A0A060D121_MAIZE Loading...

Dof zinc finger protein

Transcription factor that binds specifically to a 5'-AA[AG]G-3' consensus core sequence.

AlphaFold DB , UniProt , Accession A0A060D121, Species MAIZE (Zea mays, Maize), Gene DOF34, Length 351 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M48.8Very low49.4Very low244 Ų244125.2 Ų125.2100%1.20286%0.857SS**  0125.90-77.2169.3170.100107.6
2A48.5Very low49.3Very low106 Ų106133.7 Ų133.788%0.87686%0.857SS**  trans35.2129.5158.400000119.3
3G41Very low49.5Very low73 Ų73132.5 Ų132.575%0.75385%0.85SS**  cis106.9139.128.200000110.7
4A56.8Low49.5Very low106 Ų106129.6 Ų129.688%0.87684%0.844SS**  trans81.5125.7174.800000116
5G46Very low49.3Very low72 Ų72127.7 Ų127.774%0.74284%0.844SS**  cis79.413045.300000107.7
6C49.2Very low49.2Very low128 Ų128126.8 Ų126.887%0.86585%0.849SS**  cis-176.1175.722.445.90000108.2
7A53.2Low48.9Very low98 Ų98123.6 Ų123.681%0.8184%0.843SS**  trans105.7109149.500000119.6
8T47.9Very low49.2Very low130 Ų130122.5 Ų122.580%0.79884%0.844SS**  trans-40.7140.8160.9-47.90000116.4V10T8-V10 HydrophobicContact CG2-CG2 4.48Å
9A54.2Low49.5Very low104 Ų104122.3 Ų122.386%0.8684%0.84SS**  trans-147.8129.2146.800000110.4
10V46.2Very low49.4Very low126 Ų126121.3 Ų121.376%0.76484%0.841SS**  trans-86128.5-179167.60000109.6T8T8-V10 HydrophobicContact CG2-CG2 4.48Å
11Q51Low49.4Very low190 Ų190120.1 Ų120.189%0.88884%0.838SS**  trans-160.5114.9151.6-146.3110.29.500111
12R48.4Very low49.7Very low227 Ų227114.6 Ų114.686%0.85782%0.818SS**  trans-73167.8156.8-86175.574.5-161.54.4108.3
13P52.8Low49.6Very low118 Ų118113.9 Ų113.977%0.76681%0.812SS**  cis-143.3-165.322.334.9-10.4000114.7
14A49.1Very low50.4Low92 Ų92121.5 Ų121.576%0.7682%0.818SS**  trans109.3110.5153.300000118.4
15A46.4Very low49.8Very low102 Ų102122.7 Ų122.784%0.84382%0.815SS**  trans70.5139.6131.500000121.6
16A47.8Very low49.9Very low112 Ų112124 Ų12493%0.92682%0.818SS**  trans82.7116.7158.700000118.1
17G44.8Very low50Low73 Ų73124.6 Ų124.675%0.75382%0.818SS**  trans153.869.3163.600000114.3
18A54.3Low49.3Very low104 Ų104123 Ų12386%0.8681%0.811SS**  trans-67.1140.6169.900000111.5
19P54.4Low49.1Very low118 Ų118121.8 Ų121.877%0.76681%0.814SS**  trans-112.4126.8150.231.9-21.9000110.2A21P19-A21 PolarHBondContact O-N 3.31Å
20A47.6Very low48.3Very low103 Ų103120.3 Ų120.385%0.85181%0.81SS**  trans-57.898.7171.800000110.5V22A20-V22 PolarHBondContact O-N 3.49Å
21A48Very low48Very low96 Ų96117.4 Ų117.479%0.79381%0.805SS**  trans-80.2105.5167.700000108.3P19 A23P19-A21 PolarHBondContact O-N 3.31Å; A21-A23 PolarHBondContact O-N 3.49Å
22V55.3Low47.9Very low128 Ų128112.8 Ų112.878%0.77680%0.799SS**  trans-55.5101.2169.3174.50000108.3A20 R24A20-V22 PolarHBondContact O-N 3.49Å; V22-R24 VanDerWaalsContact C-N 3.33Å; V22-R24 PolarHBondContact O-N 2.85Å
23A47.8Very low48.2Very low91 Ų91108.7 Ų108.775%0.75280%0.799SS**  trans-63.995.7169.800000108A21 T25A21-A23 PolarHBondContact O-N 3.49Å; A23-T25 VanDerWaalsContact C-N 3.35Å; A23-T25 PolarHBondContact O-N 3.48Å
24R56.7Low48.2Very low234 Ų234107.1 Ų107.188%0.88380%0.796SS**  trans-67.199.6164.8-74.3-178.1149.2-179.8-5.1107V22 A26V22-R24 VanDerWaalsContact C-N 3.33Å; V22-R24 PolarHBondContact O-N 2.85Å; R24-A26 PolarHBondContact O-N 3.17Å
25T45.7Very low48.3Very low130 Ų130107 Ų10780%0.79878%0.783SS**  trans-50112.3166.714.40000108.6A23 V27A23-T25 VanDerWaalsContact C-N 3.35Å; A23-T25 PolarHBondContact O-N 3.48Å; T25-V27 VanDerWaalsContact C-N 3.32Å; T25-V27 PolarHBondContact O-N 3.44Å
26A47.2Very low48.5Very low99 Ų99108.2 Ų108.282%0.81878%0.782SS**  trans-6296.3167.600000107.6R24 G28R24-A26 PolarHBondContact O-N 3.17Å; A26-G28 PolarHBondContact O-N 2.82Å; A26-G28 VanDerWaalsContact O-N 3.11Å
27V52.1Low48.8Very low141 Ų141114 Ų11486%0.85578%0.779SS**  trans-61.4115.2165.4174.50000106.1T25 A29T25-V27 VanDerWaalsContact C-N 3.32Å; T25-V27 PolarHBondContact O-N 3.44Å; V27-A29 PolarHBondContact O-N 3.25Å
28G37.9Very low49.2Very low65 Ų65113.3 Ų113.367%0.6777%0.767SS**  trans-44.7125.1-170.900000112.7A26 G30A26-G28 PolarHBondContact O-N 2.82Å; A26-G28 VanDerWaalsContact O-N 3.11Å; G28-G30 PolarHBondContact O-N 2.9Å
29A42.9Very low49.4Very low104 Ų104115.6 Ų115.686%0.8676%0.76SS**  trans-63.683.7153.800000107.2V27 G31V27-A29 PolarHBondContact O-N 3.25Å; A29-G31 PolarHBondContact O-N 2.9Å
30G38.2Very low49.9Very low74 Ų74112.6 Ų112.676%0.76375%0.745SS**  trans-62.391.4160.800000106.8G28 A32G28-G30 PolarHBondContact O-N 2.9Å; G30-A32 PolarHBondContact O-N 3.12Å
31G40.7Very low51.4Low64 Ų64109.4 Ų109.466%0.6671%0.714SS**  trans-53.5109.1168.500000107.1A29 V33A29-G31 PolarHBondContact O-N 2.9Å; G31-V33 VanDerWaalsContact C-N 3.34Å; G31-V33 PolarHBondContact O-N 3.01Å
32A48.6Very low53.3Low94 Ų94113.4 Ų113.478%0.77771%0.708SS**  trans-57.4106.316700000105.7G30 A34G30-A32 PolarHBondContact O-N 3.12Å; A32-A34 PolarHBondContact O-N 3.04Å
33V53.3Low55Low141 Ų141107.3 Ų107.386%0.85567%0.671SS**  trans-58.398.8165.2179.20000104.5G31 D35G31-V33 VanDerWaalsContact C-N 3.34Å; G31-V33 PolarHBondContact O-N 3.01Å; V33-D35 PolarHBondContact O-N 3.34Å; V33-D35 VanDerWaalsContact O-N 3.08Å
34A53.1Low56.9Low84 Ų84105.8 Ų105.869%0.69465%0.653SS**  trans-63.8111.3177.500000106.1A32 P36A32-A34 PolarHBondContact O-N 3.04Å; A34-P36 VanDerWaalsContact O-CD 3.28Å; A34-P36 WeakPolarHBondContact O-CD 2.97Å; A34-P36 VanDerWaalsContact O-N 3.12Å
35D51Low58.2Low91 Ų9198 Ų9849%0.48762%0.624SS.*  trans-53.9115.6172.1-179.1-12.8000108.3V33 R37 A38V33-D35 PolarHBondContact O-N 3.34Å; V33-D35 VanDerWaalsContact O-N 3.08Å; D35-R37 PolarHBondContact O-N 3.11Å; D35-R37 WeakPolarHBondContact OD1-CB 3.41Å; D35-R37 PolarHBondContact OD1-N 2.82Å; D35-A38 PolarHBondContact O-N 3.31Å
36P51.5Low60.3Low127 Ų12794.1 Ų94.183%0.82560%0.602SS**THydrogen-bonded Turntrans-66.9-1.6-177.527.2-33.8000113.5A34A34-P36 VanDerWaalsContact O-CD 3.28Å; A34-P36 WeakPolarHBondContact O-CD 2.97Å; A34-P36 VanDerWaalsContact O-N 3.12Å
37R53.9Low62.3Low232 Ų23294.5 Ų94.588%0.87559%0.59SS**THydrogen-bonded Turntrans-90.1-12.2171.5-61.2-176.9177.9132.8-2.3113.7D35 E39D35-R37 PolarHBondContact O-N 3.11Å; D35-R37 WeakPolarHBondContact OD1-CB 3.41Å; D35-R37 PolarHBondContact OD1-N 2.82Å; R37-E39 PolarHBondContact O-N 3.47Å
38A53Low64Low60 Ų6088.7 Ų88.750%0.49656%0.556SS.*SBendtrans-93.188.6169.300000107.9D35 A40D35-A38 PolarHBondContact O-N 3.31Å; A38-A40 VanDerWaalsContact O-CA 3.3Å; A38-A40 WeakPolarHBondContact O-CA 3.43Å; A38-A40 PolarHBondContact O-N 2.83Å
39E59.1Low66.6Low152 Ų15288.3 Ų88.371%0.7155%0.547SS*.  trans-46.899.4155.1-178.171.2-143.800105.7R37 L41R37-E39 PolarHBondContact O-N 3.47Å; E39-L41 VanDerWaalsContact C-N 3.29Å; E39-L41 WeakPolarHBondContact O-CG 3.26Å; E39-L41 PolarHBondContact O-N 3.33Å
40A63.7Low68.9Low55 Ų5588.4 Ų88.446%0.45553%0.532SS..  trans-70.191-154.300000109.2A38 R42A38-A40 VanDerWaalsContact O-CA 3.3Å; A38-A40 WeakPolarHBondContact O-CA 3.43Å; A38-A40 PolarHBondContact O-N 2.83Å; A40-R42 PolarHBondContact O-N 2.92Å
