 VanDerWaalsContact C-N 3.31Å; E217-H219 PolarHBondContact O-N 3.36Å; H219-K221 PolarHBondContact O-N 2.93Å; H219-G222 PolarHBondContact O-N 3.43Å; H219-H225 AromaticContact CD2-ND1 3.33Å; H219-H225 PolarHBondContact CD2-ND1 3.22Å; H219-H225 VanDerWaalsContact CD2-ND1 3.33Å; H219-H225 AromaticContact NE2-CG 3.93Å; H219-H225 AromaticContact NE2-ND1 3.14Å; H219-H225 PolarHBondContact NE2-ND1 2.76Å; H219-H225 VanDerWaalsContact NE2-ND1 3.14Å; H219-H225 WeakPolarHBondContact O-CB 3.28Å
220N88.8Confident88.2Confident66 Ų6679.7 Ų79.735%0.35342%0.424SS..Hα-helixtrans-64.5-38.7-178.9-81.9-102.4000112.2L216 E217 G222 H225L216-N220 VanDerWaalsContact CD1-ND2 3.32Å; L216-N220 WeakPolarHBondContact CD1-ND2 3.34Å; L216-N220 WeakPolarHBondContact CG-ND2 3.42Å; L216-N220 PolarHBondContact O-N 2.91Å; L216-N220 PolarHBondContact O-ND2 2.99Å; E217-N220 PolarHBondContact O-N 3.25Å; N220-G222 VanDerWaalsContact C-N 3.25Å; N220-G222 PolarHBondContact O-N 2.99Å; N220-H225 PolarHBondContact O-CD2 3.29Å; N220-H225 PolarHBondContact OD1-CE1 2.95Å; N220-H225 PolarHBondContact OD1-NE2 3.26Å
221K90Very high87.7Confident160 Ų16082.9 Ų82.970%0.69645%0.452SS*.Hα-helixtrans-74.1-15.3174.3-63171-146.6-77.20112.6E217 H219E217-K221 WeakPolarHBondContact O-CB 3.37Å; E217-K221 VanDerWaalsContact O-CG 3.24Å; E217-K221 WeakPolarHBondContact O-CG 3.49Å; E217-K221 PolarHBondContact O-N 3.38Å; H219-K221 PolarHBondContact O-N 2.93Å
222G91.8Very high87.2Confident26 Ų2686.5 Ų86.527%0.26846%0.459SS..SBendtrans-71.8143.1-177.200000113.6A218 H219 N220 K224 H225 K226A218-G222 PolarHBondContact O-N 2.93Å; H219-G222 PolarHBondContact O-N 3.43Å; N220-G222 VanDerWaalsContact C-N 3.25Å; N220-G222 PolarHBondContact O-N 2.99Å; G222-K224 PolarHBondContact O-N 3.45Å; G222-K224 VanDerWaalsContact O-N 3.08Å; G222-H225 PolarHBondContact O-N 2.79Å; G222-K226 PolarHBondContact O-N 3.01Å
223T89.4Confident86.7Confident115 Ų11587.4 Ų87.471%0.70647%0.466SS*.Hα-helixtrans-52.3-38-175.6-40.30000113.5K226 T227T223-K226 PolarHBondContact O-N 2.85Å; T223-T227 HydrophobicContact CG2-CG2 4.44Å; T223-T227 WeakPolarHBondContact O-CG2 3.31Å; T223-T227 PolarHBondContact O-N 3.45Å; T223-T227 PolarHBondContact O-OG1 2.85Å; T223-T227 VanDerWaalsContact O-OG1 3.1Å
224K86.4Confident85.7Confident179 Ų17984.9 Ų84.978%0.77847%0.465SS*.Hα-helixtrans-66.1-37.5179.9-62.7-179-178.1178.50112.8G222 T227 I228G222-K224 PolarHBondContact O-N 3.45Å; G222-K224 VanDerWaalsContact O-N 3.08Å; K224-T227 PolarHBondContact O-OG1 3.25Å; K224-I228 VanDerWaalsContact O-CD1 3.31Å; K224-I228 WeakPolarHBondContact O-CD1 3.26Å; K224-I228 VanDerWaalsContact O-CG1 3.28Å; K224-I228 WeakPolarHBondContact O-CG1 3.28Å
225H90.6Very high84Confident3 Ų389.7 Ų89.71%0.01448%0.484CS..Hα-helixtrans-74.4-47.4175.4-177.9104.4000110C203 H219 N220 G222 T227 I228 L229C203-H225 PolarHBondContact SG-CE1 3.38Å; C203-H225 PolarHBondContact SG-ND1 3.03Å; H219-H225 AromaticContact CD2-ND1 3.33Å; H219-H225 PolarHBondContact CD2-ND1 3.22Å; H219-H225 VanDerWaalsContact CD2-ND1 3.33Å; H219-H225 AromaticContact NE2-CG 3.93Å; H219-H225 AromaticContact NE2-ND1 3.14Å; H219-H225 PolarHBondContact NE2-ND1 2.76Å; H219-H225 VanDerWaalsContact NE2-ND1 3.14Å; H219-H225 WeakPolarHBondContact O-CB 3.28Å; N220-H225 PolarHBondContact O-CD2 3.29Å; N220-H225 PolarHBondContact OD1-CE1 2.95Å; N220-H225 PolarHBondContact OD1-NE2 3.26Å; G222-H225 PolarHBondContact O-N 2.79Å; H225-T227 PolarHBondContact O-N 3.38Å; H225-I228 PolarHBondContact O-N 3.13Å; H225-I228 VanDerWaalsContact O-N 3.13Å; H225-L229 WeakPolarHBondContact O-CB 3.38Å; H225-L229 PolarHBondContact O-N 3.13Å
226K89.3Confident82.4Confident114 Ų11487.3 Ų87.350%0.49649%0.486SS..Hα-helixtrans-55.2-46.2-179.7-176.6174.6173176.70112.5G222 T223 I228 L229 E230G222-K226 PolarHBondContact O-N 3.01Å; T223-K226 PolarHBondContact O-N 2.85Å; K226-I228 PolarHBondContact O-N 3.45Å; K226-L229 PolarHBondContact O-N 3.29Å; K226-E230 WeakPolarHBondContact CE-OE1 3.31Å; K226-E230 HydrophobicContact CG-CG 4.35Å; K226-E230 IonicContact NZ-OE1 3.48Å; K226-E230 WeakPolarHBondContact O-CB 3.2Å; K226-E230 WeakPolarHBondContact O-CG 3.24Å; K226-E230 PolarHBondContact O-N 3.47Å
227T87.9Confident80.6Confident74 Ų7492.1 Ų92.145%0.45452%0.519SS..Hα-helixtrans-67.3-33.8179.154.20000113.3T223 K224 H225 A231T223-T227 HydrophobicContact CG2-CG2 4.44Å; T223-T227 WeakPolarHBondContact O-CG2 3.31Å; T223-T227 PolarHBondContact O-N 3.45Å; T223-T227 PolarHBondContact O-OG1 2.85Å; T223-T227 VanDerWaalsContact O-OG1 3.1Å; K224-T227 PolarHBondContact O-OG1 3.25Å; H225-T227 PolarHBondContact O-N 3.38Å; T227-A231 VanDerWaalsContact O-CB 3.26Å; T227-A231 WeakPolarHBondContact O-CB 3.42Å; T227-A231 PolarHBondContact O-N 3.24Å
228I85.2Confident78.4Confident72 Ų7294.9 Ų94.937%0.36954%0.535SS..Hα-helixtrans-70.2-38.3174.4-68.1171000110.6L205 K224 H225 K226 R232L205-I228 HydrophobicContact CB-CG2 4.47Å; K224-I228 VanDerWaalsContact O-CD1 3.31Å; K224-I228 WeakPolarHBondContact O-CD1 3.26Å; K224-I228 VanDerWaalsContact O-CG1 3.28Å; K224-I228 WeakPolarHBondContact O-CG1 3.28Å; H225-I228 PolarHBondContact O-N 3.13Å; H225-I228 VanDerWaalsContact O-N 3.13Å; K226-I228 PolarHBondContact O-N 3.45Å; I228-R232 VanDerWaalsContact O-CB 3.28Å; I228-R232 WeakPolarHBondContact O-CB 3.42Å; I228-R232 PolarHBondContact O-N 3.36Å
