A0A087X7S6_POEFO Loading...

Secreted frizzled-related protein 1

AlphaFold DB (A0A3B3VKF7), UniProt , Accession A0A087X7S6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 318 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M36.4Very low30.4Very low243 Ų243161.9 Ų161.9100%1.19785%0.848SS**  081.50-55.2176.5-156.900105.8
2A28.2Very low30.5Very low85 Ų85164.1 Ų164.170%0.70285%0.846SS**  72.5133.152.700000114.5
3Y26.3Very low30.7Very low241 Ų241162.6 Ų162.695%0.94585%0.849SS**  trans86.2124.6178.1-69-89.9000116.6
4G27.3Very low30.9Very low68 Ų68163.2 Ų163.270%0.70185%0.846SS**  cis164.1124.15.500000105.8
5Q29.5Very low31.2Very low186 Ų186159.1 Ų159.187%0.86984%0.837SS**  57.4106.374.8-128.7171.46.800117.2
6K31.8Very low31.5Very low196 Ų196158.7 Ų158.785%0.85283%0.834SS**  trans21123.6146.6-69.5178.2175.1179.30120
7I33.3Very low31.7Very low164 Ų164161.6 Ų161.684%0.84184%0.839SS**  trans-153109.4142.8-59.8-170.1000107
8L28.9Very low31.8Very low150 Ų150156.4 Ų156.479%0.78583%0.832SS**  86.6107.179-14882.1000115
9K30.6Very low32.1Very low188 Ų188157.8 Ų157.882%0.81784%0.838SS**  trans9.3129.6147.8-62.3176.4174.5-179.20119.7
10L31.6Very low32.3Very low176 Ų176154.6 Ų154.692%0.92184%0.835SS**  trans-147.4107.3137.4-99.6112.1000108.1
11A30.4Very low32.5Very low84 Ų84154.9 Ų154.969%0.69484%0.835SS**  87.395.9103.300000110.8
12F31.5Very low32.7Very low188 Ų188149 Ų14983%0.82582%0.818SS**  47.493.467.5-110.9-82.6000113.7
13T33.9Very low33.1Very low145 Ų145151.6 Ų151.689%0.8982%0.819SS**  trans-148.1127.5147.345.40000110.5
14Q33.7Very low33.6Very low171 Ų171146.4 Ų146.480%0.79981%0.807SS**  trans-77.6161.7-179.3-65.1155.8-4300112.7
15S34.3Very low34.2Very low102 Ų102151.9 Ų151.971%0.71382%0.82SS**  160.8105.8128.1-170.90000109.1
16L36.3Very low34.5Very low152 Ų152151 Ų15180%0.79681%0.813SS**  58.612486.5-79.8157.1000114.8
17F35.1Very low34.6Very low208 Ų208146.2 Ų146.291%0.91280%0.804SS**  trans136.1102.7153-86.1-81.3000111.4
18G33.9Very low34.7Very low69 Ų69146.4 Ų146.471%0.71181%0.806SS**  107.299.397.800000110.5
19L37.9Very low35.2Very low182 Ų182147 Ų14795%0.95381%0.809SS**  38.6106.6101.3-76.9169.5000115.5
20A35.9Very low35.5Very low93 Ų93143.4 Ų143.477%0.76981%0.805SS**  trans158104.4138.800000108.7
21L35.8Very low35.7Very low161 Ų161142.7 Ų142.784%0.84380%0.802SS**  50.491.592.8-127.199.7000113.7L23L21-L23 HydrophobicContact CD2-CD1 4.39Å
22S40.8Very low36.1Very low120 Ų120146 Ų14684%0.83981%0.806SS**  trans-143.389.7147.366.30000109.4
23L36.8Very low36.3Very low139 Ų139143.1 Ų143.173%0.72880%0.804SS**  trans-47.1150.1161.5-83.8152.9000112.4L21L21-L23 HydrophobicContact CD2-CD1 4.39Å
24L36.5Very low36.5Very low133 Ų133141.6 Ų141.670%0.69680%0.795SS**  trans86.587.7157.6-58.2158.9000118F26L24-F26 HydrophobicContact CD2-CD2 3.66Å; L24-F26 HydrophobicContact CD2-CE2 4.05Å
25L38.8Very low36.7Very low183 Ų183138.3 Ų138.396%0.95880%0.797SS**  -127.598.1129.8-107.7143000108.1
26F36.3Very low36.7Very low168 Ų168140.1 Ų140.174%0.73780%0.798SS**  trans-68.4150.4174.8-123-104.9000110.3L24L24-F26 HydrophobicContact CD2-CD2 3.66Å; L24-F26 HydrophobicContact CD2-CE2 4.05Å
27S34.3Very low36.6Very low94 Ų94141.3 Ų141.366%0.65780%0.8SS**  trans63.7105.1150.954.10000118.7
28L35.9Very low36.6Very low168 Ų168142.1 Ų142.188%0.8880%0.799SS**  172.4105.1113.3-87.6158000109.9
29L38.3Very low36.7Very low162 Ų162143.9 Ų143.985%0.84879%0.792SS**  trans167.4129.1133.2-87.1168000109.4
30P37.9Very low36.5Very low114 Ų114145.4 Ų145.474%0.7479%0.786SS**  trans-88.4122.1173.531.5-27000110.9I32P30-I32 PolarHBondContact O-N 3.28Å
31D35.4Very low36.4Very low160 Ų160149.4 Ų149.486%0.85678%0.783SS**  trans-70.9108.8164.3-74.4-47.9000109V33D31-V33 PolarHBondContact O-N 3.46Å
32I38.7Very low36.3Very low153 Ų153146.2 Ų146.279%0.78577%0.774SS**  trans-76.7103.5163.1-64.5173.7000106.5P30P30-I32 PolarHBondContact O-N 3.28Å
33V37Very low36.2Very low128 Ų128151.2 Ų151.278%0.77678%0.775SS**  trans-122.2117.5158.1179.50000107.1D31 A35D31-V33 PolarHBondContact O-N 3.46Å; V33-A35 PolarHBondContact O-N 3.13Å
34T36.7Very low36.3Very low113 Ų113152.8 Ų152.869%0.69378%0.778SS**  trans-63126.2177.246.30000110.1D36T34-D36 PolarHBondContact O-N 2.95Å
35A37.6Very low36.7Very low102 Ų102150.7 Ų150.784%0.84378%0.775SS**  trans-77.2110.9167.800000108.7V33V33-A35 PolarHBondContact O-N 3.13Å
36D34.9Very low37Very low140 Ų140148.5 Ų148.575%0.74976%0.764SS**  trans-95.9122.8158.6-87.6-27.5000108.5T34 Y38T34-D36 PolarHBondContact O-N 2.95Å; D36-Y38 PolarHBondContact O-N 3.37Å
37E35.1Very low37.3Very low178 Ų178147.6 Ų147.683%0.83277%0.767SS**  trans-62.5108.4179.6-170.4172.4169.700110.3D39E37-D39 PolarHBondContact O-N 3.29Å
38Y34.6Very low37.8Very low224 Ų224150.6 Ų150.688%0.87877%0.768SS**  trans-86.699.6169.8-93.4-92.2000109.3D36 Y40D36-Y38 PolarHBondContact O-N 3.37Å; Y38-Y40 PolarHBondContact O-N 3.25Å; Y38-Y40 VanDerWaalsContact O-N 3.1Å
39D35.3Very low38.2Very low106 Ų106151.1 Ų151.157%0.56777%0.766SS**  trans-64.1105.4169.5-111-23.1000110E37 Y41E37-D39 PolarHBondContact O-N 3.29Å; D39-Y41 HydrophobicContact CB-CD2 4.24Å; D39-Y41 HydrophobicContact CB-CE2 3.85Å; D39-Y41 PolarHBondContact O-N 2.97Å; D39-Y41 VanDerWaalsContact O-N 3.07Å
40Y34.7Very low38.6Very low214 Ų214150.5 Ų150.584%0.83976%0.763SS**  trans-75.686.7172.1-178.8-99.1000108.9Y38 S42Y38-Y40 PolarHBondContact O-N 3.25Å; Y38-Y40 VanDerWaalsContact O-N 3.1Å; Y40-S42 PolarHBondContact O-N 2.69Å; Y40-S42 VanDerWaalsContact O-N 3.07Å
41Y32.3Very low39Very low177 Ų177148.3 Ų148.369%0.69476%0.762SS**  trans-69.7104.6171.6-74.8-73.5000110.7D39 W43D39-Y41 HydrophobicContact CB-CD2 4.24Å; D39-Y41 HydrophobicContact CB-CE2 3.85Å; D39-Y41 PolarHBondContact O-N 2.97Å; D39-Y41 VanDerWaalsContact O-N 3.07Å; Y41-W43 PolarHBondContact O-N 2.79Å; Y41-W43 VanDerWaalsContact O-N 3.14Å
42S34.3Very low40Very low95 Ų95147.5 Ų147.566%0.66475%0.747SS**  trans-60.2102.8164.1171.10000110.5Y40 Q44Y40-S42 PolarHBondContact O-N 2.69Å; Y40-S42 VanDerWaalsContact O-N 3.07Å; S42-Q44 PolarHBondContact O-N 3.02Å; S42-Q44 VanDerWaalsContact O-N 3.11Å
43W39.6Very low40.7Very low225 Ų225148.9 Ų148.985%0.85275%0.747SS**  trans-7397.4168.7-76.593.1000110.7Y41 S45Y41-W43 PolarHBondContact O-N 2.79Å; Y41-W43 VanDerWaalsContact O-N 3.14Å; W43-S45 PolarHBondContact O-N 3.31Å; W43-S45 VanDerWaalsContact O-N 3.09Å; W43-S45 PolarHBondContact O-OG 3.49Å
44Q37.3Very low41.7Very low172 Ų172147.8 Ų147.880%0.80473%0.73SS**  trans-63.7107.1159.6-103166.5-8.300108.7S42 D46S42-Q44 PolarHBondContact O-N 3.02Å; S42-Q44 VanDerWaalsContact O-N 3.11Å; Q44-D46 PolarHBondContact O-N 3.27Å
45S46.4Very low42.8Very low88 Ų88149 Ų14962%0.61574%0.737SS**  trans-94.169-176.1-59.80000110.5W43W43-S45 PolarHBondContact O-N 3.31Å; W43-S45 VanDerWaalsContact O-N 3.09Å; W43-S45 PolarHBondContact O-OG 3.49Å
46D44Very low44.3Very low137 Ų137151.2 Ų151.273%0.73373%0.728SS**  trans-115.384.2173.1-72-32.4000110Q44Q44-D46 PolarHBondContact O-N 3.27Å
47N43.5Very low46.3Very low150 Ų150152.4 Ų152.480%0.80273%0.729SS**  trans176.564.9143.1-90.8-47.6000110.5H49N47-H49 PolarHBondContact O-N 2.76Å
48F44.1Very low48.7Very low156 Ų156146.1 Ų146.168%0.68470%0.704SS**  trans-88.675.2170.8-114.7-87000110.3F53F48-F53 HydrophobicContact CZ-CZ 4.46Å
49H44.9Very low51.5Low179 Ų179141.5 Ų141.583%0.82969%0.69SS**SBendtrans-132.3104.3162-77.659.3000108.1N47N47-H49 PolarHBondContact O-N 2.76Å
50N46.5Very low54.4Low149 Ų149139.4 Ų139.480%0.79768%0.683SS**SBendtrans74.863.5179.8-68.4-2.4000118.1R52N50-R52 PolarHBondContact O-N 3.19Å
51G46.7Very low57.3Low68 Ų68131 Ų13170%0.70165%0.654SS**SBendtrans47.810137.100000121.9
52R55.7Low60.4Low143 Ų143127.5 Ų127.554%0.5465%0.647SS.*  trans-116.2105.9-177.8-71.8-178.4176.3-168.4-8.3108.7N50 Y54 D85N50-R52 PolarHBondContact O-N 3.19Å; R52-Y54 HydrophobicContact CB-CD2 4.48Å; R52-Y54 HydrophobicContact CB-CE2 3.95Å; R52-Y54 PolarHBondContact O-N 2.88Å; R52-D85 IonicContact CZ-OD1 3.62Å; R52-D85 IonicContact CZ-OD2 2.89Å; R52-D85 VanDerWaalsContact CZ-OD2 3.31Å; R52-D85 VanDerWaalsContact NH1-CG 3.26Å; R52-D85 IonicContact NH1-OD1 3.31Å; R52-D85 PolarHBondContact NH1-OD1 2.81Å; R52-D85 IonicContact NH1-OD2 3.35Å; R52-D85 PolarHBondContact NH1-OD2 2.91Å; R52-D85 IonicContact NH2-OD2 3.86Å; R52-D85 PolarHBondContact NH2-OD2 3.17Å
53F53.3Low63.4Low183 Ų183123.8 Ų123.880%0.80362%0.62SS**  trans-78.395.1172.4-75.3-87.6000109F48 T55F48-F53 HydrophobicContact CZ-CZ 4.46Å; F53-T55 PolarHBondContact O-N 3.27Å
54Y58.5Low66.2Low104 Ų104114.8 Ų114.841%0.40859%0.59SS.*  trans-77.9117.1161.6-61.2-75.9000107.6R52 K56 P81 D85R52-Y54 HydrophobicContact CB-CD2 4.48Å; R52-Y54 HydrophobicContact CB-CE2 3.95Å; R52-Y54 PolarHBondContact O-N 2.88Å; Y54-K56 PolarHBondContact O-N 3.38Å; Y54-K56 VanDerWaalsContact O-N 3.17Å; Y54-P81 HydrophobicContact CD1-CB 4.47Å; Y54-P81 HydrophobicContact CD1-CG 3.45Å; Y54-P81 VanDerWaalsContact CD1-CG 3.45Å; Y54-P81 HydrophobicContact CE1-CB 4.1Å; Y54-P81 HydrophobicContact CE1-CG 3.4Å; Y54-P81 HydrophobicContact CG-CG 4.1Å; Y54-D85 PolarHBondContact OH-OD1 2.8Å
55T59.5Low68.9Low138 Ų138110.2 Ų110.285%0.84758%0.582SS**SBendtrans-67.7-10.7177.955.20000112.4F53F53-T55 PolarHBondContact O-N 3.27Å
56K69.1Low71.1Confident150 Ų150110.4 Ų110.465%0.65258%0.576SS**SBendtrans-121.6139.1177.9-72.6179.4179.8171.60111.2Y54Y54-K56 PolarHBondContact O-N 3.38Å; Y54-K56 VanDerWaalsContact O-N 3.17Å
57Q77.9Confident73.5Confident165 Ų165104 Ų10477%0.77154%0.542SS*.  trans-58.2143.2168.9-73.7-74.2-11.400110.1Q59Q57-Q59 PolarHBondContact O-N 3.1Å
58P85.4Confident75.8Confident46 Ų46106.2 Ų106.230%0.29954%0.539SS..  trans-59.2135177.2-14.926.2000110.9R79 L80P58-R79 HydrophobicContact CB-CG 4.09Å; P58-L80 CarbonylContact C-O 3.52Å; P58-L80 VanDerWaalsContact CA-O 3.28Å; P58-L80 WeakPolarHBondContact CA-O 3.38Å
59Q92.3Very high78.3Confident126 Ų12698.8 Ų98.859%0.58951%0.507SS*.EExtended strand (participates in β ladder)trans-112.2142.1-179.9-63.4-169-28.300110.7Q57 R79 L80Q57-Q59 PolarHBondContact O-N 3.1Å; Q59-R79 CarbonylContact O-C 3.55Å; Q59-R79 WeakPolarHBondContact O-CA 3.29Å; Q59-L80 PolarHBondContact N-O 2.82Å; Q59-L80 PolarHBondContact O-N 2.78Å
60C95.8Very high80.7Confident62 Ų6290.3 Ų90.342%0.41947%0.467SS..EExtended strand (participates in β ladder)trans-99.9121.8173.3-66.40000110.8M78 C123C60-M78 WeakPolarHBondContact CA-O 3.31Å; C60-C123 HydrophobicContact CB-CB 3.77Å; C60-C123 WeakPolarHBondContact CB-SG 3Å; C60-C123 WeakPolarHBondContact SG-CB 3.23Å; C60-C123 CovalentContact SG-SG 2.01Å; C60-C123 PolarHBondContact SG-SG 2.97Å
61V96.4Very high83Confident38 Ų3886.5 Ų86.523%0.2344%0.444CS..EExtended strand (participates in β ladder)trans-122.7152-177.4-60.70000109.9K77 M78 L80 M89V61-K77 CarbonylContact O-C 3.54Å; V61-K77 VanDerWaalsContact O-CA 3.29Å; V61-K77 WeakPolarHBondContact O-CA 3.35Å; V61-M78 HydrophobicContact CG2-CG 3.81Å; V61-M78 PolarHBondContact N-O 2.9Å; V61-M78 PolarHBondContact O-N 3.31Å; V61-L80 HydrophobicContact CG1-CD1 4.3Å; V61-L80 HydrophobicContact CG2-CD1 3.86Å; V61-L80 HydrophobicContact CG2-CG 4.1Å; V61-M89 HydrophobicContact CG2-CG 4.23Å; V61-M89 HydrophobicContact CG2-SD 3.73Å
62D97.4Very high85.1Confident104 Ų10489.6 Ų89.656%0.55645%0.445SS*.EExtended strand (participates in β ladder)trans-70.1141.7175.6-65.2-51000110.8P64 K76 K77D62-P64 VanDerWaalsContact O-CD 3.26Å; D62-P64 WeakPolarHBondContact O-CD 3.47Å; D62-K76 WeakPolarHBondContact CA-O 3.46Å; D62-K77 WeakPolarHBondContact OD1-CE 3.39Å; D62-K77 VanDerWaalsContact OD1-CG 3.27Å; D62-K77 WeakPolarHBondContact OD1-CG 3.05Å
63I97.9Very high86.8Confident16 Ų1684.3 Ų84.38%0.08243%0.429CS..  trans-74.6112.9171.7-65.8163.6000107.8L67 Y75 K76 M78I63-L67 HydrophobicContact CG2-CB 4.41Å; I63-L67 HydrophobicContact CG2-CD2 4.13Å; I63-Y75 HydrophobicContact CD1-CD2 3.63Å; I63-Y75 HydrophobicContact CD1-CE2 3.49Å; I63-Y75 VanDerWaalsContact CD1-CE2 3.49Å; I63-K76 PolarHBondContact N-O 2.89Å; I63-M78 HydrophobicContact CD1-CB 4.29Å; I63-M78 HydrophobicContact CG1-CB 3.92Å; I63-M78 HydrophobicContact CG1-CG 3.82Å; I63-M78 HydrophobicContact CG1-SD 4.12Å
64P96.7Very high88.7Confident37 Ų3779.3 Ų79.324%0.2443%0.428CS..  trans-78.7155.6-175.435.7-37.9000111D62 D66 L67 M89 K93D62-P64 VanDerWaalsContact O-CD 3.26Å; D62-P64 WeakPolarHBondContact O-CD 3.47Å; P64-D66 WeakPolarHBondContact CB-OD1 3.39Å; P64-D66 WeakPolarHBondContact CG-OD1 3.39Å; P64-D66 PolarHBondContact O-N 2.78Å; P64-D66 VanDerWaalsContact O-N 3.17Å; P64-L67 HydrophobicContact CG-CB 3.97Å; P64-L67 WeakPolarHBondContact O-CB 3.31Å; P64-L67 PolarHBondContact O-N 2.88Å; P64-M89 HydrophobicContact CG-CE 3.66Å; P64-K93 HydrophobicContact CG-CD 4.23Å
65A94.4Very high90.4Very high76 Ų7677 Ų7763%0.62842%0.419SS*.THydrogen-bonded Turntrans-62.6-21.8179.700000114.1H71A65-H71 VanDerWaalsContact CA-CD2 3.47Å; A65-H71 WeakPolarHBondContact CA-CD2 3Å
66D92.1Very high92.1Very high91 Ų9178.8 Ų78.849%0.48742%0.415SS..THydrogen-bonded Turntrans-82.8-10.4176.668-20.1000113.3P64 R68 K93P64-D66 WeakPolarHBondContact CB-OD1 3.39Å; P64-D66 WeakPolarHBondContact CG-OD1 3.39Å; P64-D66 PolarHBondContact O-N 2.78Å; P64-D66 VanDerWaalsContact O-N 3.17Å; D66-R68 PolarHBondContact O-N 3.12Å; D66-K93 WeakPolarHBondContact OD1-CD 3.36Å; D66-K93 IonicContact OD1-NZ 2.71Å; D66-K93 VanDerWaalsContact OD2-CD 3.26Å; D66-K93 WeakPolarHBondContact OD2-CD 3.42Å; D66-K93 IonicContact OD2-NZ 3.42Å; D66-K93 PolarHBondContact OD2-NZ 2.82Å
67L95.4Very high93.4Very high3 Ų376.9 Ų76.92%0.01641%0.407CS..  trans-7970169.4-171.365.4000110.4I63 P64 L69 C70 H71 M78 M89 V92 K93 A96 A120I63-L67 HydrophobicContact CG2-CB 4.41Å; I63-L67 HydrophobicContact CG2-CD2 4.13Å; P64-L67 HydrophobicContact CG-CB 3.97Å; P64-L67 WeakPolarHBondContact O-CB 3.31Å; P64-L67 PolarHBondContact O-N 2.88Å; L67-L69 PolarHBondContact O-N 2.92Å; L67-C70 HydrophobicContact CD2-CB 4.2Å; L67-C70 HydrophobicContact CG-CB 4.49Å; L67-C70 PolarHBondContact O-N 2.8Å; L67-H71 PolarHBondContact O-N 2.87Å; L67-M78 HydrophobicContact CD2-SD 4.17Å; L67-M89 HydrophobicContact CD2-CE 4.44Å; L67-V92 HydrophobicContact CD1-CG1 4.02Å; L67-V92 HydrophobicContact CD2-CG1 4.19Å; L67-K93 HydrophobicContact CB-CG 4.39Å; L67-K93 HydrophobicContact CD1-CB 4.42Å; L67-K93 HydrophobicContact CD1-CG 3.89Å; L67-A96 HydrophobicContact CD1-CB 3.67Å; L67-A120 HydrophobicContact CD2-CB 4.36Å
68R92.5Very high94.3Very high196 Ų19669 Ų6974%0.7437%0.37SS*.THydrogen-bonded Turntrans-52.1-28.4-172.6-65.7-175.3179.9-178.2-0.5115.1D66 V100D66-R68 PolarHBondContact O-N 3.12Å; R68-V100 HydrophobicContact CB-CG2 4.07Å
69L94.9Very high94.8Very high1 Ų169 Ų691%0.00536%0.364CS..THydrogen-bonded Turntrans-65.1-42.3179.3-172.465.2000112L67 A96 W99 V100 L103 Q112 L115 C116 F119L67-L69 PolarHBondContact O-N 2.92Å; L69-A96 HydrophobicContact CB-CB 4.16Å; L69-A96 HydrophobicContact CD2-CB 3.71Å; L69-W99 HydrophobicContact CD1-CB 4.09Å; L69-W99 HydrophobicContact CD2-CB 4.14Å; L69-V100 HydrophobicContact CB-CG2 4.37Å; L69-L103 HydrophobicContact CD1-CB 4.45Å; L69-L103 HydrophobicContact CD1-CD2 4.08Å; L69-Q112 WeakPolarHBondContact O-CG 3.37Å; L69-Q112 PolarHBondContact O-NE2 2.82Å; L69-L115 HydrophobicContact CD1-CB 4.49Å; L69-L115 HydrophobicContact CD1-CD1 4.03Å; L69-L115 HydrophobicContact CD2-CB 4.15Å; L69-C116 PolarHBondContact O-SG 2.86Å; L69-C116 VanDerWaalsContact O-SG 3.38Å; L69-F119 HydrophobicContact CD2-CB 4.35Å; L69-F119 HydrophobicContact CD2-CD2 3.88Å; L69-F119 HydrophobicContact CD2-CE2 4.45Å; L69-F119 HydrophobicContact CD2-CG 4.13Å
70C97.1Very high94.9Very high0 Ų063.6 Ų63.60%034%0.339CS..THydrogen-bonded Turntrans-125.5-0.5-165.5-58.50000114.8L67 N72 V73 C116 A120L67-C70 HydrophobicContact CD2-CB 4.2Å; L67-C70 HydrophobicContact CG-CB 4.49Å; L67-C70 PolarHBondContact O-N 2.8Å; C70-N72 PolarHBondContact O-N 3.04Å; C70-V73 HydrophobicContact CB-CG1 4.46Å; C70-V73 WeakPolarHBondContact O-CB 3.43Å; C70-V73 WeakPolarHBondContact O-CG1 3.35Å; C70-V73 PolarHBondContact O-N 2.84Å; C70-C116 WeakPolarHBondContact CA-SG 3.36Å; C70-C116 HydrophobicContact CB-CB 3.87Å; C70-C116 WeakPolarHBondContact CB-SG 3.49Å; C70-C116 WeakPolarHBondContact SG-CA 3.33Å; C70-C116 WeakPolarHBondContact SG-CB 3.34Å; C70-C116 CovalentContact SG-SG 2.04Å; C70-C116 PolarHBondContact SG-SG 2.87Å; C70-A120 HydrophobicContact CB-CB 3.78Å
71H94.1Very high94.9Very high69 Ų6961.5 Ų61.532%0.31933%0.325SS..THydrogen-bonded Turntrans-59.3132.8169.1-176.5-103.6000110.3A65 L67 V73A65-H71 VanDerWaalsContact CA-CD2 3.47Å; A65-H71 WeakPolarHBondContact CA-CD2 3Å; L67-H71 PolarHBondContact O-N 2.87Å; H71-V73 PolarHBondContact O-N 3.11Å
72N90.6Very high94.9Very high134 Ų13459.9 Ų59.972%0.71732%0.315SS*.THydrogen-bonded Turntrans63.327.3-176.3-62.3-23.2000116.3C70 G74C70-N72 PolarHBondContact O-N 3.04Å; N72-G74 PolarHBondContact O-N 2.91Å
73V91.7Very high94.8Very high32 Ų3256 Ų5619%0.19429%0.294CS..SBendtrans-74.52.1176.771.30000114.4C70 H71 Y75 C116C70-V73 HydrophobicContact CB-CG1 4.46Å; C70-V73 WeakPolarHBondContact O-CB 3.43Å; C70-V73 WeakPolarHBondContact O-CG1 3.35Å; C70-V73 PolarHBondContact O-N 2.84Å; H71-V73 PolarHBondContact O-N 3.11Å; V73-Y75 HydrophobicContact CG1-CD1 3.91Å; V73-Y75 HydrophobicContact CG1-CE1 3.38Å; V73-Y75 HydrophobicContact CG1-CE2 4.14Å; V73-Y75 HydrophobicContact CG1-CG 4.46Å; V73-Y75 VanDerWaalsContact CG1-CZ 3.49Å; V73-C116 HydrophobicContact CG1-CB 4.48Å; V73-C116 HydrophobicContact CG2-CB 3.87Å
74G92.4Very high94.6Very high77 Ų7756.4 Ų56.479%0.79430%0.297SS*.SBendtrans114.2-7.6176.400000115N72N72-G74 PolarHBondContact O-N 2.91Å
75Y94.6Very high94.4Very high56 Ų5657.6 Ų57.622%0.2230%0.301CS..  trans-138.9163.1172.654.1-85.9000110.5I63 V73 K77 A120 V122I63-Y75 HydrophobicContact CD1-CD2 3.63Å; I63-Y75 HydrophobicContact CD1-CE2 3.49Å; I63-Y75 VanDerWaalsContact CD1-CE2 3.49Å; V73-Y75 HydrophobicContact CG1-CD1 3.91Å; V73-Y75 HydrophobicContact CG1-CE1 3.38Å; V73-Y75 HydrophobicContact CG1-CE2 4.14Å; V73-Y75 HydrophobicContact CG1-CG 4.46Å; V73-Y75 VanDerWaalsContact CG1-CZ 3.49Å; Y75-K77 VanDerWaalsContact CD2-O 3.3Å; Y75-K77 WeakPolarHBondContact CD2-O 3.13Å; Y75-A120 WeakPolarHBondContact CE2-O 3.44Å; Y75-A120 PolarHBondContact OH-O 3.42Å; Y75-V122 HydrophobicContact CD1-CG2 3.78Å; Y75-V122 HydrophobicContact CD2-CG2 4.16Å; Y75-V122 HydrophobicContact CE1-CG2 3.66Å; Y75-V122 HydrophobicContact CE2-CG2 4.02Å; Y75-V122 HydrophobicContact CG-CG2 4.05Å
76K95.8Very high94.4Very high175 Ų17554.8 Ų54.876%0.76128%0.275SS*.SBendtrans-105.7-22.9-172.4-63.5-175.5180-179.40114.4D62 I63D62-K76 WeakPolarHBondContact CA-O 3.46Å; I63-K76 PolarHBondContact N-O 2.89Å
77K96.4Very high94.5Very high110 Ų11056 Ų5648%0.47828%0.278SS..EExtended strand (participates in β ladder)trans-120.9136.4-175.3-69.7-172.7176.8-170.60111.6V61 D62 Y75 C123V61-K77 CarbonylContact O-C 3.54Å; V61-K77 VanDerWaalsContact O-CA 3.29Å; V61-K77 WeakPolarHBondContact O-CA 3.35Å; D62-K77 WeakPolarHBondContact OD1-CE 3.39Å; D62-K77 VanDerWaalsContact OD1-CG 3.27Å; D62-K77 WeakPolarHBondContact OD1-CG 3.05Å; Y75-K77 VanDerWaalsContact CD2-O 3.3Å; Y75-K77 WeakPolarHBondContact CD2-O 3.13Å; K77-C123 HydrophobicContact CB-CB 4.08Å; K77-C123 PolarHBondContact O-N 2.67Å
78M96.5Very high94.4Very high0 Ų059.2 Ų59.20%030%0.297CS..EExtended strand (participates in β ladder)trans-119160.8176.362.5172.1-80.200111.7C60 V61 I63 L67 L80 M89 V92 F119 A120 P121C60-M78 WeakPolarHBondContact CA-O 3.31Å; V61-M78 HydrophobicContact CG2-CG 3.81Å; V61-M78 PolarHBondContact N-O 2.9Å; V61-M78 PolarHBondContact O-N 3.31Å; I63-M78 HydrophobicContact CD1-CB 4.29Å; I63-M78 HydrophobicContact CG1-CB 3.92Å; I63-M78 HydrophobicContact CG1-CG 3.82Å; I63-M78 HydrophobicContact CG1-SD 4.12Å; L67-M78 HydrophobicContact CD2-SD 4.17Å; M78-L80 HydrophobicContact CE-CD2 3.88Å; M78-L80 HydrophobicContact CE-CG 4.31Å; M78-M89 HydrophobicContact CE-SD 4.31Å; M78-M89 HydrophobicContact SD-CE 4.31Å; M78-M89 HydrophobicContact SD-SD 4.05Å; M78-V92 HydrophobicContact CE-CG1 4.26Å; M78-V92 HydrophobicContact CE-CG2 4.4Å; M78-F119 VanDerWaalsContact CE-O 3.28Å; M78-F119 WeakPolarHBondContact CE-O 3.33Å; M78-A120 HydrophobicContact CB-CB 4.1Å; M78-A120 HydrophobicContact CE-CB 4.2Å; M78-A120 HydrophobicContact SD-CB 3.65Å; M78-P121 CarbonylContact C-O 3.49Å; M78-P121 WeakPolarHBondContact CA-O 3.36Å; M78-P121 WeakPolarHBondContact CB-O 3.41Å