41L79.3Confident71.5Confident36 Ų3686.3 Ų86.319%0.18851%0.505CS..  trans-59.2115.2-171.2-76.4165.5000109.5E39 T51 H66 W75 R77E39-L41 VanDerWaalsContact C-N 3.29Å; E39-L41 WeakPolarHBondContact O-CG 3.26Å; E39-L41 PolarHBondContact O-N 3.33Å; L41-T51 WeakPolarHBondContact O-CB 3.29Å; L41-T51 WeakPolarHBondContact O-CG2 3.4Å; L41-T51 PolarHBondContact O-OG1 3.32Å; L41-H66 WeakPolarHBondContact CD1-NE2 3.42Å; L41-W75 HydrophobicContact CB-CH2 3.36Å; L41-W75 HydrophobicContact CB-CZ2 3.81Å; L41-W75 HydrophobicContact CB-CZ3 4.4Å; L41-W75 HydrophobicContact CD1-CH2 3.78Å; L41-W75 HydrophobicContact CD2-CH2 4.43Å; L41-W75 HydrophobicContact CG-CH2 4.04Å; L41-R77 HydrophobicContact CD1-CB 4.18Å; L41-R77 HydrophobicContact CD1-CG 4.15Å; L41-R77 HydrophobicContact CD2-CG 3.84Å
42R88.8Confident74Confident180 Ų18090.9 Ų90.968%0.67951%0.507SS*.  trans-71.8135.9178.8-64.3-172.4-178.3-175.20.9109.2A40 P44A40-R42 PolarHBondContact O-N 2.92Å; R42-P44 WeakPolarHBondContact O-CD 3.29Å
43C90.1Very high76Confident0 Ų090.5 Ų90.50%049%0.488CS..  trans-67119.7174.4-176.90000109.3R45 C46 D47 S48 T51 C68C43-R45 PolarHBondContact O-N 2.79Å; C43-C46 PolarHBondContact O-N 3.46Å; C43-D47 VanDerWaalsContact O-CA 3.29Å; C43-D47 WeakPolarHBondContact O-CA 3.43Å; C43-D47 PolarHBondContact O-N 3.44Å; C43-S48 PolarHBondContact N-O 2.82Å; C43-S48 VanDerWaalsContact N-O 3.11Å; C43-T51 HydrophobicContact CB-CG2 3.72Å; C43-C68 HydrophobicContact CB-CB 3.85Å; C43-C68 VanDerWaalsContact CB-SG 3.55Å; C43-C68 VanDerWaalsContact SG-CB 3.5Å; C43-C68 VanDerWaalsContact SG-SG 3.68Å
44P87.8Confident77.9Confident58 Ų5886.6 Ų86.638%0.37747%0.466SS..THydrogen-bonded Turntrans-67.9-2-177.328.5-36.8000114.2R42 L81R42-P44 WeakPolarHBondContact O-CD 3.29Å; P44-L81 HydrophobicContact CB-CD2 4.4Å; P44-L81 HydrophobicContact CG-CD1 4.38Å
45R84.5Confident79.8Confident70 Ų7087.6 Ų87.626%0.26445%0.453SS..THydrogen-bonded Turntrans-96.8-27.2179-65.7-174.5170.2173.5-5.1113.7C43 R73C43-R45 PolarHBondContact O-N 2.79Å; R45-R73 VanDerWaalsContact NH1-CD 3.25Å
46C89Confident81.8Confident50 Ų5088.5 Ų88.534%0.33845%0.45SS..THydrogen-bonded Turntrans-147.810.2-172.365.30000113.3C43 S48 C71C43-C46 PolarHBondContact O-N 3.46Å; C46-S48 PolarHBondContact O-N 3.1Å; C46-S48 PolarHBondContact SG-OG 2.91Å; C46-C71 HydrophobicContact CB-CB 4.18Å; C46-C71 VanDerWaalsContact SG-SG 3.64Å
47D89.2Confident83.4Confident107 Ų10783.8 Ų83.857%0.57242%0.418SS*.  trans52.915177.9-55.1-49.3000116.1C43C43-D47 VanDerWaalsContact O-CA 3.29Å; C43-D47 WeakPolarHBondContact O-CA 3.43Å; C43-D47 PolarHBondContact O-N 3.44Å
48S89.4Confident84Confident18 Ų1878.7 Ų78.713%0.12641%0.408CS..  trans-76.6135.7-178.569.50000110.9C43 C46 N50 C68 A70C43-S48 PolarHBondContact N-O 2.82Å; C43-S48 VanDerWaalsContact N-O 3.11Å; C46-S48 PolarHBondContact O-N 3.1Å; C46-S48 PolarHBondContact SG-OG 2.91Å; S48-N50 PolarHBondContact O-N 2.93Å; S48-C68 PolarHBondContact OG-SG 3.09Å; S48-A70 WeakPolarHBondContact OG-CB 3.49Å
49A92.6Very high84.8Confident58 Ų5887 Ų8748%0.47943%0.428SS..SBendtrans-73.3-4.4170.700000113.7T51A49-T51 PolarHBondContact O-N 2.85Å
50N90.5Very high85.6Confident105 Ų10581.4 Ų81.456%0.56141%0.406SS*.  trans-82.759.6-179.4-71.7-77.3000111.8S48 K69S48-N50 PolarHBondContact O-N 2.93Å; N50-K69 HydrophobicContact CB-CB 4.13Å; N50-K69 PolarHBondContact O-N 3.11Å
51T92.5Very high86.5Confident30 Ų3085.4 Ų85.418%0.18442%0.419CS..EExtended strand (participates in β ladder)trans-110.4146.9174.672.80000110.5L41 C43 A49 F67 C68 W75L41-T51 WeakPolarHBondContact O-CB 3.29Å; L41-T51 WeakPolarHBondContact O-CG2 3.4Å; L41-T51 PolarHBondContact O-OG1 3.32Å; C43-T51 HydrophobicContact CB-CG2 3.72Å; A49-T51 PolarHBondContact O-N 2.85Å; T51-F67 CarbonylContact C-O 3.49Å; T51-F67 VanDerWaalsContact CA-O 3.32Å; T51-F67 WeakPolarHBondContact CA-O 3.23Å; T51-C68 HydrophobicContact CG2-CB 4.23Å; T51-W75 HydrophobicContact CG2-CZ2 3.74Å
52K93.2Very high86.8Confident161 Ų16188.9 Ų88.970%0.745%0.446SS*.EExtended strand (participates in β ladder)trans-133.6138.1176.7-168-173172.2169.70109.1C54 H66 F67K52-C54 PolarHBondContact O-N 3.49Å; K52-H66 CarbonylContact O-C 3.49Å; K52-H66 VanDerWaalsContact O-CA 3.27Å; K52-H66 WeakPolarHBondContact O-CA 3.33Å; K52-F67 PolarHBondContact N-O 3.32Å; K52-F67 PolarHBondContact O-N 3.38Å
53F91.7Very high86.6Confident85 Ų8583.9 Ų83.937%0.37343%0.43SS..EExtended strand (participates in β ladder)trans-56134.8164.8175.4-97.8000110.2Y56 P64F53-Y56 HydrophobicContact CE1-CE2 4.28Å; F53-Y56 HydrophobicContact CE2-CD1 4.18Å; F53-Y56 HydrophobicContact CE2-CD2 4.39Å; F53-Y56 AromaticContact CE2-CE1 3.9Å; F53-Y56 HydrophobicContact CE2-CE1 3.9Å; F53-Y56 HydrophobicContact CE2-CE2 4.13Å; F53-Y56 HydrophobicContact CE2-CG 4.41Å; F53-Y56 AromaticContact CE2-CZ 3.87Å; F53-Y56 HydrophobicContact CZ-CD1 4.26Å; F53-Y56 AromaticContact CZ-CD2 3.67Å; F53-Y56 HydrophobicContact CZ-CD2 3.67Å; F53-Y56 HydrophobicContact CZ-CE1 4.07Å; F53-Y56 AromaticContact CZ-CE2 3.44Å; F53-Y56 HydrophobicContact CZ-CE2 3.44Å; F53-Y56 VanDerWaalsContact CZ-CE2 3.44Å; F53-Y56 HydrophobicContact CZ-CG 4.07Å; F53-Y56 AromaticContact CZ-CZ 3.65Å; F53-P64 HydrophobicContact CD2-CB 3.93Å; F53-P64 HydrophobicContact CE2-CB 3.61Å
54C92.6Very high86.7Confident60 Ų6085.4 Ų85.441%0.40544%0.44SS..EExtended strand (participates in β ladder)trans-113.9-56-176.9-162.30000112.2K52 R65 F67 Y74K52-C54 PolarHBondContact O-N 3.49Å; C54-R65 PolarHBondContact N-O 3.35Å; C54-F67 HydrophobicContact CB-CB 4.29Å; C54-Y74 HydrophobicContact CB-CD1 4.48Å; C54-Y74 HydrophobicContact CB-CE1 4.17Å
55Y93.4Very high86.9Confident104 Ų10484.9 Ų84.941%0.40843%0.431SS..EExtended strand (participates in β ladder)trans-168.4167.7179.663.2-80.4000110.1R65 Y74Y55-R65 VanDerWaalsContact CE2-CD 3.47Å; Y55-R65 WeakPolarHBondContact O-CA 3.33Å; Y55-R65 VanDerWaalsContact O-CB 3.32Å; Y55-R65 WeakPolarHBondContact O-CB 3.29Å; Y55-R65 PolarHBondContact O-N 2.69Å; Y55-R65 WeakPolarHBondContact OH-CD 3.29Å; Y55-Y74 HydrophobicContact CE1-CE1 4.24Å
56Y92Very high87.3Confident111 Ų11182.5 Ų82.544%0.43542%0.423SS..EExtended strand (participates in β ladder)trans-89.4142.3171.5-67-75.2000111F53 L61 P64F53-Y56 HydrophobicContact CE1-CE2 4.28Å; F53-Y56 HydrophobicContact CE2-CD1 4.18Å; F53-Y56 HydrophobicContact CE2-CD2 4.39Å; F53-Y56 AromaticContact CE2-CE1 3.9Å; F53-Y56 HydrophobicContact CE2-CE1 3.9Å; F53-Y56 HydrophobicContact CE2-CE2 4.13Å; F53-Y56 HydrophobicContact CE2-CG 4.41Å; F53-Y56 AromaticContact CE2-CZ 3.87Å; F53-Y56 HydrophobicContact CZ-CD1 4.26Å; F53-Y56 AromaticContact CZ-CD2 3.67Å; F53-Y56 HydrophobicContact CZ-CD2 3.67Å; F53-Y56 HydrophobicContact CZ-CE1 4.07Å; F53-Y56 AromaticContact CZ-CE2 3.44Å; F53-Y56 HydrophobicContact CZ-CE2 3.44Å; F53-Y56 VanDerWaalsContact CZ-CE2 3.44Å; F53-Y56 HydrophobicContact CZ-CG 4.07Å; F53-Y56 AromaticContact CZ-CZ 3.65Å; Y56-L61 HydrophobicContact CD1-CD2 4.46Å; Y56-L61 WeakPolarHBondContact CD1-O 3.2Å; Y56-L61 HydrophobicContact CD2-CD2 3.86Å; Y56-L61 VanDerWaalsContact CE1-O 3.26Å; Y56-L61 WeakPolarHBondContact CE1-O 3.29Å; Y56-L61 HydrophobicContact CE2-CD2 3.99Å; Y56-L61 HydrophobicContact CG-CD2 4.12Å; Y56-P64 HydrophobicContact CD1-CB 4.08Å; Y56-P64 HydrophobicContact CE1-CB 3.81Å