229L85.6Confident76.1Confident73 Ų7399.5 Ų99.538%0.38254%0.544SS..Hα-helixtrans-65.8-47.6175.3-168.9157.2000110.5L205 H225 K226 A231 R232 S233L205-L229 HydrophobicContact CD1-CB 3.99Å; L205-L229 HydrophobicContact CD1-CD1 3.89Å; L205-L229 HydrophobicContact CD1-CG 3.9Å; H225-L229 WeakPolarHBondContact O-CB 3.38Å; H225-L229 PolarHBondContact O-N 3.13Å; K226-L229 PolarHBondContact O-N 3.29Å; L229-A231 PolarHBondContact O-N 3.36Å; L229-R232 CarbonylContact O-C 3.46Å; L229-R232 PolarHBondContact O-N 3.1Å; L229-R232 VanDerWaalsContact O-N 3.13Å; L229-S233 VanDerWaalsContact O-CB 3.29Å; L229-S233 WeakPolarHBondContact O-CB 3.39Å; L229-S233 PolarHBondContact O-N 3.05Å; L229-S233 PolarHBondContact O-OG 3.32Å
230E81.8Confident73.8Confident106 Ų106101.9 Ų101.950%0.49557%0.571SS.*Hα-helixtrans-64-37177.3-72.8172.2148.700112.9K226 R232 S233K226-E230 WeakPolarHBondContact CE-OE1 3.31Å; K226-E230 HydrophobicContact CG-CG 4.35Å; K226-E230 IonicContact NZ-OE1 3.48Å; K226-E230 WeakPolarHBondContact O-CB 3.2Å; K226-E230 WeakPolarHBondContact O-CG 3.24Å; K226-E230 PolarHBondContact O-N 3.47Å; E230-R232 PolarHBondContact O-N 3.02Å; E230-S233 PolarHBondContact O-OG 2.99Å
231A79.2Confident71.4Confident90 Ų90107 Ų10774%0.74459%0.587SS**Hα-helixtrans-69.5-17.4175.200000113.7T227 L229T227-A231 VanDerWaalsContact O-CB 3.26Å; T227-A231 WeakPolarHBondContact O-CB 3.42Å; T227-A231 PolarHBondContact O-N 3.24Å; L229-A231 PolarHBondContact O-N 3.36Å
232R74.1Confident69.9Low168 Ų168105.1 Ų105.163%0.63459%0.591SS**Hα-helixtrans-115.7-19.7-173.7-169.8170173.1-172.4-4.4113.8I228 L229 E230 G234I228-R232 VanDerWaalsContact O-CB 3.28Å; I228-R232 WeakPolarHBondContact O-CB 3.42Å; I228-R232 PolarHBondContact O-N 3.36Å; L229-R232 CarbonylContact O-C 3.46Å; L229-R232 PolarHBondContact O-N 3.1Å; L229-R232 VanDerWaalsContact O-N 3.13Å; E230-R232 PolarHBondContact O-N 3.02Å; R232-G234 PolarHBondContact O-N 3.32Å
233S75.8Confident67.7Low64 Ų64115.1 Ų115.145%0.44862%0.62SS.*Hα-helixtrans-68.4-21.9177.560.10000112.6L229 E230 L235L229-S233 VanDerWaalsContact O-CB 3.29Å; L229-S233 WeakPolarHBondContact O-CB 3.39Å; L229-S233 PolarHBondContact O-N 3.05Å; L229-S233 PolarHBondContact O-OG 3.32Å; E230-S233 PolarHBondContact O-OG 2.99Å; S233-L235 PolarHBondContact O-N 3.18Å
234G65.4Low65.4Low54 Ų54117.2 Ų117.256%0.55763%0.626SS**  trans61.720.2153.200000116.2R232 G236R232-G234 PolarHBondContact O-N 3.32Å; G234-G236 PolarHBondContact O-N 3.23Å; G234-G236 VanDerWaalsContact O-O 3.13Å
235L51.3Low63.3Low179 Ų179111.5 Ų111.594%0.93762%0.618SS**  trans-77.752.9178.3-66-179.8000112.4S233S233-L235 PolarHBondContact O-N 3.18Å
236G55.2Low61.1Low49 Ų49117.3 Ų117.351%0.50566%0.656SS.*SBendtrans-112.8147.6150.500000107.8G234 I238G234-G236 PolarHBondContact O-N 3.23Å; G234-G236 VanDerWaalsContact O-O 3.13Å; G236-I238 PolarHBondContact O-N 3Å
237P51.5Low59.1Low131 Ų131118 Ų11885%0.85167%0.672SS**SBendtrans-69.1108.1-173.428.1-34.1000110.8
238I43.2Very low56.9Low159 Ų159120.8 Ų120.882%0.81569%0.689SS**  trans-164.4129140-93.1140.5000110G236 A240G236-I238 PolarHBondContact O-N 3Å; I238-A240 PolarHBondContact O-N 3.21Å
239K43.8Very low55Low162 Ų162123.9 Ų123.970%0.70471%0.714SS**  trans-8.4115.4158.3-143.782.3169.4-177.10115.5Y241K239-Y241 HydrophobicContact CB-CD2 4.49Å; K239-Y241 HydrophobicContact CB-CE2 4.1Å; K239-Y241 HydrophobicContact CG-CD2 4.37Å; K239-Y241 HydrophobicContact CG-CE2 3.76Å
240A43.2Very low53Low95 Ų95123.8 Ų123.879%0.78573%0.731SS**  trans-60.7138.2158.500000109.9I238I238-A240 PolarHBondContact O-N 3.21Å
241Y39.5Very low50.9Low175 Ų175128 Ų12869%0.68675%0.751SS**  trans-119.2133.4158.1-82.3-79.1000109.2K239K239-Y241 HydrophobicContact CB-CD2 4.49Å; K239-Y241 HydrophobicContact CB-CE2 4.1Å; K239-Y241 HydrophobicContact CG-CD2 4.37Å; K239-Y241 HydrophobicContact CG-CE2 3.76Å
242P57.3Low49.5Very low119 Ų119129.4 Ų129.477%0.77375%0.752SS**PPolyproline II helixtrans-58.7153.5-175.2-28.236.3000114.8L244P242-L244 PolarHBondContact O-N 3.07Å
243R45.4Very low48.3Very low236 Ų236130.8 Ų130.889%0.89177%0.765SS**PPolyproline II helixtrans-59.5118.9174-170.7-166.2-159.9-69.94.3110.1G245R243-G245 PolarHBondContact O-N 3.46Å
244L42.3Very low46.6Very low160 Ų160132 Ų13284%0.83878%0.78SS**PPolyproline II helixtrans-58.1131.5172.2-68.3167.7000110.8P242P242-L244 PolarHBondContact O-N 3.07Å
245G41.3Very low45.6Very low59 Ų59135.4 Ų135.461%0.60879%0.792SS**  trans-83.4175.5161.300000111.3R243R243-G245 PolarHBondContact O-N 3.46Å
246P44.5Very low45.5Very low125 Ų125132.3 Ų132.381%0.81279%0.785SS**PPolyproline II helixtrans-63.8150.8177-19.133000112.3
247P48Very low45.3Very low127 Ų127137 Ų13783%0.82579%0.794SS**PPolyproline II helixtrans-77.4130.5-177.631.3-34.1000112.1
248T40.8Very low45.4Very low133 Ų133135.2 Ų135.282%0.81678%0.777SS**PPolyproline II helixtrans-87.2130159.946.90000109.1
249P45.4Very low46.4Very low138 Ų138135 Ų13590%0.89677%0.766SS**PPolyproline II helixtrans-81.7126.7177.12.714.1000110.8