79R95.4Very high94.6Very high45 Ų4551.5 Ų51.517%0.1727%0.27CS..EExtended strand (participates in β ladder)trans-93.2140.3176.8177-179175.5120.9-9.9111.8P58 Q59 P121 L124 D125P58-R79 HydrophobicContact CB-CG 4.09Å; Q59-R79 CarbonylContact O-C 3.55Å; Q59-R79 WeakPolarHBondContact O-CA 3.29Å; R79-P121 HydrophobicContact CB-CG 4.28Å; R79-P121 PolarHBondContact N-O 2.98Å; R79-L124 PolarHBondContact NH1-O 3Å; R79-D125 PolarHBondContact NH1-O 2.84Å
80L95.3Very high94.6Very high13 Ų1355.6 Ų55.67%0.06830%0.296CS..EExtended strand (participates in β ladder)trans-120.7143.7164.8-71.5175.8000110.9P58 Q59 V61 M78 H86 M89 V92P58-L80 CarbonylContact C-O 3.52Å; P58-L80 VanDerWaalsContact CA-O 3.28Å; P58-L80 WeakPolarHBondContact CA-O 3.38Å; Q59-L80 PolarHBondContact N-O 2.82Å; Q59-L80 PolarHBondContact O-N 2.78Å; V61-L80 HydrophobicContact CG1-CD1 4.3Å; V61-L80 HydrophobicContact CG2-CD1 3.86Å; V61-L80 HydrophobicContact CG2-CG 4.1Å; M78-L80 HydrophobicContact CE-CD2 3.88Å; M78-L80 HydrophobicContact CE-CG 4.31Å; L80-H86 WeakPolarHBondContact CD2-O 3.04Å; L80-M89 HydrophobicContact CD1-CG 4.04Å; L80-M89 HydrophobicContact CD1-SD 4Å; L80-V92 HydrophobicContact CD2-CG2 3.81Å
81P95.1Very high94.4Very high19 Ų1958.8 Ų58.812%0.12331%0.311CS..SBendcis-61.5148.8-11.324.6-30000111.5Y54 H86 E87Y54-P81 HydrophobicContact CD1-CB 4.47Å; Y54-P81 HydrophobicContact CD1-CG 3.45Å; Y54-P81 VanDerWaalsContact CD1-CG 3.45Å; Y54-P81 HydrophobicContact CE1-CB 4.1Å; Y54-P81 HydrophobicContact CE1-CG 3.4Å; Y54-P81 HydrophobicContact CG-CG 4.1Å; P81-H86 WeakPolarHBondContact CA-O 3.44Å; P81-E87 HydrophobicContact CB-CG 4.27Å
82N95.8Very high94.5Very high3 Ų355.5 Ų55.52%0.01630%0.296CS..  trans-80-177.2179.472.210.5000111.2L84 D85 H86 L118 F119 P121N82-L84 PolarHBondContact O-N 2.89Å; N82-L84 VanDerWaalsContact O-N 3.13Å; N82-L84 WeakPolarHBondContact OD1-CA 3.35Å; N82-L84 PolarHBondContact OD1-N 2.85Å; N82-D85 PolarHBondContact O-N 2.98Å; N82-D85 VanDerWaalsContact O-N 3.07Å; N82-D85 PolarHBondContact OD1-N 3.2Å; N82-H86 PolarHBondContact N-O 3.3Å; N82-H86 VanDerWaalsContact N-O 3.17Å; N82-H86 PolarHBondContact ND2-ND1 3.19Å; N82-H86 PolarHBondContact OD1-N 2.87Å; N82-L118 WeakPolarHBondContact CB-O 3.46Å; N82-F119 PolarHBondContact ND2-O 2.89Å; N82-P121 HydrophobicContact CB-CG 4.01Å
83L95Very high94.7Very high23 Ų2352.4 Ų52.412%0.1228%0.276CS..THydrogen-bonded Turntrans-75.10.1-176.7-52.1-174.8000113.8S117 L118 P121 P127 Y129L83-S117 WeakPolarHBondContact CD1-O 3.42Å; L83-L118 HydrophobicContact CB-CD2 4.1Å; L83-L118 HydrophobicContact CD1-CD2 4.12Å; L83-L118 PolarHBondContact N-O 3.21Å; L83-P121 HydrophobicContact CD1-CB 4.39Å; L83-P121 HydrophobicContact CG-CB 4.13Å; L83-P121 HydrophobicContact CG-CG 4.16Å; L83-P127 HydrophobicContact CD2-CB 3.49Å; L83-P127 VanDerWaalsContact CD2-CB 3.49Å; L83-P127 HydrophobicContact CD2-CG 4.4Å; L83-Y129 HydrophobicContact CB-CE1 4.2Å; L83-Y129 HydrophobicContact CD1-CD1 3.86Å; L83-Y129 HydrophobicContact CD1-CE1 3.95Å; L83-Y129 HydrophobicContact CD1-CG 4.26Å; L83-Y129 HydrophobicContact CD2-CE1 4.31Å; L83-Y129 HydrophobicContact CG-CE1 4.38Å
84L94.9Very high94.6Very high25 Ų2555.7 Ų55.713%0.13129%0.289CS..THydrogen-bonded Turntrans-11014172.9-58.3176.8000111.6N82 H86 L118 F119 M156 L157N82-L84 PolarHBondContact O-N 2.89Å; N82-L84 VanDerWaalsContact O-N 3.13Å; N82-L84 WeakPolarHBondContact OD1-CA 3.35Å; N82-L84 PolarHBondContact OD1-N 2.85Å; L84-H86 PolarHBondContact O-N 2.86Å; L84-L118 HydrophobicContact CD1-CB 4.22Å; L84-L118 HydrophobicContact CD2-CB 4.32Å; L84-L118 HydrophobicContact CG-CB 4.09Å; L84-F119 HydrophobicContact CD1-CD1 3.96Å; L84-F119 HydrophobicContact CD1-CD2 3.85Å; L84-F119 HydrophobicContact CD1-CE1 3.7Å; L84-F119 HydrophobicContact CD1-CE2 3.57Å; L84-F119 HydrophobicContact CD1-CG 4.02Å; L84-F119 HydrophobicContact CD1-CZ 3.48Å; L84-F119 VanDerWaalsContact CD1-CZ 3.48Å; L84-M156 HydrophobicContact CD2-CB 4.38Å; L84-M156 HydrophobicContact CD2-CG 4.47Å; L84-L157 HydrophobicContact CD2-CD2 4.43Å
85D92.6Very high94.6Very high62 Ų6253.8 Ų53.833%0.33226%0.26SS..  trans65.218.4177.1-58.2-55.8000114.9R52 Y54 N82 E87R52-D85 IonicContact CZ-OD1 3.62Å; R52-D85 IonicContact CZ-OD2 2.89Å; R52-D85 VanDerWaalsContact CZ-OD2 3.31Å; R52-D85 VanDerWaalsContact NH1-CG 3.26Å; R52-D85 IonicContact NH1-OD1 3.31Å; R52-D85 PolarHBondContact NH1-OD1 2.81Å; R52-D85 IonicContact NH1-OD2 3.35Å; R52-D85 PolarHBondContact NH1-OD2 2.91Å; R52-D85 IonicContact NH2-OD2 3.86Å; R52-D85 PolarHBondContact NH2-OD2 3.17Å; Y54-D85 PolarHBondContact OH-OD1 2.8Å; N82-D85 PolarHBondContact O-N 2.98Å; N82-D85 VanDerWaalsContact O-N 3.07Å; N82-D85 PolarHBondContact OD1-N 3.2Å; D85-E87 PolarHBondContact O-N 2.74Å
86H94.2Very high94.6Very high17 Ų1751.2 Ų51.28%0.07925%0.25CC..  trans-75.2126.9170.9-54.6143000110L80 P81 N82 L84 E91 V92 F119L80-H86 WeakPolarHBondContact CD2-O 3.04Å; P81-H86 WeakPolarHBondContact CA-O 3.44Å; N82-H86 PolarHBondContact N-O 3.3Å; N82-H86 VanDerWaalsContact N-O 3.17Å; N82-H86 PolarHBondContact ND2-ND1 3.19Å; N82-H86 PolarHBondContact OD1-N 2.87Å; L84-H86 PolarHBondContact O-N 2.86Å; H86-E91 WeakPolarHBondContact CA-OE2 3.39Å; H86-E91 HydrophobicContact CB-CG 3.99Å; H86-E91 IonicContact CD2-OE1 2.94Å; H86-E91 PolarHBondContact CD2-OE1 2.89Å; H86-V92 HydrophobicContact CB-CG2 3.59Å; H86-F119 AromaticContact CE1-CE1 3.63Å
87E93.8Very high94.4Very high117 Ų11744.6 Ų44.655%0.54723%0.232SC..  trans-97.2-20.3-174-64.4-169.5169.100113P81 D85 E91P81-E87 HydrophobicContact CB-CG 4.27Å; D85-E87 PolarHBondContact O-N 2.74Å; E87-E91 PolarHBondContact N-OE2 3.06Å
88T94.4Very high94Very high69 Ų6941.2 Ų41.242%0.42322%0.222SC..SBendtrans-126.8146.1-171.973.90000112.6E91 V92T88-E91 WeakPolarHBondContact O-CB 3.35Å; T88-E91 PolarHBondContact O-N 2.92Å; T88-E91 WeakPolarHBondContact OG1-CB 3.3Å; T88-E91 PolarHBondContact OG1-N 2.82Å; T88-V92 WeakPolarHBondContact O-CG2 3.46Å; T88-V92 PolarHBondContact O-N 3.13Å
89M95.4Very high93.8Very high35 Ų3541.3 Ų41.317%0.17222%0.222CC..Hα-helixtrans-59.9-38.9177.3-74.9-55.3-57.400114.5V61 P64 L67 M78 L80 E91 V92 K93V61-M89 HydrophobicContact CG2-CG 4.23Å; V61-M89 HydrophobicContact CG2-SD 3.73Å; P64-M89 HydrophobicContact CG-CE 3.66Å; L67-M89 HydrophobicContact CD2-CE 4.44Å; M78-M89 HydrophobicContact CE-SD 4.31Å; M78-M89 HydrophobicContact SD-CE 4.31Å; M78-M89 HydrophobicContact SD-SD 4.05Å; L80-M89 HydrophobicContact CD1-CG 4.04Å; L80-M89 HydrophobicContact CD1-SD 4Å; M89-E91 VanDerWaalsContact C-N 3.32Å; M89-E91 PolarHBondContact O-N 3.38Å; M89-V92 PolarHBondContact O-N 2.98Å; M89-K93 HydrophobicContact CE-CG 4.45Å; M89-K93 WeakPolarHBondContact O-CB 3.41Å; M89-K93 VanDerWaalsContact O-CG 3.29Å; M89-K93 WeakPolarHBondContact O-CG 3.29Å; M89-K93 PolarHBondContact O-N 2.92Å
90P95Very high93.6Very high86 Ų8641.3 Ų41.356%0.55823%0.227SC*.Hα-helixtrans-57.7-43.5173.4-2736.9000113K93 Q94P90-K93 PolarHBondContact O-N 2.85Å; P90-Q94 WeakPolarHBondContact O-CB 3.45Å; P90-Q94 PolarHBondContact O-N 3.02Å
91E94.4Very high93.2Very high68 Ų6843.3 Ų43.332%0.31824%0.241SC..Hα-helixtrans-63.2-49.6176.1179.2-177.2-157.700111.3H86 E87 T88 M89 K93 Q94 Q95H86-E91 WeakPolarHBondContact CA-OE2 3.39Å; H86-E91 HydrophobicContact CB-CG 3.99Å; H86-E91 IonicContact CD2-OE1 2.94Å; H86-E91 PolarHBondContact CD2-OE1 2.89Å; E87-E91 PolarHBondContact N-OE2 3.06Å; T88-E91 WeakPolarHBondContact O-CB 3.35Å; T88-E91 PolarHBondContact O-N 2.92Å; T88-E91 WeakPolarHBondContact OG1-CB 3.3Å; T88-E91 PolarHBondContact OG1-N 2.82Å; M89-E91 VanDerWaalsContact C-N 3.32Å; M89-E91 PolarHBondContact O-N 3.38Å; E91-K93 VanDerWaalsContact C-N 3.31Å; E91-K93 PolarHBondContact O-N 2.83Å; E91-Q94 PolarHBondContact O-N 3.38Å; E91-Q95 HydrophobicContact CG-CG 4.33Å; E91-Q95 WeakPolarHBondContact O-CB 3.27Å; E91-Q95 VanDerWaalsContact O-CG 3.27Å; E91-Q95 WeakPolarHBondContact O-CG 3.43Å; E91-Q95 PolarHBondContact O-N 2.84Å
92V95.7Very high92.9Very high0 Ų043.3 Ų43.30%024%0.24CC..Hα-helixtrans-55-47.9176.1174.40000111L67 M78 L80 H86 T88 M89 Q94 Q95 A96L67-V92 HydrophobicContact CD1-CG1 4.02Å; L67-V92 HydrophobicContact CD2-CG1 4.19Å; M78-V92 HydrophobicContact CE-CG1 4.26Å; M78-V92 HydrophobicContact CE-CG2 4.4Å; L80-V92 HydrophobicContact CD2-CG2 3.81Å; H86-V92 HydrophobicContact CB-CG2 3.59Å; T88-V92 WeakPolarHBondContact O-CG2 3.46Å; T88-V92 PolarHBondContact O-N 3.13Å; M89-V92 PolarHBondContact O-N 2.98Å; V92-Q94 PolarHBondContact O-N 3.08Å; V92-Q95 PolarHBondContact O-N 3.23Å; V92-A96 WeakPolarHBondContact O-CB 3.4Å; V92-A96 PolarHBondContact O-N 2.71Å
93K93.9Very high92.6Very high69 Ų6945 Ų4530%0.325%0.248SC..Hα-helixtrans-62.6-42.7179.9-74.1-173.3-60.9-176.90112.3P64 D66 L67 M89 P90 E91 G97P64-K93 HydrophobicContact CG-CD 4.23Å; D66-K93 WeakPolarHBondContact OD1-CD 3.36Å; D66-K93 IonicContact OD1-NZ 2.71Å; D66-K93 VanDerWaalsContact OD2-CD 3.26Å; D66-K93 WeakPolarHBondContact OD2-CD 3.42Å; D66-K93 IonicContact OD2-NZ 3.42Å; D66-K93 PolarHBondContact OD2-NZ 2.82Å; L67-K93 HydrophobicContact CB-CG 4.39Å; L67-K93 HydrophobicContact CD1-CB 4.42Å; L67-K93 HydrophobicContact CD1-CG 3.89Å; M89-K93 HydrophobicContact CE-CG 4.45Å; M89-K93 WeakPolarHBondContact O-CB 3.41Å; M89-K93 VanDerWaalsContact O-CG 3.29Å; M89-K93 WeakPolarHBondContact O-CG 3.29Å; M89-K93 PolarHBondContact O-N 2.92Å; P90-K93 PolarHBondContact O-N 2.85Å; E91-K93 VanDerWaalsContact C-N 3.31Å; E91-K93 PolarHBondContact O-N 2.83Å; K93-G97 PolarHBondContact O-N 2.91Å
94Q90.6Very high92.2Very high100 Ų10047.4 Ų47.447%0.46727%0.272SS..Hα-helixtrans-62.3-49.6177.9179.5177.1-11.300111.1P90 E91 V92 G97P90-Q94 WeakPolarHBondContact O-CB 3.45Å; P90-Q94 PolarHBondContact O-N 3.02Å; E91-Q94 PolarHBondContact O-N 3.38Å; V92-Q94 PolarHBondContact O-N 3.08Å; Q94-G97 PolarHBondContact O-N 2.79Å
95Q92.2Very high91.7Very high38 Ų3850.3 Ų50.318%0.17828%0.283CS..Hα-helixtrans-71.8-44.4-175.7-63.4-65.6-1300111.9E91 V92 G97 S98 F119E91-Q95 HydrophobicContact CG-CG 4.33Å; E91-Q95 WeakPolarHBondContact O-CB 3.27Å; E91-Q95 VanDerWaalsContact O-CG 3.27Å; E91-Q95 WeakPolarHBondContact O-CG 3.43Å; E91-Q95 PolarHBondContact O-N 2.84Å; V92-Q95 PolarHBondContact O-N 3.23Å; Q95-G97 VanDerWaalsContact C-N 3.28Å; Q95-G97 PolarHBondContact O-N 3.11Å; Q95-S98 PolarHBondContact O-N 3.05Å; Q95-F119 HydrophobicContact CB-CE1 3.76Å
96A93.8Very high91.4Very high1 Ų155.5 Ų55.51%0.00830%0.298CS..Hα-helixtrans-63.9-33.2175.900000112.2L67 L69 V92 S98 W99 F119L67-A96 HydrophobicContact CD1-CB 3.67Å; L69-A96 HydrophobicContact CB-CB 4.16Å; L69-A96 HydrophobicContact CD2-CB 3.71Å; V92-A96 WeakPolarHBondContact O-CB 3.4Å; V92-A96 PolarHBondContact O-N 2.71Å; A96-S98 PolarHBondContact O-N 3.35Å; A96-W99 WeakPolarHBondContact O-CB 3.48Å; A96-W99 PolarHBondContact O-N 3.29Å; A96-F119 HydrophobicContact CB-CD1 3.72Å; A96-F119 HydrophobicContact CB-CE1 4.09Å; A96-F119 HydrophobicContact CB-CG 4.12Å
97G91.2Very high91.2Very high37 Ų3755.8 Ų55.838%0.38130%0.302SS..Hα-helixtrans-56.8-35.4178.500000113.2K93 Q94 Q95 W99 V100K93-G97 PolarHBondContact O-N 2.91Å; Q94-G97 PolarHBondContact O-N 2.79Å; Q95-G97 VanDerWaalsContact C-N 3.28Å; Q95-G97 PolarHBondContact O-N 3.11Å; G97-W99 PolarHBondContact O-N 3Å; G97-V100 PolarHBondContact O-N 3.3Å
98S89.6Confident91.1Very high38 Ų3850.8 Ų50.827%0.26628%0.279SS..THydrogen-bonded Turntrans-66.3-16.1177.8-61.60000114.1Q95 A96Q95-S98 PolarHBondContact O-N 3.05Å; A96-S98 PolarHBondContact O-N 3.35Å
99W92.6Very high91Very high3 Ų349.4 Ų49.41%0.01128%0.275CS..THydrogen-bonded Turntrans-94.8-14.3179.9-68.692.7000114.1L69 A96 G97 L102 L103 L115 F119 M146 P154 M156 L157 F317L69-W99 HydrophobicContact CD1-CB 4.09Å; L69-W99 HydrophobicContact CD2-CB 4.14Å; A96-W99 WeakPolarHBondContact O-CB 3.48Å; A96-W99 PolarHBondContact O-N 3.29Å; G97-W99 PolarHBondContact O-N 3Å; W99-L102 HydrophobicContact CE3-CD2 3.73Å; W99-L102 HydrophobicContact CZ3-CD2 3.66Å; W99-L102 PolarHBondContact O-N 2.96Å; W99-L102 VanDerWaalsContact O-N 3.11Å; W99-L103 PolarHBondContact O-N 2.69Å; W99-L103 VanDerWaalsContact O-N 3.1Å; W99-L115 HydrophobicContact CB-CD1 4.03Å; W99-L115 HydrophobicContact CD2-CD1 4.38Å; W99-L115 HydrophobicContact CD2-CD2 3.98Å; W99-L115 HydrophobicContact CE3-CD1 4.02Å; W99-L115 HydrophobicContact CE3-CD2 3.78Å; W99-L115 HydrophobicContact CG-CD1 4.42Å; W99-L115 HydrophobicContact CG-CD2 4.48Å; W99-L115 HydrophobicContact CZ3-CD2 4.14Å; W99-F119 AromaticContact CD1-CE2 3.53Å; W99-F119 AromaticContact CD1-CZ 3.44Å; W99-F119 VanDerWaalsContact CD1-CZ 3.44Å; W99-F119 HydrophobicContact CG-CE2 4.2Å; W99-F119 HydrophobicContact CG-CZ 4.48Å; W99-F119 AromaticContact NE1-CE2 3.56Å; W99-F119 AromaticContact NE1-CZ 3.38Å; W99-M146 HydrophobicContact CH2-CE 4.04Å; W99-M146 HydrophobicContact CH2-SD 4.45Å; W99-M146 HydrophobicContact CZ3-CE 4.05Å; W99-M146 HydrophobicContact CZ3-SD 4.04Å; W99-P154 HydrophobicContact CH2-CG 3.64Å; W99-P154 HydrophobicContact CZ2-CG 3.78Å; W99-M156 HydrophobicContact CZ2-CE 3.53Å; W99-L157 HydrophobicContact CH2-CD1 3.21Å; W99-L157 HydrophobicContact CH2-CG 4.36Å; W99-L157 HydrophobicContact CZ2-CD1 3.53Å; W99-L157 HydrophobicContact CZ2-CG 4.39Å; W99-L157 HydrophobicContact CZ3-CD1 3.9Å; W99-F317 AromaticContact CE2-CE1 3.9Å; W99-F317 HydrophobicContact CH2-CE1 4.09Å; W99-F317 AromaticContact CZ2-CE1 3.47Å; W99-F317 HydrophobicContact CZ2-CE1 3.47Å; W99-F317 VanDerWaalsContact CZ2-CE1 3.47Å; W99-F317 HydrophobicContact CZ2-CZ 4.07Å
100V90.8Very high90.9Very high44 Ų4447.8 Ų47.827%0.26727%0.266SS..Hα-helixtrans-56.9-41.2179.2177.10000112.6R68 L69 G97 L102 L103 A104R68-V100 HydrophobicContact CB-CG2 4.07Å; L69-V100 HydrophobicContact CB-CG2 4.37Å; G97-V100 PolarHBondContact O-N 3.3Å; V100-L102 VanDerWaalsContact C-N 3.32Å; V100-L102 PolarHBondContact O-N 3.4Å; V100-L103 PolarHBondContact O-N 2.83Å; V100-A104 PolarHBondContact O-N 3.34Å
101P87.3Confident90.9Very high56 Ų5643.7 Ų43.736%0.36424%0.24SC..Hα-helixtrans-61.5-37.1176.1-25.336.3000113.4A104 K105P101-A104 PolarHBondContact O-N 2.95Å; P101-K105 WeakPolarHBondContact O-CG 3.45Å; P101-K105 PolarHBondContact O-N 3.04Å
102L88.1Confident91Very high18 Ų1843.6 Ų43.69%0.09424%0.239CC..Hα-helixtrans-67.3-43.4176.5-176.166000110.9W99 V100 A104 K105 C142 V145 M146W99-L102 HydrophobicContact CE3-CD2 3.73Å; W99-L102 HydrophobicContact CZ3-CD2 3.66Å; W99-L102 PolarHBondContact O-N 2.96Å; W99-L102 VanDerWaalsContact O-N 3.11Å; V100-L102 VanDerWaalsContact C-N 3.32Å; V100-L102 PolarHBondContact O-N 3.4Å; L102-A104 VanDerWaalsContact C-N 3.26Å; L102-A104 PolarHBondContact O-N 3.19Å; L102-K105 WeakPolarHBondContact O-CB 3.48Å; L102-K105 PolarHBondContact O-N 3.23Å; L102-C142 HydrophobicContact CD1-CB 4.29Å; L102-C142 HydrophobicContact CD2-CB 4.28Å; L102-V145 HydrophobicContact CD1-CB 4.43Å; L102-V145 HydrophobicContact CD1-CG1 4.26Å; L102-M146 HydrophobicContact CD1-CG 3.74Å; L102-M146 HydrophobicContact CD2-CG 4.02Å; L102-M146 HydrophobicContact CD2-SD 3.75Å; L102-M146 HydrophobicContact CG-CG 4.5Å
103L89.1Confident90.9Very high38 Ų3845.2 Ų45.220%0.19925%0.25CC..Hα-helixtrans-58.8-39.8175.8-18061.5000111.6L69 W99 V100 K105 R106 T111 Q112L69-L103 HydrophobicContact CD1-CB 4.45Å; L69-L103 HydrophobicContact CD1-CD2 4.08Å; W99-L103 PolarHBondContact O-N 2.69Å; W99-L103 VanDerWaalsContact O-N 3.1Å; V100-L103 PolarHBondContact O-N 2.83Å; L103-K105 PolarHBondContact O-N 3.45Å; L103-R106 WeakPolarHBondContact O-CG 3.05Å; L103-R106 PolarHBondContact O-N 3.21Å; L103-T111 HydrophobicContact CD1-CG2 4.35Å; L103-Q112 HydrophobicContact CD1-CB 3.73Å; L103-Q112 HydrophobicContact CD1-CG 4.36Å; L103-Q112 HydrophobicContact CD2-CB 4.32Å; L103-Q112 HydrophobicContact CD2-CG 4.03Å
104A86.7Confident91.1Very high74 Ų7442 Ų4261%0.61224%0.235SC*.Hα-helixtrans-64.1-24.4176.300000113.4V100 P101 L102 R106V100-A104 PolarHBondContact O-N 3.34Å; P101-A104 PolarHBondContact O-N 2.95Å; L102-A104 VanDerWaalsContact C-N 3.26Å; L102-A104 PolarHBondContact O-N 3.19Å; A104-R106 VanDerWaalsContact C-N 3.27Å; A104-R106 PolarHBondContact O-N 3.31Å
105K85.1Confident91.4Very high86 Ų8637.2 Ų37.237%0.37421%0.213SC..Hα-helixtrans-73.7-16.5172.9-62.8-59.2-178.4-179.50113.3P101 L102 L103 C107 V145 Y149P101-K105 WeakPolarHBondContact O-CG 3.45Å; P101-K105 PolarHBondContact O-N 3.04Å; L102-K105 WeakPolarHBondContact O-CB 3.48Å; L102-K105 PolarHBondContact O-N 3.23Å; L103-K105 PolarHBondContact O-N 3.45Å; K105-C107 PolarHBondContact O-N 2.91Å; K105-V145 HydrophobicContact CB-CG1 4.21Å; K105-V145 HydrophobicContact CG-CG1 4.07Å; K105-Y149 PolarHBondContact NZ-OH 3.11Å
106R86.3Confident91.7Very high171 Ų17135.4 Ų35.465%0.64521%0.205SC*.THydrogen-bonded Turntrans50.643175.2-60.9-177.3-178.1-176.7-0.1113.1L103 A104 H108 P182L103-R106 WeakPolarHBondContact O-CG 3.05Å; L103-R106 PolarHBondContact O-N 3.21Å; A104-R106 VanDerWaalsContact C-N 3.27Å; A104-R106 PolarHBondContact O-N 3.31Å; R106-H108 VanDerWaalsContact C-N 3.27Å; R106-H108 PolarHBondContact O-N 3.17Å; R106-P182 HydrophobicContact CB-CG 3.87Å; R106-P182 WeakPolarHBondContact O-CG 3.14Å
107C88.7Confident91.8Very high24 Ų2435.6 Ų35.616%0.16221%0.206CC..  trans-63.7-30.9178.642.30000112.8K105 S141 C142 V145K105-C107 PolarHBondContact O-N 2.91Å; C107-S141 WeakPolarHBondContact O-CB 3.46Å; C107-C142 HydrophobicContact CB-CB 3.93Å; C107-C142 WeakPolarHBondContact CB-SG 3.28Å; C107-C142 VanDerWaalsContact SG-CA 3.53Å; C107-C142 WeakPolarHBondContact SG-CB 3.29Å; C107-C142 CovalentContact SG-SG 2.03Å; C107-C142 PolarHBondContact SG-SG 2.75Å; C107-V145 HydrophobicContact CB-CG2 4.08Å
108H92.4Very high92.1Very high11 Ų1134 Ų345%0.05119%0.188CC..  trans-141.2153.4173-163.6-94.5000110.9R106 D110 T111 V138 S141R106-H108 VanDerWaalsContact C-N 3.27Å; R106-H108 PolarHBondContact O-N 3.17Å; H108-D110 IonicContact CE1-OD2 2.76Å; H108-D110 PolarHBondContact CE1-OD2 2.87Å; H108-D110 PolarHBondContact ND1-N 3.5Å; H108-D110 IonicContact ND1-OD2 3.4Å; H108-T111 WeakPolarHBondContact CB-OG1 3.31Å; H108-T111 PolarHBondContact N-OG1 2.94Å; H108-T111 PolarHBondContact O-OG1 3.2Å; H108-T111 VanDerWaalsContact O-OG1 3.06Å; H108-V138 HydrophobicContact CB-CG2 4.34Å; H108-S141 PolarHBondContact CD2-OG 3.26Å
109A91.6Very high92.5Very high41 Ų4132.1 Ų32.134%0.33918%0.176SC..THydrogen-bonded Turntrans-70.2-40.9-179.700000111.2T111 F174 A179A109-T111 VanDerWaalsContact C-N 3.28Å; A109-T111 PolarHBondContact O-N 3.49Å; A109-F174 HydrophobicContact CB-CB 4.15Å; A109-F174 HydrophobicContact CB-CD2 3.68Å; A109-F174 HydrophobicContact CB-CE2 4.32Å; A109-F174 HydrophobicContact CB-CG 3.96Å; A109-A179 HydrophobicContact CB-CB 4.09Å
110D94.1Very high92.8Very high0 Ų032 Ų320%018%0.175CC..THydrogen-bonded Turntrans-80.64.4178.9-65.9-60.3000114.7H108 Q112 V113 F114 L134 V138 M172 Q173 F174H108-D110 IonicContact CE1-OD2 2.76Å; H108-D110 PolarHBondContact CE1-OD2 2.87Å; H108-D110 PolarHBondContact ND1-N 3.5Å; H108-D110 IonicContact ND1-OD2 3.4Å; D110-Q112 VanDerWaalsContact C-N 3.27Å; D110-Q112 PolarHBondContact O-N 3.17Å; D110-V113 PolarHBondContact O-N 2.02Å; D110-F114 WeakPolarHBondContact O-CB 3.32Å; D110-F114 PolarHBondContact O-N 3.22Å; D110-L134 HydrophobicContact CB-CD1 3.45Å; D110-L134 VanDerWaalsContact CB-CD1 3.45Å; D110-V138 HydrophobicContact CB-CG2 4.23Å; D110-M172 VanDerWaalsContact OD2-CG 3.29Å; D110-M172 WeakPolarHBondContact OD2-CG 3.32Å; D110-Q173 WeakPolarHBondContact OD1-CB 3.3Å; D110-Q173 PolarHBondContact OD1-N 3.48Å; D110-F174 VanDerWaalsContact OD1-CD2 3.25Å; D110-F174 WeakPolarHBondContact OD1-CD2 3.21Å; D110-F174 PolarHBondContact OD2-N 3.49Å
111T95.3Very high93.1Very high1 Ų130.2 Ų30.21%0.00616%0.164CC..Hα-helixtrans-56-41.8-177.4-58.70000112.1L103 H108 A109 L115 V138 C142L103-T111 HydrophobicContact CD1-CG2 4.35Å; H108-T111 WeakPolarHBondContact CB-OG1 3.31Å; H108-T111 PolarHBondContact N-OG1 2.94Å; H108-T111 PolarHBondContact O-OG1 3.2Å; H108-T111 VanDerWaalsContact O-OG1 3.06Å; A109-T111 VanDerWaalsContact C-N 3.28Å; A109-T111 PolarHBondContact O-N 3.49Å; T111-L115 HydrophobicContact CG2-CD1 3.88Å; T111-L115 HydrophobicContact CG2-CG 4.45Å; T111-L115 WeakPolarHBondContact O-CB 3.48Å; T111-L115 WeakPolarHBondContact O-CG 3.19Å; T111-L115 PolarHBondContact O-N 2.96Å; T111-V138 HydrophobicContact CG2-CG1 4.37Å; T111-C142 PolarHBondContact OG1-SG 2.02Å; T111-C142 VanDerWaalsContact OG1-SG 3.38Å