57N86.2Confident87.5Confident28 Ų2883 Ų8315%0.1542%0.42CS..SBendtrans-79.7135.2178-167.741.4000112.2Y59 S60 Q63 R65N57-Y59 PolarHBondContact O-N 2.97Å; N57-S60 PolarHBondContact O-N 3.04Å; N57-S60 PolarHBondContact O-OG 2.95Å; N57-Q63 HydrophobicContact CB-CB 4.17Å; N57-Q63 HydrophobicContact CB-CG 4.19Å; N57-Q63 PolarHBondContact N-O 2.92Å; N57-Q63 VanDerWaalsContact N-O 3.15Å; N57-Q63 PolarHBondContact ND2-OE1 3.27Å; N57-R65 HydrophobicContact CB-CG 4.39Å; N57-R65 PolarHBondContact ND2-NH2 3.47Å; N57-R65 VanDerWaalsContact ND2-NH2 3.11Å; N57-R65 PolarHBondContact OD1-NE 2.87Å; N57-R65 PolarHBondContact OD1-NH2 2.85Å
58N66.4Low87.7Confident124 Ų12478 Ų7866%0.66339%0.392SS*.THydrogen-bonded Turntrans29.866.6169.9-74.3-27.5000114.7S60N58-S60 PolarHBondContact O-N 3.12Å
59Y69.5Low87.8Confident235 Ų23584.4 Ų84.492%0.92242%0.418SS*.THydrogen-bonded Turntrans64.74.5170.3-45-79.8000115.8N57N57-Y59 PolarHBondContact O-N 2.97Å
60S76.1Confident87.8Confident34 Ų3484.2 Ų84.224%0.23842%0.416CS..  trans-101.3116.4175.468.70000111N57 N58 S62 Q63N57-S60 PolarHBondContact O-N 3.04Å; N57-S60 PolarHBondContact O-OG 2.95Å; N58-S60 PolarHBondContact O-N 3.12Å; S60-S62 PolarHBondContact O-N 2.82Å; S60-Q63 PolarHBondContact O-N 2.97Å
61L82.1Confident87.8Confident140 Ų14080.1 Ų80.173%0.73340%0.396SS*.THydrogen-bonded Turntrans-68.2-14.6171.8-63.3178.3000112.1Y56 Q63Y56-L61 HydrophobicContact CD1-CD2 4.46Å; Y56-L61 WeakPolarHBondContact CD1-O 3.2Å; Y56-L61 HydrophobicContact CD2-CD2 3.86Å; Y56-L61 VanDerWaalsContact CE1-O 3.26Å; Y56-L61 WeakPolarHBondContact CE1-O 3.29Å; Y56-L61 HydrophobicContact CE2-CD2 3.99Å; Y56-L61 HydrophobicContact CG-CD2 4.12Å; L61-Q63 VanDerWaalsContact C-N 3.3Å; L61-Q63 PolarHBondContact O-N 3.23Å
62S85.4Confident87.8Confident109 Ų10986.7 Ų86.776%0.76242%0.422SS*.THydrogen-bonded Turntrans-77-10.5178.758.30000114.1S60 P64S60-S62 PolarHBondContact O-N 2.82Å; S62-P64 VanDerWaalsContact C-CD 3.4Å; S62-P64 VanDerWaalsContact O-CD 3.25Å; S62-P64 WeakPolarHBondContact O-CD 3.22Å
63Q85.6Confident87.7Confident74 Ų7483.5 Ų83.535%0.34641%0.405SS..  trans-12270.8-176.1-158.5175.936.300113.3N57 S60 L61 R65 T76N57-Q63 HydrophobicContact CB-CB 4.17Å; N57-Q63 HydrophobicContact CB-CG 4.19Å; N57-Q63 PolarHBondContact N-O 2.92Å; N57-Q63 VanDerWaalsContact N-O 3.15Å; N57-Q63 PolarHBondContact ND2-OE1 3.27Å; S60-Q63 PolarHBondContact O-N 2.97Å; L61-Q63 VanDerWaalsContact C-N 3.3Å; L61-Q63 PolarHBondContact O-N 3.23Å; Q63-R65 PolarHBondContact O-N 2.86Å; Q63-T76 HydrophobicContact CG-CG2 4.27Å
64P90.6Very high87.7Confident33 Ų3384.9 Ų84.921%0.21441%0.409CS..EExtended strand (participates in β ladder)trans-69.5122.817827.7-34.1000112.1F53 Y56 S62 H66F53-P64 HydrophobicContact CD2-CB 3.93Å; F53-P64 HydrophobicContact CE2-CB 3.61Å; Y56-P64 HydrophobicContact CD1-CB 4.08Å; Y56-P64 HydrophobicContact CE1-CB 3.81Å; S62-P64 VanDerWaalsContact C-CD 3.4Å; S62-P64 VanDerWaalsContact O-CD 3.25Å; S62-P64 WeakPolarHBondContact O-CD 3.22Å; P64-H66 PolarHBondContact O-ND1 2.81Å
65R92Very high87.5Confident46 Ų4682.9 Ų82.917%0.17439%0.393CS..EExtended strand (participates in β ladder)trans-90.8134.2172.8-63.6-179.4175.5-74.42.2110.9C54 Y55 N57 Q63 T76C54-R65 PolarHBondContact N-O 3.35Å; Y55-R65 VanDerWaalsContact CE2-CD 3.47Å; Y55-R65 WeakPolarHBondContact O-CA 3.33Å; Y55-R65 VanDerWaalsContact O-CB 3.32Å; Y55-R65 WeakPolarHBondContact O-CB 3.29Å; Y55-R65 PolarHBondContact O-N 2.69Å; Y55-R65 WeakPolarHBondContact OH-CD 3.29Å; N57-R65 HydrophobicContact CB-CG 4.39Å; N57-R65 PolarHBondContact ND2-NH2 3.47Å; N57-R65 VanDerWaalsContact ND2-NH2 3.11Å; N57-R65 PolarHBondContact OD1-NE 2.87Å; N57-R65 PolarHBondContact OD1-NH2 2.85Å; Q63-R65 PolarHBondContact O-N 2.86Å; R65-T76 HydrophobicContact CG-CG2 3.95Å
66H93.1Very high87.4Confident21 Ų2179.3 Ų79.310%0.09738%0.382CS..EExtended strand (participates in β ladder)trans-114.4137.4177.8-63.974.2000109.6L41 K52 P64 Y74 W75L41-H66 WeakPolarHBondContact CD1-NE2 3.42Å; K52-H66 CarbonylContact O-C 3.49Å; K52-H66 VanDerWaalsContact O-CA 3.27Å; K52-H66 WeakPolarHBondContact O-CA 3.33Å; P64-H66 PolarHBondContact O-ND1 2.81Å; H66-Y74 CarbonylContact O-C 3.47Å; H66-Y74 VanDerWaalsContact O-CA 3.24Å; H66-Y74 WeakPolarHBondContact O-CA 3.39Å; H66-W75 HydrophobicContact CB-CD2 3.89Å; H66-W75 HydrophobicContact CB-CE3 4.42Å; H66-W75 HydrophobicContact CB-CG 4.38Å; H66-W75 HydrophobicContact CB-CH2 3.74Å; H66-W75 HydrophobicContact CB-CZ2 3.26Å; H66-W75 HydrophobicContact CB-CZ3 4.35Å; H66-W75 AromaticContact CD2-CH2 3.86Å; H66-W75 AromaticContact CD2-CZ2 3.89Å; H66-W75 AromaticContact CG-CH2 3.54Å; H66-W75 AromaticContact CG-CZ2 3.55Å; H66-W75 PolarHBondContact N-O 3.08Å; H66-W75 AromaticContact ND1-CH2 3.86Å; H66-W75 PolarHBondContact O-N 2.97Å
67F92.8Very high86.9Confident61 Ų6181.1 Ų81.127%0.26839%0.388SS..EExtended strand (participates in β ladder)trans-98.6127.3172.9-177.9-104.7000109.9T51 K52 C54 K72 Y74T51-F67 CarbonylContact C-O 3.49Å; T51-F67 VanDerWaalsContact CA-O 3.32Å; T51-F67 WeakPolarHBondContact CA-O 3.23Å; K52-F67 PolarHBondContact N-O 3.32Å; K52-F67 PolarHBondContact O-N 3.38Å; C54-F67 HydrophobicContact CB-CB 4.29Å; F67-K72 HydrophobicContact CE2-CB 4.49Å; F67-K72 HydrophobicContact CZ-CB 4.12Å; F67-K72 HydrophobicContact CZ-CG 4.48Å; F67-Y74 HydrophobicContact CB-CD1 3.99Å; F67-Y74 HydrophobicContact CB-CE1 3.9Å; F67-Y74 AromaticContact CD2-CD1 3.82Å; F67-Y74 HydrophobicContact CD2-CD1 3.82Å; F67-Y74 HydrophobicContact CD2-CD2 4.49Å; F67-Y74 AromaticContact CD2-CE1 3.53Å; F67-Y74 HydrophobicContact CD2-CE1 3.53Å; F67-Y74 HydrophobicContact CD2-CE2 4.23Å; F67-Y74 HydrophobicContact CD2-CG 4.29Å; F67-Y74 AromaticContact CD2-CZ 3.75Å; F67-Y74 HydrophobicContact CE2-CE1 4.46Å; F67-Y74 HydrophobicContact CG-CD1 4.41Å; F67-Y74 HydrophobicContact CG-CE1 4.11Å
68C93.4Very high86.6Confident0 Ų084 Ų840%042%0.424CS..EExtended strand (participates in β ladder)trans-91.4119.4171.9177.50000110.6C43 S48 T51 A70 C71 K72 R73C43-C68 HydrophobicContact CB-CB 3.85Å; C43-C68 VanDerWaalsContact CB-SG 3.55Å; C43-C68 VanDerWaalsContact SG-CB 3.5Å; C43-C68 VanDerWaalsContact SG-SG 3.68Å; S48-C68 PolarHBondContact OG-SG 3.09Å; T51-C68 HydrophobicContact CG2-CB 4.23Å; C68-A70 VanDerWaalsContact C-N 3.33Å; C68-A70 PolarHBondContact O-N 2.82Å; C68-C71 VanDerWaalsContact CB-SG 3.58Å; C68-C71 PolarHBondContact SG-SG 2.87Å; C68-K72 WeakPolarHBondContact O-CA 3.18Å; C68-K72 PolarHBondContact O-N 3.02Å; C68-R73 PolarHBondContact N-O 3.36Å; C68-R73 PolarHBondContact O-N 3.14Å
69K92.1Very high87.1Confident154 Ų15479.8 Ų79.867%0.6741%0.41SS*.THydrogen-bonded Turntrans-69.6-30.6179.2-166.4176.3-179.2-177.40112.5N50N50-K69 HydrophobicContact CB-CB 4.13Å; N50-K69 PolarHBondContact O-N 3.11Å
70A91.9Very high87Confident53 Ų5375 Ų7544%0.43841%0.405SS..THydrogen-bonded Turntrans-72.3-47.7-177.700000112.7S48 C68S48-A70 WeakPolarHBondContact OG-CB 3.49Å; C68-A70 VanDerWaalsContact C-N 3.33Å; C68-A70 PolarHBondContact O-N 2.82Å