250G43.9Very low47.8Very low70 Ų70131 Ų13172%0.72276%0.755SS**  trans163122.2170.900000114.7
251E38.5Very low49.5Very low196 Ų196129 Ų12992%0.91673%0.729SS**  trans78.5152.7154.9-67.5-167.692.500120.5
252P48.9Very low51.8Low119 Ų119125.5 Ų125.577%0.77372%0.719SS**  trans-112.1-173.3-134.342.7-36.9000116.2
253E49.2Very low53.3Low196 Ų196120.2 Ų120.292%0.91668%0.684SS**  trans-65.2145.2-164.1-51.8-175.2105.600116.3
254A39Very low55.1Low91 Ų91115.6 Ų115.675%0.75267%0.673SS**  trans-142.3151158.700000108.6
255P45.3Very low57.1Low125 Ų125112.5 Ų112.581%0.81266%0.656SS**  trans-70.8142.3-14525.1-35.1000114.5Q257P255-Q257 PolarHBondContact O-N 2.97Å
256S49.9Very low59.1Low113 Ų113111.8 Ų111.879%0.7964%0.642SS**  trans-50.2106.7174.151.60000111.8D258S256-D258 PolarHBondContact O-N 3.18Å
257Q50.1Low61Low148 Ų148112.8 Ų112.869%0.69264%0.64SS**  trans-59.2105.9155.1-70.5-177.1-10.500106.8P255 R259P255-Q257 PolarHBondContact O-N 2.97Å; Q257-R259 HydrophobicContact CB-CG 4.36Å; Q257-R259 PolarHBondContact O-N 3.26Å
258D54.2Low62.7Low94 Ų94109.5 Ų109.550%0.50362%0.618SS.*  trans-67.378.5173.9-165.7-33.1000108.2S256 T260 N271S256-D258 PolarHBondContact O-N 3.18Å; D258-T260 PolarHBondContact O-N 3.39Å; D258-T260 PolarHBondContact O-OG1 3.22Å; D258-N271 VanDerWaalsContact CG-ND2 3.25Å; D258-N271 PolarHBondContact OD1-ND2 3.39Å; D258-N271 PolarHBondContact OD2-ND2 3.17Å
259R62.8Low65Low154 Ų154110.9 Ų110.958%0.58161%0.612SS**  trans-6784.6178.6-75.1-174.2173.5-166.6-2.1106.8Q257 F261Q257-R259 HydrophobicContact CB-CG 4.36Å; Q257-R259 PolarHBondContact O-N 3.26Å; R259-F261 HydrophobicContact CB-CE2 4.19Å; R259-F261 HydrophobicContact CB-CZ 4.16Å; R259-F261 WeakPolarHBondContact O-CD2 3.48Å; R259-F261 WeakPolarHBondContact O-CE2 3.34Å; R259-F261 WeakPolarHBondContact O-CG 3.38Å; R259-F261 PolarHBondContact O-N 3.22Å
260T73.8Confident66.9Low78 Ų78105.5 Ų105.548%0.47958%0.577SS.*  trans-63.5105.6-173.3-22.90000108.7D258 H262 K269D258-T260 PolarHBondContact O-N 3.39Å; D258-T260 PolarHBondContact O-OG1 3.22Å; T260-H262 PolarHBondContact O-N 3.1Å; T260-K269 HydrophobicContact CG2-CB 4.24Å
261F79.8Confident68.8Low53 Ų53106.9 Ų106.923%0.23257%0.568CS.*EExtended strand (participates in β ladder)trans-74.6110.1-169.9-73.5-82000109.4R259 V270 E273 L276R259-F261 HydrophobicContact CB-CE2 4.19Å; R259-F261 HydrophobicContact CB-CZ 4.16Å; R259-F261 WeakPolarHBondContact O-CD2 3.48Å; R259-F261 WeakPolarHBondContact O-CE2 3.34Å; R259-F261 WeakPolarHBondContact O-CG 3.38Å; R259-F261 PolarHBondContact O-N 3.22Å; F261-V270 HydrophobicContact CB-CG2 4.09Å; F261-V270 PolarHBondContact N-O 3.08Å; F261-V270 WeakPolarHBondContact O-CG2 3.44Å; F261-V270 PolarHBondContact O-N 2.85Å; F261-E273 HydrophobicContact CD1-CB 4.18Å; F261-E273 HydrophobicContact CD1-CG 4.05Å; F261-E273 HydrophobicContact CD2-CB 4.1Å; F261-E273 HydrophobicContact CE1-CB 3.72Å; F261-E273 HydrophobicContact CE1-CG 3.56Å; F261-E273 HydrophobicContact CE2-CB 3.65Å; F261-E273 HydrophobicContact CE2-CG 4.43Å; F261-E273 HydrophobicContact CG-CB 4.36Å; F261-E273 HydrophobicContact CZ-CB 3.45Å; F261-E273 VanDerWaalsContact CZ-CB 3.45Å; F261-E273 HydrophobicContact CZ-CG 3.79Å; F261-L276 HydrophobicContact CB-CB 3.74Å; F261-L276 HydrophobicContact CB-CD2 3.76Å; F261-L276 HydrophobicContact CB-CG 4.21Å; F261-L276 HydrophobicContact CD1-CD2 4.06Å; F261-L276 HydrophobicContact CG-CB 4.42Å; F261-L276 HydrophobicContact CG-CD2 4.35Å
262H87.1Confident71.1Confident102 Ų10299.4 Ų99.447%0.47254%0.537SS..EExtended strand (participates in β ladder)trans-98.3139.4-177.271.1-67.1000111.8T260 E264 K269T260-H262 PolarHBondContact O-N 3.1Å; H262-E264 WeakPolarHBondContact CD2-CG 3.49Å; H262-E264 IonicContact CD2-OE1 3.62Å; H262-E264 IonicContact CE1-OE1 3.83Å; H262-E264 WeakPolarHBondContact NE2-CG 3.3Å; H262-E264 IonicContact NE2-OE1 2.79Å; H262-E264 PolarHBondContact NE2-OE1 3.48Å; H262-K269 HydrophobicContact CB-CG 4.24Å
263C88.5Confident72.9Confident7 Ų798 Ų985%0.04752%0.52CS..EExtended strand (participates in β ladder)trans-103108.2167.1175.10000108.6I265 C266 N267 V268 L276 H279 H285C263-I265 VanDerWaalsContact C-N 3.33Å; C263-I265 PolarHBondContact O-N 2.89Å; C263-C266 PolarHBondContact O-N 3.01Å; C263-C266 PolarHBondContact SG-N 3.12Å; C263-N267 WeakPolarHBondContact O-CA 3.35Å; C263-N267 PolarHBondContact O-N 3.11Å; C263-V268 PolarHBondContact N-O 3.31Å; C263-V268 PolarHBondContact O-N 3.12Å; C263-L276 HydrophobicContact CB-CD1 3.78Å; C263-H279 PolarHBondContact SG-NE2 3.22Å; C263-H285 PolarHBondContact SG-CE1 3.48Å; C263-H285 PolarHBondContact SG-ND1 3.32Å
264E84.6Confident74.9Confident139 Ų13993.5 Ų93.565%0.6551%0.506SS*.THydrogen-bonded Turntrans-65.3-36.8-179.1-64173-176.700112H262 C266 N267H262-E264 WeakPolarHBondContact CD2-CG 3.49Å; H262-E264 IonicContact CD2-OE1 3.62Å; H262-E264 IonicContact CE1-OE1 3.83Å; H262-E264 WeakPolarHBondContact NE2-CG 3.3Å; H262-E264 IonicContact NE2-OE1 2.79Å; H262-E264 PolarHBondContact NE2-OE1 3.48Å; E264-C266 VanDerWaalsContact C-N 3.3Å; E264-C266 PolarHBondContact O-N 2.86Å; E264-N267 PolarHBondContact O-N 3.4Å; E264-N267 PolarHBondContact O-ND2 3.14Å