112Q95.4Very high93.4Very high65 Ų6530.6 Ų30.630%0.30417%0.166SC..Hα-helixtrans-66.3-46.9179.7-166.5174.619.900111.6L69 L103 D110 L115 C116L69-Q112 WeakPolarHBondContact O-CG 3.37Å; L69-Q112 PolarHBondContact O-NE2 2.82Å; L103-Q112 HydrophobicContact CD1-CB 3.73Å; L103-Q112 HydrophobicContact CD1-CG 4.36Å; L103-Q112 HydrophobicContact CD2-CB 4.32Å; L103-Q112 HydrophobicContact CD2-CG 4.03Å; D110-Q112 VanDerWaalsContact C-N 3.27Å; D110-Q112 PolarHBondContact O-N 3.17Å; Q112-L115 PolarHBondContact O-N 3.12Å; Q112-C116 VanDerWaalsContact O-CB 3.25Å; Q112-C116 WeakPolarHBondContact O-CB 3.46Å; Q112-C116 PolarHBondContact O-N 3.13Å; Q112-C116 PolarHBondContact O-SG 2.89Å
113V95.2Very high93.7Very high35 Ų3531.9 Ų31.921%0.21218%0.175CC..Hα-helixtrans-61.1-47.6-179.91750000110.3D110 C116 S117 I170D110-V113 PolarHBondContact O-N 2.02Å; V113-C116 PolarHBondContact O-N 3.21Å; V113-S117 WeakPolarHBondContact O-CB 3.03Å; V113-S117 PolarHBondContact O-N 3.14Å; V113-I170 HydrophobicContact CG1-CG2 4.27Å
114F97.1Very high93.8Very high0 Ų033.8 Ų33.80%019%0.186CC..Hα-helixtrans-57.5-53.5177.4172-110.5000111.8D110 C116 S117 L118 P130 L134 C135 V138 W153 L157 F162D110-F114 WeakPolarHBondContact O-CB 3.32Å; D110-F114 PolarHBondContact O-N 3.22Å; F114-C116 PolarHBondContact O-N 3.02Å; F114-S117 PolarHBondContact O-N 3.23Å; F114-S117 PolarHBondContact O-OG 2.98Å; F114-L118 HydrophobicContact CE2-CD1 4.19Å; F114-L118 HydrophobicContact CZ-CD1 4.03Å; F114-P130 HydrophobicContact CD2-CB 3.89Å; F114-P130 HydrophobicContact CD2-CG 3.97Å; F114-P130 HydrophobicContact CE2-CB 4.19Å; F114-P130 HydrophobicContact CE2-CG 3.83Å; F114-L134 HydrophobicContact CB-CD1 4.39Å; F114-L134 HydrophobicContact CB-CG 4.36Å; F114-L134 HydrophobicContact CD2-CG 4.31Å; F114-C135 HydrophobicContact CD2-CB 4.44Å; F114-C135 HydrophobicContact CE2-CB 3.68Å; F114-C135 HydrophobicContact CZ-CB 4.11Å; F114-V138 HydrophobicContact CB-CG2 4Å; F114-V138 HydrophobicContact CD1-CB 4.23Å; F114-V138 HydrophobicContact CD1-CG1 3.82Å; F114-V138 HydrophobicContact CE1-CG1 4.43Å; F114-V138 HydrophobicContact CG-CB 4.42Å; F114-V138 HydrophobicContact CG-CG1 4.39Å; F114-V138 HydrophobicContact CG-CG2 4.33Å; F114-W153 AromaticContact CE1-CH2 3.86Å; F114-W153 HydrophobicContact CE1-CH2 3.86Å; F114-W153 AromaticContact CE1-CZ2 3.71Å; F114-W153 HydrophobicContact CE1-CZ2 3.71Å; F114-W153 HydrophobicContact CZ-CZ2 4.12Å; F114-L157 HydrophobicContact CE1-CD1 4.18Å; F114-L157 HydrophobicContact CZ-CB 4.46Å; F114-L157 HydrophobicContact CZ-CD2 4.42Å; F114-F162 HydrophobicContact CE2-CD2 4.45Å; F114-F162 AromaticContact CE2-CE2 3.84Å; F114-F162 HydrophobicContact CE2-CE2 3.84Å; F114-F162 HydrophobicContact CE2-CZ 4.29Å; F114-F162 AromaticContact CZ-CE2 4Å; F114-F162 HydrophobicContact CZ-CE2 4Å; F114-F162 HydrophobicContact CZ-CZ 4.44Å
115L97.5Very high93.7Very high1 Ų137.7 Ų37.71%0.00520%0.196CC..Hα-helixtrans-64.5-40.7-178.6-68.2173.1000112.1L69 W99 T111 Q112 S117 L118 F119 L157L69-L115 HydrophobicContact CD1-CB 4.49Å; L69-L115 HydrophobicContact CD1-CD1 4.03Å; L69-L115 HydrophobicContact CD2-CB 4.15Å; W99-L115 HydrophobicContact CB-CD1 4.03Å; W99-L115 HydrophobicContact CD2-CD1 4.38Å; W99-L115 HydrophobicContact CD2-CD2 3.98Å; W99-L115 HydrophobicContact CE3-CD1 4.02Å; W99-L115 HydrophobicContact CE3-CD2 3.78Å; W99-L115 HydrophobicContact CG-CD1 4.42Å; W99-L115 HydrophobicContact CG-CD2 4.48Å; W99-L115 HydrophobicContact CZ3-CD2 4.14Å; T111-L115 HydrophobicContact CG2-CD1 3.88Å; T111-L115 HydrophobicContact CG2-CG 4.45Å; T111-L115 WeakPolarHBondContact O-CB 3.48Å; T111-L115 WeakPolarHBondContact O-CG 3.19Å; T111-L115 PolarHBondContact O-N 2.96Å; Q112-L115 PolarHBondContact O-N 3.12Å; L115-S117 VanDerWaalsContact C-N 3.35Å; L115-S117 PolarHBondContact O-N 3.04Å; L115-L118 PolarHBondContact O-N 2.69Å; L115-L118 VanDerWaalsContact O-N 3.15Å; L115-F119 WeakPolarHBondContact O-CD2 3.1Å; L115-F119 PolarHBondContact O-N 3.01Å; L115-L157 HydrophobicContact CD2-CD1 4.07Å
116C97.7Very high93.9Very high0 Ų043.1 Ų43.10%021%0.214CC..Hα-helixtrans-71.9-27.1-179.7-66.90000113.7L69 C70 V73 Q112 V113 F114 L118 A120L69-C116 PolarHBondContact O-SG 2.86Å; L69-C116 VanDerWaalsContact O-SG 3.38Å; C70-C116 WeakPolarHBondContact CA-SG 3.36Å; C70-C116 HydrophobicContact CB-CB 3.87Å; C70-C116 WeakPolarHBondContact CB-SG 3.49Å; C70-C116 WeakPolarHBondContact SG-CA 3.33Å; C70-C116 WeakPolarHBondContact SG-CB 3.34Å; C70-C116 CovalentContact SG-SG 2.04Å; C70-C116 PolarHBondContact SG-SG 2.87Å; V73-C116 HydrophobicContact CG1-CB 4.48Å; V73-C116 HydrophobicContact CG2-CB 3.87Å; Q112-C116 VanDerWaalsContact O-CB 3.25Å; Q112-C116 WeakPolarHBondContact O-CB 3.46Å; Q112-C116 PolarHBondContact O-N 3.13Å; Q112-C116 PolarHBondContact O-SG 2.89Å; V113-C116 PolarHBondContact O-N 3.21Å; F114-C116 PolarHBondContact O-N 3.02Å; C116-L118 PolarHBondContact O-N 2.93Å; C116-A120 CarbonylContact O-C 3.04Å; C116-A120 WeakPolarHBondContact O-CA 3.3Å; C116-A120 PolarHBondContact O-N 2.95Å
117S96.9Very high94Very high5 Ų537.7 Ų37.74%0.03520%0.201CC..Hα-helixtrans-58.3-28170.375.80000112.4L83 V113 F114 L115 P121L83-S117 WeakPolarHBondContact CD1-O 3.42Å; V113-S117 WeakPolarHBondContact O-CB 3.03Å; V113-S117 PolarHBondContact O-N 3.14Å; F114-S117 PolarHBondContact O-N 3.23Å; F114-S117 PolarHBondContact O-OG 2.98Å; L115-S117 VanDerWaalsContact C-N 3.35Å; L115-S117 PolarHBondContact O-N 3.04Å; S117-P121 WeakPolarHBondContact O-CB 2.98Å
118L97.4Very high94.3Very high2 Ų239 Ų391%0.0121%0.206CC..Hα-helixtrans-97-47.9-179.1-57175.1000112.6N82 L83 L84 F114 L115 C116 P130 L157 F162N82-L118 WeakPolarHBondContact CB-O 3.46Å; L83-L118 HydrophobicContact CB-CD2 4.1Å; L83-L118 HydrophobicContact CD1-CD2 4.12Å; L83-L118 PolarHBondContact N-O 3.21Å; L84-L118 HydrophobicContact CD1-CB 4.22Å; L84-L118 HydrophobicContact CD2-CB 4.32Å; L84-L118 HydrophobicContact CG-CB 4.09Å; F114-L118 HydrophobicContact CE2-CD1 4.19Å; F114-L118 HydrophobicContact CZ-CD1 4.03Å; L115-L118 PolarHBondContact O-N 2.69Å; L115-L118 VanDerWaalsContact O-N 3.15Å; C116-L118 PolarHBondContact O-N 2.93Å; L118-P130 HydrophobicContact CD2-CG 4Å; L118-P130 HydrophobicContact CG-CG 4.45Å; L118-L157 HydrophobicContact CD1-CD2 3.28Å; L118-F162 HydrophobicContact CD1-CE1 4.44Å; L118-F162 HydrophobicContact CD1-CZ 3.84Å; L118-F162 HydrophobicContact CD2-CE1 3.68Å; L118-F162 HydrophobicContact CD2-CZ 3.93Å
119F97.6Very high94.5Very high0 Ų042.5 Ų42.50%022%0.219CC..Hα-helixtrans-76-34.4-177-85.1-79.3000113.5L69 M78 N82 L84 H86 Q95 A96 W99 L115L69-F119 HydrophobicContact CD2-CB 4.35Å; L69-F119 HydrophobicContact CD2-CD2 3.88Å; L69-F119 HydrophobicContact CD2-CE2 4.45Å; L69-F119 HydrophobicContact CD2-CG 4.13Å; M78-F119 VanDerWaalsContact CE-O 3.28Å; M78-F119 WeakPolarHBondContact CE-O 3.33Å; N82-F119 PolarHBondContact ND2-O 2.89Å; L84-F119 HydrophobicContact CD1-CD1 3.96Å; L84-F119 HydrophobicContact CD1-CD2 3.85Å; L84-F119 HydrophobicContact CD1-CE1 3.7Å; L84-F119 HydrophobicContact CD1-CE2 3.57Å; L84-F119 HydrophobicContact CD1-CG 4.02Å; L84-F119 HydrophobicContact CD1-CZ 3.48Å; L84-F119 VanDerWaalsContact CD1-CZ 3.48Å; H86-F119 AromaticContact CE1-CE1 3.63Å; Q95-F119 HydrophobicContact CB-CE1 3.76Å; A96-F119 HydrophobicContact CB-CD1 3.72Å; A96-F119 HydrophobicContact CB-CE1 4.09Å; A96-F119 HydrophobicContact CB-CG 4.12Å; W99-F119 AromaticContact CD1-CE2 3.53Å; W99-F119 AromaticContact CD1-CZ 3.44Å; W99-F119 VanDerWaalsContact CD1-CZ 3.44Å; W99-F119 HydrophobicContact CG-CE2 4.2Å; W99-F119 HydrophobicContact CG-CZ 4.48Å; W99-F119 AromaticContact NE1-CE2 3.56Å; W99-F119 AromaticContact NE1-CZ 3.38Å; L115-F119 WeakPolarHBondContact O-CD2 3.1Å; L115-F119 PolarHBondContact O-N 3.01Å
120A97.7Very high94.7Very high0 Ų040.5 Ų40.50%020%0.203CC..SBendtrans-136.753.8-174.500000111.3L67 C70 Y75 M78 C116L67-A120 HydrophobicContact CD2-CB 4.36Å; C70-A120 HydrophobicContact CB-CB 3.78Å; Y75-A120 WeakPolarHBondContact CE2-O 3.44Å; Y75-A120 PolarHBondContact OH-O 3.42Å; M78-A120 HydrophobicContact CB-CB 4.1Å; M78-A120 HydrophobicContact CE-CB 4.2Å; M78-A120 HydrophobicContact SD-CB 3.65Å; C116-A120 CarbonylContact O-C 3.04Å; C116-A120 WeakPolarHBondContact O-CA 3.3Å; C116-A120 PolarHBondContact O-N 2.95Å
121P97.1Very high94.9Very high6 Ų640.7 Ų40.74%0.03920%0.204CC..  trans-56.1144.2-17625.1-34.9000111.2M78 R79 N82 L83 S117 C123M78-P121 CarbonylContact C-O 3.49Å; M78-P121 WeakPolarHBondContact CA-O 3.36Å; M78-P121 WeakPolarHBondContact CB-O 3.41Å; R79-P121 HydrophobicContact CB-CG 4.28Å; R79-P121 PolarHBondContact N-O 2.98Å; N82-P121 HydrophobicContact CB-CG 4.01Å; L83-P121 HydrophobicContact CD1-CB 4.39Å; L83-P121 HydrophobicContact CG-CB 4.13Å; L83-P121 HydrophobicContact CG-CG 4.16Å; S117-P121 WeakPolarHBondContact O-CB 2.98Å; P121-C123 PolarHBondContact O-N 3.44Å
122V95.4Very high94.9Very high65 Ų6543.9 Ų43.939%0.39422%0.216SC..BIsolated β-bridgetrans-54.2139.3177.6-174.20000109.8Y75 L124Y75-V122 HydrophobicContact CD1-CG2 3.78Å; Y75-V122 HydrophobicContact CD2-CG2 4.16Å; Y75-V122 HydrophobicContact CE1-CG2 3.66Å; Y75-V122 HydrophobicContact CE2-CG2 4.02Å; Y75-V122 HydrophobicContact CG-CG2 4.05Å; V122-L124 HydrophobicContact CB-CD1 4.48Å; V122-L124 HydrophobicContact CB-CG 4.38Å; V122-L124 HydrophobicContact CG1-CD1 4.45Å; V122-L124 HydrophobicContact CG1-CG 4.07Å; V122-L124 PolarHBondContact O-N 3.36Å
123C94.3Very high94.9Very high44 Ų4442.3 Ų42.330%0.29721%0.212SC..SBendtrans-64.792.61731690000110.9C60 K77 P121C60-C123 HydrophobicContact CB-CB 3.77Å; C60-C123 WeakPolarHBondContact CB-SG 3Å; C60-C123 WeakPolarHBondContact SG-CB 3.23Å; C60-C123 CovalentContact SG-SG 2.01Å; C60-C123 PolarHBondContact SG-SG 2.97Å; K77-C123 HydrophobicContact CB-CB 4.08Å; K77-C123 PolarHBondContact O-N 2.67Å; P121-C123 PolarHBondContact O-N 3.44Å
124L90.3Very high95Very high79 Ų7940.6 Ų40.641%0.41420%0.202SC..  trans-133.8157.2173.8-63.5175.1000109.4R79 V122 R126 I128R79-L124 PolarHBondContact NH1-O 3Å; V122-L124 HydrophobicContact CB-CD1 4.48Å; V122-L124 HydrophobicContact CB-CG 4.38Å; V122-L124 HydrophobicContact CG1-CD1 4.45Å; V122-L124 HydrophobicContact CG1-CG 4.07Å; V122-L124 PolarHBondContact O-N 3.36Å; L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 WeakPolarHBondContact CB-O 3.04Å; L124-R126 PolarHBondContact O-N 2.95Å; L124-I128 HydrophobicContact CD1-CD1 3.64Å; L124-I128 HydrophobicContact CD1-CG1 4.17Å
125D85.2Confident95Very high156 Ų15640.6 Ų40.683%0.83420%0.202SC*.SBendtrans-62.5-41.5178.6-65.1-30.7000111.7R79R79-D125 PolarHBondContact NH1-O 2.84Å
126R87.9Confident94.9Very high200 Ų20043.8 Ų43.876%0.75522%0.217SC*.SBendtrans-107.2130.9175-63.7-175.3-179.1-158.9-1.1110.1L124L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 WeakPolarHBondContact CB-O 3.04Å; L124-R126 PolarHBondContact O-N 2.95Å
127P90.3Very high94.8Very high57 Ų5744.9 Ų44.937%0.3723%0.226SC..  trans-68.1142.5175.728.4-33.4000111.1L83 Y129L83-P127 HydrophobicContact CD2-CB 3.49Å; L83-P127 VanDerWaalsContact CD2-CB 3.49Å; L83-P127 HydrophobicContact CD2-CG 4.4Å; P127-Y129 HydrophobicContact CB-CE2 4.41Å; P127-Y129 HydrophobicContact CG-CE2 4.28Å
128I94.1Very high94.7Very high51 Ų5144.7 Ų44.726%0.26222%0.224SC..  trans-111.8120172.5-53.9178.8000107.8L124 I170L124-I128 HydrophobicContact CD1-CD1 3.64Å; L124-I128 HydrophobicContact CD1-CG1 4.17Å; I128-I170 HydrophobicContact CG2-CD1 4.45Å; I128-I170 HydrophobicContact CG2-CG1 3.89Å
129Y95.8Very high94.7Very high84 Ų8448.1 Ų48.133%0.32924%0.237SC..PPolyproline II helixtrans-84156.4178.4-72.5-93.3000111.2L83 P127 F162 C169 I170L83-Y129 HydrophobicContact CB-CE1 4.2Å; L83-Y129 HydrophobicContact CD1-CD1 3.86Å; L83-Y129 HydrophobicContact CD1-CE1 3.95Å; L83-Y129 HydrophobicContact CD1-CG 4.26Å; L83-Y129 HydrophobicContact CD2-CE1 4.31Å; L83-Y129 HydrophobicContact CG-CE1 4.38Å; P127-Y129 HydrophobicContact CB-CE2 4.41Å; P127-Y129 HydrophobicContact CG-CE2 4.28Å; Y129-F162 HydrophobicContact CD1-CD1 4.02Å; Y129-F162 HydrophobicContact CD1-CE1 4.16Å; Y129-C169 CarbonylContact O-C 3.36Å; Y129-C169 VanDerWaalsContact O-CA 3.24Å; Y129-C169 WeakPolarHBondContact O-CA 3.18Å; Y129-C169 VanDerWaalsContact O-CB 3.28Å; Y129-C169 WeakPolarHBondContact O-CB 3.22Å; Y129-I170 PolarHBondContact O-N 3.45Å
130P96.9Very high94.5Very high0 Ų052.7 Ų52.70%026%0.262CS..BIsolated β-bridgetrans-63.3146.9165.828.7-33.7000110.4F114 L118 L134 F162F114-P130 HydrophobicContact CD2-CB 3.89Å; F114-P130 HydrophobicContact CD2-CG 3.97Å; F114-P130 HydrophobicContact CE2-CB 4.19Å; F114-P130 HydrophobicContact CE2-CG 3.83Å; L118-P130 HydrophobicContact CD2-CG 4Å; L118-P130 HydrophobicContact CG-CG 4.45Å; P130-L134 HydrophobicContact CB-CD2 3.91Å; P130-L134 HydrophobicContact CB-CG 4.47Å; P130-F162 HydrophobicContact CG-CD1 3.86Å; P130-F162 HydrophobicContact CG-CD2 4.31Å; P130-F162 HydrophobicContact CG-CE1 3.89Å; P130-F162 HydrophobicContact CG-CE2 4.34Å; P130-F162 HydrophobicContact CG-CG 4.1Å; P130-F162 HydrophobicContact CG-CZ 4.15Å; P130-F162 WeakPolarHBondContact O-CB 3.37Å
131C97.3Very high94.2Very high3 Ų354.1 Ų54.12%0.0227%0.272CS..PPolyproline II helixtrans-67153.6172-57.80000110.5S133 L134 C135 D165 C169 I170C131-S133 VanDerWaalsContact C-N 3.3Å; C131-S133 PolarHBondContact O-N 2.97Å; C131-L134 WeakPolarHBondContact O-CB 3.47Å; C131-L134 PolarHBondContact O-N 2.82Å; C131-C135 PolarHBondContact O-N 3.34Å; C131-D165 WeakPolarHBondContact CB-OD1 3.1Å; C131-C169 WeakPolarHBondContact CA-SG 3.34Å; C131-C169 HydrophobicContact CB-CB 3.98Å; C131-C169 WeakPolarHBondContact CB-SG 3.45Å; C131-C169 WeakPolarHBondContact SG-CB 3.48Å; C131-C169 CovalentContact SG-SG 2.03Å; C131-C169 PolarHBondContact SG-SG 2.94Å; C131-I170 PolarHBondContact N-O 3.21Å; C131-I170 PolarHBondContact SG-O 3.46Å
132R96.5Very high94Very high68 Ų6853.8 Ų53.826%0.25727%0.27SS..Hα-helixtrans-57.1-43.2176.9-175.3173.6-59166.55.1111.9L134 C135 E136 C159 F162 P163R132-L134 VanDerWaalsContact C-N 3.3Å; R132-L134 PolarHBondContact O-N 3.41Å; R132-C135 WeakPolarHBondContact O-CB 3.44Å; R132-C135 PolarHBondContact O-N 3.24Å; R132-C135 VanDerWaalsContact O-N 3.14Å; R132-E136 HydrophobicContact CG-CG 4.21Å; R132-E136 WeakPolarHBondContact O-CG 3.44Å; R132-E136 PolarHBondContact O-N 2.92Å; R132-C159 HydrophobicContact CG-CB 4.25Å; R132-C159 PolarHBondContact NE-O 3.4Å; R132-F162 PolarHBondContact NE-O 3.36Å; R132-F162 PolarHBondContact NH2-O 2.85Å; R132-P163 WeakPolarHBondContact CB-O 3.23Å; R132-P163 PolarHBondContact N-O 3.45Å
133S95.3Very high93.8Very high32 Ų3251.1 Ų51.122%0.22425%0.254CS..Hα-helixtrans-56.9-41.7177.970.70000113C131 E136 A137 D165 M172C131-S133 VanDerWaalsContact C-N 3.3Å; C131-S133 PolarHBondContact O-N 2.97Å; S133-E136 PolarHBondContact O-N 2.05Å; S133-A137 WeakPolarHBondContact O-CB 3.42Å; S133-A137 PolarHBondContact O-N 3.02Å; S133-D165 VanDerWaalsContact CB-OD1 3.3Å; S133-D165 WeakPolarHBondContact CB-OD1 2.9Å; S133-D165 VanDerWaalsContact CB-OD2 3.3Å; S133-D165 WeakPolarHBondContact CB-OD2 3.22Å; S133-D165 PolarHBondContact N-OD2 2.88Å; S133-D165 VanDerWaalsContact OG-CG 3.27Å; S133-D165 PolarHBondContact OG-OD1 3.01Å; S133-D165 PolarHBondContact OG-OD2 3.18Å; S133-M172 WeakPolarHBondContact O-CE 3.41Å
134L96Very high93.4Very high0 Ų051.7 Ų51.70%026%0.258CS..Hα-helixtrans-64-45.1177.3168.859.2000110.6D110 F114 P130 C131 R132 V138 I170 M172D110-L134 HydrophobicContact CB-CD1 3.45Å; D110-L134 VanDerWaalsContact CB-CD1 3.45Å; F114-L134 HydrophobicContact CB-CD1 4.39Å; F114-L134 HydrophobicContact CB-CG 4.36Å; F114-L134 HydrophobicContact CD2-CG 4.31Å; P130-L134 HydrophobicContact CB-CD2 3.91Å; P130-L134 HydrophobicContact CB-CG 4.47Å; C131-L134 WeakPolarHBondContact O-CB 3.47Å; C131-L134 PolarHBondContact O-N 2.82Å; R132-L134 VanDerWaalsContact C-N 3.3Å; R132-L134 PolarHBondContact O-N 3.41Å; L134-V138 HydrophobicContact CD1-CG2 4.06Å; L134-V138 WeakPolarHBondContact O-CG2 3.49Å; L134-V138 PolarHBondContact O-N 3.14Å; L134-V138 VanDerWaalsContact O-N 3.17Å; L134-I170 HydrophobicContact CD2-CG2 4.25Å; L134-I170 WeakPolarHBondContact CD2-O 3.19Å; L134-M172 HydrophobicContact CB-CB 4.39Å; L134-M172 HydrophobicContact CD1-CB 4.47Å; L134-M172 HydrophobicContact CD1-CG 4.39Å
135C97.8Very high93.2Very high0 Ų049.7 Ų49.70%025%0.248CC..Hα-helixtrans-59.3-48.9175.21770000111.7F114 C131 R132 V138 R139 L157 C159 F162F114-C135 HydrophobicContact CD2-CB 4.44Å; F114-C135 HydrophobicContact CE2-CB 3.68Å; F114-C135 HydrophobicContact CZ-CB 4.11Å; C131-C135 PolarHBondContact O-N 3.34Å; R132-C135 WeakPolarHBondContact O-CB 3.44Å; R132-C135 PolarHBondContact O-N 3.24Å; R132-C135 VanDerWaalsContact O-N 3.14Å; C135-V138 PolarHBondContact O-N 3.44Å; C135-R139 VanDerWaalsContact O-CB 3.24Å; C135-R139 WeakPolarHBondContact O-CB 3.49Å; C135-R139 PolarHBondContact O-N 3.42Å; C135-L157 PolarHBondContact SG-O 3.47Å; C135-L157 VanDerWaalsContact SG-O 3.42Å; C135-C159 HydrophobicContact CB-CB 3.72Å; C135-C159 WeakPolarHBondContact CB-SG 3.47Å; C135-C159 WeakPolarHBondContact SG-CA 3.06Å; C135-C159 WeakPolarHBondContact SG-CB 3.06Å; C135-C159 CovalentContact SG-SG 2.05Å; C135-C159 PolarHBondContact SG-SG 3.26Å; C135-F162 HydrophobicContact CB-CD2 3.56Å; C135-F162 HydrophobicContact CB-CE2 3.93Å; C135-F162 VanDerWaalsContact SG-CE2 3.54Å
136E96.4Very high93.4Very high68 Ų6842.9 Ų42.932%0.31821%0.212SC..Hα-helixtrans-62.8-45.2-176.6-71178.1152.800111.5R132 S133 V138 R139 D140 C159R132-E136 HydrophobicContact CG-CG 4.21Å; R132-E136 WeakPolarHBondContact O-CG 3.44Å; R132-E136 PolarHBondContact O-N 2.92Å; S133-E136 PolarHBondContact O-N 2.05Å; E136-V138 PolarHBondContact O-N 2.98Å; E136-R139 PolarHBondContact O-N 3.13Å; E136-D140 WeakPolarHBondContact O-CB 3.37Å; E136-D140 PolarHBondContact O-N 3.32Å; E136-C159 HydrophobicContact CG-CB 3.78Å; E136-C159 PolarHBondContact N-SG 2.83Å; E136-C159 VanDerWaalsContact N-SG 3.42Å
137A94.7Very high93.3Very high22 Ų2237.7 Ų37.718%0.18220%0.196CC..Hα-helixtrans-62.6-41.617800000113.2S133 S141 M172S133-A137 WeakPolarHBondContact O-CB 3.42Å; S133-A137 PolarHBondContact O-N 3.02Å; A137-S141 WeakPolarHBondContact O-CB 3.48Å; A137-S141 PolarHBondContact O-N 3.42Å; A137-S141 PolarHBondContact O-OG 3.26Å; A137-M172 HydrophobicContact CB-CE 3.29Å; A137-M172 HydrophobicContact CB-SD 3.99Å
138V95.8Very high92.9Very high1 Ų135.6 Ų35.61%0.00618%0.182CC..Hα-helixtrans-67.1-45.4175.4174.90000110.4H108 D110 T111 F114 L134 C135 E136 S141 C142 W153H108-V138 HydrophobicContact CB-CG2 4.34Å; D110-V138 HydrophobicContact CB-CG2 4.23Å; T111-V138 HydrophobicContact CG2-CG1 4.37Å; F114-V138 HydrophobicContact CB-CG2 4Å; F114-V138 HydrophobicContact CD1-CB 4.23Å; F114-V138 HydrophobicContact CD1-CG1 3.82Å; F114-V138 HydrophobicContact CE1-CG1 4.43Å; F114-V138 HydrophobicContact CG-CB 4.42Å; F114-V138 HydrophobicContact CG-CG1 4.39Å; F114-V138 HydrophobicContact CG-CG2 4.33Å; L134-V138 HydrophobicContact CD1-CG2 4.06Å; L134-V138 WeakPolarHBondContact O-CG2 3.49Å; L134-V138 PolarHBondContact O-N 3.14Å; L134-V138 VanDerWaalsContact O-N 3.17Å; C135-V138 PolarHBondContact O-N 3.44Å; E136-V138 PolarHBondContact O-N 2.98Å; V138-S141 PolarHBondContact O-N 3.29Å; V138-C142 WeakPolarHBondContact O-CB 3.45Å; V138-C142 PolarHBondContact O-N 3.22Å; V138-C142 PolarHBondContact O-SG 3.37Å; V138-C142 VanDerWaalsContact O-SG 3.39Å; V138-W153 HydrophobicContact CG1-CH2 4.11Å
139R95.9Very high92.3Very high74 Ų7434.1 Ų34.128%0.27917%0.174SC..Hα-helixtrans-56.8-52.2176.5178.1-163.870.3-159.8-5.8110.6C135 E136 S141 C142 A143 W153C135-R139 VanDerWaalsContact O-CB 3.24Å; C135-R139 WeakPolarHBondContact O-CB 3.49Å; C135-R139 PolarHBondContact O-N 3.42Å; E136-R139 PolarHBondContact O-N 3.13Å; R139-S141 PolarHBondContact O-N 2.85Å; R139-C142 PolarHBondContact O-N 3.06Å; R139-A143 HydrophobicContact CG-CB 4.23Å; R139-A143 WeakPolarHBondContact O-CA 3.44Å; R139-A143 WeakPolarHBondContact O-CB 3.31Å; R139-A143 PolarHBondContact O-N 3.25Å; R139-W153 HydrophobicContact CB-CD2 4.14Å; R139-W153 HydrophobicContact CB-CE3 4.49Å; R139-W153 HydrophobicContact CB-CH2 4.32Å; R139-W153 HydrophobicContact CB-CZ2 3.93Å; R139-W153 HydrophobicContact CG-CB 4.5Å; R139-W153 HydrophobicContact CG-CD2 3.75Å; R139-W153 HydrophobicContact CG-CE3 4.31Å; R139-W153 HydrophobicContact CG-CG 3.83Å; R139-W153 HydrophobicContact CG-CZ2 4.43Å