71C91.1Very high86.6Confident20 Ų2076.2 Ų76.214%0.13541%0.409CS..THydrogen-bonded Turntrans-101.91.4-179.7690000114.3C46 C68 R73C46-C71 HydrophobicContact CB-CB 4.18Å; C46-C71 VanDerWaalsContact SG-SG 3.64Å; C68-C71 VanDerWaalsContact CB-SG 3.58Å; C68-C71 PolarHBondContact SG-SG 2.87Å; C71-R73 VanDerWaalsContact C-N 3.26Å; C71-R73 WeakPolarHBondContact O-CG 3.29Å; C71-R73 PolarHBondContact O-N 2.79Å
72K92.1Very high86.2Confident167 Ų16779.2 Ų79.273%0.72641%0.41SS*.THydrogen-bonded Turntrans52.140-180-57-172.8179.2-165.80113.6F67 C68F67-K72 HydrophobicContact CE2-CB 4.49Å; F67-K72 HydrophobicContact CZ-CB 4.12Å; F67-K72 HydrophobicContact CZ-CG 4.48Å; C68-K72 WeakPolarHBondContact O-CA 3.18Å; C68-K72 PolarHBondContact O-N 3.02Å
73R90.8Very high84.8Confident94 Ų9481.9 Ų81.936%0.35542%0.416SS..EExtended strand (participates in β ladder)trans-127.1142.6-176.2-79.2163.2167.9-130.610.7110.9R45 C68 C71R45-R73 VanDerWaalsContact NH1-CD 3.25Å; C68-R73 PolarHBondContact N-O 3.36Å; C68-R73 PolarHBondContact O-N 3.14Å; C71-R73 VanDerWaalsContact C-N 3.26Å; C71-R73 WeakPolarHBondContact O-CG 3.29Å; C71-R73 PolarHBondContact O-N 2.79Å
74Y92.1Very high83.4Confident114 Ų11480 Ų8045%0.44741%0.41SS..EExtended strand (participates in β ladder)trans-79144.3170.2-59.7-79000111.2C54 Y55 H66 F67C54-Y74 HydrophobicContact CB-CD1 4.48Å; C54-Y74 HydrophobicContact CB-CE1 4.17Å; Y55-Y74 HydrophobicContact CE1-CE1 4.24Å; H66-Y74 CarbonylContact O-C 3.47Å; H66-Y74 VanDerWaalsContact O-CA 3.24Å; H66-Y74 WeakPolarHBondContact O-CA 3.39Å; F67-Y74 HydrophobicContact CB-CD1 3.99Å; F67-Y74 HydrophobicContact CB-CE1 3.9Å; F67-Y74 AromaticContact CD2-CD1 3.82Å; F67-Y74 HydrophobicContact CD2-CD1 3.82Å; F67-Y74 HydrophobicContact CD2-CD2 4.49Å; F67-Y74 AromaticContact CD2-CE1 3.53Å; F67-Y74 HydrophobicContact CD2-CE1 3.53Å; F67-Y74 HydrophobicContact CD2-CE2 4.23Å; F67-Y74 HydrophobicContact CD2-CG 4.29Å; F67-Y74 AromaticContact CD2-CZ 3.75Å; F67-Y74 HydrophobicContact CE2-CE1 4.46Å; F67-Y74 HydrophobicContact CG-CD1 4.41Å; F67-Y74 HydrophobicContact CG-CE1 4.11Å
75W89.9Confident82Confident18 Ų1883.2 Ų83.27%0.06843%0.431CS..EExtended strand (participates in β ladder)trans-149.8167.1176.465.5-85.3000110.1L41 T51 H66 R77L41-W75 HydrophobicContact CB-CH2 3.36Å; L41-W75 HydrophobicContact CB-CZ2 3.81Å; L41-W75 HydrophobicContact CB-CZ3 4.4Å; L41-W75 HydrophobicContact CD1-CH2 3.78Å; L41-W75 HydrophobicContact CD2-CH2 4.43Å; L41-W75 HydrophobicContact CG-CH2 4.04Å; T51-W75 HydrophobicContact CG2-CZ2 3.74Å; H66-W75 HydrophobicContact CB-CD2 3.89Å; H66-W75 HydrophobicContact CB-CE3 4.42Å; H66-W75 HydrophobicContact CB-CG 4.38Å; H66-W75 HydrophobicContact CB-CH2 3.74Å; H66-W75 HydrophobicContact CB-CZ2 3.26Å; H66-W75 HydrophobicContact CB-CZ3 4.35Å; H66-W75 AromaticContact CD2-CH2 3.86Å; H66-W75 AromaticContact CD2-CZ2 3.89Å; H66-W75 AromaticContact CG-CH2 3.54Å; H66-W75 AromaticContact CG-CZ2 3.55Å; H66-W75 PolarHBondContact N-O 3.08Å; H66-W75 AromaticContact ND1-CH2 3.86Å; H66-W75 PolarHBondContact O-N 2.97Å; W75-R77 HydrophobicContact CZ3-CB 4.05Å
76T90.3Very high80.4Confident30 Ų3087.7 Ų87.718%0.18446%0.463CS..EExtended strand (participates in β ladder)trans-129.8139.2-178.247.40000109.7Q63 R65 G78Q63-T76 HydrophobicContact CG-CG2 4.27Å; R65-T76 HydrophobicContact CG-CG2 3.95Å; T76-G78 PolarHBondContact O-N 2.82Å
77R82.6Confident78.9Confident149 Ų14990.1 Ų90.156%0.56249%0.494SS*.THydrogen-bonded Turntrans-70.8126.3175.7-171.2-172.3-176.7140.11.5108.8L41 W75 G79L41-R77 HydrophobicContact CD1-CB 4.18Å; L41-R77 HydrophobicContact CD1-CG 4.15Å; L41-R77 HydrophobicContact CD2-CG 3.84Å; W75-R77 HydrophobicContact CZ3-CB 4.05Å; R77-G79 PolarHBondContact O-N 3.19Å; R77-G79 VanDerWaalsContact O-N 3.16Å
78G78.7Confident77.4Confident87 Ų8789.3 Ų89.390%0.89750%0.502SS*.THydrogen-bonded Turntrans72.4-0.4176.200000116.2T76T76-G78 PolarHBondContact O-N 2.82Å
79G76.5Confident75.9Confident36 Ų3691.4 Ų91.437%0.37152%0.524SS..SBendtrans-78.3147.1169.600000110.7R77 L81R77-G79 PolarHBondContact O-N 3.19Å; R77-G79 VanDerWaalsContact O-N 3.16Å; G79-L81 PolarHBondContact O-N 3.06Å
80T66.9Low74.3Confident134 Ų13488.8 Ų88.882%0.82252%0.524SS*.  trans-53.4113.2169-54.40000108.3R82T80-R82 PolarHBondContact O-N 2.9Å
81L69.2Low72.9Confident61 Ų6197.2 Ų97.232%0.31955%0.545SS..  trans-61.9112.5170.7-175.765.6000105.4P44 G79 N83 V84P44-L81 HydrophobicContact CB-CD2 4.4Å; P44-L81 HydrophobicContact CG-CD1 4.38Å; G79-L81 PolarHBondContact O-N 3.06Å; L81-N83 PolarHBondContact O-N 3.31Å; L81-V84 HydrophobicContact CD1-CG2 4.22Å; L81-V84 HydrophobicContact CD2-CB 4.07Å; L81-V84 HydrophobicContact CD2-CG2 4.39Å; L81-V84 HydrophobicContact CG-CB 4.28Å; L81-V84 HydrophobicContact CG-CG2 4.1Å
82R73.8Confident71.4Confident202 Ų202105.4 Ų105.476%0.76258%0.578SS**  trans-44.7114.8170.3-64.5178.1-176.1160.4-1.7106.4T80 V84T80-R82 PolarHBondContact O-N 2.9Å; R82-V84 WeakPolarHBondContact O-CG2 3.36Å; R82-V84 PolarHBondContact O-N 3.46Å
83N56.2Low69.8Low165 Ų165104.2 Ų104.288%0.88258%0.58SS**SBendtrans-36.7100.9-163.9-72.5-52.8000111.6L81L81-N83 PolarHBondContact O-N 3.31Å
84V54.5Low67.9Low35 Ų35109 Ų10921%0.21260%0.603CS.*  trans-112.4111.7177.8-179.50000106.1L81 R82 V86L81-V84 HydrophobicContact CD1-CG2 4.22Å; L81-V84 HydrophobicContact CD2-CB 4.07Å; L81-V84 HydrophobicContact CD2-CG2 4.39Å; L81-V84 HydrophobicContact CG-CB 4.28Å; L81-V84 HydrophobicContact CG-CG2 4.1Å; R82-V84 WeakPolarHBondContact O-CG2 3.36Å; R82-V84 PolarHBondContact O-N 3.46Å; V84-V86 PolarHBondContact O-N 3.49Å
85P63.2Low66.3Low101 Ų101114.6 Ų114.666%0.65662%0.623SS**  trans-58128.8171.323.4-31.5000109.2G87 G88P85-G87 PolarHBondContact O-N 3.15Å; P85-G88 PolarHBondContact O-N 3.16Å; P85-G88 VanDerWaalsContact O-N 3.12Å
86V57.3Low64.7Low139 Ų139118.6 Ų118.684%0.84265%0.654SS**THydrogen-bonded Turntrans-58.5109.8175.6-176.90000107.1V84V84-V86 PolarHBondContact O-N 3.49Å
87G62.3Low62.9Low73 Ų73122 Ų12275%0.75368%0.679SS**THydrogen-bonded Turntrans124.4-5.3-173.400000116P85 G89P85-G87 PolarHBondContact O-N 3.15Å; G87-G89 VanDerWaalsContact C-N 3.33Å; G87-G89 PolarHBondContact O-N 3.21Å
88G60.5Low61.3Low43 Ų43126.6 Ų126.644%0.44370%0.696SS.*  trans-74.864.4-179.500000116.7P85P85-G88 PolarHBondContact O-N 3.16Å; P85-G88 VanDerWaalsContact O-N 3.12Å
89G61.2Low59.9Low45 Ų45127.9 Ų127.946%0.46469%0.692SS.*  trans76.584.5144.100000118.4G87 R91G87-G89 VanDerWaalsContact C-N 3.33Å; G87-G89 PolarHBondContact O-N 3.21Å; G89-R91 PolarHBondContact O-N 3.42Å; G89-R91 VanDerWaalsContact O-N 3.12Å
90C59.7Low58.4Low99 Ų99130.1 Ų130.167%0.66971%0.714SS**  trans-64.4105.1140.8-175.50000106.6K92C90-K92 VanDerWaalsContact C-N 3.27Å; C90-K92 PolarHBondContact O-N 2.94Å
91R61.1Low57.5Low229 Ų229127.4 Ų127.486%0.86471%0.713SS**  trans-63.994.2170.5-77.9-174.5177.7-161.9-0.3107.2G89 N93G89-R91 PolarHBondContact O-N 3.42Å; G89-R91 VanDerWaalsContact O-N 3.12Å; R91-N93 PolarHBondContact O-N 3.27Å
92K59.8Low56.3Low192 Ų192128.7 Ų128.784%0.83574%0.741SS**  trans-63.7102.3166.1-174.7115.5175.1-175.30106.4C90 K94C90-K92 VanDerWaalsContact C-N 3.27Å; C90-K92 PolarHBondContact O-N 2.94Å; K92-K94 PolarHBondContact O-N 3.48Å