265I82.7Confident77.2Confident95 Ų9593.6 Ų93.649%0.48749%0.491SS..THydrogen-bonded Turntrans-68.8-28.8-176.6-54.7-179.4000112C263 V289C263-I265 VanDerWaalsContact C-N 3.33Å; C263-I265 PolarHBondContact O-N 2.89Å; I265-V289 HydrophobicContact CD1-CG2 3.71Å; I265-V289 HydrophobicContact CG2-CG2 4.07Å
266C84.7Confident79.4Confident45 Ų4588.8 Ų88.830%0.30446%0.458SS..THydrogen-bonded Turntrans-111.7-3.7177.7-58.40000113.3C263 E264 V268 H279C263-C266 PolarHBondContact O-N 3.01Å; C263-C266 PolarHBondContact SG-N 3.12Å; E264-C266 VanDerWaalsContact C-N 3.3Å; E264-C266 PolarHBondContact O-N 2.86Å; C266-V268 HydrophobicContact CB-CG2 3.91Å; C266-V268 WeakPolarHBondContact O-CG2 3.4Å; C266-V268 PolarHBondContact O-N 3.49Å; C266-H279 PolarHBondContact SG-NE2 3.31Å; C266-H279 VanDerWaalsContact SG-NE2 3.45Å
267N83.4Confident81.3Confident146 Ų14689.3 Ų89.378%0.78145%0.446SS*.THydrogen-bonded Turntrans47.837.3-170.4-69.9-69.1000114.2C263 E264C263-N267 WeakPolarHBondContact O-CA 3.35Å; C263-N267 PolarHBondContact O-N 3.11Å; E264-N267 PolarHBondContact O-N 3.4Å; E264-N267 PolarHBondContact O-ND2 3.14Å
268V84.2Confident83.3Confident58 Ų5888.7 Ų88.735%0.35244%0.443SS..EExtended strand (participates in β ladder)trans-104.4129.5177.9-175.20000109.4C263 C266 V270C263-V268 PolarHBondContact N-O 3.31Å; C263-V268 PolarHBondContact O-N 3.12Å; C266-V268 HydrophobicContact CB-CG2 3.91Å; C266-V268 WeakPolarHBondContact O-CG2 3.4Å; C266-V268 PolarHBondContact O-N 3.49Å; V268-V270 HydrophobicContact CG1-CG1 4.04Å
269K88.1Confident85.2Confident161 Ų16186 Ų8670%0.743%0.428SS*.EExtended strand (participates in β ladder)trans-96.5134168.2-62.8-177.1179.7-175.40109.1T260 H262T260-K269 HydrophobicContact CG2-CB 4.24Å; H262-K269 HydrophobicContact CB-CG 4.24Å
270V86Confident86.5Confident25 Ų2582.2 Ų82.215%0.15242%0.418CS..EExtended strand (participates in β ladder)trans-129.2150.7175-65.60000110.2F261 V268 S272 Q275 L276F261-V270 HydrophobicContact CB-CG2 4.09Å; F261-V270 PolarHBondContact N-O 3.08Å; F261-V270 WeakPolarHBondContact O-CG2 3.44Å; F261-V270 PolarHBondContact O-N 2.85Å; V268-V270 HydrophobicContact CG1-CG1 4.04Å; V270-S272 PolarHBondContact O-N 2.87Å; V270-Q275 HydrophobicContact CB-CB 3.96Å; V270-Q275 HydrophobicContact CG1-CB 4.48Å; V270-Q275 HydrophobicContact CG2-CB 4.02Å; V270-L276 HydrophobicContact CG2-CB 3.66Å; V270-L276 HydrophobicContact CG2-CD1 4.18Å
271N83.1Confident87.3Confident99 Ų9982.2 Ų82.253%0.52942%0.421SS..SBendtrans-83.4-9.9-168.7179.6-110.9000113.6D258D258-N271 VanDerWaalsContact CG-ND2 3.25Å; D258-N271 PolarHBondContact OD1-ND2 3.39Å; D258-N271 PolarHBondContact OD2-ND2 3.17Å
272S86.8Confident87.8Confident40 Ų4081.6 Ų81.628%0.2842%0.423SS..  trans-134.2143-178.3175.70000112.5V270 V274 Q275 L276V270-S272 PolarHBondContact O-N 2.87Å; S272-V274 PolarHBondContact O-N 3.2Å; S272-V274 PolarHBondContact OG-N 2.8Å; S272-Q275 WeakPolarHBondContact O-CB 3.32Å; S272-Q275 PolarHBondContact O-N 2.61Å; S272-Q275 VanDerWaalsContact O-N 3.08Å; S272-L276 PolarHBondContact O-N 3.45Å
273E87.6Confident87.9Confident89 Ų8986.2 Ų86.242%0.41644%0.437SS..Hα-helixtrans-58.2-34.1173.9-161.2-179.7148.900111.3F261 L276 K277F261-E273 HydrophobicContact CD1-CB 4.18Å; F261-E273 HydrophobicContact CD1-CG 4.05Å; F261-E273 HydrophobicContact CD2-CB 4.1Å; F261-E273 HydrophobicContact CE1-CB 3.72Å; F261-E273 HydrophobicContact CE1-CG 3.56Å; F261-E273 HydrophobicContact CE2-CB 3.65Å; F261-E273 HydrophobicContact CE2-CG 4.43Å; F261-E273 HydrophobicContact CG-CB 4.36Å; F261-E273 HydrophobicContact CZ-CB 3.45Å; F261-E273 VanDerWaalsContact CZ-CB 3.45Å; F261-E273 HydrophobicContact CZ-CG 3.79Å; E273-L276 PolarHBondContact O-N 3.11Å; E273-K277 HydrophobicContact CG-CD 4.37Å; E273-K277 WeakPolarHBondContact O-CB 3.45Å; E273-K277 VanDerWaalsContact O-CG 3.32Å; E273-K277 WeakPolarHBondContact O-CG 2.91Å; E273-K277 PolarHBondContact O-N 2.9Å; E273-K277 WeakPolarHBondContact OE1-CE 3.36Å; E273-K277 IonicContact OE1-NZ 2.6Å; E273-K277 PolarHBondContact OE1-NZ 3.23Å
274V90.4Very high87.7Confident101 Ų10196.5 Ų96.561%0.61247%0.474SS*.Hα-helixtrans-68.2-41.6178-175.60000110.4S272 L276 K277 Q278S272-V274 PolarHBondContact O-N 3.2Å; S272-V274 PolarHBondContact OG-N 2.8Å; V274-L276 VanDerWaalsContact C-N 3.32Å; V274-L276 PolarHBondContact O-N 3.5Å; V274-K277 PolarHBondContact O-N 3.15Å; V274-Q278 WeakPolarHBondContact O-CB 3.29Å; V274-Q278 PolarHBondContact O-N 3.3Å
275Q87.4Confident87.9Confident94 Ų9490.5 Ų90.544%0.43945%0.447SS..Hα-helixtrans-63.8-37.8173.1-69175.56.700111.4V270 S272 Q278 H279V270-Q275 HydrophobicContact CB-CB 3.96Å; V270-Q275 HydrophobicContact CG1-CB 4.48Å; V270-Q275 HydrophobicContact CG2-CB 4.02Å; S272-Q275 WeakPolarHBondContact O-CB 3.32Å; S272-Q275 PolarHBondContact O-N 2.61Å; S272-Q275 VanDerWaalsContact O-N 3.08Å; Q275-Q278 PolarHBondContact O-N 3.24Å; Q275-H279 VanDerWaalsContact O-CB 3.28Å; Q275-H279 WeakPolarHBondContact O-CB 3.26Å; Q275-H279 PolarHBondContact O-N 3.11Å