140D94.2Very high91.8Very high96 Ų9630.5 Ų30.551%0.51316%0.162SC..Hα-helixtrans-65.1-31.1-173.5-66.7-6.4000111.7E136 P144E136-D140 WeakPolarHBondContact O-CB 3.37Å; E136-D140 PolarHBondContact O-N 3.32Å; D140-P144 WeakPolarHBondContact O-CD 3.5Å
141S90.4Very high91.3Very high30 Ų3032.7 Ų32.721%0.2117%0.171CC..Hα-helixtrans-81.6-35.8176.2-55.80000113.2C107 H108 A137 V138 R139C107-S141 WeakPolarHBondContact O-CB 3.46Å; H108-S141 PolarHBondContact CD2-OG 3.26Å; A137-S141 WeakPolarHBondContact O-CB 3.48Å; A137-S141 PolarHBondContact O-N 3.42Å; A137-S141 PolarHBondContact O-OG 3.26Å; V138-S141 PolarHBondContact O-N 3.29Å; R139-S141 PolarHBondContact O-N 2.85Å
142C92.6Very high91Very high0 Ų036 Ų360%019%0.193CC..Hα-helixtrans-102.2-28.4-169.9-65.20000114.6L102 C107 T111 V138 R139 V145 M146 W153L102-C142 HydrophobicContact CD1-CB 4.29Å; L102-C142 HydrophobicContact CD2-CB 4.28Å; C107-C142 HydrophobicContact CB-CB 3.93Å; C107-C142 WeakPolarHBondContact CB-SG 3.28Å; C107-C142 VanDerWaalsContact SG-CA 3.53Å; C107-C142 WeakPolarHBondContact SG-CB 3.29Å; C107-C142 CovalentContact SG-SG 2.03Å; C107-C142 PolarHBondContact SG-SG 2.75Å; T111-C142 PolarHBondContact OG1-SG 2.02Å; T111-C142 VanDerWaalsContact OG1-SG 3.38Å; V138-C142 WeakPolarHBondContact O-CB 3.45Å; V138-C142 PolarHBondContact O-N 3.22Å; V138-C142 PolarHBondContact O-SG 3.37Å; V138-C142 VanDerWaalsContact O-SG 3.39Å; R139-C142 PolarHBondContact O-N 3.06Å; C142-V145 WeakPolarHBondContact O-CB 3.22Å; C142-V145 PolarHBondContact O-N 3.09Å; C142-V145 VanDerWaalsContact O-N 3.11Å; C142-M146 PolarHBondContact O-N 3.08Å; C142-W153 HydrophobicContact CB-CZ3 4.25Å
143A91.5Very high90.8Very high9 Ų934.8 Ų34.87%0.07419%0.188CC..Hα-helixtrans-58.7-43.3178.800000112.5R139 V145 M146 E147 W153R139-A143 HydrophobicContact CG-CB 4.23Å; R139-A143 WeakPolarHBondContact O-CA 3.44Å; R139-A143 WeakPolarHBondContact O-CB 3.31Å; R139-A143 PolarHBondContact O-N 3.25Å; A143-V145 PolarHBondContact O-N 3.25Å; A143-M146 WeakPolarHBondContact O-CB 3.13Å; A143-M146 PolarHBondContact O-N 3.4Å; A143-E147 WeakPolarHBondContact O-CG 2.78Å; A143-E147 PolarHBondContact O-N 3.11Å; A143-W153 HydrophobicContact CB-CB 4.18Å; A143-W153 HydrophobicContact CB-CE3 4.17Å
144P87.3Confident90.7Very high56 Ų5633.8 Ų33.836%0.36418%0.181SC..Hα-helixtrans-60.5-32.3176-24.535.4000113.4D140 T148D140-P144 WeakPolarHBondContact O-CD 3.5Å; P144-T148 PolarHBondContact O-N 3.06Å; P144-T148 PolarHBondContact O-OG1 2.83Å
145V86Confident90.5Very high36 Ų3640.9 Ų40.922%0.21821%0.214CC..Hα-helixtrans-67.1-47.1174.5-178.80000110L102 K105 C107 C142 A143 E147 T148 Y149L102-V145 HydrophobicContact CD1-CB 4.43Å; L102-V145 HydrophobicContact CD1-CG1 4.26Å; K105-V145 HydrophobicContact CB-CG1 4.21Å; K105-V145 HydrophobicContact CG-CG1 4.07Å; C107-V145 HydrophobicContact CB-CG2 4.08Å; C142-V145 WeakPolarHBondContact O-CB 3.22Å; C142-V145 PolarHBondContact O-N 3.09Å; C142-V145 VanDerWaalsContact O-N 3.11Å; A143-V145 PolarHBondContact O-N 3.25Å; V145-E147 PolarHBondContact O-N 3.28Å; V145-T148 WeakPolarHBondContact O-CB 3.38Å; V145-T148 PolarHBondContact O-N 3.06Å; V145-Y149 HydrophobicContact CG1-CE2 4.39Å; V145-Y149 WeakPolarHBondContact O-CD2 3.44Å
146M88.1Confident90.3Very high14 Ų1443.7 Ų43.77%0.06923%0.228CC..Hα-helixtrans-61.2-44.1177.3-65.2179.764.900112.2W99 L102 C142 A143 T148 Y149 G150 F151 P152 W153W99-M146 HydrophobicContact CH2-CE 4.04Å; W99-M146 HydrophobicContact CH2-SD 4.45Å; W99-M146 HydrophobicContact CZ3-CE 4.05Å; W99-M146 HydrophobicContact CZ3-SD 4.04Å; L102-M146 HydrophobicContact CD1-CG 3.74Å; L102-M146 HydrophobicContact CD2-CG 4.02Å; L102-M146 HydrophobicContact CD2-SD 3.75Å; L102-M146 HydrophobicContact CG-CG 4.5Å; C142-M146 PolarHBondContact O-N 3.08Å; A143-M146 WeakPolarHBondContact O-CB 3.13Å; A143-M146 PolarHBondContact O-N 3.4Å; M146-T148 VanDerWaalsContact C-N 3.26Å; M146-T148 PolarHBondContact O-N 3.21Å; M146-Y149 CarbonylContact O-C 3.57Å; M146-Y149 WeakPolarHBondContact O-CA 3.29Å; M146-Y149 PolarHBondContact O-N 3.19Å; M146-G150 PolarHBondContact O-N 3.09Å; M146-F151 CarbonylContact C-O 3.58Å; M146-F151 HydrophobicContact CB-CB 4.16Å; M146-F151 WeakPolarHBondContact CB-O 3Å; M146-F151 HydrophobicContact CE-CB 4.11Å; M146-F151 PolarHBondContact O-N 3.48Å; M146-P152 WeakPolarHBondContact CE-O 3.28Å; M146-W153 HydrophobicContact SD-CE3 3.7Å; M146-W153 HydrophobicContact SD-CZ3 3.98Å
147E85.9Confident90.2Very high91 Ų9140.5 Ų40.543%0.42521%0.213SC..Hα-helixtrans-62-33.9-179.9-74.8176.3-178.400112.4A143 V145 Y149 G150 F151A143-E147 WeakPolarHBondContact O-CG 2.78Å; A143-E147 PolarHBondContact O-N 3.11Å; V145-E147 PolarHBondContact O-N 3.28Å; E147-Y149 PolarHBondContact O-N 3.42Å; E147-G150 PolarHBondContact O-N 2.83Å; E147-F151 PolarHBondContact N-O 3.02Å
148T81.8Confident90.3Very high12 Ų1241 Ų417%0.07422%0.216CC..Hα-helixtrans-57.6-30.5174.3-58.30000111.8P144 V145 M146 P189 P190P144-T148 PolarHBondContact O-N 3.06Å; P144-T148 PolarHBondContact O-OG1 2.83Å; V145-T148 WeakPolarHBondContact O-CB 3.38Å; V145-T148 PolarHBondContact O-N 3.06Å; M146-T148 VanDerWaalsContact C-N 3.26Å; M146-T148 PolarHBondContact O-N 3.21Å; T148-P189 HydrophobicContact CG2-CB 4.02Å; T148-P189 HydrophobicContact CG2-CG 3.99Å; T148-P190 HydrophobicContact CG2-CG 4.16Å
149Y82.8Confident90.3Very high21 Ų2141 Ų418%0.08222%0.216CC..THydrogen-bonded Turntrans-98.36.3177-64.1-75.1000113.4K105 V145 M146 E147 F151 P189 M286K105-Y149 PolarHBondContact NZ-OH 3.11Å; V145-Y149 HydrophobicContact CG1-CE2 4.39Å; V145-Y149 WeakPolarHBondContact O-CD2 3.44Å; M146-Y149 CarbonylContact O-C 3.57Å; M146-Y149 WeakPolarHBondContact O-CA 3.29Å; M146-Y149 PolarHBondContact O-N 3.19Å; E147-Y149 PolarHBondContact O-N 3.42Å; Y149-F151 WeakPolarHBondContact O-CD2 3.21Å; Y149-F151 WeakPolarHBondContact O-CE2 3.03Å; Y149-P189 HydrophobicContact CE2-CB 4.07Å; Y149-P189 VanDerWaalsContact OH-CB 3.25Å; Y149-P189 WeakPolarHBondContact OH-CB 3.32Å; Y149-P189 PolarHBondContact OH-O 2.87Å; Y149-M286 HydrophobicContact CD1-CB 4.26Å; Y149-M286 HydrophobicContact CD1-CE 4.14Å; Y149-M286 HydrophobicContact CD1-CG 4.35Å; Y149-M286 WeakPolarHBondContact CE1-O 3.12Å
150G84.1Confident90.4Very high8 Ų843.2 Ų43.28%0.08223%0.233CC..THydrogen-bonded Turntrans76.125.8179.100000114.3M146 E147 R277 L284M146-G150 PolarHBondContact O-N 3.09Å; E147-G150 PolarHBondContact O-N 2.83Å; G150-R277 PolarHBondContact O-NH1 2.79Å; G150-R277 VanDerWaalsContact O-NH1 3.13Å; G150-L284 VanDerWaalsContact CA-CD1 3.5Å
151F87.4Confident90.3Very high46 Ų4643.8 Ų43.820%0.20223%0.231CC..  trans-109.4119172.4-63.1-87.4000109M146 E147 Y149 M286 F317M146-F151 CarbonylContact C-O 3.58Å; M146-F151 HydrophobicContact CB-CB 4.16Å; M146-F151 WeakPolarHBondContact CB-O 3Å; M146-F151 HydrophobicContact CE-CB 4.11Å; M146-F151 PolarHBondContact O-N 3.48Å; E147-F151 PolarHBondContact N-O 3.02Å; Y149-F151 WeakPolarHBondContact O-CD2 3.21Å; Y149-F151 WeakPolarHBondContact O-CE2 3.03Å; F151-M286 HydrophobicContact CE2-CE 3.98Å; F151-F317 AromaticContact CD1-CD2 3.59Å; F151-F317 HydrophobicContact CD1-CD2 3.59Å; F151-F317 AromaticContact CD1-CE2 3.98Å; F151-F317 HydrophobicContact CD1-CE2 3.98Å; F151-F317 HydrophobicContact CD1-CG 4.49Å; F151-F317 AromaticContact CE1-CD2 3.94Å; F151-F317 HydrophobicContact CE1-CD2 3.94Å; F151-F317 HydrophobicContact CE1-CE2 4.2Å
152P90.1Very high90.6Very high73 Ų7342.8 Ų42.847%0.47422%0.223SC..PPolyproline II helixtrans-72.8162.8172.132.2-34.3000110.4M146 P154M146-P152 WeakPolarHBondContact CE-O 3.28Å; P152-P154 WeakPolarHBondContact O-CD 3.2Å
153W92.8Very high90.7Very high42 Ų4244.2 Ų44.216%0.15923%0.232CC..PPolyproline II helixtrans-64121.7165.3-169.7-100.4000109.2F114 V138 R139 C142 A143 M146 L157F114-W153 AromaticContact CE1-CH2 3.86Å; F114-W153 HydrophobicContact CE1-CH2 3.86Å; F114-W153 AromaticContact CE1-CZ2 3.71Å; F114-W153 HydrophobicContact CE1-CZ2 3.71Å; F114-W153 HydrophobicContact CZ-CZ2 4.12Å; V138-W153 HydrophobicContact CG1-CH2 4.11Å; R139-W153 HydrophobicContact CB-CD2 4.14Å; R139-W153 HydrophobicContact CB-CE3 4.49Å; R139-W153 HydrophobicContact CB-CH2 4.32Å; R139-W153 HydrophobicContact CB-CZ2 3.93Å; R139-W153 HydrophobicContact CG-CB 4.5Å; R139-W153 HydrophobicContact CG-CD2 3.75Å; R139-W153 HydrophobicContact CG-CE3 4.31Å; R139-W153 HydrophobicContact CG-CG 3.83Å; R139-W153 HydrophobicContact CG-CZ2 4.43Å; C142-W153 HydrophobicContact CB-CZ3 4.25Å; A143-W153 HydrophobicContact CB-CB 4.18Å; A143-W153 HydrophobicContact CB-CE3 4.17Å; M146-W153 HydrophobicContact SD-CE3 3.7Å; M146-W153 HydrophobicContact SD-CZ3 3.98Å; W153-L157 HydrophobicContact CH2-CD1 4.18Å; W153-L157 HydrophobicContact CZ2-CB 3.82Å; W153-L157 HydrophobicContact CZ2-CD1 3.95Å; W153-L157 PolarHBondContact NE1-O 3.25Å
154P93.8Very high90.7Very high10 Ų1048 Ų487%0.06525%0.25CC..PPolyproline II helixtrans-78.6150.3-168.630.6-34.8000112.2W99 P152 M156 L157 F317W99-P154 HydrophobicContact CH2-CG 3.64Å; W99-P154 HydrophobicContact CZ2-CG 3.78Å; P152-P154 WeakPolarHBondContact O-CD 3.2Å; P154-M156 HydrophobicContact CB-CG 4.23Å; P154-M156 HydrophobicContact CG-CE 4.17Å; P154-M156 HydrophobicContact CG-CG 4.27Å; P154-M156 PolarHBondContact O-N 3.48Å; P154-L157 HydrophobicContact CG-CB 4.29Å; P154-L157 HydrophobicContact CG-CD1 4.01Å; P154-L157 HydrophobicContact CG-CG 3.98Å; P154-L157 PolarHBondContact O-N 3.34Å; P154-F317 HydrophobicContact CB-CD1 3.85Å; P154-F317 HydrophobicContact CG-CD1 4.07Å; P154-F317 HydrophobicContact CG-CE1 4.24Å
155E92.4Very high90.7Very high149 Ų14948.8 Ų48.870%0.69625%0.251SS*.G310 helixtrans-62.7-29.8-176.9-159-148.8120.900113L157 S158 K161E155-L157 PolarHBondContact O-N 2.95Å; E155-L157 VanDerWaalsContact O-N 3.14Å; E155-S158 WeakPolarHBondContact O-CB 3.16Å; E155-S158 PolarHBondContact O-N 3.01Å; E155-K161 WeakPolarHBondContact O-CE 3.01Å; E155-K161 PolarHBondContact O-NZ 2.76Å; E155-K161 IonicContact OE1-NZ 3.89Å; E155-K161 PolarHBondContact OE1-NZ 2.78Å
156M91.9Very high90.4Very high60 Ų6054.5 Ų54.530%0.29628%0.28SS..G310 helixtrans-61.2-20174.772.4-177.5178.100113L84 W99 P154 F317L84-M156 HydrophobicContact CD2-CB 4.38Å; L84-M156 HydrophobicContact CD2-CG 4.47Å; W99-M156 HydrophobicContact CZ2-CE 3.53Å; P154-M156 HydrophobicContact CB-CG 4.23Å; P154-M156 HydrophobicContact CG-CE 4.17Å; P154-M156 HydrophobicContact CG-CG 4.27Å; P154-M156 PolarHBondContact O-N 3.48Å; M156-F317 HydrophobicContact CE-CE1 4.16Å
157L95.3Very high90.1Very high0 Ų059 Ų590%030%0.304CS..G310 helixtrans-109.117.8176.1-56.1-173000112.5L84 W99 F114 L115 L118 C135 W153 P154 E155 C159L84-L157 HydrophobicContact CD2-CD2 4.43Å; W99-L157 HydrophobicContact CH2-CD1 3.21Å; W99-L157 HydrophobicContact CH2-CG 4.36Å; W99-L157 HydrophobicContact CZ2-CD1 3.53Å; W99-L157 HydrophobicContact CZ2-CG 4.39Å; W99-L157 HydrophobicContact CZ3-CD1 3.9Å; F114-L157 HydrophobicContact CE1-CD1 4.18Å; F114-L157 HydrophobicContact CZ-CB 4.46Å; F114-L157 HydrophobicContact CZ-CD2 4.42Å; L115-L157 HydrophobicContact CD2-CD1 4.07Å; L118-L157 HydrophobicContact CD1-CD2 3.28Å; C135-L157 PolarHBondContact SG-O 3.47Å; C135-L157 VanDerWaalsContact SG-O 3.42Å; W153-L157 HydrophobicContact CH2-CD1 4.18Å; W153-L157 HydrophobicContact CZ2-CB 3.82Å; W153-L157 HydrophobicContact CZ2-CD1 3.95Å; W153-L157 PolarHBondContact NE1-O 3.25Å; P154-L157 HydrophobicContact CG-CB 4.29Å; P154-L157 HydrophobicContact CG-CD1 4.01Å; P154-L157 HydrophobicContact CG-CG 3.98Å; P154-L157 PolarHBondContact O-N 3.34Å; E155-L157 PolarHBondContact O-N 2.95Å; E155-L157 VanDerWaalsContact O-N 3.14Å; L157-C159 PolarHBondContact O-N 3.31Å
158S95.9Very high90.4Very high34 Ų3461.6 Ų61.624%0.23832%0.321CS..  trans-60.1125.6176.6-176.80000110.7E155 D160 K161E155-S158 WeakPolarHBondContact O-CB 3.16Å; E155-S158 PolarHBondContact O-N 3.01Å; S158-D160 PolarHBondContact O-N 3.21Å; S158-K161 WeakPolarHBondContact O-CB 3.36Å; S158-K161 PolarHBondContact O-N 3.35Å; S158-K161 VanDerWaalsContact O-N 3.08Å
159C97.3Very high91Very high1 Ų161.9 Ų61.91%0.00732%0.323CS..G310 helixtrans-67.6-19.6-172.6-56.10000113.8R132 C135 E136 L157 K161 F162R132-C159 HydrophobicContact CG-CB 4.25Å; R132-C159 PolarHBondContact NE-O 3.4Å; C135-C159 HydrophobicContact CB-CB 3.72Å; C135-C159 WeakPolarHBondContact CB-SG 3.47Å; C135-C159 WeakPolarHBondContact SG-CA 3.06Å; C135-C159 WeakPolarHBondContact SG-CB 3.06Å; C135-C159 CovalentContact SG-SG 2.05Å; C135-C159 PolarHBondContact SG-SG 3.26Å; E136-C159 HydrophobicContact CG-CB 3.78Å; E136-C159 PolarHBondContact N-SG 2.83Å; E136-C159 VanDerWaalsContact N-SG 3.42Å; L157-C159 PolarHBondContact O-N 3.31Å; C159-K161 PolarHBondContact O-N 2.94Å; C159-F162 PolarHBondContact O-N 3.29Å; C159-F162 VanDerWaalsContact O-N 3.11Å
160D96.1Very high91.6Very high119 Ų11962.9 Ų62.964%0.63633%0.329SS*.G310 helixtrans-65.8-20.7174.8-61.1-35.1000112.6S158 F162S158-D160 PolarHBondContact O-N 3.21Å; D160-F162 PolarHBondContact O-N 2.64Å
161K93.8Very high92Very high109 Ų10966 Ų6647%0.47435%0.348SS..G310 helixtrans-75-10.4176-62.1178.7175.7174.90112.7E155 S158 C159E155-K161 WeakPolarHBondContact O-CE 3.01Å; E155-K161 PolarHBondContact O-NZ 2.76Å; E155-K161 IonicContact OE1-NZ 3.89Å; E155-K161 PolarHBondContact OE1-NZ 2.78Å; S158-K161 WeakPolarHBondContact O-CB 3.36Å; S158-K161 PolarHBondContact O-N 3.35Å; S158-K161 VanDerWaalsContact O-N 3.08Å; C159-K161 PolarHBondContact O-N 2.94Å
162F95.6Very high92.1Very high9 Ų966.1 Ų66.14%0.03935%0.35CS..SBendtrans-104.9148-174.9-59.8-47.2000112.6F114 L118 Y129 P130 R132 C135 C159 D160F114-F162 HydrophobicContact CE2-CD2 4.45Å; F114-F162 AromaticContact CE2-CE2 3.84Å; F114-F162 HydrophobicContact CE2-CE2 3.84Å; F114-F162 HydrophobicContact CE2-CZ 4.29Å; F114-F162 AromaticContact CZ-CE2 4Å; F114-F162 HydrophobicContact CZ-CE2 4Å; F114-F162 HydrophobicContact CZ-CZ 4.44Å; L118-F162 HydrophobicContact CD1-CE1 4.44Å; L118-F162 HydrophobicContact CD1-CZ 3.84Å; L118-F162 HydrophobicContact CD2-CE1 3.68Å; L118-F162 HydrophobicContact CD2-CZ 3.93Å; Y129-F162 HydrophobicContact CD1-CD1 4.02Å; Y129-F162 HydrophobicContact CD1-CE1 4.16Å; P130-F162 HydrophobicContact CG-CD1 3.86Å; P130-F162 HydrophobicContact CG-CD2 4.31Å; P130-F162 HydrophobicContact CG-CE1 3.89Å; P130-F162 HydrophobicContact CG-CE2 4.34Å; P130-F162 HydrophobicContact CG-CG 4.1Å; P130-F162 HydrophobicContact CG-CZ 4.15Å; P130-F162 WeakPolarHBondContact O-CB 3.37Å; R132-F162 PolarHBondContact NE-O 3.36Å; R132-F162 PolarHBondContact NH2-O 2.85Å; C135-F162 HydrophobicContact CB-CD2 3.56Å; C135-F162 HydrophobicContact CB-CE2 3.93Å; C135-F162 VanDerWaalsContact SG-CE2 3.54Å; C159-F162 PolarHBondContact O-N 3.29Å; C159-F162 VanDerWaalsContact O-N 3.11Å; D160-F162 PolarHBondContact O-N 2.64Å
163P94.9Very high91.8Very high30 Ų3068.2 Ų68.220%0.19535%0.353CS..  trans-63.6153.2179.827.4-36.4000112.1R132 D167 C169R132-P163 WeakPolarHBondContact CB-O 3.23Å; R132-P163 PolarHBondContact N-O 3.45Å; P163-D167 HydrophobicContact CB-CB 4.07Å; P163-C169 HydrophobicContact CB-CB 4.49Å; P163-C169 HydrophobicContact CG-CB 3.59Å
164I92.4Very high91Very high88 Ų8870.3 Ų70.345%0.45136%0.364SS..  trans-73.2149.2171.4-60.6171.9000108N166 D167I164-N166 PolarHBondContact O-N 2.56Å; I164-D167 PolarHBondContact O-N 3.5Å
165D87.3Confident89.3Confident72 Ų7274.2 Ų74.239%0.38540%0.397SS..THydrogen-bonded Turntrans-54.7-9.7-175.9-64.9-111.1000116.6C131 S133C131-D165 WeakPolarHBondContact CB-OD1 3.1Å; S133-D165 VanDerWaalsContact CB-OD1 3.3Å; S133-D165 WeakPolarHBondContact CB-OD1 2.9Å; S133-D165 VanDerWaalsContact CB-OD2 3.3Å; S133-D165 WeakPolarHBondContact CB-OD2 3.22Å; S133-D165 PolarHBondContact N-OD2 2.88Å; S133-D165 VanDerWaalsContact OG-CG 3.27Å; S133-D165 PolarHBondContact OG-OD1 3.01Å; S133-D165 PolarHBondContact OG-OD2 3.18Å
166N79.1Confident87.4Confident157 Ų15770.3 Ų70.384%0.8440%0.396SS*.THydrogen-bonded Turntrans-81.3-14.5175-65.1-24.2000113.3I164I164-N166 PolarHBondContact O-N 2.56Å
167D82.4Confident85.4Confident107 Ų10771.5 Ų71.557%0.57240%0.404SS*.SBendtrans-94.1170176.5-65.2-42.5000111.6P163 I164 C169P163-D167 HydrophobicContact CB-CB 4.07Å; I164-D167 PolarHBondContact O-N 3.5Å; D167-C169 PolarHBondContact O-N 3.4Å; D167-C169 PolarHBondContact O-SG 3.25Å; D167-C169 VanDerWaalsContact O-SG 3.41Å
168L90.9Very high83.2Confident147 Ų14778.6 Ų78.677%0.7744%0.437SS*.SBendtrans-66.1100.6173.2179.666.3000110.5
169C95.1Very high80.9Confident17 Ų1778 Ų7812%0.11543%0.433CS..  trans-146.5167.2177.5590000111.9Y129 C131 P163 D167 P171Y129-C169 CarbonylContact O-C 3.36Å; Y129-C169 VanDerWaalsContact O-CA 3.24Å; Y129-C169 WeakPolarHBondContact O-CA 3.18Å; Y129-C169 VanDerWaalsContact O-CB 3.28Å; Y129-C169 WeakPolarHBondContact O-CB 3.22Å; C131-C169 WeakPolarHBondContact CA-SG 3.34Å; C131-C169 HydrophobicContact CB-CB 3.98Å; C131-C169 WeakPolarHBondContact CB-SG 3.45Å; C131-C169 WeakPolarHBondContact SG-CB 3.48Å; C131-C169 CovalentContact SG-SG 2.03Å; C131-C169 PolarHBondContact SG-SG 2.94Å; P163-C169 HydrophobicContact CB-CB 4.49Å; P163-C169 HydrophobicContact CG-CB 3.59Å; D167-C169 PolarHBondContact O-N 3.4Å; D167-C169 PolarHBondContact O-SG 3.25Å; D167-C169 VanDerWaalsContact O-SG 3.41Å; C169-P171 VanDerWaalsContact O-CD 3.26Å; C169-P171 WeakPolarHBondContact O-CD 3.3Å
170I94.4Very high78.3Confident43 Ų4384 Ų8422%0.22147%0.47CS..BIsolated β-bridgetrans-81.4111.3176.9-59.1159000108.4V113 I128 Y129 C131 L134V113-I170 HydrophobicContact CG1-CG2 4.27Å; I128-I170 HydrophobicContact CG2-CD1 4.45Å; I128-I170 HydrophobicContact CG2-CG1 3.89Å; Y129-I170 PolarHBondContact O-N 3.45Å; C131-I170 PolarHBondContact N-O 3.21Å; C131-I170 PolarHBondContact SG-O 3.46Å; L134-I170 HydrophobicContact CD2-CG2 4.25Å; L134-I170 WeakPolarHBondContact CD2-O 3.19Å
171P93Very high75.7Confident74 Ų7485 Ų8548%0.48147%0.471SS..  trans-78168.6-177.234.5-36.7000111.3C169 Q173C169-P171 VanDerWaalsContact O-CD 3.26Å; C169-P171 WeakPolarHBondContact O-CD 3.3Å; P171-Q173 PolarHBondContact O-N 3.07Å
172M89.9Confident73.3Confident48 Ų4882.2 Ų82.224%0.23646%0.464CS..  trans-65.3127.5170.2-166.3-175.6-46.900110.4D110 S133 L134 A137 A175D110-M172 VanDerWaalsContact OD2-CG 3.29Å; D110-M172 WeakPolarHBondContact OD2-CG 3.32Å; S133-M172 WeakPolarHBondContact O-CE 3.41Å; L134-M172 HydrophobicContact CB-CB 4.39Å; L134-M172 HydrophobicContact CD1-CB 4.47Å; L134-M172 HydrophobicContact CD1-CG 4.39Å; A137-M172 HydrophobicContact CB-CE 3.29Å; A137-M172 HydrophobicContact CB-SD 3.99Å; M172-A175 HydrophobicContact SD-CB 4.48Å
173Q84Confident70.9Confident117 Ų11787.4 Ų87.455%0.54750%0.499SS..SBendtrans-85.4-28.4179.8-56.1-177.42.100111.4D110 P171D110-Q173 WeakPolarHBondContact OD1-CB 3.3Å; D110-Q173 PolarHBondContact OD1-N 3.48Å; P171-Q173 PolarHBondContact O-N 3.07Å
174F74.9Confident68.8Low86 Ų8690.3 Ų90.338%0.37752%0.516SS..  trans-115.760.7-175.6-60.3-75.2000112.3A109 D110 G176 N177A109-F174 HydrophobicContact CB-CB 4.15Å; A109-F174 HydrophobicContact CB-CD2 3.68Å; A109-F174 HydrophobicContact CB-CE2 4.32Å; A109-F174 HydrophobicContact CB-CG 3.96Å; D110-F174 VanDerWaalsContact OD1-CD2 3.25Å; D110-F174 WeakPolarHBondContact OD1-CD2 3.21Å; D110-F174 PolarHBondContact OD2-N 3.49Å; F174-G176 PolarHBondContact O-N 2.86Å; F174-N177 HydrophobicContact CB-CB 4.26Å; F174-N177 PolarHBondContact O-N 3.45Å
175A58Low67Low91 Ų9188.1 Ų88.175%0.75251%0.508SS*.THydrogen-bonded Turntrans-61.21.4-176.100000116.8M172M172-A175 HydrophobicContact SD-CB 4.48Å
176G53.1Low66.2Low67 Ų6793.2 Ų93.269%0.69153%0.527SS*.THydrogen-bonded Turntrans-144.4-0.5178.200000114.7F174F174-G176 PolarHBondContact O-N 2.86Å
177N49.2Very low66.4Low86 Ų8687.8 Ų87.846%0.4650%0.499SS..  trans-106.888.7171.3-65.3-26000106.6F174 A179F174-N177 HydrophobicContact CB-CB 4.26Å; F174-N177 PolarHBondContact O-N 3.45Å; N177-A179 PolarHBondContact O-N 3.48Å
178H50.4Low66.5Low149 Ų14982.7 Ų82.769%0.6947%0.472SS*.SBendtrans-45.2106.8134.8-66.9-68.8000103.5T180H178-T180 PolarHBondContact O-N 2.89Å
179A46.4Very low66.2Low20 Ų2077.6 Ų77.617%0.16545%0.448CS..  trans-36.5115.2-175.600000106.2A109 N177 Q181A109-A179 HydrophobicContact CB-CB 4.09Å; N177-A179 PolarHBondContact O-N 3.48Å; A179-Q181 VanDerWaalsContact C-N 3.28Å; A179-Q181 WeakPolarHBondContact O-CA 3.24Å; A179-Q181 PolarHBondContact O-N 3.13Å