93N58.4Low55.1Low143 Ų143122.8 Ų122.877%0.76574%0.743SS**  trans-59.5103.7165.9-77.991.1000107.6R91 R95R91-N93 PolarHBondContact O-N 3.27Å; N93-R95 VanDerWaalsContact C-N 3.26Å; N93-R95 PolarHBondContact O-N 3.45Å
94K52.6Low54.9Low193 Ų193126.1 Ų126.184%0.83974%0.744SS**  trans-68.493.7160.9-164.2164.6-175.2-169.80105.5K92 S96K92-K94 PolarHBondContact O-N 3.48Å; K94-S96 PolarHBondContact O-N 2.86Å
95R58.5Low54.8Low233 Ų233131.9 Ų131.988%0.87977%0.773SS**  trans-62.390.8161.4-81.6-173.7-178.7-155.7-0106.2N93 S97N93-R95 VanDerWaalsContact C-N 3.26Å; N93-R95 PolarHBondContact O-N 3.45Å; R95-S97 PolarHBondContact O-N 2.86Å
96S54.9Low54.1Low102 Ų102130.8 Ų130.871%0.71378%0.78SS**  trans-71.675.115543.40000107.2K94 R98K94-S96 PolarHBondContact O-N 2.86Å; S96-R98 PolarHBondContact O-N 3.28Å; S96-R98 VanDerWaalsContact O-N 3.11Å
97S52.8Low53.9Low101 Ų101129.7 Ų129.771%0.70678%0.779SS**  trans-68.1106.6160.251.80000106.4R95 S99R95-S97 PolarHBondContact O-N 2.86Å; S97-S99 VanDerWaalsContact C-N 3.32Å; S97-S99 PolarHBondContact O-N 2.85Å
98R48.3Very low53.3Low246 Ų246131.8 Ų131.893%0.92878%0.782SS**  trans-56.294.6170.2-68.8164.176.8171.73.3108.2S96 G100S96-R98 PolarHBondContact O-N 3.28Å; S96-R98 VanDerWaalsContact O-N 3.11Å; R98-G100 PolarHBondContact O-N 3.43Å
99S51.1Low53Low114 Ų114134.9 Ų134.980%0.79780%0.797SS**  trans-77.7100.4158.648.30000106.8S97S97-S99 VanDerWaalsContact C-N 3.32Å; S97-S99 PolarHBondContact O-N 2.85Å
100G43.2Very low52.4Low82 Ų82138.2 Ų138.285%0.84581%0.813SS**  trans-59.6133.516500000109.6R98R98-G100 PolarHBondContact O-N 3.43Å
101G48.1Very low52.3Low77 Ų77142.6 Ų142.679%0.79482%0.821SS**  trans170.888.4179.100000112.4
102G45.8Very low51.6Low88 Ų88137.4 Ų137.491%0.90782%0.82SS**  trans35.7131.6144.600000121.8
103G48Very low51.2Low79 Ų79133.1 Ų133.181%0.81481%0.814SS**  trans152.980150.900000116.4
104R51.2Low50.8Low235 Ų235131.5 Ų131.589%0.88781%0.814SS**  trans-16.4125.8153.3-60.5166.9175.3-177.5-3.8115.8
105N52.6Low50.8Low156 Ų156128.5 Ų128.583%0.83482%0.817SS**  177.2110.8116.3-92.6-4.1000110.6
106G47.6Very low50.6Low78 Ų78122.2 Ų122.280%0.80482%0.815SS**  trans-87.5125.6159.300000108.8
107S54.9Low50.2Low116 Ų116123.7 Ų123.781%0.81182%0.815SS**  trans-147.4117.9159.5-68.60000108.6
108S49.9Very low49.9Very low116 Ų116124.7 Ų124.781%0.81182%0.822SS**  trans-53.5139.9169.3450000114.5
109S53.6Low50.2Low109 Ų109118 Ų11876%0.76281%0.809SS**  trans-157.9119.2140.649.50000110.9
110S48.8Very low49.9Very low115 Ų115117 Ų11780%0.80481%0.807SS**  trans-77.5141.5176.4-42.70000110.6
111F56.1Low50.7Low191 Ų191120.4 Ų120.484%0.83881%0.805SS**  trans-143.6120.6148.951.5-87.6000108.9
112S46.6Very low51.2Low120 Ų120122.4 Ų122.484%0.83980%0.804SS**  trans-112.9126.9176.8-55.10000107.9
113S52.5Low51.7Low102 Ų102126.1 Ų126.171%0.71380%0.802SS**  trans-168.695.2160.239.10000107.1
114S49.5Very low52.8Low109 Ų109128 Ų12876%0.76280%0.8SS**  74105.596.763.10000113.2
115S53.6Low53.9Low129 Ų129122.1 Ų122.190%0.90279%0.792SS**  trans-175.6123.4130.7-76.70000109.2
116A53.4Low54.8Low102 Ų102120.2 Ų120.284%0.84379%0.789SS**  trans-79136.8178.800000110.6
117D45.8Very low55.9Low132 Ų132122.7 Ų122.771%0.70679%0.79SS**  trans-154.6118.7137.1-161.586.8000107.1T119D117-T119 PolarHBondContact OD2-N 3.28Å; D117-T119 PolarHBondContact OD2-OG1 3.47Å
118S47.3Very low55.7Low123 Ų123123.4 Ų123.486%0.8679%0.79SS**  trans-13182.3173.1-710000106.3A120S118-A120 PolarHBondContact O-N 3.05Å
119T54.5Low55.9Low106 Ų106124.6 Ų124.665%0.6579%0.793SS**  trans-76.3107.1168.3-57.40000108.4D117D117-T119 PolarHBondContact OD2-N 3.28Å; D117-T119 PolarHBondContact OD2-OG1 3.47Å
120A45.3Very low55.8Low93 Ų93128.1 Ų128.177%0.76980%0.8SS**  trans-64.9128.7170.800000110.3S118S118-A120 PolarHBondContact O-N 3.05Å
121L58.7Low56Low152 Ų152125.9 Ų125.980%0.79679%0.794SS**  trans-115.5128.1164.1-67.1-179.8000108.9
122P59.4Low55.7Low119 Ų119122.4 Ų122.477%0.77379%0.794SS**PPolyproline II helixtrans-81.7144.7-174.231.9-32.4000112.3
123L56.2Low55.7Low166 Ų166124.1 Ų124.187%0.86979%0.792SS**PPolyproline II helixtrans-59.6138.8165.8-9566000111
124P72.1Confident55.9Low119 Ų119125 Ų12577%0.77380%0.796SS**PPolyproline II helixtrans-86.1141162.331.7-30.3000111.9
125P74.3Confident55.9Low111 Ų111124.8 Ų124.872%0.72179%0.794SS**PPolyproline II helixtrans-83.1160.1174.133.7-33.8000112.5
126P70.6Confident55.8Low117 Ų117123.2 Ų123.276%0.7678%0.784SS**PPolyproline II helixtrans-80.7133.517832.4-32.4000111.6T128P126-T128 PolarHBondContact O-N 3.46Å
127P70.9Confident55.6Low129 Ų129126.9 Ų126.984%0.83879%0.788SS**  trans-84.8111.9171.230.1-29.9000111.6
128T50.7Low55.4Low131 Ų131123.9 Ų123.980%0.80479%0.788SS**  trans-85.6108.9154.7420000109P126P126-T128 PolarHBondContact O-N 3.46Å
129T53.8Low55.4Low141 Ų141126.4 Ų126.487%0.86579%0.791SS**  trans-164.9142152.33.30000112
130M51.2Low55.2Low184 Ų184127.5 Ų127.591%0.90680%0.8SS**  trans-72.2148.4-176.6-54.4-145.975.900113.4
131G54.1Low55.3Low67 Ų67127.1 Ų127.169%0.69181%0.805SS**  trans-159.499.1158.300000106.7
132S49.5Very low54.8Low118 Ų118123.8 Ų123.883%0.82581%0.807SS**  62.4108.888.3-53.10000112.1
133L47.3Very low54.3Low156 Ų156122.8 Ų122.882%0.81781%0.809SS**  trans-48.5161.8-176.9-61.8146.3000114.4
134P56.6Low53.9Low122 Ų122120.2 Ų120.279%0.79281%0.805SS**  -128.5134.6107.234.8-28.6000113.4
135S48.2Very low52.7Low103 Ų103123 Ų12372%0.7281%0.812SS**  trans-67.4128.9166.1-51.80000110.6
136S51.6Low51.6Low97 Ų97125.3 Ų125.368%0.67882%0.818SS**  trans-174.6134.1154.938.20000111
137L49.7Very low50.5Low179 Ų179128.4 Ų128.494%0.93783%0.827SS**  trans79.4104.3169.5-48.5158.7000113.3
138G42.2Very low49.3Very low68 Ų68125.4 Ų125.470%0.70182%0.819SS**  cis114.393.923.800000108.6
139L47.4Very low49.2Very low177 Ų177124.7 Ų124.793%0.92782%0.82SS**  trans-160.5139.8150.9-121.289.4000109
140P49.5Very low48.7Very low129 Ų129122.5 Ų122.584%0.83882%0.816SS**  trans-104.5158.9-15939-32000115
141G48.6Very low48.5Very low85 Ų85121.6 Ų121.688%0.87681%0.814SS**  trans126.7116164.600000111.5
142G47.1Very low48.2Very low82 Ų82124.6 Ų124.685%0.84582%0.821SS**  cis144.188.28.300000107.8
143A48Very low47.8Very low97 Ų97122.9 Ų122.980%0.80282%0.822SS**  trans-17692156.600000111.3
144S47.8Very low47.4Very low113 Ų113118.9 Ų118.979%0.7982%0.818SS**  trans43.4101.4134.8-51.80000120.8
145L48.2Very low46.8Very low176 Ų176118.3 Ų118.392%0.92182%0.824SS**  trans-80.4122.2144.3-70.2169.3000108.7
146L51.3Low46.7Very low160 Ų160115.5 Ų115.584%0.83881%0.811SS**  trans-132.898.1159.7-75.3179.8000110.1
147L47.7Very low47Very low183 Ų183118.7 Ų118.796%0.95882%0.821SS**  trans3129.8134.3-143.773.4000117.7
148G45.1Very low47.3Very low65 Ų65117 Ų11767%0.6781%0.807SS**  trans135.4127.6160.900000111.2
149S48.4Very low48.1Very low117 Ų117120.8 Ų120.882%0.81881%0.807SS**  cis-160.1151.26.7-65.30000107.1
150A42.7Very low48.7Very low95 Ų95120 Ų12079%0.78580%0.798SS**  trans-58.6139.5177.300000113.5
151L48.2Very low49.4Very low165 Ų165119.8 Ų119.886%0.86479%0.789SS**  trans-136131.3145.3-85.4102.9000108.8
152P46.2Very low50.4Low130 Ų130117.5 Ų117.584%0.84477%0.766SS**  trans-94.9145.7175.436-28.8000110.8
153G43Very low51.7Low82 Ų82119.5 Ų119.585%0.84576%0.757SS**  trans146.2126.4160.100000114.5