276L91.6Very high88.2Confident24 Ų2494.1 Ų94.113%0.12645%0.454CS..Hα-helixtrans-68-46.3176.3-176.367.3000111.3F261 C263 V270 S272 E273 V274 Q278 H279 I280F261-L276 HydrophobicContact CB-CB 3.74Å; F261-L276 HydrophobicContact CB-CD2 3.76Å; F261-L276 HydrophobicContact CB-CG 4.21Å; F261-L276 HydrophobicContact CD1-CD2 4.06Å; F261-L276 HydrophobicContact CG-CB 4.42Å; F261-L276 HydrophobicContact CG-CD2 4.35Å; C263-L276 HydrophobicContact CB-CD1 3.78Å; V270-L276 HydrophobicContact CG2-CB 3.66Å; V270-L276 HydrophobicContact CG2-CD1 4.18Å; S272-L276 PolarHBondContact O-N 3.45Å; E273-L276 PolarHBondContact O-N 3.11Å; V274-L276 VanDerWaalsContact C-N 3.32Å; V274-L276 PolarHBondContact O-N 3.5Å; L276-Q278 VanDerWaalsContact C-N 3.3Å; L276-Q278 PolarHBondContact O-N 2.93Å; L276-H279 WeakPolarHBondContact O-CB 3.06Å; L276-H279 PolarHBondContact O-N 3.21Å; L276-I280 HydrophobicContact CD1-CD1 4.1Å; L276-I280 HydrophobicContact CD1-CG1 4.29Å; L276-I280 HydrophobicContact CD2-CD1 4.17Å; L276-I280 HydrophobicContact CG-CD1 3.75Å; L276-I280 HydrophobicContact CG-CG1 4.33Å; L276-I280 WeakPolarHBondContact O-CB 3.42Å; L276-I280 VanDerWaalsContact O-CG1 3.3Å; L276-I280 WeakPolarHBondContact O-CG1 3.36Å; L276-I280 PolarHBondContact O-N 3.25Å
277K89.6Confident88.2Confident124 Ų12496 Ų9654%0.53946%0.461SS..Hα-helixtrans-58.1-43.1175.1-75.2170.2-179.3167.80111.3E273 V274 I280 S281E273-K277 HydrophobicContact CG-CD 4.37Å; E273-K277 WeakPolarHBondContact O-CB 3.45Å; E273-K277 VanDerWaalsContact O-CG 3.32Å; E273-K277 WeakPolarHBondContact O-CG 2.91Å; E273-K277 PolarHBondContact O-N 2.9Å; E273-K277 WeakPolarHBondContact OE1-CE 3.36Å; E273-K277 IonicContact OE1-NZ 2.6Å; E273-K277 PolarHBondContact OE1-NZ 3.23Å; V274-K277 PolarHBondContact O-N 3.15Å; K277-I280 PolarHBondContact O-N 3.21Å; K277-S281 WeakPolarHBondContact O-CB 3.38Å; K277-S281 PolarHBondContact O-N 3.14Å; K277-S281 PolarHBondContact O-OG 3.48Å
278Q92.6Very high88.1Confident134 Ų13490.8 Ų90.863%0.62644%0.442SS*.Hα-helixtrans-65-43.6175.3-167.6175.414.900111.8V274 Q275 L276 S281 S282V274-Q278 WeakPolarHBondContact O-CB 3.29Å; V274-Q278 PolarHBondContact O-N 3.3Å; Q275-Q278 PolarHBondContact O-N 3.24Å; L276-Q278 VanDerWaalsContact C-N 3.3Å; L276-Q278 PolarHBondContact O-N 2.93Å; Q278-S281 PolarHBondContact O-N 3.33Å; Q278-S281 PolarHBondContact O-OG 3.06Å; Q278-S282 PolarHBondContact O-N 2.84Å
279H93.8Very high87.9Confident39 Ų3991.8 Ų91.818%0.18145%0.448CS..Hα-helixtrans-57.5-49.8173.8172.890000111.8C263 C266 Q275 L276 S281 S282 H285C263-H279 PolarHBondContact SG-NE2 3.22Å; C266-H279 PolarHBondContact SG-NE2 3.31Å; C266-H279 VanDerWaalsContact SG-NE2 3.45Å; Q275-H279 VanDerWaalsContact O-CB 3.28Å; Q275-H279 WeakPolarHBondContact O-CB 3.26Å; Q275-H279 PolarHBondContact O-N 3.11Å; L276-H279 WeakPolarHBondContact O-CB 3.06Å; L276-H279 PolarHBondContact O-N 3.21Å; H279-S281 VanDerWaalsContact C-N 3.34Å; H279-S281 PolarHBondContact O-N 2.99Å; H279-S282 WeakPolarHBondContact O-CB 3.3Å; H279-S282 PolarHBondContact O-N 3.32Å; H279-S282 PolarHBondContact O-OG 2.99Å; H279-H285 AromaticContact CD2-ND1 3.71Å; H279-H285 AromaticContact NE2-ND1 3.43Å; H279-H285 PolarHBondContact NE2-ND1 2.66Å; H279-H285 WeakPolarHBondContact O-CB 3.43Å
280I91.4Very high87.4Confident73 Ų7387.2 Ų87.237%0.37444%0.44SS..Hα-helixtrans-62.6-40.2179.3-68.3169.1000111.2L276 K277 S282 H285L276-I280 HydrophobicContact CD1-CD1 4.1Å; L276-I280 HydrophobicContact CD1-CG1 4.29Å; L276-I280 HydrophobicContact CD2-CD1 4.17Å; L276-I280 HydrophobicContact CG-CD1 3.75Å; L276-I280 HydrophobicContact CG-CG1 4.33Å; L276-I280 WeakPolarHBondContact O-CB 3.42Å; L276-I280 VanDerWaalsContact O-CG1 3.3Å; L276-I280 WeakPolarHBondContact O-CG1 3.36Å; L276-I280 PolarHBondContact O-N 3.25Å; K277-I280 PolarHBondContact O-N 3.21Å; I280-S282 PolarHBondContact O-N 3.29Å; I280-H285 PolarHBondContact O-CD2 3.21Å
281S90.1Very high86.2Confident79 Ų7989.1 Ų89.155%0.55247%0.465SS*.Hα-helixtrans-67.3-20.9175.478.70000113.6K277 Q278 H279K277-S281 WeakPolarHBondContact O-CB 3.38Å; K277-S281 PolarHBondContact O-N 3.14Å; K277-S281 PolarHBondContact O-OG 3.48Å; Q278-S281 PolarHBondContact O-N 3.33Å; Q278-S281 PolarHBondContact O-OG 3.06Å; H279-S281 VanDerWaalsContact C-N 3.34Å; H279-S281 PolarHBondContact O-N 2.99Å
282S90.6Very high84.8Confident39 Ų3992.2 Ų92.227%0.27347%0.474SS..SBendtrans-66.9147.6-173.282.40000112.1Q278 H279 I280 R284 H285 R286Q278-S282 PolarHBondContact O-N 2.84Å; H279-S282 WeakPolarHBondContact O-CB 3.3Å; H279-S282 PolarHBondContact O-N 3.32Å; H279-S282 PolarHBondContact O-OG 2.99Å; I280-S282 PolarHBondContact O-N 3.29Å; S282-R284 PolarHBondContact O-N 3.38Å; S282-H285 PolarHBondContact O-N 3.46Å; S282-H285 PolarHBondContact OG-N 2.98Å; S282-R286 WeakPolarHBondContact O-CG 3.48Å; S282-R286 PolarHBondContact O-N 2.67Å; S282-R286 VanDerWaalsContact O-N 3.11Å
283R88.4Confident83Confident200 Ų20096.1 Ų96.176%0.75550%0.498SS*.Hα-helixtrans-55.8-38.2177.1-177.4173.2178.6-179.63.1112.5H285 R286 D287R283-H285 PolarHBondContact O-N 2.83Å; R283-R286 PolarHBondContact O-N 2.75Å; R283-D287 WeakPolarHBondContact CG-OD2 3.25Å; R283-D287 IonicContact NE-OD2 3.59Å; R283-D287 WeakPolarHBondContact O-CB 3.42Å; R283-D287 PolarHBondContact O-N 3.28Å