180T43.2Very low65.8Low127 Ų12776.8 Ų76.878%0.77944%0.442SS*.  trans-36.5101-170.9-510000106.2H178 P182H178-T180 PolarHBondContact O-N 2.89Å; T180-P182 WeakPolarHBondContact O-CA 3.33Å; T180-P182 WeakPolarHBondContact O-CD 3.35Å
181Q41.8Very low65.5Low140 Ų14075.1 Ų75.165%0.65444%0.435SS*.  trans-42.3107.2-153-93-171.9-1.400106.4A179 P183 V184A179-Q181 VanDerWaalsContact C-N 3.28Å; A179-Q181 WeakPolarHBondContact O-CA 3.24Å; A179-Q181 PolarHBondContact O-N 3.13Å; Q181-P183 VanDerWaalsContact C-N 3.35Å; Q181-P183 WeakPolarHBondContact O-CA 3.48Å; Q181-V184 HydrophobicContact CB-CG2 4.05Å; Q181-V184 HydrophobicContact CG-CG2 4.05Å
182P43.3Very low65Low51 Ų5175.1 Ų75.133%0.33143%0.431SS..  trans-57.7111.3-175.618.1-27.9000102.5R106 T180 V184R106-P182 HydrophobicContact CB-CG 3.87Å; R106-P182 WeakPolarHBondContact O-CG 3.14Å; T180-P182 WeakPolarHBondContact O-CA 3.33Å; T180-P182 WeakPolarHBondContact O-CD 3.35Å; P182-V184 VanDerWaalsContact C-N 3.27Å; P182-V184 VanDerWaalsContact O-CA 3.26Å; P182-V184 WeakPolarHBondContact O-CA 3.22Å; P182-V184 PolarHBondContact O-N 3.41Å
183P44.8Very low64.5Low119 Ų11973.8 Ų73.877%0.77343%0.425SS*.  trans-42.1101-140.812.7-30.2000106Q181 S185Q181-P183 VanDerWaalsContact C-N 3.35Å; Q181-P183 WeakPolarHBondContact O-CA 3.48Å; P183-S185 VanDerWaalsContact C-N 3.29Å; P183-S185 WeakPolarHBondContact O-CA 3.25Å; P183-S185 PolarHBondContact O-N 3Å
184V51.3Low64.3Low91 Ų9173.5 Ų73.555%0.55242%0.423SS*.  trans-50.5113-169.5176.50000101.6Q181 P182 K186Q181-V184 HydrophobicContact CB-CG2 4.05Å; Q181-V184 HydrophobicContact CG-CG2 4.05Å; P182-V184 VanDerWaalsContact C-N 3.27Å; P182-V184 VanDerWaalsContact O-CA 3.26Å; P182-V184 WeakPolarHBondContact O-CA 3.22Å; P182-V184 PolarHBondContact O-N 3.41Å; V184-K186 PolarHBondContact O-N 3.16Å
185S54.9Low64.7Low41 Ų4173 Ų7329%0.28742%0.424SS..  trans-52.8120.9-169.154.50000102.6P183 V187 D192P183-S185 VanDerWaalsContact C-N 3.29Å; P183-S185 WeakPolarHBondContact O-CA 3.25Å; P183-S185 PolarHBondContact O-N 3Å; S185-V187 CarbonylContact O-C 3.59Å; S185-V187 PolarHBondContact O-N 3.45Å; S185-V187 PolarHBondContact OG-O 3.12Å; S185-D192 WeakPolarHBondContact CB-OD2 3.45Å; S185-D192 VanDerWaalsContact OG-CG 3.24Å; S185-D192 PolarHBondContact OG-OD2 3.06Å
186K70.1Confident66.2Low180 Ų18074 Ų7478%0.78341%0.411SS*.SBendtrans-54.8-23.4-172.7-66.7-178.4-179.8179.30108.4V184 C260 P261V184-K186 PolarHBondContact O-N 3.16Å; K186-C260 VanDerWaalsContact O-CA 3.3Å; K186-C260 WeakPolarHBondContact O-CA 3.33Å; K186-C260 VanDerWaalsContact O-CB 3.23Å; K186-C260 WeakPolarHBondContact O-CB 3.1Å; K186-P261 VanDerWaalsContact C-CG 3.44Å; K186-P261 HydrophobicContact CB-CG 3.82Å; K186-P261 WeakPolarHBondContact O-CD 3.37Å; K186-P261 VanDerWaalsContact O-CG 3.22Å; K186-P261 WeakPolarHBondContact O-CG 3.49Å
187V82.8Confident67.9Low42 Ų4272 Ų7226%0.25539%0.386SS..SBendtrans-61138172.8-169.50000112.8S185 C191 D192 P261S185-V187 CarbonylContact O-C 3.59Å; S185-V187 PolarHBondContact O-N 3.45Å; S185-V187 PolarHBondContact OG-O 3.12Å; V187-C191 HydrophobicContact CG1-CB 3.76Å; V187-D192 HydrophobicContact CB-CB 4.22Å; V187-D192 HydrophobicContact CG1-CB 4.02Å; V187-P261 CarbonylContact C-O 3.57Å; V187-P261 WeakPolarHBondContact CA-O 3.44Å
188C84.7Confident69.7Low0 Ų074 Ų740%040%0.396CS..  trans-59137.7175.8-55.20000111P190 C191 D192 R225 I254 C260 P261C188-P190 VanDerWaalsContact C-CD 3.47Å; C188-P190 VanDerWaalsContact C-N 3.31Å; C188-P190 VanDerWaalsContact O-N 3.13Å; C188-C191 HydrophobicContact CB-CB 4.29Å; C188-C191 WeakPolarHBondContact O-CA 3.38Å; C188-C191 WeakPolarHBondContact O-CB 3.35Å; C188-C191 PolarHBondContact O-N 2.83Å; C188-D192 PolarHBondContact O-N 3.48Å; C188-D192 VanDerWaalsContact O-N 3.09Å; C188-R225 PolarHBondContact SG-NH1 3.28Å; C188-R225 VanDerWaalsContact SG-NH1 3.45Å; C188-I254 HydrophobicContact CB-CG2 4.4Å; C188-C260 WeakPolarHBondContact CA-SG 3.28Å; C188-C260 HydrophobicContact CB-CB 3.95Å; C188-C260 WeakPolarHBondContact CB-SG 3.24Å; C188-C260 VanDerWaalsContact SG-C 3.55Å; C188-C260 WeakPolarHBondContact SG-CB 3.45Å; C188-C260 PolarHBondContact SG-O 2.51Å; C188-C260 CovalentContact SG-SG 2.02Å; C188-C260 PolarHBondContact SG-SG 2.03Å; C188-P261 PolarHBondContact N-O 3.3Å; C188-P261 PolarHBondContact SG-O 3.2Å; C188-P261 VanDerWaalsContact SG-O 3.37Å
189P84.8Confident71.4Confident40 Ų4069 Ų6926%0.2638%0.375SS..THydrogen-bonded Turntrans-53.5-36.1-178.4-26.133.1000115.2T148 Y149 C191T148-P189 HydrophobicContact CG2-CB 4.02Å; T148-P189 HydrophobicContact CG2-CG 3.99Å; Y149-P189 HydrophobicContact CE2-CB 4.07Å; Y149-P189 VanDerWaalsContact OH-CB 3.25Å; Y149-P189 WeakPolarHBondContact OH-CB 3.32Å; Y149-P189 PolarHBondContact OH-O 2.87Å; P189-C191 PolarHBondContact O-N 3.34Å
190P87.4Confident73.5Confident0 Ų068.1 Ų68.10%037%0.367CS..THydrogen-bonded Turntrans-68.9-17.1174.1-25.238000115.2T148 C188 N193 I254 L285 M286 S287 I288T148-P190 HydrophobicContact CG2-CG 4.16Å; C188-P190 VanDerWaalsContact C-CD 3.47Å; C188-P190 VanDerWaalsContact C-N 3.31Å; C188-P190 VanDerWaalsContact O-N 3.13Å; P190-N193 PolarHBondContact O-ND2 2.89Å; P190-I254 HydrophobicContact CG-CG2 4.08Å; P190-L285 HydrophobicContact CB-CD2 3.97Å; P190-L285 HydrophobicContact CB-CG 4.04Å; P190-L285 VanDerWaalsContact CG-O 3.23Å; P190-L285 WeakPolarHBondContact CG-O 3.27Å; P190-M286 VanDerWaalsContact CA-O 3.31Å; P190-M286 WeakPolarHBondContact CA-O 3.14Å; P190-M286 WeakPolarHBondContact CB-O 3.29Å; P190-S287 WeakPolarHBondContact O-CA 3.43Å; P190-I288 PolarHBondContact O-N 3.49Å
191C87.5Confident75.8Confident9 Ų962.7 Ų62.76%0.06133%0.334CS..THydrogen-bonded Turntrans-100.2-18.9-177.9-57.80000113.2V187 C188 P189 N193 C262 Q264V187-C191 HydrophobicContact CG1-CB 3.76Å; C188-C191 HydrophobicContact CB-CB 4.29Å; C188-C191 WeakPolarHBondContact O-CA 3.38Å; C188-C191 WeakPolarHBondContact O-CB 3.35Å; C188-C191 PolarHBondContact O-N 2.83Å; P189-C191 PolarHBondContact O-N 3.34Å; C191-N193 PolarHBondContact O-N 2.89Å; C191-C262 HydrophobicContact CB-CB 3.77Å; C191-C262 WeakPolarHBondContact CB-SG 3.37Å; C191-C262 WeakPolarHBondContact SG-CB 3.42Å; C191-C262 CovalentContact SG-SG 2.02Å; C191-C262 PolarHBondContact SG-SG 3.42Å; C191-Q264 PolarHBondContact O-NE2 3.46Å
192D83.5Confident77.9Confident74 Ų7461 Ų6140%0.39633%0.325SS..  trans-87.432-178-165.836.4000112.9S185 V187 C188S185-D192 WeakPolarHBondContact CB-OD2 3.45Å; S185-D192 VanDerWaalsContact OG-CG 3.24Å; S185-D192 PolarHBondContact OG-OD2 3.06Å; V187-D192 HydrophobicContact CB-CB 4.22Å; V187-D192 HydrophobicContact CG1-CB 4.02Å; C188-D192 PolarHBondContact O-N 3.48Å; C188-D192 VanDerWaalsContact O-N 3.09Å
193N78.3Confident80.1Confident20 Ų2059.7 Ų59.711%0.10732%0.315CS..  trans-100.6122.5-177.8-69.3-39.6000110.4P190 C191 H203 S287 H289P190-N193 PolarHBondContact O-ND2 2.89Å; C191-N193 PolarHBondContact O-N 2.89Å; N193-H203 PolarHBondContact OD1-CE1 2.92Å; N193-H203 VanDerWaalsContact OD1-CE1 3.25Å; N193-H203 PolarHBondContact OD1-NE2 3.4Å; N193-S287 VanDerWaalsContact ND2-CB 3.32Å; N193-S287 WeakPolarHBondContact ND2-CB 3.21Å; N193-S287 PolarHBondContact ND2-OG 3.29Å; N193-H289 PolarHBondContact O-CE1 3.34Å
194E80.1Confident82.4Confident110 Ų11055.1 Ų55.151%0.51428%0.283SS..  trans-61.4138.2173.3-60.5-175.6169.500110.9K196E194-K196 HydrophobicContact CB-CG 4.44Å; E194-K196 PolarHBondContact O-N 3.3Å; E194-K196 VanDerWaalsContact OE2-CD 3.3Å; E194-K196 WeakPolarHBondContact OE2-CD 3.34Å; E194-K196 WeakPolarHBondContact OE2-CE 3.34Å; E194-K196 IonicContact OE2-NZ 3.74Å; E194-K196 PolarHBondContact OE2-NZ 3.09Å
195L83.9Confident84.2Confident76 Ų7652.1 Ų52.140%0.39827%0.265SS..  trans-7652.2176.7-94.9154.1000112I200 H289 E297L195-I200 HydrophobicContact CD2-CD1 4.27Å; L195-H289 HydrophobicContact CD2-CB 4.06Å; L195-E297 VanDerWaalsContact O-CB 3.3Å; L195-E297 WeakPolarHBondContact O-CB 3.41Å; L195-E297 WeakPolarHBondContact O-CG 3.48Å
196K89.8Confident85.7Confident111 Ų11152.2 Ų52.248%0.48327%0.268SS..  trans-101.6144.6173.7-72.8179.8-179.5155.20110.4E194 D198 N199 I200E194-K196 HydrophobicContact CB-CG 4.44Å; E194-K196 PolarHBondContact O-N 3.3Å; E194-K196 VanDerWaalsContact OE2-CD 3.3Å; E194-K196 WeakPolarHBondContact OE2-CD 3.34Å; E194-K196 WeakPolarHBondContact OE2-CE 3.34Å; E194-K196 IonicContact OE2-NZ 3.74Å; E194-K196 PolarHBondContact OE2-NZ 3.09Å; K196-D198 VanDerWaalsContact C-N 3.3Å; K196-D198 PolarHBondContact O-N 3.1Å; K196-N199 HydrophobicContact CB-CB 4.48Å; K196-N199 PolarHBondContact O-N 2.84Å; K196-I200 WeakPolarHBondContact O-CG1 3.44Å; K196-I200 PolarHBondContact O-N 3.03Å
197T87.8Confident86.8Confident26 Ų2643.7 Ų43.716%0.1623%0.231CC..Hα-helixtrans-51.9-49.8178.7-62.20000111.9N199 I200 M201 F300 A301T197-N199 PolarHBondContact O-N 3.3Å; T197-I200 PolarHBondContact O-N 3.35Å; T197-I200 VanDerWaalsContact O-N 3.16Å; T197-M201 HydrophobicContact CG2-CG 4.24Å; T197-M201 WeakPolarHBondContact O-CG 3.4Å; T197-M201 PolarHBondContact O-N 3.42Å; T197-F300 HydrophobicContact CG2-CD1 3.42Å; T197-F300 VanDerWaalsContact CG2-CD1 3.42Å; T197-F300 HydrophobicContact CG2-CE1 3.79Å; T197-A301 HydrophobicContact CG2-CB 4.38Å
198D86.4Confident87.2Confident127 Ų12743.5 Ų43.568%0.67923%0.229SC*.Hα-helixtrans-62.8-46.2-172.9-57.2-20.9000110.8K196 I200 M201 E202K196-D198 VanDerWaalsContact C-N 3.3Å; K196-D198 PolarHBondContact O-N 3.1Å; D198-I200 VanDerWaalsContact C-N 3.34Å; D198-I200 PolarHBondContact O-N 3.49Å; D198-M201 PolarHBondContact O-N 3.33Å; D198-M201 VanDerWaalsContact O-N 3.13Å; D198-E202 PolarHBondContact O-N 3.43Å
199N86.9Confident87.7Confident46 Ų4643.5 Ų43.525%0.24623%0.229CC..Hα-helixtrans-61.8-40.5175.5-63.5-2.7000112K196 T197 M201 E202 H203K196-N199 HydrophobicContact CB-CB 4.48Å; K196-N199 PolarHBondContact O-N 2.84Å; T197-N199 PolarHBondContact O-N 3.3Å; N199-M201 VanDerWaalsContact C-N 3.29Å; N199-M201 PolarHBondContact O-N 3.14Å; N199-E202 PolarHBondContact O-N 3.17Å; N199-H203 PolarHBondContact O-N 3.36Å; N199-H203 VanDerWaalsContact O-N 3.07Å; N199-H203 PolarHBondContact O-ND1 3Å
200I91.1Very high88.2Confident0 Ų041.6 Ų41.60%022%0.216CC..Hα-helixtrans-64.2-39.1176.9-67.3166.9000110.2L195 K196 T197 D198 Y204 L273 M275 A301 M305L195-I200 HydrophobicContact CD2-CD1 4.27Å; K196-I200 WeakPolarHBondContact O-CG1 3.44Å; K196-I200 PolarHBondContact O-N 3.03Å; T197-I200 PolarHBondContact O-N 3.35Å; T197-I200 VanDerWaalsContact O-N 3.16Å; D198-I200 VanDerWaalsContact C-N 3.34Å; D198-I200 PolarHBondContact O-N 3.49Å; I200-Y204 VanDerWaalsContact O-CB 3.29Å; I200-Y204 WeakPolarHBondContact O-CB 3.36Å; I200-Y204 PolarHBondContact O-N 3.28Å; I200-L273 HydrophobicContact CG2-CD2 4.21Å; I200-M275 HydrophobicContact CG2-CE 3.57Å; I200-A301 HydrophobicContact CB-CB 4.03Å; I200-A301 HydrophobicContact CD1-CB 4.19Å; I200-A301 HydrophobicContact CG2-CB 3.58Å; I200-M305 HydrophobicContact CG2-CE 3.29Å
201M90.3Very high88.6Confident14 Ų1441.6 Ų41.67%0.06922%0.216CC..Hα-helixtrans-71.8-38.8179.2-70.6-54.6-5100112.5T197 D198 N199 Y204 C205 A301 Y304 M305 H308T197-M201 HydrophobicContact CG2-CG 4.24Å; T197-M201 WeakPolarHBondContact O-CG 3.4Å; T197-M201 PolarHBondContact O-N 3.42Å; D198-M201 PolarHBondContact O-N 3.33Å; D198-M201 VanDerWaalsContact O-N 3.13Å; N199-M201 VanDerWaalsContact C-N 3.29Å; N199-M201 PolarHBondContact O-N 3.14Å; M201-Y204 HydrophobicContact CE-CD1 3.79Å; M201-Y204 HydrophobicContact CE-CE1 4.37Å; M201-Y204 HydrophobicContact CE-CG 4.45Å; M201-Y204 WeakPolarHBondContact O-CB 3.37Å; M201-Y204 PolarHBondContact O-N 2.8Å; M201-C205 PolarHBondContact O-N 2.89Å; M201-C205 PolarHBondContact O-SG 2.91Å; M201-A301 HydrophobicContact SD-CB 4.47Å; M201-Y304 HydrophobicContact CE-CD1 3.51Å; M201-Y304 HydrophobicContact CE-CE1 4.08Å; M201-Y304 HydrophobicContact CE-CG 4.48Å; M201-Y304 HydrophobicContact CG-CD1 3.84Å; M201-Y304 HydrophobicContact CG-CE1 4.48Å; M201-Y304 HydrophobicContact SD-CD1 3.7Å; M201-Y304 HydrophobicContact SD-CG 4.44Å; M201-M305 HydrophobicContact CE-CG 4.23Å; M201-M305 HydrophobicContact SD-CE 4.38Å; M201-M305 HydrophobicContact SD-CG 3.74Å; M201-H308 HydrophobicContact CE-CB 4.12Å
202E86.6Confident89Confident103 Ų10343.1 Ų43.148%0.48122%0.222SC..Hα-helixtrans-58.3-50.7172.9-173.8177.3-172.100110.8D198 N199 Y204 C205 A206D198-E202 PolarHBondContact O-N 3.43Å; N199-E202 PolarHBondContact O-N 3.17Å; E202-Y204 VanDerWaalsContact C-N 3.33Å; E202-Y204 PolarHBondContact O-N 3.4Å; E202-C205 PolarHBondContact O-N 3.39Å; E202-A206 WeakPolarHBondContact O-CB 3.45Å; E202-A206 PolarHBondContact O-N 3.39Å
203H89.7Confident89.5Confident24 Ų2439.8 Ų39.811%0.11120%0.204CC..Hα-helixtrans-63.2-37.1175.4-69.7113000112.8N193 N199 C205 A206 S207 M275N193-H203 PolarHBondContact OD1-CE1 2.92Å; N193-H203 VanDerWaalsContact OD1-CE1 3.25Å; N193-H203 PolarHBondContact OD1-NE2 3.4Å; N199-H203 PolarHBondContact O-N 3.36Å; N199-H203 VanDerWaalsContact O-N 3.07Å; N199-H203 PolarHBondContact O-ND1 3Å; H203-C205 VanDerWaalsContact C-N 3.3Å; H203-C205 PolarHBondContact O-N 3.21Å; H203-A206 PolarHBondContact O-N 2.83Å; H203-S207 WeakPolarHBondContact O-CB 3.42Å; H203-S207 PolarHBondContact O-N 2.7Å; H203-S207 PolarHBondContact O-OG 2.05Å; H203-M275 VanDerWaalsContact C-SD 3.59Å; H203-M275 HydrophobicContact CB-SD 3.54Å; H203-M275 VanDerWaalsContact CB-SD 3.54Å
204Y91.9Very high90.2Very high24 Ų2442.3 Ų42.39%0.09421%0.214CC..Hα-helixtrans-61.7-40176.1169.8-96.4000111.8I200 M201 E202 V210 K238 M275 M305 C310I200-Y204 VanDerWaalsContact O-CB 3.29Å; I200-Y204 WeakPolarHBondContact O-CB 3.36Å; I200-Y204 PolarHBondContact O-N 3.28Å; M201-Y204 HydrophobicContact CE-CD1 3.79Å; M201-Y204 HydrophobicContact CE-CE1 4.37Å; M201-Y204 HydrophobicContact CE-CG 4.45Å; M201-Y204 WeakPolarHBondContact O-CB 3.37Å; M201-Y204 PolarHBondContact O-N 2.8Å; E202-Y204 VanDerWaalsContact C-N 3.33Å; E202-Y204 PolarHBondContact O-N 3.4Å; Y204-V210 HydrophobicContact CD2-CB 4.32Å; Y204-V210 HydrophobicContact CD2-CG1 4.45Å; Y204-V210 HydrophobicContact CD2-CG2 3.73Å; Y204-V210 HydrophobicContact CE2-CG2 4.24Å; Y204-K238 HydrophobicContact CE2-CB 3.98Å; Y204-K238 HydrophobicContact CE2-CD 4.05Å; Y204-K238 HydrophobicContact CE2-CG 4.47Å; Y204-K238 PolarHBondContact O-NZ 2.94Å; Y204-M275 PolarHBondContact N-SD 3.43Å; Y204-M275 VanDerWaalsContact N-SD 3.41Å; Y204-M305 HydrophobicContact CD1-CG 4.1Å; Y204-M305 HydrophobicContact CD2-CB 4.2Å; Y204-M305 HydrophobicContact CD2-CE 4.19Å; Y204-M305 HydrophobicContact CD2-CG 3.53Å; Y204-M305 HydrophobicContact CD2-SD 3.7Å; Y204-M305 HydrophobicContact CE1-CB 4.32Å; Y204-M305 HydrophobicContact CE1-CG 4.26Å; Y204-M305 HydrophobicContact CE2-CB 3.88Å; Y204-M305 HydrophobicContact CE2-CG 3.75Å; Y204-M305 HydrophobicContact CE2-SD 4.11Å; Y204-M305 HydrophobicContact CG-CE 4.37Å; Y204-M305 HydrophobicContact CG-CG 3.75Å; Y204-M305 HydrophobicContact CG-SD 4.32Å; Y204-M305 PolarHBondContact OH-O 3.42Å; Y204-M305 VanDerWaalsContact OH-O 3.11Å; Y204-C310 VanDerWaalsContact CD1-SG 3.56Å; Y204-C310 VanDerWaalsContact CE1-SG 3.59Å
205C89.3Confident90.9Very high28 Ų2837.2 Ų37.219%0.18919%0.19CC..Hα-helixtrans-73.9-40.2178.6-70.20000112.7M201 E202 H203 S207 C310M201-C205 PolarHBondContact O-N 2.89Å; M201-C205 PolarHBondContact O-SG 2.91Å; E202-C205 PolarHBondContact O-N 3.39Å; H203-C205 VanDerWaalsContact C-N 3.3Å; H203-C205 PolarHBondContact O-N 3.21Å; C205-S207 VanDerWaalsContact C-N 3.31Å; C205-S207 PolarHBondContact O-N 2.81Å; C205-C310 WeakPolarHBondContact CA-SG 3.38Å; C205-C310 HydrophobicContact CB-CB 3.57Å; C205-C310 WeakPolarHBondContact CB-SG 3.29Å; C205-C310 VanDerWaalsContact SG-CA 3.56Å; C205-C310 WeakPolarHBondContact SG-CB 3.3Å; C205-C310 CovalentContact SG-SG 2.05Å; C205-C310 PolarHBondContact SG-SG 3.03Å
206A87.6Confident91.4Very high42 Ų4240 Ų4035%0.34720%0.2SC..Hα-helixtrans-71.7-21.4176.900000114.3E202 H203 R277 M286E202-A206 WeakPolarHBondContact O-CB 3.45Å; E202-A206 PolarHBondContact O-N 3.39Å; H203-A206 PolarHBondContact O-N 2.83Å; A206-R277 WeakPolarHBondContact O-CD 3.28Å; A206-M286 HydrophobicContact CB-CE 3.95Å
207S92Very high91.6Very high1 Ų137.5 Ų37.51%0.00719%0.189CC..  trans-86.7141.4-176.3-64.40000113H203 C205 K238 M275 G276H203-S207 WeakPolarHBondContact O-CB 3.42Å; H203-S207 PolarHBondContact O-N 2.7Å; H203-S207 PolarHBondContact O-OG 2.05Å; C205-S207 VanDerWaalsContact C-N 3.31Å; C205-S207 PolarHBondContact O-N 2.81Å; S207-K238 WeakPolarHBondContact O-CE 3.3Å; S207-K238 PolarHBondContact O-NZ 2.82Å; S207-M275 VanDerWaalsContact OG-CB 3.28Å; S207-M275 WeakPolarHBondContact OG-CB 3.01Å; S207-G276 WeakPolarHBondContact CB-O 3.12Å
208D92.6Very high91.8Very high38 Ų3838.6 Ų38.620%0.20320%0.196CC..SBendtrans-72.3-36.3175.3-54.4-32.3000111.2G240 V241 G276 R277 K278D208-G240 VanDerWaalsContact O-CA 3.3Å; D208-G240 WeakPolarHBondContact O-CA 3.4Å; D208-V241 HydrophobicContact CB-CG2 3.87Å; D208-G276 PolarHBondContact N-O 3.43Å; D208-R277 HydrophobicContact CB-CG 4.46Å; D208-R277 IonicContact OD1-NE 2.85Å; D208-R277 WeakPolarHBondContact OD2-CA 3.42Å; D208-R277 VanDerWaalsContact OD2-CB 3.3Å; D208-R277 WeakPolarHBondContact OD2-CB 3.48Å; D208-R277 IonicContact OD2-NE 2.81Å; D208-K278 PolarHBondContact OD2-N 3.41Å
209F94Very high92.1Very high0 Ų037.1 Ų37.10%018%0.183CC..EExtended strand (participates in β ladder)trans-136.4151.6-17966.1-96.6000112.7L211 K238 L242 L252 G276 L283F209-L211 HydrophobicContact CD2-CD1 4.08Å; F209-L211 HydrophobicContact CD2-CG 4.09Å; F209-L211 HydrophobicContact CE2-CD1 4.33Å; F209-K238 WeakPolarHBondContact CA-O 3.43Å; F209-L242 HydrophobicContact CB-CD1 3.4Å; F209-L242 VanDerWaalsContact CB-CD1 3.4Å; F209-L242 HydrophobicContact CB-CD2 4.47Å; F209-L242 HydrophobicContact CB-CG 3.61Å; F209-L242 HydrophobicContact CD1-CD1 4.05Å; F209-L242 HydrophobicContact CD1-CD2 3.76Å; F209-L242 HydrophobicContact CD1-CG 3.84Å; F209-L242 HydrophobicContact CD2-CD1 3.8Å; F209-L242 HydrophobicContact CD2-CG 4.49Å; F209-L242 HydrophobicContact CE1-CD2 4.16Å; F209-L242 HydrophobicContact CG-CD1 3.47Å; F209-L242 VanDerWaalsContact CG-CD1 3.47Å; F209-L242 HydrophobicContact CG-CD2 4.08Å; F209-L242 HydrophobicContact CG-CG 3.73Å; F209-L252 HydrophobicContact CE2-CD2 3.82Å; F209-L252 HydrophobicContact CZ-CD2 3.56Å; F209-G276 WeakPolarHBondContact CD1-O 3.36Å; F209-G276 VanDerWaalsContact CE1-C 3.42Å; F209-G276 PolarHBondContact N-O 3.34Å; F209-G276 PolarHBondContact O-N 3.07Å; F209-G276 VanDerWaalsContact O-N 3.08Å; F209-L283 HydrophobicContact CE1-CB 4.28Å; F209-L283 HydrophobicContact CE1-CD2 3.9Å; F209-L283 HydrophobicContact CZ-CB 4.06Å; F209-L283 HydrophobicContact CZ-CD2 4.4Å
210V95.8Very high92.4Very high0 Ų041.5 Ų41.50%020%0.2CC..EExtended strand (participates in β ladder)trans-139.3125.8179-177.90000110Y204 L237 K238 L273 I274 M275Y204-V210 HydrophobicContact CD2-CB 4.32Å; Y204-V210 HydrophobicContact CD2-CG1 4.45Å; Y204-V210 HydrophobicContact CD2-CG2 3.73Å; Y204-V210 HydrophobicContact CE2-CG2 4.24Å; V210-L237 HydrophobicContact CB-CB 4.27Å; V210-L237 HydrophobicContact CG1-CB 4.01Å; V210-L237 HydrophobicContact CG1-CD1 4.1Å; V210-L237 PolarHBondContact O-N 3.21Å; V210-K238 HydrophobicContact CB-CB 3.76Å; V210-K238 HydrophobicContact CG2-CB 3.95Å; V210-K238 HydrophobicContact CG2-CD 4.2Å; V210-K238 PolarHBondContact N-O 3.23Å; V210-K238 PolarHBondContact O-N 3.17Å; V210-L273 HydrophobicContact CG1-CD1 3.6Å; V210-I274 CarbonylContact C-O 3.54Å; V210-I274 WeakPolarHBondContact CA-O 3.35Å; V210-M275 HydrophobicContact CG1-CE 4.39Å; V210-M275 HydrophobicContact CG1-CG 4.03Å; V210-M275 HydrophobicContact CG2-CB 4.19Å; V210-M275 HydrophobicContact CG2-CG 3.99Å; V210-M275 HydrophobicContact CG2-SD 4.46Å
211L95.6Very high92.3Very high0 Ų045.3 Ų45.30%022%0.218CC..EExtended strand (participates in β ladder)trans-131.1146.6-172.4-58.1175.7000110.7F209 V236 L242 L247 L250 I274F209-L211 HydrophobicContact CD2-CD1 4.08Å; F209-L211 HydrophobicContact CD2-CG 4.09Å; F209-L211 HydrophobicContact CE2-CD1 4.33Å; L211-V236 HydrophobicContact CD2-CB 4.04Å; L211-V236 HydrophobicContact CD2-CG1 3.98Å; L211-V236 HydrophobicContact CD2-CG2 3.73Å; L211-L242 HydrophobicContact CD1-CD1 4.19Å; L211-L242 HydrophobicContact CD2-CD1 4.31Å; L211-L247 HydrophobicContact CD1-CD2 4.43Å; L211-L247 HydrophobicContact CD2-CD2 4.18Å; L211-L250 HydrophobicContact CD1-CD1 4.15Å; L211-L250 HydrophobicContact CD1-CD2 3.44Å; L211-L250 VanDerWaalsContact CD1-CD2 3.44Å; L211-L250 HydrophobicContact CD1-CG 4.47Å; L211-I274 PolarHBondContact N-O 3.2Å; L211-I274 PolarHBondContact O-N 3.4Å