154G38.3Very low53Low71 Ų71120.9 Ų120.973%0.73275%0.745SS**  trans106.581.9152.900000116.3
155A43.3Very low54.4Low110 Ų110121.2 Ų121.291%0.90973%0.733SS**  trans28.1126.5133.200000120.4
156G46.7Very low55.5Low44 Ų44115.3 Ų115.345%0.45471%0.71SS.*  trans124.483.6144.900000115.7H158G156-H158 PolarHBondContact O-N 2.77Å
157D57.5Low56.7Low165 Ų165110 Ų11088%0.88269%0.69SS**SBendtrans34.814.1140.7-59.1-44.1000123.1
158H57.1Low57.8Low142 Ų142105.9 Ų105.966%0.65767%0.667SS**  trans-115.44.9-175.1-73-68.7000115.9G156 H160 G162G156-H158 PolarHBondContact O-N 2.77Å; H158-H160 PolarHBondContact O-N 3.08Å; H158-G162 PolarHBondContact O-N 2.8Å
159H58.4Low58.9Low148 Ų148108.2 Ų108.269%0.68566%0.66SS**Hα-helixtrans-70.6-24.4-174-69.1-82.7000115.1L163H159-L163 WeakPolarHBondContact O-CG 3.49Å; H159-L163 PolarHBondContact O-N 2.84Å; H159-L163 VanDerWaalsContact O-N 3.11Å
160H59.1Low59.7Low160 Ų160105.8 Ų105.874%0.74164%0.643SS**Hα-helixtrans-76.9-35.9179.9-166.5-100.3000112.8H158 F164H158-H160 PolarHBondContact O-N 3.08Å; H160-F164 WeakPolarHBondContact O-CB 3.46Å; H160-F164 PolarHBondContact O-N 3.31Å
161L64.5Low60.8Low126 Ų126105 Ų10566%0.6663%0.628SS**Hα-helixtrans-68.4-37.6173.6-95129.5000111.6F164 Q165L161-F164 PolarHBondContact O-N 2.67Å; L161-Q165 VanDerWaalsContact O-CB 3.29Å; L161-Q165 WeakPolarHBondContact O-CB 3.12Å; L161-Q165 PolarHBondContact O-N 3.49Å
162G69.8Low61.5Low37 Ų37101.8 Ų101.838%0.38162%0.615SS.*Hα-helixtrans-64.7-44.5175.400000112.9H158 Q165 A166H158-G162 PolarHBondContact O-N 2.8Å; G162-Q165 PolarHBondContact O-N 2.91Å; G162-A166 VanDerWaalsContact O-CB 3.29Å; G162-A166 WeakPolarHBondContact O-CB 3.38Å; G162-A166 PolarHBondContact O-N 3.43Å
163L73.7Confident62.4Low124 Ų12499 Ų9965%0.64960%0.599SS**Hα-helixtrans-65.5-39.5175.9-76.6165.7000112.3H159 A166 A167H159-L163 WeakPolarHBondContact O-CG 3.49Å; H159-L163 PolarHBondContact O-N 2.84Å; H159-L163 VanDerWaalsContact O-N 3.11Å; L163-A166 PolarHBondContact O-N 3.39Å; L163-A167 VanDerWaalsContact O-CB 3.29Å; L163-A167 WeakPolarHBondContact O-CB 3.24Å; L163-A167 PolarHBondContact O-N 2.83Å
164F77.1Confident63.2Low126 Ų12698.2 Ų98.255%0.55358%0.581SS**Hα-helixtrans-67.2-41.2174.9-178.9-101.4000112H160 L161 A167 M168H160-F164 WeakPolarHBondContact O-CB 3.46Å; H160-F164 PolarHBondContact O-N 3.31Å; L161-F164 PolarHBondContact O-N 2.67Å; F164-A167 PolarHBondContact O-N 3.26Å; F164-M168 HydrophobicContact CD1-CG 4.1Å; F164-M168 HydrophobicContact CD2-CG 4.47Å; F164-M168 HydrophobicContact CE1-CG 3.67Å; F164-M168 HydrophobicContact CE1-SD 4.45Å; F164-M168 HydrophobicContact CE2-CG 4.08Å; F164-M168 HydrophobicContact CE2-SD 4.31Å; F164-M168 HydrophobicContact CG-CG 4.49Å; F164-M168 HydrophobicContact CZ-CG 3.66Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.38Å; F164-M168 VanDerWaalsContact O-CG 3.26Å; F164-M168 WeakPolarHBondContact O-CG 3.38Å; F164-M168 PolarHBondContact O-N 3.07Å
165Q75.4Confident64.2Low119 Ų11999.8 Ų99.856%0.55657%0.572SS**Hα-helixtrans-64.9-40.9175.3-174.4172.625.100111.5L161 G162 M168 Q169L161-Q165 VanDerWaalsContact O-CB 3.29Å; L161-Q165 WeakPolarHBondContact O-CB 3.12Å; L161-Q165 PolarHBondContact O-N 3.49Å; G162-Q165 PolarHBondContact O-N 2.91Å; Q165-M168 PolarHBondContact O-N 3Å; Q165-Q169 WeakPolarHBondContact O-CB 3.21Å; Q165-Q169 WeakPolarHBondContact O-CG 3.42Å; Q165-Q169 PolarHBondContact O-N 3.2Å
166A72Confident65Low53 Ų5397.4 Ų97.444%0.43855%0.552SS.*Hα-helixtrans-65.1-39173.900000111.9G162 L163 Q169 S170G162-A166 VanDerWaalsContact O-CB 3.29Å; G162-A166 WeakPolarHBondContact O-CB 3.38Å; G162-A166 PolarHBondContact O-N 3.43Å; L163-A166 PolarHBondContact O-N 3.39Å; A166-Q169 PolarHBondContact O-N 3.16Å; A166-S170 WeakPolarHBondContact O-CB 3.34Å; A166-S170 PolarHBondContact O-N 3.48Å
167A75.5Confident66Low49 Ų4999.1 Ų99.141%0.40555%0.554SS.*Hα-helixtrans-65.6-40.6173.700000111.6L163 F164 S170 V171L163-A167 VanDerWaalsContact O-CB 3.29Å; L163-A167 WeakPolarHBondContact O-CB 3.24Å; L163-A167 PolarHBondContact O-N 2.83Å; F164-A167 PolarHBondContact O-N 3.26Å; A167-S170 WeakPolarHBondContact O-CB 3.42Å; A167-S170 PolarHBondContact O-N 3.11Å; A167-V171 WeakPolarHBondContact O-CG1 3.38Å; A167-V171 PolarHBondContact O-N 3.3Å
168M72.1Confident66.6Low95 Ų9593.9 Ų93.947%0.46853%0.534SS..Hα-helixtrans-68.5-38.5176.4-72.1-66.9-71.400112F164 Q165 V171 V172F164-M168 HydrophobicContact CD1-CG 4.1Å; F164-M168 HydrophobicContact CD2-CG 4.47Å; F164-M168 HydrophobicContact CE1-CG 3.67Å; F164-M168 HydrophobicContact CE1-SD 4.45Å; F164-M168 HydrophobicContact CE2-CG 4.08Å; F164-M168 HydrophobicContact CE2-SD 4.31Å; F164-M168 HydrophobicContact CG-CG 4.49Å; F164-M168 HydrophobicContact CZ-CG 3.66Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.38Å; F164-M168 VanDerWaalsContact O-CG 3.26Å; F164-M168 WeakPolarHBondContact O-CG 3.38Å; F164-M168 PolarHBondContact O-N 3.07Å; Q165-M168 PolarHBondContact O-N 3Å; M168-V171 WeakPolarHBondContact O-CG2 3.18Å; M168-V171 HydrophobicContact SD-CG2 4.35Å; M168-V172 VanDerWaalsContact O-CG2 3.23Å; M168-V172 WeakPolarHBondContact O-CG2 3.48Å; M168-V172 PolarHBondContact O-N 2.65Å; M168-V172 VanDerWaalsContact O-N 3.09Å
169Q68.9Low67Low115 Ų11594.8 Ų94.854%0.53753%0.533SS..Hα-helixtrans-68.1-37172.1-73.7175.417.100111.3Q165 A166 V172 S173Q165-Q169 WeakPolarHBondContact O-CB 3.21Å; Q165-Q169 WeakPolarHBondContact O-CG 3.42Å; Q165-Q169 PolarHBondContact O-N 3.2Å; A166-Q169 PolarHBondContact O-N 3.16Å; Q169-V172 PolarHBondContact O-N 3.04Å; Q169-S173 VanDerWaalsContact O-CB 3.29Å; Q169-S173 WeakPolarHBondContact O-CB 3.33Å; Q169-S173 PolarHBondContact O-N 3.33Å; Q169-S173 PolarHBondContact O-OG 3.47Å
170S64.3Low67.8Low66 Ų6692.5 Ų92.546%0.46253%0.525SS..Hα-helixtrans-61.5-45.3173.3155.70000111.9A166 A167 S173 S174A166-S170 WeakPolarHBondContact O-CB 3.34Å; A166-S170 PolarHBondContact O-N 3.48Å; A167-S170 WeakPolarHBondContact O-CB 3.42Å; A167-S170 PolarHBondContact O-N 3.11Å; S170-S173 PolarHBondContact O-N 3.41Å; S170-S174 VanDerWaalsContact O-CB 3.29Å; S170-S174 WeakPolarHBondContact O-CB 3.29Å; S170-S174 PolarHBondContact O-N 2.84Å; S170-S174 PolarHBondContact O-OG 3.45Å
171V66.3Low68.5Low77 Ų7791.4 Ų91.447%0.46752%0.52SS..Hα-helixtrans-69.1-34.6177.6-60.60000112.1A167 M168 D175A167-V171 WeakPolarHBondContact O-CG1 3.38Å; A167-V171 PolarHBondContact O-N 3.3Å; M168-V171 WeakPolarHBondContact O-CG2 3.18Å; M168-V171 HydrophobicContact SD-CG2 4.35Å; V171-D175 PolarHBondContact O-N 2.9Å; V171-D175 VanDerWaalsContact O-N 3.1Å
172V62.5Low69.1Low99 Ų9991 Ų9160%0.652%0.517SS*.Hα-helixtrans-70.2-39.6175.6173.50000111.4M168 Q169 A176M168-V172 VanDerWaalsContact O-CG2 3.23Å; M168-V172 WeakPolarHBondContact O-CG2 3.48Å; M168-V172 PolarHBondContact O-N 2.65Å; M168-V172 VanDerWaalsContact O-N 3.09Å; Q169-V172 PolarHBondContact O-N 3.04Å; V172-A176 WeakPolarHBondContact O-CB 3.49Å; V172-A176 PolarHBondContact O-N 2.97Å