284R85.8Confident81.3Confident222 Ų22296.5 Ų96.584%0.83850%0.503SS*.Hα-helixtrans-63.3-41.5179.9-66.7-176.9-176.3174.22112.5S282 G288S282-R284 PolarHBondContact O-N 3.38Å; R284-G288 PolarHBondContact O-N 3.35Å; R284-G288 VanDerWaalsContact O-N 3.16Å
285H88.9Confident79.8Confident14 Ų1497.1 Ų97.17%0.06551%0.509CS..Hα-helixtrans-66.2-48.8174.8179.587.5000110.6C263 H279 I280 S282 R283 D287 G288 V289C263-H285 PolarHBondContact SG-CE1 3.48Å; C263-H285 PolarHBondContact SG-ND1 3.32Å; H279-H285 AromaticContact CD2-ND1 3.71Å; H279-H285 AromaticContact NE2-ND1 3.43Å; H279-H285 PolarHBondContact NE2-ND1 2.66Å; H279-H285 WeakPolarHBondContact O-CB 3.43Å; I280-H285 PolarHBondContact O-CD2 3.21Å; S282-H285 PolarHBondContact O-N 3.46Å; S282-H285 PolarHBondContact OG-N 2.98Å; R283-H285 PolarHBondContact O-N 2.83Å; H285-D287 VanDerWaalsContact C-N 3.31Å; H285-D287 PolarHBondContact O-N 3.41Å; H285-G288 CarbonylContact O-C 3.58Å; H285-G288 WeakPolarHBondContact O-CA 3.44Å; H285-G288 PolarHBondContact O-N 3.08Å; H285-V289 WeakPolarHBondContact NE2-CG2 3.38Å; H285-V289 VanDerWaalsContact O-CG2 3.26Å; H285-V289 WeakPolarHBondContact O-CG2 3.4Å; H285-V289 PolarHBondContact O-N 2.99Å
286R87.9Confident78.3Confident171 Ų17199.3 Ų99.365%0.64552%0.523SS*.Hα-helixtrans-60.1-37.7179.7-63.9178.972.5169.45.9113.3S282 R283 A290S282-R286 WeakPolarHBondContact O-CG 3.48Å; S282-R286 PolarHBondContact O-N 2.67Å; S282-R286 VanDerWaalsContact O-N 3.11Å; R283-R286 PolarHBondContact O-N 2.75Å; R286-A290 PolarHBondContact O-N 3.1Å
287D84.9Confident76.6Confident83 Ų83104.3 Ų104.344%0.44455%0.549SS..Hα-helixtrans-68.8-33.7175-69.2-24.2000111.5R283 H285R283-D287 WeakPolarHBondContact CG-OD2 3.25Å; R283-D287 IonicContact NE-OD2 3.59Å; R283-D287 WeakPolarHBondContact O-CB 3.42Å; R283-D287 PolarHBondContact O-N 3.28Å; H285-D287 VanDerWaalsContact C-N 3.31Å; H285-D287 PolarHBondContact O-N 3.41Å
288G80.8Confident74.7Confident37 Ų37104 Ų10438%0.38156%0.562SS.*Hα-helixtrans-72.3-40.2173.300000114.1R284 H285 A290 G291R284-G288 PolarHBondContact O-N 3.35Å; R284-G288 VanDerWaalsContact O-N 3.16Å; H285-G288 CarbonylContact O-C 3.58Å; H285-G288 WeakPolarHBondContact O-CA 3.44Å; H285-G288 PolarHBondContact O-N 3.08Å; G288-A290 PolarHBondContact O-N 2.83Å; G288-G291 PolarHBondContact O-N 2.98Å
289V81.2Confident72.9Confident80 Ų80108.1 Ų108.149%0.48557%0.572SS.*Hα-helixtrans-57.9-35.1173.1175.90000111.2I265 H285 G291I265-V289 HydrophobicContact CD1-CG2 3.71Å; I265-V289 HydrophobicContact CG2-CG2 4.07Å; H285-V289 WeakPolarHBondContact NE2-CG2 3.38Å; H285-V289 VanDerWaalsContact O-CG2 3.26Å; H285-V289 WeakPolarHBondContact O-CG2 3.4Å; H285-V289 PolarHBondContact O-N 2.99Å; V289-G291 PolarHBondContact O-N 3.07Å
290A76.5Confident71.1Confident65 Ų65114.5 Ų114.554%0.53760%0.602SS.*THydrogen-bonded Turntrans-72.410.4-17800000114.7R286 G288 K292R286-A290 PolarHBondContact O-N 3.1Å; G288-A290 PolarHBondContact O-N 2.83Å; A290-K292 PolarHBondContact O-N 2.78Å
291G61.5Low68.9Low64 Ų64120.6 Ų120.666%0.6663%0.626SS**THydrogen-bonded Turntrans6611.1172.400000115G288 V289 P293G288-G291 PolarHBondContact O-N 2.98Å; V289-G291 PolarHBondContact O-N 3.07Å; G291-P293 WeakPolarHBondContact O-CD 3.44Å
292K52.7Low66.3Low165 Ų165126 Ų12672%0.71764%0.639SS**  trans-87104.5175.6-72.1174.5-179.1176.70108A290 N294A290-K292 PolarHBondContact O-N 2.78Å; K292-N294 PolarHBondContact O-N 2.83Å
293P50.3Low64.1Low121 Ų121129.8 Ų129.879%0.78666%0.662SS**  trans-61.2118.5178.626.1-33.8000108.4G291 P295G291-P293 WeakPolarHBondContact O-CD 3.44Å; P293-P295 VanDerWaalsContact O-CD 3.25Å; P293-P295 WeakPolarHBondContact O-CD 3.24Å
294N50.5Low61.8Low97 Ų97132.4 Ų132.452%0.51967%0.672SS.*  trans-71.1113.2175.9-174.6-36.9000108.1K292 L296 L297K292-N294 PolarHBondContact O-N 2.83Å; N294-L296 PolarHBondContact O-N 3.21Å; N294-L296 PolarHBondContact OD1-N 2.92Å; N294-L297 HydrophobicContact CB-CD2 4.36Å; N294-L297 PolarHBondContact O-N 3.46Å
295P58.4Low59.4Low115 Ų115125.5 Ų125.575%0.74767%0.671SS**THydrogen-bonded Turntrans-68.4-9.1-168.927.6-35.2000113.7P293P293-P295 VanDerWaalsContact O-CD 3.25Å; P293-P295 WeakPolarHBondContact O-CD 3.24Å
296L57.1Low57.2Low140 Ų140130 Ų13073%0.73371%0.71SS**THydrogen-bonded Turntrans-98.2-7.5-172.8-55-170000114.9N294N294-L296 PolarHBondContact O-N 3.21Å; N294-L296 PolarHBondContact OD1-N 2.92Å
297L54.8Low54.7Low128 Ų128126.4 Ų126.467%0.6772%0.717SS**THydrogen-bonded Turntrans-101.4-17.1-174.1-77.8-62.8000114.3N294 R299N294-L297 HydrophobicContact CB-CD2 4.36Å; N294-L297 PolarHBondContact O-N 3.46Å; L297-R299 PolarHBondContact O-N 2.98Å
298S51.3Low52.5Low117 Ų117130 Ų13082%0.81873%0.731SS**THydrogen-bonded Turntrans-73-3.3179.4-73.10000115.3
299R54.5Low50.8Low221 Ų221135.2 Ų135.283%0.83475%0.75SS**THydrogen-bonded Turntrans-85-11.9-172.7-165163.7-178.1-168.4-1115.5L297L297-R299 PolarHBondContact O-N 2.98Å
300H55.4Low48.7Very low173 Ų173136.6 Ų136.680%0.80177%0.769SS**SBendtrans-119.928.6-165.1-85.4101.2000117.6