212K95.3Very high92Very high41 Ų4154 Ų5418%0.17826%0.256CS..EExtended strand (participates in β ladder)trans-106.5118.1160.1174.1-167.9-174.5169.60109.1K235 N271 F272 W291K212-K235 HydrophobicContact CB-CB 4.17Å; K212-K235 PolarHBondContact N-O 3.07Å; K212-K235 PolarHBondContact O-N 3.17Å; K212-N271 HydrophobicContact CG-CB 4.27Å; K212-F272 VanDerWaalsContact CA-O 3.3Å; K212-F272 WeakPolarHBondContact CA-O 2.97Å; K212-W291 HydrophobicContact CB-CE3 4.03Å; K212-W291 HydrophobicContact CB-CH2 4.38Å; K212-W291 HydrophobicContact CB-CZ3 3.74Å; K212-W291 HydrophobicContact CD-CD2 3.75Å; K212-W291 HydrophobicContact CD-CE3 3.66Å; K212-W291 HydrophobicContact CD-CH2 3.63Å; K212-W291 HydrophobicContact CD-CZ2 3.74Å; K212-W291 HydrophobicContact CD-CZ3 3.6Å; K212-W291 VanDerWaalsContact CE-CD2 3.42Å; K212-W291 HydrophobicContact CG-CD2 4Å; K212-W291 HydrophobicContact CG-CE3 3.55Å; K212-W291 HydrophobicContact CG-CH2 4.25Å; K212-W291 HydrophobicContact CG-CZ3 3.7Å
213M94.8Very high91.9Very high4 Ų451.1 Ų51.12%0.0225%0.253CS..EExtended strand (participates in β ladder)trans-155.9169.4178.764.6168.4-16700113.1A229 K234 L250 L252 N271 F272 I274M213-A229 HydrophobicContact CE-CB 3.82Å; M213-A229 HydrophobicContact SD-CB 3.43Å; M213-A229 WeakPolarHBondContact SD-CB 3.22Å; M213-K234 HydrophobicContact CB-CB 4.17Å; M213-K234 HydrophobicContact CB-CD 4.39Å; M213-K234 HydrophobicContact CB-CG 4Å; M213-K234 HydrophobicContact SD-CD 3.95Å; M213-L250 HydrophobicContact CE-CD2 3.53Å; M213-L250 HydrophobicContact SD-CD2 3.35Å; M213-L250 WeakPolarHBondContact SD-CD2 3.3Å; M213-L252 HydrophobicContact CE-CD1 3.49Å; M213-L252 VanDerWaalsContact CE-CD1 3.49Å; M213-N271 CarbonylContact O-C 3.55Å; M213-N271 WeakPolarHBondContact O-CA 3.39Å; M213-F272 PolarHBondContact N-O 2.81Å; M213-F272 VanDerWaalsContact N-O 3.11Å; M213-F272 PolarHBondContact O-N 3.35Å; M213-I274 HydrophobicContact CE-CD1 3.23Å; M213-I274 HydrophobicContact CG-CD1 3.73Å; M213-I274 HydrophobicContact SD-CD1 4.31Å
214K93.9Very high91.8Very high74 Ų7450.8 Ų50.832%0.32225%0.252SS..  trans-97.4140.5170.7-174.2166.7-177.4166.70109.8A230 L268 G269K214-A230 HydrophobicContact CB-CB 4.14Å; K214-A230 HydrophobicContact CG-CB 4.48Å; K214-A230 WeakPolarHBondContact O-CB 3.06Å; K214-A230 PolarHBondContact O-N 2.86Å; K214-L268 WeakPolarHBondContact CE-O 3.4Å; K214-G269 VanDerWaalsContact CE-O 3.29Å; K214-G269 WeakPolarHBondContact CE-O 3.42Å; K214-G269 PolarHBondContact NZ-O 3.39Å
215I94.9Very high91.8Very high2 Ų250.8 Ų50.81%0.0125%0.252CS..EExtended strand (participates in β ladder)trans-90134.1174.3-63.8163.1000107.7V218 L227 L265 L268 F272 I274 I288I215-V218 HydrophobicContact CG2-CG2 3.96Å; I215-L227 HydrophobicContact CD1-CD2 3.84Å; I215-L265 HydrophobicContact CD1-CD2 3.43Å; I215-L265 VanDerWaalsContact CD1-CD2 3.43Å; I215-L268 HydrophobicContact CB-CD2 4.09Å; I215-L268 HydrophobicContact CG2-CD1 4.32Å; I215-L268 HydrophobicContact CG2-CD2 3.95Å; I215-F272 HydrophobicContact CB-CE2 4.46Å; I215-F272 HydrophobicContact CD1-CD2 3.79Å; I215-F272 HydrophobicContact CD1-CE2 4.08Å; I215-F272 HydrophobicContact CD1-CG 4.16Å; I215-F272 HydrophobicContact CG1-CD2 4.05Å; I215-F272 HydrophobicContact CG1-CE2 4.42Å; I215-I274 HydrophobicContact CD1-CD1 4.25Å; I215-I274 HydrophobicContact CG1-CD1 4.26Å; I215-I288 HydrophobicContact CD1-CD1 3.67Å
216K93.9Very high92Very high136 Ų13651.2 Ų51.259%0.59125%0.251SS*.EExtended strand (participates in β ladder)trans-84.5-50.8178.1179.7-176.4176.4-172.80110.7I228 A230K216-I228 PolarHBondContact N-O 3.39Å; K216-A230 HydrophobicContact CB-CB 4.42Å
217E93.1Very high92.3Very high58 Ų5849.2 Ų49.227%0.27123%0.234SC..EExtended strand (participates in β ladder)trans-151.8152.9-17359.8178.8-178.500110.4K219 I228E217-K219 VanDerWaalsContact CD-CE 3.41Å; E217-K219 IonicContact OE1-NZ 2.97Å; E217-K219 PolarHBondContact OE1-NZ 3.38Å; E217-K219 WeakPolarHBondContact OE2-CE 3.32Å; E217-K219 IonicContact OE2-NZ 2.69Å; E217-K219 PolarHBondContact OE2-NZ 2.03Å; E217-I228 HydrophobicContact CG-CB 3.66Å; E217-I228 HydrophobicContact CG-CD1 3.81Å; E217-I228 HydrophobicContact CG-CG1 4.19Å; E217-I228 HydrophobicContact CG-CG2 4.16Å; E217-I228 PolarHBondContact O-N 3.11Å; E217-I228 WeakPolarHBondContact OE1-CD1 3.48Å
218V93.3Very high92.4Very high49 Ų4950.7 Ų50.730%0.29724%0.241SC..EExtended strand (participates in β ladder)trans-123.3127.8175.6-177.40000107.6I215 R225 K226 L227 L265 L268I215-V218 HydrophobicContact CG2-CG2 3.96Å; V218-R225 HydrophobicContact CG1-CG 3.42Å; V218-R225 VanDerWaalsContact CG1-CG 3.42Å; V218-K226 CarbonylContact C-O 3.53Å; V218-K226 VanDerWaalsContact CA-O 3.31Å; V218-K226 WeakPolarHBondContact CA-O 3.5Å; V218-L227 HydrophobicContact CG2-CG 4.33Å; V218-L265 HydrophobicContact CG2-CD1 4.45Å; V218-L265 HydrophobicContact CG2-CD2 4.38Å; V218-L268 HydrophobicContact CG2-CD1 4.26Å; V218-L268 HydrophobicContact CG2-CD2 4.06Å
219K92.8Very high92.4Very high95 Ų9549 Ų4941%0.41323%0.233SC..EExtended strand (participates in β ladder)trans-125.4151.9-177.2-71175.9172.61600110E217 R225 K226 I228E217-K219 VanDerWaalsContact CD-CE 3.41Å; E217-K219 IonicContact OE1-NZ 2.97Å; E217-K219 PolarHBondContact OE1-NZ 3.38Å; E217-K219 WeakPolarHBondContact OE2-CE 3.32Å; E217-K219 IonicContact OE2-NZ 2.69Å; E217-K219 PolarHBondContact OE2-NZ 2.03Å; K219-R225 CarbonylContact O-C 3.54Å; K219-R225 WeakPolarHBondContact O-CA 3.01Å; K219-K226 HydrophobicContact CB-CB 4.42Å; K219-K226 PolarHBondContact N-O 3.03Å; K219-K226 PolarHBondContact O-N 3.21Å; K219-I228 HydrophobicContact CD-CD1 4.12Å
220K91.6Very high92.3Very high138 Ų13849.7 Ų49.760%0.624%0.239SC*.EExtended strand (participates in β ladder)trans-98.6130.9168.7-59.2-175.3-174.7-164.70108.1D224 A258K220-D224 WeakPolarHBondContact CA-O 3.42Å; K220-A258 HydrophobicContact CB-CB 4.42Å; K220-A258 HydrophobicContact CD-CB 4.26Å; K220-A258 WeakPolarHBondContact CD-O 3.4Å; K220-A258 WeakPolarHBondContact CE-O 2.98Å; K220-A258 HydrophobicContact CG-CB 4.42Å; K220-A258 PolarHBondContact NZ-O 2.85Å
221E89.2Confident91.7Very high81 Ų8157.1 Ų57.138%0.37927%0.273SS..EExtended strand (participates in β ladder)trans-147.7120.7-177.1-172.4175.716400109.2G223 D224 K226E221-G223 VanDerWaalsContact C-N 3.3Å; E221-G223 PolarHBondContact O-N 2.58Å; E221-D224 PolarHBondContact N-O 2.87Å; E221-D224 WeakPolarHBondContact O-CA 3.41Å; E221-D224 WeakPolarHBondContact O-CB 3.1Å; E221-D224 PolarHBondContact O-N 3.34Å; E221-K226 IonicContact OE1-NZ 3.94Å; E221-K226 WeakPolarHBondContact OE2-CD 3.47Å; E221-K226 WeakPolarHBondContact OE2-CE 3.41Å; E221-K226 IonicContact OE2-NZ 3.8Å; E221-K226 PolarHBondContact OE2-NZ 3.21Å
222K84.8Confident90.9Very high197 Ų19764.7 Ų64.786%0.85731%0.306SS*.THydrogen-bonded Turntrans51.340.4176.2-60-179.4177-174.30114.9D224K222-D224 PolarHBondContact O-N 3.01Å
223G83.7Confident90.2Very high41 Ų4173 Ų7342%0.42334%0.342SS..THydrogen-bonded Turntrans81.6-10.6-177.200000114.9E221 N256 G257 A258E221-G223 VanDerWaalsContact C-N 3.3Å; E221-G223 PolarHBondContact O-N 2.58Å; G223-N256 CarbonylContact O-C 3.54Å; G223-N256 WeakPolarHBondContact O-CA 3.1Å; G223-G257 PolarHBondContact O-N 3.26Å; G223-A258 VanDerWaalsContact C-CB 3.5Å; G223-A258 WeakPolarHBondContact O-CB 3.26Å; G223-A258 PolarHBondContact O-N 3.1Å
224D88.3Confident90Very high17 Ų1774.5 Ų74.59%0.09135%0.349CS..EExtended strand (participates in β ladder)trans-94.8161175.6-66.1-18.5000111.6K220 E221 K222 I254 K255 N256K220-D224 WeakPolarHBondContact CA-O 3.42Å; E221-D224 PolarHBondContact N-O 2.87Å; E221-D224 WeakPolarHBondContact O-CA 3.41Å; E221-D224 WeakPolarHBondContact O-CB 3.1Å; E221-D224 PolarHBondContact O-N 3.34Å; K222-D224 PolarHBondContact O-N 3.01Å; D224-I254 WeakPolarHBondContact CA-O 3.48Å; D224-K255 VanDerWaalsContact OD1-CA 3.27Å; D224-K255 WeakPolarHBondContact OD1-CA 3.16Å; D224-K255 WeakPolarHBondContact OD2-CD 3.32Å; D224-K255 IonicContact OD2-NZ 3.67Å; D224-K255 PolarHBondContact OD2-NZ 3.07Å; D224-N256 PolarHBondContact OD1-N 3.39Å
225R90.9Very high90Very high25 Ų2576.1 Ų76.19%0.09436%0.356CS..EExtended strand (participates in β ladder)trans-108.3121168.5-177.7177.3-68.5164.25.6110.1C188 V218 K219 L227 Y253 I254 G257 A258 C260C188-R225 PolarHBondContact SG-NH1 3.28Å; C188-R225 VanDerWaalsContact SG-NH1 3.45Å; V218-R225 HydrophobicContact CG1-CG 3.42Å; V218-R225 VanDerWaalsContact CG1-CG 3.42Å; K219-R225 CarbonylContact O-C 3.54Å; K219-R225 WeakPolarHBondContact O-CA 3.01Å; R225-L227 HydrophobicContact CG-CD1 4.12Å; R225-Y253 CarbonylContact O-C 3.54Å; R225-Y253 WeakPolarHBondContact O-CA 3.32Å; R225-I254 HydrophobicContact CB-CB 4.21Å; R225-I254 HydrophobicContact CB-CD1 4.48Å; R225-I254 PolarHBondContact N-O 3.46Å; R225-I254 PolarHBondContact O-N 3.32Å; R225-G257 WeakPolarHBondContact CB-O 3.2Å; R225-G257 VanDerWaalsContact CZ-O 3.22Å; R225-G257 PolarHBondContact NE-O 3.07Å; R225-G257 PolarHBondContact NH2-O 3.4Å; R225-A258 PolarHBondContact NH2-O 3.31Å; R225-C260 PolarHBondContact NH1-O 3.13Å; R225-C260 PolarHBondContact NH2-O 2.98Å
226K93.6Very high89.9Confident37 Ų3778.6 Ų78.616%0.16137%0.371CS..EExtended strand (participates in β ladder)trans-101.7125.1-176-176.7173.3-177.9162.80110.8V218 K219 E221 I228 T251 L252 Y253V218-K226 CarbonylContact C-O 3.53Å; V218-K226 VanDerWaalsContact CA-O 3.31Å; V218-K226 WeakPolarHBondContact CA-O 3.5Å; K219-K226 HydrophobicContact CB-CB 4.42Å; K219-K226 PolarHBondContact N-O 3.03Å; K219-K226 PolarHBondContact O-N 3.21Å; E221-K226 IonicContact OE1-NZ 3.94Å; E221-K226 WeakPolarHBondContact OE2-CD 3.47Å; E221-K226 WeakPolarHBondContact OE2-CE 3.41Å; E221-K226 IonicContact OE2-NZ 3.8Å; E221-K226 PolarHBondContact OE2-NZ 3.21Å; K226-I228 HydrophobicContact CG-CG1 4.32Å; K226-T251 HydrophobicContact CD-CG2 4.03Å; K226-T251 VanDerWaalsContact CE-CG2 3.5Å; K226-T251 HydrophobicContact CG-CG2 3.52Å; K226-L252 CarbonylContact C-O 3.49Å; K226-L252 WeakPolarHBondContact CA-O 3.36Å; K226-Y253 HydrophobicContact CB-CD1 4.16Å; K226-Y253 HydrophobicContact CB-CE1 4.06Å; K226-Y253 HydrophobicContact CD-CE1 3.74Å; K226-Y253 WeakPolarHBondContact CE-OH 3.42Å; K226-Y253 HydrophobicContact CG-CD1 4.23Å; K226-Y253 HydrophobicContact CG-CE1 3.75Å
227L93.9Very high89.9Confident0 Ų074.2 Ų74.20%035%0.354CS..EExtended strand (participates in β ladder)trans-110.8120179.9-6868000108.8I215 V218 R225 T251 L252 I254 L265 L285 I288I215-L227 HydrophobicContact CD1-CD2 3.84Å; V218-L227 HydrophobicContact CG2-CG 4.33Å; R225-L227 HydrophobicContact CG-CD1 4.12Å; L227-T251 WeakPolarHBondContact O-CA 3.06Å; L227-L252 HydrophobicContact CB-CB 4.24Å; L227-L252 PolarHBondContact N-O 2.91Å; L227-L252 PolarHBondContact O-N 3.43Å; L227-I254 HydrophobicContact CD1-CD1 3.88Å; L227-I254 HydrophobicContact CD1-CG1 3.97Å; L227-L265 HydrophobicContact CD1-CD1 4.46Å; L227-L265 HydrophobicContact CD2-CD1 4.02Å; L227-L265 HydrophobicContact CD2-CD2 3.93Å; L227-L265 HydrophobicContact CG-CD1 4.29Å; L227-L285 HydrophobicContact CD2-CD2 3.9Å; L227-I288 HydrophobicContact CD2-CD1 4.42Å
228I93.8Very high89.9Confident31 Ų3173.8 Ų73.816%0.15935%0.351CS..EExtended strand (participates in β ladder)trans-104.6124.2-177.1-65.1168.2000108.8K216 E217 K219 K226 T251K216-I228 PolarHBondContact N-O 3.39Å; E217-I228 HydrophobicContact CG-CB 3.66Å; E217-I228 HydrophobicContact CG-CD1 3.81Å; E217-I228 HydrophobicContact CG-CG1 4.19Å; E217-I228 HydrophobicContact CG-CG2 4.16Å; E217-I228 PolarHBondContact O-N 3.11Å; E217-I228 WeakPolarHBondContact OE1-CD1 3.48Å; K219-I228 HydrophobicContact CD-CD1 4.12Å; K226-I228 HydrophobicContact CG-CG1 4.32Å; I228-T251 HydrophobicContact CG1-CG2 4.28Å
229A93.8Very high89.8Confident3 Ų376.5 Ų76.53%0.02536%0.36CS..EExtended strand (participates in β ladder)trans-69.4146.8-178.900000112.3M213 K234 L250M213-A229 HydrophobicContact CE-CB 3.82Å; M213-A229 HydrophobicContact SD-CB 3.43Å; M213-A229 WeakPolarHBondContact SD-CB 3.22Å; A229-K234 VanDerWaalsContact CB-CE 3.46Å; A229-L250 HydrophobicContact CB-CB 3.92Å; A229-L250 HydrophobicContact CB-CD2 4.2Å; A229-L250 WeakPolarHBondContact CB-O 3.3Å; A229-L250 PolarHBondContact N-O 3.31Å; A229-L250 VanDerWaalsContact N-O 3.12Å
230A91.4Very high89.7Confident15 Ų1574.4 Ų74.412%0.12437%0.366CS..  trans-65.5148.6167.100000111K214 K216 K232K214-A230 HydrophobicContact CB-CB 4.14Å; K214-A230 HydrophobicContact CG-CB 4.48Å; K214-A230 WeakPolarHBondContact O-CB 3.06Å; K214-A230 PolarHBondContact O-N 2.86Å; K216-A230 HydrophobicContact CB-CB 4.42Å; A230-K232 PolarHBondContact O-N 3.32Å
231Q82.6Confident89.6Confident155 Ų15571.6 Ų71.672%0.72436%0.36SS*.SBendtrans-71.8-4.5179-66.1-63.7-31.700113.6
232K79.7Confident89.7Confident159 Ų15968 Ų6869%0.69134%0.344SS*.SBendtrans-65.4160.7175.9-66.5-173.8177-172.30111.5A230 K234A230-K232 PolarHBondContact O-N 3.32Å; K232-K234 PolarHBondContact O-N 3.09Å
233K79.4Confident89.9Confident215 Ų21566.3 Ų66.394%0.93533%0.332SS*.PPolyproline II helixtrans-56.5120.5177.7-169.5174.5-176.5175.80110.5
234K90.7Very high90.1Very high37 Ų3772.8 Ų72.816%0.16135%0.348CS..PPolyproline II helixtrans-89.8143.5175.5-48.4-179.6-174.982.60108.3M213 A229 K232 L247 L250M213-K234 HydrophobicContact CB-CB 4.17Å; M213-K234 HydrophobicContact CB-CD 4.39Å; M213-K234 HydrophobicContact CB-CG 4Å; M213-K234 HydrophobicContact SD-CD 3.95Å; A229-K234 VanDerWaalsContact CB-CE 3.46Å; K232-K234 PolarHBondContact O-N 3.09Å; K234-L247 PolarHBondContact NZ-O 3.03Å; K234-L250 HydrophobicContact CD-CB 4.49Å; K234-L250 HydrophobicContact CD-CD2 4.2Å
235K93.7Very high90.1Very high108 Ų10878.1 Ų78.147%0.4737%0.371SS..EExtended strand (participates in β ladder)trans-100.4118.3172.2176.8179.6-175.1-1800108.8K212 L237K212-K235 HydrophobicContact CB-CB 4.17Å; K212-K235 PolarHBondContact N-O 3.07Å; K212-K235 PolarHBondContact O-N 3.17Å; K235-L237 HydrophobicContact CD-CD2 4.11Å; K235-L237 HydrophobicContact CG-CD2 4.2Å
236V93.8Very high90Very high54 Ų5478.2 Ų78.233%0.32737%0.373SS..EExtended strand (participates in β ladder)trans-82.3127.2174.2-174.40000108.4L211 Q239 L247L211-V236 HydrophobicContact CD2-CB 4.04Å; L211-V236 HydrophobicContact CD2-CG1 3.98Å; L211-V236 HydrophobicContact CD2-CG2 3.73Å; V236-Q239 HydrophobicContact CG1-CB 3.91Å; V236-L247 HydrophobicContact CG2-CD1 4.16Å; V236-L247 HydrophobicContact CG2-CD2 4.28Å
237L93.7Very high89.8Confident44 Ų4478.2 Ų78.223%0.2338%0.375CS..EExtended strand (participates in β ladder)trans-103.2-38.5174.1-60.7177.9000110.7V210 K235 L273 W291V210-L237 HydrophobicContact CB-CB 4.27Å; V210-L237 HydrophobicContact CG1-CB 4.01Å; V210-L237 HydrophobicContact CG1-CD1 4.1Å; V210-L237 PolarHBondContact O-N 3.21Å; K235-L237 HydrophobicContact CD-CD2 4.11Å; K235-L237 HydrophobicContact CG-CD2 4.2Å; L237-L273 HydrophobicContact CD1-CD1 3.61Å; L237-W291 HydrophobicContact CD1-CZ3 4.35Å
238K93.2Very high89.4Confident48 Ų4886 Ų8621%0.20941%0.408CS..EExtended strand (participates in β ladder)trans-134.8119.7170.7-173.3-178-171.8-179.90108Y204 S207 F209 V210Y204-K238 HydrophobicContact CE2-CB 3.98Å; Y204-K238 HydrophobicContact CE2-CD 4.05Å; Y204-K238 HydrophobicContact CE2-CG 4.47Å; Y204-K238 PolarHBondContact O-NZ 2.94Å; S207-K238 WeakPolarHBondContact O-CE 3.3Å; S207-K238 PolarHBondContact O-NZ 2.82Å; F209-K238 WeakPolarHBondContact CA-O 3.43Å; V210-K238 HydrophobicContact CB-CB 3.76Å; V210-K238 HydrophobicContact CG2-CB 3.95Å; V210-K238 HydrophobicContact CG2-CD 4.2Å; V210-K238 PolarHBondContact N-O 3.23Å; V210-K238 PolarHBondContact O-N 3.17Å
239Q91.7Very high89.1Confident106 Ų10692.8 Ų92.850%0.49544%0.437SS..  trans-81.9-45.8-179.1-176.1167.6-29.800111.8V236 V241 L242V236-Q239 HydrophobicContact CG1-CB 3.91Å; Q239-V241 PolarHBondContact O-N 3.41Å; Q239-L242 HydrophobicContact CG-CB 4.44Å; Q239-L242 PolarHBondContact NE2-O 3.25Å; Q239-L242 WeakPolarHBondContact O-CB 3.45Å; Q239-L242 PolarHBondContact O-N 2.91Å; Q239-L242 VanDerWaalsContact O-N 3.1Å
240G89.6Confident89Confident52 Ų5292.9 Ų92.954%0.53644%0.437SS..THydrogen-bonded Turntrans46.8-126-174.900000112.4D208 L242D208-G240 VanDerWaalsContact O-CA 3.3Å; D208-G240 WeakPolarHBondContact O-CA 3.4Å; G240-L242 VanDerWaalsContact C-N 3.29Å; G240-L242 PolarHBondContact O-N 3.48Å
241V89.7Confident89.1Confident79 Ų7993.2 Ų93.248%0.47944%0.438SS..THydrogen-bonded Turntrans-81.92.1-175.8-57.20000114.7D208 Q239 K278D208-V241 HydrophobicContact CB-CG2 3.87Å; Q239-V241 PolarHBondContact O-N 3.41Å; V241-K278 HydrophobicContact CG2-CB 3.6Å; V241-K278 HydrophobicContact CG2-CD 3.95Å; V241-K278 HydrophobicContact CG2-CG 4.36Å
242L91.2Very high89.7Confident5 Ų585.9 Ų85.93%0.02640%0.403CS..  trans-72.1133-180-68.9-177.5000112.2F209 L211 Q239 G240 D246 L247 L283F209-L242 HydrophobicContact CB-CD1 3.4Å; F209-L242 VanDerWaalsContact CB-CD1 3.4Å; F209-L242 HydrophobicContact CB-CD2 4.47Å; F209-L242 HydrophobicContact CB-CG 3.61Å; F209-L242 HydrophobicContact CD1-CD1 4.05Å; F209-L242 HydrophobicContact CD1-CD2 3.76Å; F209-L242 HydrophobicContact CD1-CG 3.84Å; F209-L242 HydrophobicContact CD2-CD1 3.8Å; F209-L242 HydrophobicContact CD2-CG 4.49Å; F209-L242 HydrophobicContact CE1-CD2 4.16Å; F209-L242 HydrophobicContact CG-CD1 3.47Å; F209-L242 VanDerWaalsContact CG-CD1 3.47Å; F209-L242 HydrophobicContact CG-CD2 4.08Å; F209-L242 HydrophobicContact CG-CG 3.73Å; L211-L242 HydrophobicContact CD1-CD1 4.19Å; L211-L242 HydrophobicContact CD2-CD1 4.31Å; Q239-L242 HydrophobicContact CG-CB 4.44Å; Q239-L242 PolarHBondContact NE2-O 3.25Å; Q239-L242 WeakPolarHBondContact O-CB 3.45Å; Q239-L242 PolarHBondContact O-N 2.91Å; Q239-L242 VanDerWaalsContact O-N 3.1Å; G240-L242 VanDerWaalsContact C-N 3.29Å; G240-L242 PolarHBondContact O-N 3.48Å; L242-D246 HydrophobicContact CD2-CB 4.08Å; L242-L247 HydrophobicContact CD1-CD2 4.03Å; L242-L283 HydrophobicContact CD2-CD1 4.22Å; L242-L283 HydrophobicContact CD2-CD2 3.64Å
243R90.5Very high90.3Very high162 Ų16280.5 Ų80.561%0.61138%0.379SS*.  trans-98.2161173.8-59.4-175.3-173.8-177.25.7110.9K245 D246 L247R243-K245 HydrophobicContact CB-CG 3.97Å; R243-K245 PolarHBondContact O-N 3.37Å; R243-K245 VanDerWaalsContact O-N 3.13Å; R243-D246 PolarHBondContact N-OD2 3.2Å; R243-D246 WeakPolarHBondContact O-CB 3.41Å; R243-D246 PolarHBondContact O-N 3.14Å; R243-L247 PolarHBondContact O-N 3.34Å
244K87.8Confident90.9Very high177 Ų17770.2 Ų70.277%0.7733%0.334SS*.Hα-helixtrans-54.3-34.6175.9-68.2-177.4-178.4175.50112.8D246 L247 K248K244-D246 VanDerWaalsContact C-N 3.34Å; K244-L247 PolarHBondContact O-N 3.38Å; K244-K248 PolarHBondContact O-N 2.99Å
245K88.3Confident90.7Very high128 Ų12871 Ų7156%0.55734%0.337SS*.Hα-helixtrans-61.7-40.2175.664.6172.7-171.5172.40112.5R243 L247 K248R243-K245 HydrophobicContact CB-CG 3.97Å; R243-K245 PolarHBondContact O-N 3.37Å; R243-K245 VanDerWaalsContact O-N 3.13Å; K245-L247 VanDerWaalsContact C-N 3.31Å; K245-L247 PolarHBondContact O-N 3.32Å; K245-K248 PolarHBondContact O-N 3.11Å
246D88.9Confident90.2Very high27 Ų2770.6 Ų70.614%0.14434%0.341CS..Hα-helixtrans-67.4-37.4-178.9-53.4-30.2000109.7L242 R243 K244 K248 K249 L250 K278L242-D246 HydrophobicContact CD2-CB 4.08Å; R243-D246 PolarHBondContact N-OD2 3.2Å; R243-D246 WeakPolarHBondContact O-CB 3.41Å; R243-D246 PolarHBondContact O-N 3.14Å; K244-D246 VanDerWaalsContact C-N 3.34Å; D246-K248 PolarHBondContact O-N 3.17Å; D246-K249 CarbonylContact O-C 3.51Å; D246-L250 VanDerWaalsContact O-CA 3.31Å; D246-L250 WeakPolarHBondContact O-CA 3.29Å; D246-L250 WeakPolarHBondContact O-CD1 3.48Å; D246-L250 PolarHBondContact O-N 2.98Å; D246-K278 IonicContact OD1-NZ 2.69Å; D246-K278 IonicContact OD2-NZ 2.79Å; D246-K278 PolarHBondContact OD2-NZ 2.9Å
247L87.7Confident89.6Confident38 Ų3868 Ų6820%0.19933%0.325CS..Hα-helixtrans-71.3-26.4177.9-65175.5000114L211 K234 V236 L242 R243 K244 K245L211-L247 HydrophobicContact CD1-CD2 4.43Å; L211-L247 HydrophobicContact CD2-CD2 4.18Å; K234-L247 PolarHBondContact NZ-O 3.03Å; V236-L247 HydrophobicContact CG2-CD1 4.16Å; V236-L247 HydrophobicContact CG2-CD2 4.28Å; L242-L247 HydrophobicContact CD1-CD2 4.03Å; R243-L247 PolarHBondContact O-N 3.34Å; K244-L247 PolarHBondContact O-N 3.38Å; K245-L247 VanDerWaalsContact C-N 3.31Å; K245-L247 PolarHBondContact O-N 3.32Å