173S64.6Low69.4Low70 Ų7095.7 Ų95.749%0.4953%0.529SS..Hα-helixtrans-69.1-39.7174.2-70.50000111.8Q169 S170 D175 A176 T177Q169-S173 VanDerWaalsContact O-CB 3.29Å; Q169-S173 WeakPolarHBondContact O-CB 3.33Å; Q169-S173 PolarHBondContact O-N 3.33Å; Q169-S173 PolarHBondContact O-OG 3.47Å; S170-S173 PolarHBondContact O-N 3.41Å; S173-D175 PolarHBondContact O-N 3.15Å; S173-A176 PolarHBondContact O-N 3.11Å; S173-T177 WeakPolarHBondContact O-CG2 3.27Å; S173-T177 PolarHBondContact O-N 3.25Å; S173-T177 PolarHBondContact O-OG1 3.03Å; S173-T177 VanDerWaalsContact O-OG1 3.08Å
174S60.5Low69.6Low67 Ų6795.7 Ų95.747%0.46953%0.525SS..Hα-helixtrans-63.5-40.4177.5-68.30000112.3S170 T177 A178S170-S174 VanDerWaalsContact O-CB 3.29Å; S170-S174 WeakPolarHBondContact O-CB 3.29Å; S170-S174 PolarHBondContact O-N 2.84Å; S170-S174 PolarHBondContact O-OG 3.45Å; S174-T177 PolarHBondContact O-OG1 3.49Å; S174-A178 VanDerWaalsContact O-CB 3.22Å; S174-A178 WeakPolarHBondContact O-CB 3.13Å; S174-A178 PolarHBondContact O-N 2.92Å
175D58.7Low69.7Low103 Ų10396.3 Ų96.355%0.55153%0.53SS*.Hα-helixtrans-68.1-40.6173.1-88.3-40.7000110.9V171 S173 A178 Y179V171-D175 PolarHBondContact O-N 2.9Å; V171-D175 VanDerWaalsContact O-N 3.1Å; S173-D175 PolarHBondContact O-N 3.15Å; D175-A178 PolarHBondContact O-N 3.15Å; D175-Y179 WeakPolarHBondContact O-CD2 3.32Å; D175-Y179 PolarHBondContact O-N 2.84Å; D175-Y179 VanDerWaalsContact O-N 3.16Å
176A61.1Low69.8Low60 Ų6097 Ų9750%0.49653%0.533SS..Hα-helixtrans-64.3-42.6178.600000113V172 S173 Y179 D180V172-A176 WeakPolarHBondContact O-CB 3.49Å; V172-A176 PolarHBondContact O-N 2.97Å; S173-A176 PolarHBondContact O-N 3.11Å; A176-Y179 PolarHBondContact O-N 2.86Å; A176-D180 PolarHBondContact O-N 3.31Å; A176-D180 VanDerWaalsContact O-N 3.15Å
177T67.3Low70.1Confident81 Ų8199.7 Ų99.750%0.49754%0.537SS..Hα-helixtrans-72-33.4177.556.50000112S173 S174 Y179 D180 E181S173-T177 WeakPolarHBondContact O-CG2 3.27Å; S173-T177 PolarHBondContact O-N 3.25Å; S173-T177 PolarHBondContact O-OG1 3.03Å; S173-T177 VanDerWaalsContact O-OG1 3.08Å; S174-T177 PolarHBondContact O-OG1 3.49Å; T177-Y179 VanDerWaalsContact C-N 3.32Å; T177-Y179 PolarHBondContact O-N 2.77Å; T177-D180 PolarHBondContact O-N 3.48Å; T177-E181 PolarHBondContact O-N 2.91Å
178A70.2Confident70.2Confident54 Ų54101.3 Ų101.345%0.44654%0.542SS..Hα-helixtrans-65.6-35.317600000112.3S174 D175 M182S174-A178 VanDerWaalsContact O-CB 3.22Å; S174-A178 WeakPolarHBondContact O-CB 3.13Å; S174-A178 PolarHBondContact O-N 2.92Å; D175-A178 PolarHBondContact O-N 3.15Å; A178-M182 WeakPolarHBondContact O-CB 3.32Å; A178-M182 PolarHBondContact O-N 3.37Å
179Y65.5Low70.5Confident162 Ų162103.3 Ų103.364%0.63555%0.55SS*.Hα-helixtrans-71.7-39.3173.2-80.6-68.5000112.6D175 A176 T177 M182 Q183D175-Y179 WeakPolarHBondContact O-CD2 3.32Å; D175-Y179 PolarHBondContact O-N 2.84Å; D175-Y179 VanDerWaalsContact O-N 3.16Å; A176-Y179 PolarHBondContact O-N 2.86Å; T177-Y179 VanDerWaalsContact C-N 3.32Å; T177-Y179 PolarHBondContact O-N 2.77Å; Y179-M182 PolarHBondContact O-N 2.96Å; Y179-Q183 PolarHBondContact O-N 2.82Å
180D74.4Confident71Confident100 Ų100101.4 Ų101.454%0.53554%0.543SS..Hα-helixtrans-65.8-44.5178-162-102.7000111.7A176 T177 M182 Q183 Q184A176-D180 PolarHBondContact O-N 3.31Å; A176-D180 VanDerWaalsContact O-N 3.15Å; T177-D180 PolarHBondContact O-N 3.48Å; D180-M182 PolarHBondContact O-N 2.76Å; D180-Q183 PolarHBondContact O-N 2.87Å; D180-Q184 WeakPolarHBondContact O-CB 3.25Å; D180-Q184 PolarHBondContact O-N 2.98Å
181E74.5Confident71.5Confident136 Ų136100.5 Ų100.564%0.63653%0.533SS*.Hα-helixtrans-61.5-43.3174.4-94.1-16690.200112.1T177 Q183 Q184 Q185T177-E181 PolarHBondContact O-N 2.91Å; E181-Q183 VanDerWaalsContact C-N 3.32Å; E181-Q183 PolarHBondContact O-N 2.92Å; E181-Q184 PolarHBondContact O-N 3.48Å; E181-Q185 WeakPolarHBondContact O-CB 3.25Å; E181-Q185 PolarHBondContact O-N 3.45Å
182M75.8Confident72.1Confident118 Ų118104.5 Ų104.558%0.58155%0.546SS*.Hα-helixtrans-64.6-38.6178.8-169.7-168.471.300111.5A178 Y179 D180 Q186A178-M182 WeakPolarHBondContact O-CB 3.32Å; A178-M182 PolarHBondContact O-N 3.37Å; Y179-M182 PolarHBondContact O-N 2.96Å; D180-M182 PolarHBondContact O-N 2.76Å; M182-Q186 PolarHBondContact O-N 2.71Å
183Q77.2Confident72.7Confident135 Ų135106.8 Ų106.863%0.63155%0.554SS**Hα-helixtrans-67.9-42.1174.8-107.2-156.7-2400111.8Y179 D180 E181 Q185 Q186 Q187Y179-Q183 PolarHBondContact O-N 2.82Å; D180-Q183 PolarHBondContact O-N 2.87Å; E181-Q183 VanDerWaalsContact C-N 3.32Å; E181-Q183 PolarHBondContact O-N 2.92Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 2.75Å; Q183-Q186 PolarHBondContact O-N 3.33Å; Q183-Q187 WeakPolarHBondContact O-CB 3.49Å; Q183-Q187 PolarHBondContact O-N 3.02Å
184Q77.5Confident73Confident124 Ų124108.7 Ų108.758%0.57956%0.559SS**Hα-helixtrans-64.8-35.9177.8-165.6170.676.900111.3D180 E181 Q187 T188D180-Q184 WeakPolarHBondContact O-CB 3.25Å; D180-Q184 PolarHBondContact O-N 2.98Å; E181-Q184 PolarHBondContact O-N 3.48Å; Q184-Q187 PolarHBondContact O-N 2.93Å; Q184-T188 WeakPolarHBondContact O-CB 3.42Å; Q184-T188 PolarHBondContact O-N 2.75Å; Q184-T188 PolarHBondContact O-OG1 2.93Å
185Q78.6Confident73Confident140 Ų140108.8 Ų108.865%0.65457%0.57SS**Hα-helixtrans-69.2-38.4175.5-158.2177.41.200112E181 Q183 T188 Q189E181-Q185 WeakPolarHBondContact O-CB 3.25Å; E181-Q185 PolarHBondContact O-N 3.45Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 2.75Å; Q185-T188 PolarHBondContact O-N 3.44Å; Q185-Q189 WeakPolarHBondContact O-CB 3.37Å; Q185-Q189 PolarHBondContact O-N 2.7Å
186Q79.4Confident73.2Confident134 Ų134109.2 Ų109.263%0.62657%0.571SS**Hα-helixtrans-66.6-41.3172.4-176.8173.566.200111.7M182 Q183 Q189 L190M182-Q186 PolarHBondContact O-N 2.71Å; Q183-Q186 PolarHBondContact O-N 3.33Å; Q186-Q189 WeakPolarHBondContact O-CB 3.3Å; Q186-Q189 PolarHBondContact O-N 2.91Å; Q186-L190 PolarHBondContact O-N 2.95Å
187Q77Confident72.4Confident109 Ų109109.1 Ų109.151%0.50958%0.576SS.*Hα-helixtrans-64.5-42.5176-169.166.845.700110.8Q183 Q184 Q189 L190 D191Q183-Q187 WeakPolarHBondContact O-CB 3.49Å; Q183-Q187 PolarHBondContact O-N 3.02Å; Q184-Q187 PolarHBondContact O-N 2.93Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.34Å; Q187-L190 CarbonylContact O-C 3.54Å; Q187-L190 WeakPolarHBondContact O-CA 3.29Å; Q187-L190 WeakPolarHBondContact O-CB 3.29Å; Q187-L190 PolarHBondContact O-N 3.41Å; Q187-D191 PolarHBondContact NE2-OD2 3.45Å; Q187-D191 PolarHBondContact O-N 3.27Å
188T76.8Confident71.8Confident83 Ų83116.5 Ų116.551%0.50960%0.597SS.*Hα-helixtrans-64.5-38.7175.6-51.50000111.3Q184 Q185 L190 D191 H192Q184-T188 WeakPolarHBondContact O-CB 3.42Å; Q184-T188 PolarHBondContact O-N 2.75Å; Q184-T188 PolarHBondContact O-OG1 2.93Å; Q185-T188 PolarHBondContact O-N 3.44Å; T188-L190 VanDerWaalsContact C-N 3.31Å; T188-D191 PolarHBondContact O-N 3.01Å; T188-H192 WeakPolarHBondContact O-CB 3.49Å; T188-H192 PolarHBondContact O-N 3.17Å
189Q78.6Confident70.5Confident136 Ų136117.3 Ų117.364%0.63661%0.61SS**Hα-helixtrans-60.9-41.2170.1-96.2-89.6-65.100111.4Q185 Q186 Q187 H192 L193Q185-Q189 WeakPolarHBondContact O-CB 3.37Å; Q185-Q189 PolarHBondContact O-N 2.7Å; Q186-Q189 WeakPolarHBondContact O-CB 3.3Å; Q186-Q189 PolarHBondContact O-N 2.91Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.34Å; Q189-H192 PolarHBondContact O-N 2.97Å; Q189-L193 VanDerWaalsContact O-CB 3.29Å; Q189-L193 WeakPolarHBondContact O-CB 3.26Å; Q189-L193 PolarHBondContact O-N 3.02Å