301K44.5Very low46.6Very low202 Ų202136.6 Ų136.688%0.87878%0.775SS**  trans-124.278.8157.4-81.4-164.6173.8-174.50111.8P303K301-P303 WeakPolarHBondContact O-CD 3.24Å
302K36.5Very low45.4Very low193 Ų193140 Ų14084%0.83978%0.784SS**  trans-87.7107.6160.5-172.485.6174.7-176.50107.2R304K302-R304 PolarHBondContact O-N 2.93Å
303P43.3Very low44.7Very low117 Ų117140 Ų14076%0.7679%0.791SS**  trans-66.2134.1167.328-31.5000108.7K301K301-P303 WeakPolarHBondContact O-CD 3.24Å
304R41.6Very low44Very low255 Ų255141.2 Ų141.296%0.96280%0.796SS**  trans-103.5109.7174.7-174.1179.8-172.4167.81.7107.4K302K302-R304 PolarHBondContact O-N 2.93Å
305G34.5Very low43.1Very low78 Ų78145.4 Ų145.480%0.80481%0.81SS**  trans-173139.7178.800000109.1
306A42.4Very low42.3Very low107 Ų107145.8 Ų145.888%0.88482%0.815SS**  trans-122.2137-169.100000112.1
307A36.6Very low41.5Very low96 Ų96146.5 Ų146.579%0.79381%0.813SS**  trans178.7115.1154.200000105.6
308E39.1Very low40.5Very low160 Ų160147 Ų14775%0.74881%0.812SS**  74118.376.9-96.9-75.980.300115.4
309L44.3Very low39.9Very low146 Ų146147.6 Ų147.676%0.76481%0.805SS**  trans68.8150.9161.3-54.9-178.1000123.7
310A35.9Very low40Very low108 Ų108141.6 Ų141.689%0.89379%0.794SS**  trans68.8129175.200000117.7
311G33Very low39.1Very low65 Ų65142.1 Ų142.167%0.6779%0.794SS**  cis179.3173.4-5.100000114.3
312T36.4Very low38.4Very low136 Ų136137.5 Ų137.583%0.83479%0.787SS**  trans5693.5156.756.20000120.7
313L39Very low38.3Very low165 Ų165136.3 Ų136.386%0.86479%0.789SS**  14.1126.2123.2-56.3171.7000119.1
314T34.8Very low37.6Very low146 Ų146135.6 Ų135.690%0.89679%0.793SS**  trans-137.4126.3132.237.10000110.6
315F32.1Very low37.1Very low185 Ų185127.5 Ų127.581%0.81179%0.789SS**  trans-103.7128.9178-154.9-90.7000107K317F315-K317 HydrophobicContact CD1-CB 4.21Å; F315-K317 HydrophobicContact CE1-CB 4.38Å
316S42Very low36.9Very low124 Ų124127.1 Ų127.187%0.86779%0.786SS**  trans-114.5125.8169-63.60000109
317K40.4Very low36.5Very low155 Ų155129.9 Ų129.967%0.67478%0.784SS**  trans-124.4166.1-167.6-173-172.7147.3176.70108.8F315F315-K317 HydrophobicContact CD1-CB 4.21Å; F315-K317 HydrophobicContact CE1-CB 4.38Å
318E33.4Very low36.8Very low139 Ų139133.1 Ų133.165%0.6579%0.787SS**  trans81.5140171.1-51.7-63.975.500115.9
319L38.3Very low36.8Very low129 Ų129131.4 Ų131.468%0.67579%0.79SS**  cis-164.8154.3-20.8-163.6132.2000108.4
320P56.5Low36.6Very low94 Ų94129.8 Ų129.861%0.6179%0.791SS**  trans-112.2178-173.840.3-31.5000115.5
321K35.6Very low36.9Very low184 Ų184130 Ų13080%0.878%0.783SS**  trans106.1146.3177.9-63.6175.4-15977.70112.9
322S31.4Very low36.8Very low105 Ų105134.1 Ų134.173%0.73479%0.789SS**  cis-157.1143.5-1.4-108.30000112.6
323L33.1Very low36.8Very low169 Ų169131.8 Ų131.889%0.88578%0.784SS**  38.1114.8125.8-160.3101.6000121.6
324A29.3Very low36.6Very low101 Ų101130.3 Ų130.384%0.83578%0.781SS**  trans-170.7129.213300000113.9
325G29.9Very low36.6Very low86 Ų86128 Ų12889%0.88778%0.777SS**  trans80.9106.5142.400000121
326G31.1Very low36.7Very low70 Ų70123.5 Ų123.572%0.72277%0.774SS**  trans140.498.7141.400000119.1
327L34.4Very low36.3Very low164 Ų164124.7 Ų124.786%0.85978%0.776SS**  trans6893.5140.4-50.3179000120.6
328L42.3Very low36.2Very low164 Ų164126 Ų12686%0.85979%0.787SS**  trans50.7117133.2-54.9177.3000121.3
329P39.7Very low36.3Very low125 Ų125124.1 Ų124.181%0.81280%0.795SS**  trans-107.7143.7153.335.2-26.8000113.8
330S39.5Very low36.2Very low112 Ų112122.5 Ų122.578%0.78380%0.8SS**  trans79.4138.4168.7-151.70000117.2
331P41.4Very low35Very low112 Ų112122.5 Ų122.573%0.72781%0.807SS**  -138.2150.494.338.3-26.5000116.3
332L31.8Very low35Very low152 Ų152119 Ų11980%0.79681%0.813SS**  trans41.5118.6136.6-63160.2000119
333A35.8Very low35.1Very low86 Ų86117.5 Ų117.571%0.71181%0.814SS**  70.2148.678.200000113
334V35.1Very low35.4Very low135 Ų135114.9 Ų114.982%0.81881%0.81SS**  cis-159.7152.435.7166.60000109.8
335A34.7Very low36.5Very low97 Ų97115.1 Ų115.180%0.80280%0.803SS**  trans150.3145.5131.400000113.4
336A34.3Very low36.7Very low91 Ų91118.2 Ų118.275%0.75280%0.798SS**  cis-169.8151-25.900000108.4
337V34.9Very low36.7Very low149 Ų149119.4 Ų119.490%0.90380%0.796SS**  trans178.9147.4137.1147.80000108.5
338M37.3Very low36.5Very low183 Ų183118.8 Ų118.890%0.90179%0.793SS**  trans-104.8175.8-158.7-78.4-75.3-165.200115
339A36.1Very low36.3Very low99 Ų99121.8 Ų121.882%0.81879%0.792SS**  trans92135.6162.100000117.4
340A35.2Very low36.4Very low94 Ų94120.9 Ų120.978%0.77779%0.786SS**  cis-162.2157.8-16.300000111.9
341A33.1Very low36.1Very low94 Ų94119.8 Ų119.878%0.77778%0.784SS**  trans60.6123.315100000122.2
342A34.9Very low36.4Very low110 Ų110120.4 Ų120.491%0.90979%0.788SS**  trans52.2145.7144.600000120.6
343G32.5Very low36.4Very low74 Ų74118.2 Ų118.276%0.76379%0.792SS**  cis173.4133.2-1.400000108.2
344S39.7Very low36.5Very low115 Ų115118.6 Ų118.680%0.80480%0.795SS**  trans-80.4-169.7-171-30.90000112.6
345P52.8Low37.1Very low105 Ų105117.8 Ų117.868%0.68279%0.793SS**  cis-139.9-167.2-11.423.33.9000114.8
346L33.3Very low37.1Very low151 Ų151121.1 Ų121.179%0.79180%0.796SS**  trans109110.1143.6-55.6-177.7000121.5