248K87.3Confident89.1Confident162 Ų16266.3 Ų66.370%0.70432%0.317SS*.Hα-helixtrans-67.5-51.3177.5-74.6-176.9-179.3-174.90111.2K244 K245 D246K244-K248 PolarHBondContact O-N 2.99Å; K245-K248 PolarHBondContact O-N 3.11Å; D246-K248 PolarHBondContact O-N 3.17Å
249K85.8Confident88.5Confident175 Ų17570.7 Ų70.776%0.76134%0.343SS*.THydrogen-bonded Turntrans-118.965.8179.9-167.1179.4177.9179.70110.9D246 T251D246-K249 CarbonylContact O-C 3.51Å; K249-T251 PolarHBondContact O-N 3.33Å
250L92.1Very high88.1Confident5 Ų566.8 Ų66.83%0.02633%0.327CS..  trans-75118.4-175.9-164.586.8000111.2L211 M213 A229 K234 D246 L283L211-L250 HydrophobicContact CD1-CD1 4.15Å; L211-L250 HydrophobicContact CD1-CD2 3.44Å; L211-L250 VanDerWaalsContact CD1-CD2 3.44Å; L211-L250 HydrophobicContact CD1-CG 4.47Å; M213-L250 HydrophobicContact CE-CD2 3.53Å; M213-L250 HydrophobicContact SD-CD2 3.35Å; M213-L250 WeakPolarHBondContact SD-CD2 3.3Å; A229-L250 HydrophobicContact CB-CB 3.92Å; A229-L250 HydrophobicContact CB-CD2 4.2Å; A229-L250 WeakPolarHBondContact CB-O 3.3Å; A229-L250 PolarHBondContact N-O 3.31Å; A229-L250 VanDerWaalsContact N-O 3.12Å; K234-L250 HydrophobicContact CD-CB 4.49Å; K234-L250 HydrophobicContact CD-CD2 4.2Å; D246-L250 VanDerWaalsContact O-CA 3.31Å; D246-L250 WeakPolarHBondContact O-CA 3.29Å; D246-L250 WeakPolarHBondContact O-CD1 3.48Å; D246-L250 PolarHBondContact O-N 2.98Å; L250-L283 HydrophobicContact CD1-CD1 3.4Å; L250-L283 VanDerWaalsContact CD1-CD1 3.4Å; L250-L283 HydrophobicContact CG-CD1 4.21Å
251T93.8Very high88Confident22 Ų2267.4 Ų67.414%0.13532%0.322CS..EExtended strand (participates in β ladder)trans-131.3128.2177-57.20000108K226 L227 I228 K249 Y253K226-T251 HydrophobicContact CD-CG2 4.03Å; K226-T251 VanDerWaalsContact CE-CG2 3.5Å; K226-T251 HydrophobicContact CG-CG2 3.52Å; L227-T251 WeakPolarHBondContact O-CA 3.06Å; I228-T251 HydrophobicContact CG1-CG2 4.28Å; K249-T251 PolarHBondContact O-N 3.33Å; T251-Y253 HydrophobicContact CG2-CE2 3.84Å
252L94.7Very high87.9Confident0 Ų064 Ų640%030%0.301CS..EExtended strand (participates in β ladder)trans-113.1153.4-179.5-61.9158.4000110.3F209 M213 K226 L227 I274 L283 L285F209-L252 HydrophobicContact CE2-CD2 3.82Å; F209-L252 HydrophobicContact CZ-CD2 3.56Å; M213-L252 HydrophobicContact CE-CD1 3.49Å; M213-L252 VanDerWaalsContact CE-CD1 3.49Å; K226-L252 CarbonylContact C-O 3.49Å; K226-L252 WeakPolarHBondContact CA-O 3.36Å; L227-L252 HydrophobicContact CB-CB 4.24Å; L227-L252 PolarHBondContact N-O 2.91Å; L227-L252 PolarHBondContact O-N 3.43Å; L252-I274 HydrophobicContact CD1-CD1 4.11Å; L252-I274 HydrophobicContact CD1-CG2 3.52Å; L252-L283 CarbonylContact C-O 3.55Å; L252-L283 VanDerWaalsContact CA-O 3.29Å; L252-L283 WeakPolarHBondContact CA-O 3.06Å; L252-L283 HydrophobicContact CD2-CB 3.65Å; L252-L285 HydrophobicContact CD1-CD1 4.42Å
253Y93.1Very high87.7Confident46 Ų4667.5 Ų67.518%0.1833%0.326CS..EExtended strand (participates in β ladder)trans-126.2139179.9-61.4-93.6000110.8R225 K226 T251 L283 L284 L285R225-Y253 CarbonylContact O-C 3.54Å; R225-Y253 WeakPolarHBondContact O-CA 3.32Å; K226-Y253 HydrophobicContact CB-CD1 4.16Å; K226-Y253 HydrophobicContact CB-CE1 4.06Å; K226-Y253 HydrophobicContact CD-CE1 3.74Å; K226-Y253 WeakPolarHBondContact CE-OH 3.42Å; K226-Y253 HydrophobicContact CG-CD1 4.23Å; K226-Y253 HydrophobicContact CG-CE1 3.75Å; T251-Y253 HydrophobicContact CG2-CE2 3.84Å; Y253-L283 PolarHBondContact N-O 3.4Å; Y253-L284 WeakPolarHBondContact O-CA 3.36Å; Y253-L285 PolarHBondContact O-N 3.19Å
254I91.3Very high87.4Confident0 Ų061.2 Ų61.20%030%0.304CS..EExtended strand (participates in β ladder)trans-103.5109162.5-56.6170.4000105.7C188 P190 D224 R225 L227 G257 L265 L285C188-I254 HydrophobicContact CB-CG2 4.4Å; P190-I254 HydrophobicContact CG-CG2 4.08Å; D224-I254 WeakPolarHBondContact CA-O 3.48Å; R225-I254 HydrophobicContact CB-CB 4.21Å; R225-I254 HydrophobicContact CB-CD1 4.48Å; R225-I254 PolarHBondContact N-O 3.46Å; R225-I254 PolarHBondContact O-N 3.32Å; L227-I254 HydrophobicContact CD1-CD1 3.88Å; L227-I254 HydrophobicContact CD1-CG1 3.97Å; I254-G257 PolarHBondContact O-N 3.46Å; I254-L265 HydrophobicContact CD1-CD1 4.34Å; I254-L285 HydrophobicContact CD1-CD2 3.72Å; I254-L285 HydrophobicContact CG1-CB 4.03Å; I254-L285 HydrophobicContact CG1-CD2 3.62Å; I254-L285 HydrophobicContact CG1-CG 4.43Å
255K86.9Confident87.4Confident52 Ų5253.5 Ų53.523%0.22627%0.271CS..THydrogen-bonded Turntrans-63.5136.2178.3-75-77.2169.1-159.90110.5D224 G257 Q282 L284D224-K255 VanDerWaalsContact OD1-CA 3.27Å; D224-K255 WeakPolarHBondContact OD1-CA 3.16Å; D224-K255 WeakPolarHBondContact OD2-CD 3.32Å; D224-K255 IonicContact OD2-NZ 3.67Å; D224-K255 PolarHBondContact OD2-NZ 3.07Å; K255-G257 PolarHBondContact O-N 2.96Å; K255-Q282 VanDerWaalsContact CE-OE1 3.28Å; K255-L284 HydrophobicContact CD-CD2 4.49Å; K255-L284 HydrophobicContact CG-CD1 4.47Å; K255-L284 HydrophobicContact CG-CD2 3.83Å
256N82.8Confident87.2Confident100 Ų10054.9 Ų54.954%0.53528%0.28SS..THydrogen-bonded Turntrans54.121-175.9-59.1-40.7000113.4G223 D224G223-N256 CarbonylContact O-C 3.54Å; G223-N256 WeakPolarHBondContact O-CA 3.1Å; D224-N256 PolarHBondContact OD1-N 3.39Å
257G81.8Confident87.1Confident1 Ų158 Ų581%0.0130%0.296CS..  trans-91.23.4-170.100000115.2G223 R225 I254 K255 N259 C260G223-G257 PolarHBondContact O-N 3.26Å; R225-G257 WeakPolarHBondContact CB-O 3.2Å; R225-G257 VanDerWaalsContact CZ-O 3.22Å; R225-G257 PolarHBondContact NE-O 3.07Å; R225-G257 PolarHBondContact NH2-O 3.4Å; I254-G257 PolarHBondContact O-N 3.46Å; K255-G257 PolarHBondContact O-N 2.96Å; G257-N259 VanDerWaalsContact C-N 3.27Å; G257-N259 PolarHBondContact O-N 3.36Å; G257-C260 VanDerWaalsContact CA-SG 3.51Å; G257-C260 PolarHBondContact O-SG 2.98Å; G257-C260 VanDerWaalsContact O-SG 3.4Å
258A82.3Confident87.1Confident7 Ų758.1 Ų58.16%0.05830%0.297CS..SBendtrans-59.5-38.4-173.900000112.5K220 G223 R225K220-A258 HydrophobicContact CB-CB 4.42Å; K220-A258 HydrophobicContact CD-CB 4.26Å; K220-A258 WeakPolarHBondContact CD-O 3.4Å; K220-A258 WeakPolarHBondContact CE-O 2.98Å; K220-A258 HydrophobicContact CG-CB 4.42Å; K220-A258 PolarHBondContact NZ-O 2.85Å; G223-A258 VanDerWaalsContact C-CB 3.5Å; G223-A258 WeakPolarHBondContact O-CB 3.26Å; G223-A258 PolarHBondContact O-N 3.1Å; R225-A258 PolarHBondContact NH2-O 3.31Å
259N82.1Confident87Confident140 Ų14052.6 Ų52.675%0.74929%0.286SS*.SBendtrans-109.1-7.5-167-63.6-25000115.2G257G257-N259 VanDerWaalsContact C-N 3.27Å; G257-N259 PolarHBondContact O-N 3.36Å
260C82.9Confident87.2Confident25 Ų2545.4 Ų45.417%0.16926%0.258CS..SBendtrans-81.8134.5176.952.20000111.9K186 C188 R225 G257K186-C260 VanDerWaalsContact O-CA 3.3Å; K186-C260 WeakPolarHBondContact O-CA 3.33Å; K186-C260 VanDerWaalsContact O-CB 3.23Å; K186-C260 WeakPolarHBondContact O-CB 3.1Å; C188-C260 WeakPolarHBondContact CA-SG 3.28Å; C188-C260 HydrophobicContact CB-CB 3.95Å; C188-C260 WeakPolarHBondContact CB-SG 3.24Å; C188-C260 VanDerWaalsContact SG-C 3.55Å; C188-C260 WeakPolarHBondContact SG-CB 3.45Å; C188-C260 PolarHBondContact SG-O 2.51Å; C188-C260 CovalentContact SG-SG 2.02Å; C188-C260 PolarHBondContact SG-SG 2.03Å; R225-C260 PolarHBondContact NH1-O 3.13Å; R225-C260 PolarHBondContact NH2-O 2.98Å; G257-C260 VanDerWaalsContact CA-SG 3.51Å; G257-C260 PolarHBondContact O-SG 2.98Å; G257-C260 VanDerWaalsContact O-SG 3.4Å
261P86.9Confident87.3Confident65 Ų6548.6 Ų48.642%0.42228%0.275SS..  trans-55.8153.4168.511.5-30000114K186 V187 C188K186-P261 VanDerWaalsContact C-CG 3.44Å; K186-P261 HydrophobicContact CB-CG 3.82Å; K186-P261 WeakPolarHBondContact O-CD 3.37Å; K186-P261 VanDerWaalsContact O-CG 3.22Å; K186-P261 WeakPolarHBondContact O-CG 3.49Å; V187-P261 CarbonylContact C-O 3.57Å; V187-P261 WeakPolarHBondContact CA-O 3.44Å; C188-P261 PolarHBondContact N-O 3.3Å; C188-P261 PolarHBondContact SG-O 3.2Å; C188-P261 VanDerWaalsContact SG-O 3.37Å
262C88.6Confident87.3Confident7 Ų747.5 Ų47.55%0.04727%0.268CS..  trans-153.988.4171.3179.20000108.6C191 Q264 L265C191-C262 HydrophobicContact CB-CB 3.77Å; C191-C262 WeakPolarHBondContact CB-SG 3.37Å; C191-C262 WeakPolarHBondContact SG-CB 3.42Å; C191-C262 CovalentContact SG-SG 2.02Å; C191-C262 PolarHBondContact SG-SG 3.42Å; C262-Q264 PolarHBondContact O-N 3.37Å; C262-Q264 VanDerWaalsContact O-N 3.13Å; C262-L265 HydrophobicContact CB-CB 4.47Å; C262-L265 HydrophobicContact CB-CD1 4.16Å; C262-L265 HydrophobicContact CB-CG 4.41Å; C262-L265 PolarHBondContact O-N 2.7Å; C262-L265 VanDerWaalsContact SG-CD1 3.6Å; C262-L265 VanDerWaalsContact SG-CG 3.53Å
263S86.3Confident87.3Confident79 Ų7947.5 Ų47.555%0.55227%0.268SS*.G310 helixtrans-56.6-30.8-175.356.40000113L265 E266S263-L265 PolarHBondContact O-N 2.9Å; S263-E266 PolarHBondContact O-N 3.2Å
264Q84.8Confident87.5Confident29 Ų2945.3 Ų45.314%0.13626%0.26CS..G310 helixtrans-59.4-29.5175.9-58.3-161.433.600113.4C191 C262 F272 I288C191-Q264 PolarHBondContact O-NE2 3.46Å; C262-Q264 PolarHBondContact O-N 3.37Å; C262-Q264 VanDerWaalsContact O-N 3.13Å; Q264-F272 WeakPolarHBondContact O-CE1 3.42Å; Q264-F272 WeakPolarHBondContact O-CZ 3.46Å; Q264-I288 VanDerWaalsContact CD-O 3.23Å; Q264-I288 PolarHBondContact NE2-O 2.88Å; Q264-I288 VanDerWaalsContact OE1-C 3.22Å; Q264-I288 PolarHBondContact OE1-O 2.04Å
265L87.1Confident87.6Confident16 Ų1645.3 Ų45.38%0.08426%0.26CS..G310 helixtrans-92.8-6-177.4-67.6177.2000113.8I215 V218 L227 I254 C262 S263 N267 L268 I288I215-L265 HydrophobicContact CD1-CD2 3.43Å; I215-L265 VanDerWaalsContact CD1-CD2 3.43Å; V218-L265 HydrophobicContact CG2-CD1 4.45Å; V218-L265 HydrophobicContact CG2-CD2 4.38Å; L227-L265 HydrophobicContact CD1-CD1 4.46Å; L227-L265 HydrophobicContact CD2-CD1 4.02Å; L227-L265 HydrophobicContact CD2-CD2 3.93Å; L227-L265 HydrophobicContact CG-CD1 4.29Å; I254-L265 HydrophobicContact CD1-CD1 4.34Å; C262-L265 HydrophobicContact CB-CB 4.47Å; C262-L265 HydrophobicContact CB-CD1 4.16Å; C262-L265 HydrophobicContact CB-CG 4.41Å; C262-L265 PolarHBondContact O-N 2.7Å; C262-L265 VanDerWaalsContact SG-CD1 3.6Å; C262-L265 VanDerWaalsContact SG-CG 3.53Å; S263-L265 PolarHBondContact O-N 2.9Å; L265-N267 VanDerWaalsContact C-N 3.31Å; L265-N267 PolarHBondContact O-N 2.89Å; L265-L268 HydrophobicContact CB-CD2 4.46Å; L265-L268 HydrophobicContact CD2-CD2 4.19Å; L265-L268 WeakPolarHBondContact O-CD2 3.5Å; L265-I288 HydrophobicContact CD2-CD1 3.64Å; L265-I288 HydrophobicContact CG-CD1 4.47Å
266E84.8Confident88Confident157 Ų15742.9 Ų42.973%0.73425%0.249SC*.THydrogen-bonded Turntrans-66.4-36.4177.2-67.9172.7-171.900111.4S263S263-E266 PolarHBondContact O-N 3.2Å
267N85.3Confident88.5Confident92 Ų9239.7 Ų39.749%0.49223%0.229SC..  trans-111.593.5176.3-171.9-24.4000111.5L265 G269 F272L265-N267 VanDerWaalsContact C-N 3.31Å; L265-N267 PolarHBondContact O-N 2.89Å; N267-G269 PolarHBondContact O-N 2.89Å; N267-G269 WeakPolarHBondContact OD1-CA 3.25Å; N267-G269 PolarHBondContact OD1-N 3.23Å; N267-F272 WeakPolarHBondContact O-CZ 3.49Å
268L89.1Confident88.9Confident41 Ų4141.7 Ų41.722%0.21524%0.238CC..THydrogen-bonded Turntrans-75.62.8178.4-55.3-178000113.8K214 I215 V218 L265 S270K214-L268 WeakPolarHBondContact CE-O 3.4Å; I215-L268 HydrophobicContact CB-CD2 4.09Å; I215-L268 HydrophobicContact CG2-CD1 4.32Å; I215-L268 HydrophobicContact CG2-CD2 3.95Å; V218-L268 HydrophobicContact CG2-CD1 4.26Å; V218-L268 HydrophobicContact CG2-CD2 4.06Å; L265-L268 HydrophobicContact CB-CD2 4.46Å; L265-L268 HydrophobicContact CD2-CD2 4.19Å; L265-L268 WeakPolarHBondContact O-CD2 3.5Å; L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 3.06Å
269G85.2Confident89.2Confident46 Ų4643.7 Ų43.747%0.47425%0.249SC..THydrogen-bonded Turntrans-65.6-30.4-174.300000114.5K214 N267K214-G269 VanDerWaalsContact CE-O 3.29Å; K214-G269 WeakPolarHBondContact CE-O 3.42Å; K214-G269 PolarHBondContact NZ-O 3.39Å; N267-G269 PolarHBondContact O-N 2.89Å; N267-G269 WeakPolarHBondContact OD1-CA 3.25Å; N267-G269 PolarHBondContact OD1-N 3.23Å
270S90.1Very high89.4Confident24 Ų2444 Ų4417%0.16825%0.251CS..SBendtrans-87.7169.3-177.948.20000113.7L268 F272 K290L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 3.06Å; S270-F272 VanDerWaalsContact O-CE2 3.32Å; S270-F272 WeakPolarHBondContact O-CE2 3.26Å; S270-K290 VanDerWaalsContact OG-CE 3.29Å; S270-K290 WeakPolarHBondContact OG-CE 3.25Å; S270-K290 WeakPolarHBondContact OG-CG 3.42Å
271N93Very high89.5Confident71 Ų7151.3 Ų51.338%0.3828%0.282SS..  trans-77.5160.9161.8-68.1-73000109.3K212 M213 W291K212-N271 HydrophobicContact CG-CB 4.27Å; M213-N271 CarbonylContact O-C 3.55Å; M213-N271 WeakPolarHBondContact O-CA 3.39Å; N271-W291 VanDerWaalsContact C-CB 3.47Å; N271-W291 HydrophobicContact CB-CB 3.79Å; N271-W291 HydrophobicContact CB-CG 4.21Å; N271-W291 WeakPolarHBondContact O-CA 3.45Å; N271-W291 WeakPolarHBondContact O-CB 3.33Å; N271-W291 PolarHBondContact O-N 3.43Å
272F94.6Very high89.7Confident0 Ų052.2 Ų52.20%028%0.281CS..EExtended strand (participates in β ladder)trans-127.3144.1176.3-62.9-86.2000109.3K212 M213 I215 Q264 N267 S270 I274 I288 H289 K290K212-F272 VanDerWaalsContact CA-O 3.3Å; K212-F272 WeakPolarHBondContact CA-O 2.97Å; M213-F272 PolarHBondContact N-O 2.81Å; M213-F272 VanDerWaalsContact N-O 3.11Å; M213-F272 PolarHBondContact O-N 3.35Å; I215-F272 HydrophobicContact CB-CE2 4.46Å; I215-F272 HydrophobicContact CD1-CD2 3.79Å; I215-F272 HydrophobicContact CD1-CE2 4.08Å; I215-F272 HydrophobicContact CD1-CG 4.16Å; I215-F272 HydrophobicContact CG1-CD2 4.05Å; I215-F272 HydrophobicContact CG1-CE2 4.42Å; Q264-F272 WeakPolarHBondContact O-CE1 3.42Å; Q264-F272 WeakPolarHBondContact O-CZ 3.46Å; N267-F272 WeakPolarHBondContact O-CZ 3.49Å; S270-F272 VanDerWaalsContact O-CE2 3.32Å; S270-F272 WeakPolarHBondContact O-CE2 3.26Å; F272-I274 HydrophobicContact CB-CD1 4.07Å; F272-I274 HydrophobicContact CB-CG1 3.89Å; F272-I288 HydrophobicContact CB-CD1 4.12Å; F272-I288 HydrophobicContact CB-CG1 4.07Å; F272-I288 HydrophobicContact CD1-CD1 3.77Å; F272-I288 HydrophobicContact CD1-CG1 3.9Å; F272-I288 HydrophobicContact CE1-CD1 4.43Å; F272-I288 HydrophobicContact CG-CD1 3.99Å; F272-I288 HydrophobicContact CG-CG1 4.27Å; F272-H289 CarbonylContact C-O 3.04Å; F272-H289 WeakPolarHBondContact CA-O 3.32Å; F272-K290 HydrophobicContact CE1-CB 4.42Å; F272-K290 HydrophobicContact CE1-CG 4.47Å
273L95.4Very high89.9Confident0 Ų052.4 Ų52.40%028%0.282CS..EExtended strand (participates in β ladder)trans-84.6121.1159.3176.262.6000106.8I200 V210 L237 M275 I288 H289 W291 L298 M305I200-L273 HydrophobicContact CG2-CD2 4.21Å; V210-L273 HydrophobicContact CG1-CD1 3.6Å; L237-L273 HydrophobicContact CD1-CD1 3.61Å; L273-M275 HydrophobicContact CD1-CE 4.3Å; L273-M275 HydrophobicContact CD2-CE 3.57Å; L273-M275 HydrophobicContact CG-CE 3.92Å; L273-I288 WeakPolarHBondContact O-CA 3.26Å; L273-H289 HydrophobicContact CB-CB 4.35Å; L273-H289 PolarHBondContact N-O 3.08Å; L273-H289 PolarHBondContact O-N 3.38Å; L273-W291 HydrophobicContact CB-CE3 4.06Å; L273-W291 HydrophobicContact CB-CZ3 4.32Å; L273-W291 HydrophobicContact CD1-CZ3 4.29Å; L273-L298 HydrophobicContact CD2-CD1 3.54Å; L273-M305 HydrophobicContact CD2-CE 4.28Å
274I95.5Very high90.3Very high0 Ų049 Ų490%026%0.257CS..EExtended strand (participates in β ladder)trans-123.5127.1-173.2-72.4175.4000107.8V210 L211 M213 I215 L252 F272 L285 I288V210-I274 CarbonylContact C-O 3.54Å; V210-I274 WeakPolarHBondContact CA-O 3.35Å; L211-I274 PolarHBondContact N-O 3.2Å; L211-I274 PolarHBondContact O-N 3.4Å; M213-I274 HydrophobicContact CE-CD1 3.23Å; M213-I274 HydrophobicContact CG-CD1 3.73Å; M213-I274 HydrophobicContact SD-CD1 4.31Å; I215-I274 HydrophobicContact CD1-CD1 4.25Å; I215-I274 HydrophobicContact CG1-CD1 4.26Å; L252-I274 HydrophobicContact CD1-CD1 4.11Å; L252-I274 HydrophobicContact CD1-CG2 3.52Å; F272-I274 HydrophobicContact CB-CD1 4.07Å; F272-I274 HydrophobicContact CB-CG1 3.89Å; I274-L285 HydrophobicContact CG2-CD1 3.72Å; I274-I288 HydrophobicContact CG1-CD1 4.28Å; I274-I288 HydrophobicContact CG1-CG1 4.16Å
275M95.1Very high90.7Very high0 Ų047.7 Ų47.70%025%0.251CS..EExtended strand (participates in β ladder)trans-123.6135.2177-46.9-169.8176.600108.6I200 H203 Y204 S207 V210 L273 M286 S287 M305I200-M275 HydrophobicContact CG2-CE 3.57Å; H203-M275 VanDerWaalsContact C-SD 3.59Å; H203-M275 HydrophobicContact CB-SD 3.54Å; H203-M275 VanDerWaalsContact CB-SD 3.54Å; Y204-M275 PolarHBondContact N-SD 3.43Å; Y204-M275 VanDerWaalsContact N-SD 3.41Å; S207-M275 VanDerWaalsContact OG-CB 3.28Å; S207-M275 WeakPolarHBondContact OG-CB 3.01Å; V210-M275 HydrophobicContact CG1-CE 4.39Å; V210-M275 HydrophobicContact CG1-CG 4.03Å; V210-M275 HydrophobicContact CG2-CB 4.19Å; V210-M275 HydrophobicContact CG2-CG 3.99Å; V210-M275 HydrophobicContact CG2-SD 4.46Å; L273-M275 HydrophobicContact CD1-CE 4.3Å; L273-M275 HydrophobicContact CD2-CE 3.57Å; L273-M275 HydrophobicContact CG-CE 3.92Å; M275-M286 PolarHBondContact O-N 3.28Å; M275-S287 PolarHBondContact N-O 2.64Å; M275-S287 PolarHBondContact O-N 2.9Å; M275-S287 VanDerWaalsContact O-N 3.12Å; M275-M305 HydrophobicContact CE-CE 3.59Å
276G94.1Very high90.8Very high0 Ų047.2 Ų47.20%025%0.248CC..EExtended strand (participates in β ladder)trans-161.8172.9-174.300000113.7S207 D208 F209 L284S207-G276 WeakPolarHBondContact CB-O 3.12Å; D208-G276 PolarHBondContact N-O 3.43Å; F209-G276 WeakPolarHBondContact CD1-O 3.36Å; F209-G276 VanDerWaalsContact CE1-C 3.42Å; F209-G276 PolarHBondContact N-O 3.34Å; F209-G276 PolarHBondContact O-N 3.07Å; F209-G276 VanDerWaalsContact O-N 3.08Å; G276-L284 CarbonylContact C-O 3.52Å; G276-L284 WeakPolarHBondContact CA-O 3.49Å
277R92.9Very high91.2Very high34 Ų3439.7 Ų39.713%0.12821%0.213CC..EExtended strand (participates in β ladder)trans-123.1154.7179.5-72.5-177.980.6-148.14.2111G150 A206 D208 L284 M286G150-R277 PolarHBondContact O-NH1 2.79Å; G150-R277 VanDerWaalsContact O-NH1 3.13Å; A206-R277 WeakPolarHBondContact O-CD 3.28Å; D208-R277 HydrophobicContact CB-CG 4.46Å; D208-R277 IonicContact OD1-NE 2.85Å; D208-R277 WeakPolarHBondContact OD2-CA 3.42Å; D208-R277 VanDerWaalsContact OD2-CB 3.3Å; D208-R277 WeakPolarHBondContact OD2-CB 3.48Å; D208-R277 IonicContact OD2-NE 2.81Å; R277-L284 PolarHBondContact N-O 3Å; R277-L284 PolarHBondContact O-N 3.49Å; R277-M286 HydrophobicContact CB-SD 4.34Å; R277-M286 WeakPolarHBondContact CD-SD 3.28Å; R277-M286 HydrophobicContact CG-CG 4.24Å; R277-M286 HydrophobicContact CG-SD 3.37Å; R277-M286 WeakPolarHBondContact CG-SD 3.3Å
278K91.9Very high91.6Very high42 Ų4235.3 Ų35.318%0.18319%0.19CC..EExtended strand (participates in β ladder)trans-108.2108175.1-177.2173.6-176175.70108.2D208 V241 D246 D280 Q282 L283D208-K278 PolarHBondContact OD2-N 3.41Å; V241-K278 HydrophobicContact CG2-CB 3.6Å; V241-K278 HydrophobicContact CG2-CD 3.95Å; V241-K278 HydrophobicContact CG2-CG 4.36Å; D246-K278 IonicContact OD1-NZ 2.69Å; D246-K278 IonicContact OD2-NZ 2.79Å; D246-K278 PolarHBondContact OD2-NZ 2.9Å; K278-D280 WeakPolarHBondContact CE-O 3.26Å; K278-Q282 WeakPolarHBondContact CA-O 3.33Å; K278-L283 HydrophobicContact CB-CD2 3.86Å; K278-L283 HydrophobicContact CD-CD2 3.97Å; K278-L283 HydrophobicContact CG-CD2 3.78Å
279V88.6Confident91.7Very high49 Ų4933.4 Ų33.430%0.29718%0.18SC..EExtended strand (participates in β ladder)trans-103.9115.4172.4-175.50000106.3Q281 Q282 L284V279-Q281 PolarHBondContact O-N 2.9Å; V279-Q282 PolarHBondContact N-O 3.23Å; V279-Q282 PolarHBondContact O-N 3.01Å; V279-L284 HydrophobicContact CB-CD1 4.17Å; V279-L284 HydrophobicContact CG2-CD1 3.75Å; V279-L284 HydrophobicContact CG2-CG 4.47Å
280D85.7Confident92.1Very high146 Ų14635.7 Ų35.778%0.78118%0.177SC*.THydrogen-bonded Turntrans53.7-104.6-170.9-52.7-47.3000113.1K278K278-D280 WeakPolarHBondContact CE-O 3.26Å
281Q85.8Confident92.1Very high179 Ų17936.4 Ų36.484%0.83618%0.176SC*.THydrogen-bonded Turntrans-112.1-2.1177.4-59.5-168.54.600113V279V279-Q281 PolarHBondContact O-N 2.9Å
282Q90Very high91.9Very high85 Ų8536.6 Ų36.640%0.39718%0.177SC..EExtended strand (participates in β ladder)trans-95.1138179.8-63.1-170.35.900110.5K255 K278 V279 L284K255-Q282 VanDerWaalsContact CE-OE1 3.28Å; K278-Q282 WeakPolarHBondContact CA-O 3.33Å; V279-Q282 PolarHBondContact N-O 3.23Å; V279-Q282 PolarHBondContact O-N 3.01Å; Q282-L284 HydrophobicContact CB-CD2 4.4Å