347S31.8Very low37.3Very low95 Ų95124.6 Ų124.666%0.66480%0.801SS**  80.2127.8118.1-72.70000125.7
348L31.1Very low37.3Very low152 Ų152127 Ų12780%0.79680%0.803SS**  trans87.692132.4-69.5166.8000123.4
349R37.6Very low37.3Very low227 Ų227121.6 Ų121.686%0.85779%0.794SS**  67.9-174.9121.1-136.2129.1154.989.53.7116.6
350P42Very low38.1Very low105 Ų105122.9 Ų122.968%0.68279%0.794SS**  -137.3178.4-111.444.5-25000118.5
351A33.4Very low38.7Very low90 Ų90124 Ų12474%0.74479%0.793SS**  trans77.8-177.9154.700000117.2
352P47Very low39.4Very low125 Ų125127.7 Ų127.781%0.81280%0.798SS**  -132.2160.3-86.739.8-24.7000115.4
353A32.8Very low39.6Very low105 Ų105127.1 Ų127.187%0.86878%0.783SS**  trans-165.2156.1156.300000112.4
354A37.8Very low39.9Very low94 Ų94131.8 Ų131.878%0.77779%0.785SS**  trans-123.5-160.2171.500000109.8
355P46.4Very low40.2Very low118 Ų118131.5 Ų131.577%0.76678%0.78SS**  -105.9168.9-97.638.8-27.9000113.1
356L34.8Very low39.7Very low167 Ų167134.3 Ų134.387%0.87479%0.789SS**  trans-143.4149.1169-88.5-173.2000115.1
357L39.6Very low40Very low165 Ų165135 Ų13586%0.86479%0.792SS**  trans84.796.7164.5-64.2167.8000119.5
358Q33.7Very low40.8Very low199 Ų199139.4 Ų139.493%0.9380%0.802SS**  trans-55.1153155-70.3150.3-83.100113.2
359G37.7Very low41.5Very low70 Ų70137.8 Ų137.872%0.72280%0.8SS**  trans-132.1144157.600000110.4
360P53.5Low41.6Very low126 Ų126131.3 Ų131.382%0.81880%0.796SS**  trans-84.7166.3-169-10.529.7000115
361P47.7Very low41.9Very low116 Ų116132.9 Ų132.975%0.75381%0.806SS**  trans-88.1146-172.135.1-34.5000113.7
362I47.7Very low42.8Very low173 Ų173131.3 Ų131.389%0.88780%0.798SS**  trans-109.3136.3162.1-59.6-179000108.1
363T38.1Very low42.8Very low97 Ų97131.4 Ų131.460%0.59580%0.799SS**  trans-114.4161.3-168.351.70000112.7
364H40.6Very low43.5Very low172 Ų172134.1 Ų134.180%0.79680%0.797SS**  trans73.2163.9164.9-57-61.6000115.9
365P43.9Very low44Very low109 Ų109140.8 Ų140.871%0.70880%0.802SS**  -128.7-173.3-102.6242.1000111.2
366L42.8Very low44Very low164 Ų164141.4 Ų141.486%0.85980%0.804SS**  176.7127.3128.1-94.5162.5000110H368L366-H368 PolarHBondContact O-N 3.29Å
367L41.1Very low44.4Very low166 Ų166138 Ų13887%0.86980%0.801SS**PPolyproline II helixtrans-72.7118.5178.2-67.2144.7000109.1P369L367-P369 WeakPolarHBondContact O-CD 2.99Å
368H48.7Very low44.6Very low188 Ų188139.3 Ų139.387%0.8780%0.802SS**PPolyproline II helixtrans-68.7122.7165.3-98.1-108.6000109.6L366L366-H368 PolarHBondContact O-N 3.29Å
369P45.1Very low45.5Very low117 Ų117133 Ų13376%0.7679%0.79SS**PPolyproline II helixtrans-67.3142.5173.1-18.933.2000111.2L367L367-P369 WeakPolarHBondContact O-CD 2.99Å
370A39.8Very low46.5Very low91 Ų91136.1 Ų136.175%0.75280%0.798SS**PPolyproline II helixtrans-69.4144.1176.300000111.6G372A370-G372 PolarHBondContact O-N 3.03Å
371P48.1Very low46.5Very low138 Ų138136.9 Ų136.990%0.89679%0.794SS**  trans-65.1108.3171.1-18.831.9000110.7
372G52.5Low46.7Very low57 Ų57139.5 Ų139.559%0.58880%0.8SS**  trans-73.3159.3176.500000113A370 I374A370-G372 PolarHBondContact O-N 3.03Å; G372-I374 PolarHBondContact O-N 3.46Å
373P46.7Very low47.1Very low127 Ų127140.3 Ų140.383%0.82580%0.798SS**  trans-75.4121.2-179-8.625.6000111.2R375P373-R375 PolarHBondContact O-N 2.95Å; P373-R375 VanDerWaalsContact O-N 3.11Å
374I48.3Very low47.3Very low163 Ų163141.1 Ų141.184%0.83681%0.807SS**  trans-70.6107172.2-59.2174.2000108.4G372 T376G372-I374 PolarHBondContact O-N 3.46Å; I374-T376 PolarHBondContact O-N 3.31Å
375R46.7Very low48.5Very low233 Ų233138.6 Ų138.688%0.87981%0.806SS**  trans-78.8114169.1-58-176.678.2-164.34.4108.4P373 A377P373-R375 PolarHBondContact O-N 2.95Å; P373-R375 VanDerWaalsContact O-N 3.11Å; R375-A377 PolarHBondContact O-N 2.6Å
376T46.5Very low48.5Very low131 Ų131147.9 Ų147.980%0.80483%0.829SS**PPolyproline II helixtrans-66.8119.8168.546.40000109.5I374I374-T376 PolarHBondContact O-N 3.31Å
377A44.3Very low48.8Very low97 Ų97147.1 Ų147.180%0.80283%0.828SS**PPolyproline II helixtrans-69.3156.4178.200000112.1R375R375-A377 PolarHBondContact O-N 2.6Å
378H43Very low49.2Very low191 Ų191146.1 Ų146.188%0.88483%0.826SS**PPolyproline II helixtrans-67.4135.4-179.6-72.9-117.8000111.9
379G53Low49.2Very low67 Ų67143.8 Ų143.869%0.69182%0.823SS**PPolyproline II helixtrans-91.5144.1157.300000110.3
380P58Low49.5Very low136 Ų136145.4 Ų145.488%0.88383%0.827SS**PPolyproline II helixtrans-75.9156.9-177.131-35000113.2
381I53.8Low50.1Low142 Ų142148.8 Ų148.873%0.72883%0.832SS**PPolyproline II helixtrans-77.4138.8-176.8-63.2157.2000110.6F383I381-F383 HydrophobicContact CG2-CD2 3.8Å
382L53.2Low50.2Low171 Ų171149.5 Ų149.590%0.89583%0.827SS**  trans-128.8106.4153.2-78.9174.7000109.3
383F54.8Low50.1Low189 Ų189156.1 Ų156.183%0.82984%0.844SS**  trans-85.2135.1161.2-102.4-107.3000108I381I381-F383 HydrophobicContact CG2-CD2 3.8Å
384S43.3Very low50.3Low114 Ų114158.3 Ų158.380%0.79785%0.846SS**  trans-128.6115.4163.2-71.10000108.6
385P65.5Low50.5Low119 Ų119157.9 Ų157.977%0.77385%0.847SS**  trans-93.4128.117233.7-28.6000111.1
386Y43.8Very low50.8Low305 Ų305151.1 Ų151.1100%1.19684%0.844SS**  trans-154.20145.3-149-90.7000109.4

Retrieved 386 of 386 residues in 70.7 ms (Link to these results)