283L93.7Very high91.5Very high11 Ų1144.1 Ų44.16%0.05821%0.209CC..EExtended strand (participates in β ladder)trans-100.2109.5174.4-54.4178.3000108.1F209 L242 L250 L252 Y253 K278F209-L283 HydrophobicContact CE1-CB 4.28Å; F209-L283 HydrophobicContact CE1-CD2 3.9Å; F209-L283 HydrophobicContact CZ-CB 4.06Å; F209-L283 HydrophobicContact CZ-CD2 4.4Å; L242-L283 HydrophobicContact CD2-CD1 4.22Å; L242-L283 HydrophobicContact CD2-CD2 3.64Å; L250-L283 HydrophobicContact CD1-CD1 3.4Å; L250-L283 VanDerWaalsContact CD1-CD1 3.4Å; L250-L283 HydrophobicContact CG-CD1 4.21Å; L252-L283 CarbonylContact C-O 3.55Å; L252-L283 VanDerWaalsContact CA-O 3.29Å; L252-L283 WeakPolarHBondContact CA-O 3.06Å; L252-L283 HydrophobicContact CD2-CB 3.65Å; Y253-L283 PolarHBondContact N-O 3.4Å; K278-L283 HydrophobicContact CB-CD2 3.86Å; K278-L283 HydrophobicContact CD-CD2 3.97Å; K278-L283 HydrophobicContact CG-CD2 3.78Å
284L93.3Very high91.2Very high8 Ų852.6 Ų52.64%0.04225%0.246CC..EExtended strand (participates in β ladder)trans-93.8135.8-177.8-58.4-176.6000110G150 Y253 K255 G276 R277 V279 Q282G150-L284 VanDerWaalsContact CA-CD1 3.5Å; Y253-L284 WeakPolarHBondContact O-CA 3.36Å; K255-L284 HydrophobicContact CD-CD2 4.49Å; K255-L284 HydrophobicContact CG-CD1 4.47Å; K255-L284 HydrophobicContact CG-CD2 3.83Å; G276-L284 CarbonylContact C-O 3.52Å; G276-L284 WeakPolarHBondContact CA-O 3.49Å; R277-L284 PolarHBondContact N-O 3Å; R277-L284 PolarHBondContact O-N 3.49Å; V279-L284 HydrophobicContact CB-CD1 4.17Å; V279-L284 HydrophobicContact CG2-CD1 3.75Å; V279-L284 HydrophobicContact CG2-CG 4.47Å; Q282-L284 HydrophobicContact CB-CD2 4.4Å
285L93.3Very high91Very high0 Ų053.4 Ų53.40%025%0.252CS..EExtended strand (participates in β ladder)trans-83.2117.4175.7-175.973.7000109.3P190 L227 L252 Y253 I254 I274 I288P190-L285 HydrophobicContact CB-CD2 3.97Å; P190-L285 HydrophobicContact CB-CG 4.04Å; P190-L285 VanDerWaalsContact CG-O 3.23Å; P190-L285 WeakPolarHBondContact CG-O 3.27Å; L227-L285 HydrophobicContact CD2-CD2 3.9Å; L252-L285 HydrophobicContact CD1-CD1 4.42Å; Y253-L285 PolarHBondContact O-N 3.19Å; I254-L285 HydrophobicContact CD1-CD2 3.72Å; I254-L285 HydrophobicContact CG1-CB 4.03Å; I254-L285 HydrophobicContact CG1-CD2 3.62Å; I254-L285 HydrophobicContact CG1-CG 4.43Å; I274-L285 HydrophobicContact CG2-CD1 3.72Å; L285-I288 HydrophobicContact CD1-CB 4.3Å; L285-I288 HydrophobicContact CD2-CB 4.15Å; L285-I288 HydrophobicContact CD2-CG2 4.17Å
286M90.6Very high90.9Very high6 Ų661.2 Ų61.23%0.0329%0.286CS..EExtended strand (participates in β ladder)trans-93.8-40.6174.4-72.6-173.273.700112.4Y149 F151 P190 A206 M275 R277Y149-M286 HydrophobicContact CD1-CB 4.26Å; Y149-M286 HydrophobicContact CD1-CE 4.14Å; Y149-M286 HydrophobicContact CD1-CG 4.35Å; Y149-M286 WeakPolarHBondContact CE1-O 3.12Å; F151-M286 HydrophobicContact CE2-CE 3.98Å; P190-M286 VanDerWaalsContact CA-O 3.31Å; P190-M286 WeakPolarHBondContact CA-O 3.14Å; P190-M286 WeakPolarHBondContact CB-O 3.29Å; A206-M286 HydrophobicContact CB-CE 3.95Å; M275-M286 PolarHBondContact O-N 3.28Å; R277-M286 HydrophobicContact CB-SD 4.34Å; R277-M286 WeakPolarHBondContact CD-SD 3.28Å; R277-M286 HydrophobicContact CG-CG 4.24Å; R277-M286 HydrophobicContact CG-SD 3.37Å; R277-M286 WeakPolarHBondContact CG-SD 3.3Å
287S92.4Very high90.8Very high0 Ų065.1 Ų65.10%030%0.304CS..EExtended strand (participates in β ladder)trans-149.2140179.3-179.10000111P190 N193 M275 H289P190-S287 WeakPolarHBondContact O-CA 3.43Å; N193-S287 VanDerWaalsContact ND2-CB 3.32Å; N193-S287 WeakPolarHBondContact ND2-CB 3.21Å; N193-S287 PolarHBondContact ND2-OG 3.29Å; M275-S287 PolarHBondContact N-O 2.64Å; M275-S287 PolarHBondContact O-N 2.9Å; M275-S287 VanDerWaalsContact O-N 3.12Å; S287-H289 PolarHBondContact OG-CD2 3.18Å; S287-H289 PolarHBondContact OG-NE2 3.15Å
288I93.1Very high90.7Very high0 Ų063.6 Ų63.60%030%0.299CS..EExtended strand (participates in β ladder)trans-127.1138170.4-170.6167.9000110.1P190 I215 L227 Q264 L265 F272 L273 I274 L285P190-I288 PolarHBondContact O-N 3.49Å; I215-I288 HydrophobicContact CD1-CD1 3.67Å; L227-I288 HydrophobicContact CD2-CD1 4.42Å; Q264-I288 VanDerWaalsContact CD-O 3.23Å; Q264-I288 PolarHBondContact NE2-O 2.88Å; Q264-I288 VanDerWaalsContact OE1-C 3.22Å; Q264-I288 PolarHBondContact OE1-O 2.04Å; L265-I288 HydrophobicContact CD2-CD1 3.64Å; L265-I288 HydrophobicContact CG-CD1 4.47Å; F272-I288 HydrophobicContact CB-CD1 4.12Å; F272-I288 HydrophobicContact CB-CG1 4.07Å; F272-I288 HydrophobicContact CD1-CD1 3.77Å; F272-I288 HydrophobicContact CD1-CG1 3.9Å; F272-I288 HydrophobicContact CE1-CD1 4.43Å; F272-I288 HydrophobicContact CG-CD1 3.99Å; F272-I288 HydrophobicContact CG-CG1 4.27Å; L273-I288 WeakPolarHBondContact O-CA 3.26Å; I274-I288 HydrophobicContact CG1-CD1 4.28Å; I274-I288 HydrophobicContact CG1-CG1 4.16Å; L285-I288 HydrophobicContact CD1-CB 4.3Å; L285-I288 HydrophobicContact CD2-CB 4.15Å; L285-I288 HydrophobicContact CD2-CG2 4.17Å
289H92.8Very high90.7Very high0 Ų067 Ų670%031%0.313CS..EExtended strand (participates in β ladder)trans-134.2133.8172.1-62.2-75.1000110.2N193 L195 F272 L273 S287 W291N193-H289 PolarHBondContact O-CE1 3.34Å; L195-H289 HydrophobicContact CD2-CB 4.06Å; F272-H289 CarbonylContact C-O 3.04Å; F272-H289 WeakPolarHBondContact CA-O 3.32Å; L273-H289 HydrophobicContact CB-CB 4.35Å; L273-H289 PolarHBondContact N-O 3.08Å; L273-H289 PolarHBondContact O-N 3.38Å; S287-H289 PolarHBondContact OG-CD2 3.18Å; S287-H289 PolarHBondContact OG-NE2 3.15Å; H289-W291 PolarHBondContact O-N 2.69Å
290K92.1Very high90.9Very high95 Ų9570.3 Ų70.341%0.41332%0.324SS..EExtended strand (participates in β ladder)trans-58.8131.5171-169.9173.4-178.2176.80109.9S270 F272 D292S270-K290 VanDerWaalsContact OG-CE 3.29Å; S270-K290 WeakPolarHBondContact OG-CE 3.25Å; S270-K290 WeakPolarHBondContact OG-CG 3.42Å; F272-K290 HydrophobicContact CE1-CB 4.42Å; F272-K290 HydrophobicContact CE1-CG 4.47Å; K290-D292 PolarHBondContact O-N 2.8Å
291W91.1Very high91.2Very high39 Ų3963.3 Ų63.315%0.14829%0.287CS..  trans-7791.8178.8-169.2-75.1000110.3K212 L237 N271 L273 H289 L298 I302K212-W291 HydrophobicContact CB-CE3 4.03Å; K212-W291 HydrophobicContact CB-CH2 4.38Å; K212-W291 HydrophobicContact CB-CZ3 3.74Å; K212-W291 HydrophobicContact CD-CD2 3.75Å; K212-W291 HydrophobicContact CD-CE3 3.66Å; K212-W291 HydrophobicContact CD-CH2 3.63Å; K212-W291 HydrophobicContact CD-CZ2 3.74Å; K212-W291 HydrophobicContact CD-CZ3 3.6Å; K212-W291 VanDerWaalsContact CE-CD2 3.42Å; K212-W291 HydrophobicContact CG-CD2 4Å; K212-W291 HydrophobicContact CG-CE3 3.55Å; K212-W291 HydrophobicContact CG-CH2 4.25Å; K212-W291 HydrophobicContact CG-CZ3 3.7Å; L237-W291 HydrophobicContact CD1-CZ3 4.35Å; N271-W291 VanDerWaalsContact C-CB 3.47Å; N271-W291 HydrophobicContact CB-CB 3.79Å; N271-W291 HydrophobicContact CB-CG 4.21Å; N271-W291 WeakPolarHBondContact O-CA 3.45Å; N271-W291 WeakPolarHBondContact O-CB 3.33Å; N271-W291 PolarHBondContact O-N 3.43Å; L273-W291 HydrophobicContact CB-CE3 4.06Å; L273-W291 HydrophobicContact CB-CZ3 4.32Å; L273-W291 HydrophobicContact CD1-CZ3 4.29Å; H289-W291 PolarHBondContact O-N 2.69Å; W291-L298 HydrophobicContact CD2-CD2 4.4Å; W291-I302 HydrophobicContact CH2-CD1 3.18Å; W291-I302 HydrophobicContact CH2-CG1 4.05Å; W291-I302 HydrophobicContact CZ2-CD1 3.54Å; W291-I302 HydrophobicContact CZ3-CD1 3.79Å; W291-I302 HydrophobicContact CZ3-CG1 4.49Å
292D89.3Confident91.5Very high74 Ų7456 Ų5640%0.39625%0.253SS..  trans-97.8119.3171.4-179.723.1000111.4K290 K294 S295K290-D292 PolarHBondContact O-N 2.8Å; D292-K294 PolarHBondContact O-N 2.82Å; D292-K294 PolarHBondContact OD1-N 2.98Å; D292-S295 PolarHBondContact OD2-N 2.93Å
293K84.3Confident91.6Very high158 Ų15859.4 Ų59.469%0.68727%0.266SS*.SBendtrans-73.9-9.8175.6-69.8-175.1-178.7179.10112.6K299K293-K299 WeakPolarHBondContact O-CE 3.5Å; K293-K299 PolarHBondContact O-NZ 3.42Å
294K89.4Confident91.4Very high178 Ų17863.5 Ų63.577%0.77428%0.282SS*.SBendtrans-90.1-35.4178.7-64.4-176.1179.7-177.50111.9D292 K296D292-K294 PolarHBondContact O-N 2.82Å; D292-K294 PolarHBondContact OD1-N 2.98Å; K294-K296 PolarHBondContact O-N 2.89Å
295S91.5Very high91.4Very high17 Ų1763.6 Ų63.612%0.11928%0.282CS..  trans-48.4126.7174.1169.20000113D292 E297 L298 K299D292-S295 PolarHBondContact OD2-N 2.93Å; S295-E297 PolarHBondContact OG-N 2.84Å; S295-E297 PolarHBondContact OG-OE2 3.03Å; S295-L298 PolarHBondContact OG-N 2.71Å; S295-L298 VanDerWaalsContact OG-N 3.12Å; S295-K299 WeakPolarHBondContact O-CG 3.16Å
296K92.7Very high91Very high165 Ų16571.6 Ų71.672%0.71732%0.317SS*.Hα-helixtrans-77.4-38.2177.9-69.4-179.1179.6177.20110.5K294 K299 F300K294-K296 PolarHBondContact O-N 2.89Å; K296-K299 WeakPolarHBondContact O-CB 3.21Å; K296-K299 PolarHBondContact O-N 3.22Å; K296-F300 WeakPolarHBondContact O-CB 3.05Å; K296-F300 PolarHBondContact O-N 2.95Å
297E92.4Very high90.8Very high82 Ų8275.8 Ų75.838%0.38335%0.346SS..Hα-helixtrans-60.9-50.8-179.9-5571.1-15200110.1L195 S295 K299 F300 A301L195-E297 VanDerWaalsContact O-CB 3.3Å; L195-E297 WeakPolarHBondContact O-CB 3.41Å; L195-E297 WeakPolarHBondContact O-CG 3.48Å; S295-E297 PolarHBondContact OG-N 2.84Å; S295-E297 PolarHBondContact OG-OE2 3.03Å; E297-K299 VanDerWaalsContact C-N 3.35Å; E297-K299 PolarHBondContact O-N 2.86Å; E297-F300 PolarHBondContact O-N 3.41Å; E297-A301 WeakPolarHBondContact O-CB 3.43Å; E297-A301 PolarHBondContact O-N 3.49Å
298L91.9Very high90.5Very high2 Ų278.4 Ų78.41%0.0136%0.359CS..Hα-helixtrans-62.3-41.5177.7-179.959000111.8L273 W291 S295 I302L273-L298 HydrophobicContact CD2-CD1 3.54Å; W291-L298 HydrophobicContact CD2-CD2 4.4Å; S295-L298 PolarHBondContact OG-N 2.71Å; S295-L298 VanDerWaalsContact OG-N 3.12Å; L298-I302 HydrophobicContact CD1-CD1 3.81Å; L298-I302 HydrophobicContact CD1-CG1 4.15Å; L298-I302 HydrophobicContact CG-CD1 3.76Å; L298-I302 VanDerWaalsContact O-CD1 3.28Å; L298-I302 WeakPolarHBondContact O-CD1 3.26Å; L298-I302 WeakPolarHBondContact O-CG1 3.34Å; L298-I302 PolarHBondContact O-N 2.85Å
299K91.8Very high90Very high112 Ų11286.8 Ų86.849%0.48740%0.398SS..Hα-helixtrans-61.8-46.8176.9-76.9172.8-177.4160.20111.8K293 S295 K296 E297 I302 K303K293-K299 WeakPolarHBondContact O-CE 3.5Å; K293-K299 PolarHBondContact O-NZ 3.42Å; S295-K299 WeakPolarHBondContact O-CG 3.16Å; K296-K299 WeakPolarHBondContact O-CB 3.21Å; K296-K299 PolarHBondContact O-N 3.22Å; E297-K299 VanDerWaalsContact C-N 3.35Å; E297-K299 PolarHBondContact O-N 2.86Å; K299-I302 PolarHBondContact O-N 2.64Å; K299-K303 PolarHBondContact O-N 2.9Å
300F91.9Very high89.6Confident119 Ų11988.7 Ų88.752%0.52241%0.411SS..Hα-helixtrans-64.5-46.1-179.3-174.2-90.7000110.5T197 K296 E297 I302 K303 Y304T197-F300 HydrophobicContact CG2-CD1 3.42Å; T197-F300 VanDerWaalsContact CG2-CD1 3.42Å; T197-F300 HydrophobicContact CG2-CE1 3.79Å; K296-F300 WeakPolarHBondContact O-CB 3.05Å; K296-F300 PolarHBondContact O-N 2.95Å; E297-F300 PolarHBondContact O-N 3.41Å; F300-I302 PolarHBondContact O-N 3.47Å; F300-K303 WeakPolarHBondContact O-CB 3.39Å; F300-K303 PolarHBondContact O-N 2.53Å; F300-K303 VanDerWaalsContact O-N 3.14Å; F300-Y304 WeakPolarHBondContact O-CB 3.14Å; F300-Y304 PolarHBondContact O-N 3.22Å
301A92.5Very high88.6Confident0 Ų087.2 Ų87.20%041%0.411CS..Hα-helixtrans-57.7-47.7175.400000112T197 I200 M201 E297 K303 Y304 M305T197-A301 HydrophobicContact CG2-CB 4.38Å; I200-A301 HydrophobicContact CB-CB 4.03Å; I200-A301 HydrophobicContact CD1-CB 4.19Å; I200-A301 HydrophobicContact CG2-CB 3.58Å; M201-A301 HydrophobicContact SD-CB 4.47Å; E297-A301 WeakPolarHBondContact O-CB 3.43Å; E297-A301 PolarHBondContact O-N 3.49Å; A301-K303 VanDerWaalsContact C-N 3.3Å; A301-K303 PolarHBondContact O-N 3.43Å; A301-Y304 PolarHBondContact O-N 2.81Å; A301-Y304 VanDerWaalsContact O-N 3.13Å; A301-M305 HydrophobicContact CB-CE 4.17Å; A301-M305 WeakPolarHBondContact O-CG 3.47Å; A301-M305 PolarHBondContact O-N 3.46Å
302I92.1Very high87Confident24 Ų2490.2 Ų90.212%0.12344%0.438CS..Hα-helixtrans-61.8-36.8177.5-67.2158000112.3W291 L298 K299 F300W291-I302 HydrophobicContact CH2-CD1 3.18Å; W291-I302 HydrophobicContact CH2-CG1 4.05Å; W291-I302 HydrophobicContact CZ2-CD1 3.54Å; W291-I302 HydrophobicContact CZ3-CD1 3.79Å; W291-I302 HydrophobicContact CZ3-CG1 4.49Å; L298-I302 HydrophobicContact CD1-CD1 3.81Å; L298-I302 HydrophobicContact CD1-CG1 4.15Å; L298-I302 HydrophobicContact CG-CD1 3.76Å; L298-I302 VanDerWaalsContact O-CD1 3.28Å; L298-I302 WeakPolarHBondContact O-CD1 3.26Å; L298-I302 WeakPolarHBondContact O-CG1 3.34Å; L298-I302 PolarHBondContact O-N 2.85Å; K299-I302 PolarHBondContact O-N 2.64Å; F300-I302 PolarHBondContact O-N 3.47Å
303K91.6Very high85.3Confident157 Ų15793.2 Ų93.268%0.68344%0.444SS*.Hα-helixtrans-64.8-46.1175.4-175.2-178.4178.2-175.60109.8K299 F300 A301 K306K299-K303 PolarHBondContact O-N 2.9Å; F300-K303 WeakPolarHBondContact O-CB 3.39Å; F300-K303 PolarHBondContact O-N 2.53Å; F300-K303 VanDerWaalsContact O-N 3.14Å; A301-K303 VanDerWaalsContact C-N 3.3Å; A301-K303 PolarHBondContact O-N 3.43Å; K303-K306 PolarHBondContact O-N 3.38Å
304Y90.4Very high83.4Confident98 Ų9893.2 Ų93.238%0.38445%0.447SS..Hα-helixtrans-67.3-40-177.8-161.4-118.4000112.5M201 F300 A301 K306 S307 H308M201-Y304 HydrophobicContact CE-CD1 3.51Å; M201-Y304 HydrophobicContact CE-CE1 4.08Å; M201-Y304 HydrophobicContact CE-CG 4.48Å; M201-Y304 HydrophobicContact CG-CD1 3.84Å; M201-Y304 HydrophobicContact CG-CE1 4.48Å; M201-Y304 HydrophobicContact SD-CD1 3.7Å; M201-Y304 HydrophobicContact SD-CG 4.44Å; F300-Y304 WeakPolarHBondContact O-CB 3.14Å; F300-Y304 PolarHBondContact O-N 3.22Å; A301-Y304 PolarHBondContact O-N 2.81Å; A301-Y304 VanDerWaalsContact O-N 3.13Å; Y304-K306 PolarHBondContact O-N 2.94Å; Y304-S307 PolarHBondContact O-N 2.83Å; Y304-S307 PolarHBondContact O-OG 2.93Å; Y304-H308 HydrophobicContact CD1-CB 3.95Å; Y304-H308 HydrophobicContact CE1-CB 3.83Å; Y304-H308 AromaticContact CE1-CE1 3.89Å; Y304-H308 AromaticContact CE1-CG 3.51Å; Y304-H308 AromaticContact CE1-ND1 3.36Å; Y304-H308 WeakPolarHBondContact CE1-ND1 2.94Å; Y304-H308 HydrophobicContact CG-CB 4.32Å; Y304-H308 AromaticContact CZ-CG 3.87Å; Y304-H308 AromaticContact CZ-ND1 3.33Å; Y304-H308 VanDerWaalsContact CZ-ND1 3.33Å; Y304-H308 WeakPolarHBondContact O-CB 3.47Å; Y304-H308 PolarHBondContact O-N 3.37Å; Y304-H308 PolarHBondContact OH-ND1 2.95Å; Y304-H308 VanDerWaalsContact OH-ND1 3.09Å
305M91.9Very high81.2Confident10 Ų1088.3 Ų88.35%0.04943%0.432CS..Hα-helixtrans-52.1-31.6174.6-73.2171-166.800114I200 M201 Y204 L273 M275 A301I200-M305 HydrophobicContact CG2-CE 3.29Å; M201-M305 HydrophobicContact CE-CG 4.23Å; M201-M305 HydrophobicContact SD-CE 4.38Å; M201-M305 HydrophobicContact SD-CG 3.74Å; Y204-M305 HydrophobicContact CD1-CG 4.1Å; Y204-M305 HydrophobicContact CD2-CB 4.2Å; Y204-M305 HydrophobicContact CD2-CE 4.19Å; Y204-M305 HydrophobicContact CD2-CG 3.53Å; Y204-M305 HydrophobicContact CD2-SD 3.7Å; Y204-M305 HydrophobicContact CE1-CB 4.32Å; Y204-M305 HydrophobicContact CE1-CG 4.26Å; Y204-M305 HydrophobicContact CE2-CB 3.88Å; Y204-M305 HydrophobicContact CE2-CG 3.75Å; Y204-M305 HydrophobicContact CE2-SD 4.11Å; Y204-M305 HydrophobicContact CG-CE 4.37Å; Y204-M305 HydrophobicContact CG-CG 3.75Å; Y204-M305 HydrophobicContact CG-SD 4.32Å; Y204-M305 PolarHBondContact OH-O 3.42Å; Y204-M305 VanDerWaalsContact OH-O 3.11Å; L273-M305 HydrophobicContact CD2-CE 4.28Å; M275-M305 HydrophobicContact CE-CE 3.59Å; A301-M305 HydrophobicContact CB-CE 4.17Å; A301-M305 WeakPolarHBondContact O-CG 3.47Å; A301-M305 PolarHBondContact O-N 3.46Å
306K86.3Confident79Confident168 Ų16889.1 Ų89.173%0.7344%0.436SS*.Hα-helixtrans-75.5-28.8-178-68178.4178.7-176.10113.4K303 Y304K303-K306 PolarHBondContact O-N 3.38Å; Y304-K306 PolarHBondContact O-N 2.94Å
307S86Confident76.5Confident93 Ų9383.5 Ų83.565%0.6541%0.411SS*.Hα-helixtrans-108.3-19.9-175.254.90000112.9Y304Y304-S307 PolarHBondContact O-N 2.83Å; Y304-S307 PolarHBondContact O-OG 2.93Å
308H85.6Confident73.5Confident56 Ų5690.7 Ų90.726%0.25945%0.445SS..PPolyproline II helixtrans-84.2127.9-174.7-171.472.7000111.5M201 Y304M201-H308 HydrophobicContact CE-CB 4.12Å; Y304-H308 HydrophobicContact CD1-CB 3.95Å; Y304-H308 HydrophobicContact CE1-CB 3.83Å; Y304-H308 AromaticContact CE1-CE1 3.89Å; Y304-H308 AromaticContact CE1-CG 3.51Å; Y304-H308 AromaticContact CE1-ND1 3.36Å; Y304-H308 WeakPolarHBondContact CE1-ND1 2.94Å; Y304-H308 HydrophobicContact CG-CB 4.32Å; Y304-H308 AromaticContact CZ-CG 3.87Å; Y304-H308 AromaticContact CZ-ND1 3.33Å; Y304-H308 VanDerWaalsContact CZ-ND1 3.33Å; Y304-H308 WeakPolarHBondContact O-CB 3.47Å; Y304-H308 PolarHBondContact O-N 3.37Å; Y304-H308 PolarHBondContact OH-ND1 2.95Å; Y304-H308 VanDerWaalsContact OH-ND1 3.09Å
309Q82.4Confident72.6Confident176 Ų17695.1 Ų95.182%0.82247%0.467SS*.PPolyproline II helixtrans-90.3119.3166.5-70-177.7-7.500108.3
310C83.4Confident71.5Confident39 Ų3994.2 Ų94.226%0.26447%0.466SS..PPolyproline II helixtrans-65.4145.2175.3-69.70000110.3Y204 C205 S312Y204-C310 VanDerWaalsContact CD1-SG 3.56Å; Y204-C310 VanDerWaalsContact CE1-SG 3.59Å; C205-C310 WeakPolarHBondContact CA-SG 3.38Å; C205-C310 HydrophobicContact CB-CB 3.57Å; C205-C310 WeakPolarHBondContact CB-SG 3.29Å; C205-C310 VanDerWaalsContact SG-CA 3.56Å; C205-C310 WeakPolarHBondContact SG-CB 3.3Å; C205-C310 CovalentContact SG-SG 2.05Å; C205-C310 PolarHBondContact SG-SG 3.03Å; C310-S312 PolarHBondContact O-N 2.9Å
311P72.9Confident70.4Confident65 Ų6592.8 Ų92.842%0.42246%0.463SS..PPolyproline II helixtrans-57135.4173.6-14.225.5000108.9Y313P311-Y313 HydrophobicContact CB-CD2 4.05Å; P311-Y313 HydrophobicContact CB-CE1 4.35Å; P311-Y313 HydrophobicContact CB-CE2 3.53Å; P311-Y313 HydrophobicContact CG-CE2 3.61Å; P311-Y313 WeakPolarHBondContact O-CD2 3.19Å; P311-Y313 PolarHBondContact O-N 2.82Å
312S57Low69.1Low102 Ų10298.3 Ų98.371%0.71349%0.49SS*.  trans-72.976.6172.358.20000108.6C310 H314C310-S312 PolarHBondContact O-N 2.9Å; S312-H314 PolarHBondContact O-N 3.17Å
313Y53.8Low67.7Low136 Ų136102.9 Ų102.953%0.53351%0.513SS..  trans-68.494.1156-51.5-76.6000104P311 T315P311-Y313 HydrophobicContact CB-CD2 4.05Å; P311-Y313 HydrophobicContact CB-CE1 4.35Å; P311-Y313 HydrophobicContact CB-CE2 3.53Å; P311-Y313 HydrophobicContact CG-CE2 3.61Å; P311-Y313 WeakPolarHBondContact O-CD2 3.19Å; P311-Y313 PolarHBondContact O-N 2.82Å; Y313-T315 PolarHBondContact O-N 3.19Å
314H43.6Very low66.1Low158 Ų15899.3 Ų99.373%0.73150%0.501SS*.  trans-43.7133.7161.4-106.6-89.5000106.3S312 V316S312-H314 PolarHBondContact O-N 3.17Å; H314-V316 WeakPolarHBondContact O-CG2 3.27Å; H314-V316 PolarHBondContact O-N 3.3Å
315T44.6Very low64.3Low75 Ų7599.4 Ų99.446%0.4651%0.51SS..  trans-53.492.7178.840.20000109.1Y313 F317 Q318Y313-T315 PolarHBondContact O-N 3.19Å; T315-F317 PolarHBondContact O-N 3.49Å; T315-Q318 PolarHBondContact O-N 2.01Å
316V44.4Very low62.2Low34 Ų34106.3 Ų106.321%0.20655%0.545CS..THydrogen-bonded Turntrans-64.5-6-174.2171.30000112.1H314H314-V316 WeakPolarHBondContact O-CG2 3.27Å; H314-V316 PolarHBondContact O-N 3.3Å
317F39.5Very low60.2Low47 Ų47101.2 Ų101.221%0.20653%0.53CS..THydrogen-bonded Turntrans-12226.6-172.4-51.5-63.3000112.9W99 F151 P154 M156 T315W99-F317 AromaticContact CE2-CE1 3.9Å; W99-F317 HydrophobicContact CH2-CE1 4.09Å; W99-F317 AromaticContact CZ2-CE1 3.47Å; W99-F317 HydrophobicContact CZ2-CE1 3.47Å; W99-F317 VanDerWaalsContact CZ2-CE1 3.47Å; W99-F317 HydrophobicContact CZ2-CZ 4.07Å; F151-F317 AromaticContact CD1-CD2 3.59Å; F151-F317 HydrophobicContact CD1-CD2 3.59Å; F151-F317 AromaticContact CD1-CE2 3.98Å; F151-F317 HydrophobicContact CD1-CE2 3.98Å; F151-F317 HydrophobicContact CD1-CG 4.49Å; F151-F317 AromaticContact CE1-CD2 3.94Å; F151-F317 HydrophobicContact CE1-CD2 3.94Å; F151-F317 HydrophobicContact CE1-CE2 4.2Å; P154-F317 HydrophobicContact CB-CD1 3.85Å; P154-F317 HydrophobicContact CG-CD1 4.07Å; P154-F317 HydrophobicContact CG-CE1 4.24Å; M156-F317 HydrophobicContact CE-CE1 4.16Å; T315-F317 PolarHBondContact O-N 3.49Å
318Q29.5Very low57.9Low233 Ų233101.9 Ų101.9100%1.08952%0.519SS*.  trans-82.60165.1-88.9-172.2-28.800110.8T315T315-Q318 PolarHBondContact O-N 2.01Å

Retrieved 318 of 318 residues in 134.8 ms (Link to these results)