190L80.9Confident69.3Low76 Ų76113.8 Ų113.840%0.39862%0.623SS.*Hα-helixtrans-68.2-42176.8-122.4168.6000112.2Q186 Q187 T188 H192 L193 L194Q186-L190 PolarHBondContact O-N 2.95Å; Q187-L190 CarbonylContact O-C 3.54Å; Q187-L190 WeakPolarHBondContact O-CA 3.29Å; Q187-L190 WeakPolarHBondContact O-CB 3.29Å; Q187-L190 PolarHBondContact O-N 3.41Å; T188-L190 VanDerWaalsContact C-N 3.31Å; L190-H192 VanDerWaalsContact C-N 3.35Å; L190-L193 CarbonylContact O-C 3.58Å; L190-L193 PolarHBondContact O-N 3.01Å; L190-L193 VanDerWaalsContact O-N 3.15Å; L190-L194 HydrophobicContact CD2-CD1 3.46Å; L190-L194 VanDerWaalsContact CD2-CD1 3.46Å; L190-L194 HydrophobicContact CD2-CG 3.78Å; L190-L194 VanDerWaalsContact O-CB 3.29Å; L190-L194 WeakPolarHBondContact O-CB 3.28Å; L190-L194 VanDerWaalsContact O-CG 3.29Å; L190-L194 WeakPolarHBondContact O-CG 3.37Å; L190-L194 PolarHBondContact O-N 3.08Å
191D74Confident67.6Low47 Ų47112.3 Ų112.325%0.25163%0.631SS.*Hα-helixtrans-66.3-35.9175-91.8-74000112Q187 T188 L193 G195 L196Q187-D191 PolarHBondContact NE2-OD2 3.45Å; Q187-D191 PolarHBondContact O-N 3.27Å; T188-D191 PolarHBondContact O-N 3.01Å; D191-L193 VanDerWaalsContact C-N 3.31Å; D191-G195 PolarHBondContact O-N 2.81Å; D191-L196 PolarHBondContact O-N 2.95Å; D191-L196 VanDerWaalsContact OD1-CB 3.25Å; D191-L196 WeakPolarHBondContact OD1-CB 3.45Å
192H79.2Confident66.1Low160 Ų160110.9 Ų110.974%0.74164%0.643SS**Hα-helixtrans-71.7-27.5172.6-159-71.4000111.9T188 Q189 L190T188-H192 WeakPolarHBondContact O-CB 3.49Å; T188-H192 PolarHBondContact O-N 3.17Å; Q189-H192 PolarHBondContact O-N 2.97Å; L190-H192 VanDerWaalsContact C-N 3.35Å
193L74.5Confident64Low147 Ų147109.2 Ų109.277%0.7766%0.656SS**Hα-helixtrans-81.7-32.7174.7-152.274.6000112.4Q189 L190 D191Q189-L193 VanDerWaalsContact O-CB 3.29Å; Q189-L193 WeakPolarHBondContact O-CB 3.26Å; Q189-L193 PolarHBondContact O-N 3.02Å; L190-L193 CarbonylContact O-C 3.58Å; L190-L193 PolarHBondContact O-N 3.01Å; L190-L193 VanDerWaalsContact O-N 3.15Å; D191-L193 VanDerWaalsContact C-N 3.31Å
194L72.4Confident62.5Low111 Ų111107 Ų10758%0.58166%0.661SS**Hα-helixtrans-91.2-2.7178.8-67.3177.7000113.3L190 L196L190-L194 HydrophobicContact CD2-CD1 3.46Å; L190-L194 VanDerWaalsContact CD2-CD1 3.46Å; L190-L194 HydrophobicContact CD2-CG 3.78Å; L190-L194 VanDerWaalsContact O-CB 3.29Å; L190-L194 WeakPolarHBondContact O-CB 3.28Å; L190-L194 VanDerWaalsContact O-CG 3.29Å; L190-L194 WeakPolarHBondContact O-CG 3.37Å; L190-L194 PolarHBondContact O-N 3.08Å; L194-L196 HydrophobicContact CB-CD1 4.22Å; L194-L196 HydrophobicContact CB-CG 4.26Å; L194-L196 PolarHBondContact O-N 3.07Å
195G59.2Low60.7Low68 Ų68109.7 Ų109.770%0.70167%0.673SS**THydrogen-bonded Turntrans66.822.1177.600000114.3D191D191-G195 PolarHBondContact O-N 2.81Å
196L62.6Low59.3Low112 Ų112109.5 Ų109.559%0.58668%0.676SS**  trans-98.51.9-175.9-66.6176.7000113.4D191 L194 Y198D191-L196 PolarHBondContact O-N 2.95Å; D191-L196 VanDerWaalsContact OD1-CB 3.25Å; D191-L196 WeakPolarHBondContact OD1-CB 3.45Å; L194-L196 HydrophobicContact CB-CD1 4.22Å; L194-L196 HydrophobicContact CB-CG 4.26Å; L194-L196 PolarHBondContact O-N 3.07Å; L196-Y198 PolarHBondContact O-N 3.02Å
197G44.9Very low57.3Low58 Ų58110.7 Ų110.760%0.59868%0.681SS**  trans-65.797.9174.400000112.8G199G197-G199 PolarHBondContact O-N 2.91Å
198Y53.7Low56.1Low237 Ų237112.8 Ų112.893%0.92970%0.695SS**  trans-66.175.6165.1-94.2-98.6000110.2L196 G200L196-Y198 PolarHBondContact O-N 3.02Å; Y198-G200 PolarHBondContact O-N 2.84Å
199G43.3Very low54.7Low70 Ų70117.5 Ų117.572%0.72271%0.708SS**  trans-76.7107.4163.800000109.4G197 G201G197-G199 PolarHBondContact O-N 2.91Å; G199-G201 PolarHBondContact O-N 3.11Å
200G40.1Very low52.9Low89 Ų89117 Ų11792%0.91872%0.717SS**  trans-59.1115.4164.800000110Y198Y198-G200 PolarHBondContact O-N 2.84Å
201G38.9Very low51.6Low68 Ų68123.1 Ų123.170%0.70174%0.735SS**  trans179.696.8178.700000112G199G199-G201 PolarHBondContact O-N 3.11Å
202A42.6Very low50.1Low107 Ų107128.6 Ų128.688%0.88476%0.761SS**SBendtrans54.4104.9154.800000118.8
203G33.7Very low48.3Very low83 Ų83129.7 Ų129.786%0.85677%0.766SS**  trans74.772.2132.400000117.7
204A43.8Very low46.8Very low88 Ų88131.8 Ų131.873%0.72777%0.772SS**  trans-143.599.8148.100000109I206A204-I206 PolarHBondContact O-N 3.3Å
205Q41.2Very low45.5Very low181 Ų181131 Ų13185%0.84678%0.782SS**  trans-56.9100.4167.6-91.7-97.9-7.400109.2
206I48Very low44.6Very low136 Ų136133.2 Ų133.270%0.69779%0.793SS**  trans-106.4104.9160.7-60.1176.7000106.4A204 L208A204-I206 PolarHBondContact O-N 3.3Å; I206-L208 HydrophobicContact CG2-CD1 4.15Å; I206-L208 PolarHBondContact O-N 2.93Å
207Q37.8Very low43.4Very low159 Ų159130.8 Ų130.874%0.74380%0.796SS**  trans-55.8102.2172.8-93.1-102.631.300110.8
208L51.3Low43.4Very low153 Ų153133 Ų13380%0.80181%0.808SS**  trans-112.3122.4160.9-78.9130.6000107.9I206I206-L208 HydrophobicContact CG2-CD1 4.15Å; I206-L208 PolarHBondContact O-N 2.93Å
209K48.5Very low42.6Very low182 Ų182125.9 Ų125.979%0.79181%0.807SS**  trans-55.3135.5-169.5-75.5117.5170.9174.80112.6
210P39.5Very low42.1Very low125 Ų125126.4 Ų126.481%0.81281%0.813SS**  trans-88112.317733.4-28.2000110.1
211W54.6Low42.3Very low204 Ų204126.9 Ų126.977%0.77381%0.808SS**  trans-139.710.2168.370-87.6000114.7
212M42.4Very low42.6Very low162 Ų162129.7 Ų129.780%0.79881%0.813SS**  trans-130.650.9177.5-92.5-173.4162.100112.5
213Q41Very low42.6Very low184 Ų184127.7 Ų127.786%0.8680%0.804SS**  trans-133.381165.4-169.6152.149.800108
214E43.5Very low43.2Very low190 Ų190130.6 Ų130.689%0.88880%0.798SS**  trans-164.3150.3159.8-153.685.1134.100106.9
215A44.1Very low43.6Very low95 Ų95133.7 Ų133.779%0.78580%0.799SS**  trans86.750-179.500000117.1G217A215-G217 PolarHBondContact O-N 3.06Å
216A41.7Very low43.7Very low114 Ų114132.1 Ų132.194%0.94280%0.797SS**  trans-7799.5135.400000107.6
217G37.6Very low43.5Very low62 Ų62130.7 Ų130.764%0.63980%0.799SS**  trans165.5115.2175.500000114.5A215A215-G217 PolarHBondContact O-N 3.06Å
218A44.1Very low43.8Very low104 Ų104133.1 Ų133.186%0.8681%0.807SS**  trans69.3100.415500000118.4
219G36.8Very low43.3Very low88 Ų88136.6 Ų136.691%0.90781%0.811SS**  67.2112120.500000119
220G33.5Very low43.3Very low81 Ų81132.4 Ų132.484%0.83581%0.811SS**  trans129.295.3151.700000115
221A42.9Very low43.7Very low99 Ų99131.9 Ų131.982%0.81881%0.807SS**  trans-72.2174.6151.100000109.2
222P45.7Very low43.3Very low126 Ų126130.5 Ų130.582%0.81881%0.814SS**  cis-146.8170.512.639.5-18.6000117.8
223G43.1Very low43.4Very low66 Ų66130.8 Ų130.868%0.6882%0.818SS**  trans83.6149.8150.800000116.9
224I47.1Very low43.5Very low143 Ų143127.4 Ų127.473%0.73382%0.815SS**  cis-174.2163.4-2.234.6177.3000105.1
225M51.5Low43.5Very low154 Ų154124 Ų12476%0.75981%0.812SS**  trans94.1100.7161.7-45.8175.2-153.400118.5
226D42.9Very low43.3Very low148 Ų148124.7 Ų124.779%0.79181%0.811SS**  98.6130.5118.9-91.7-77.6000123.4
227S44.7Very low43.4Very low106 Ų106126.6 Ų126.674%0.74180%0.804SS**  trans83.475.9148.7-68.20000119.5
228F43Very low43.8Very low210 Ų210130.7 Ų130.792%0.92182%0.817SS**  trans-81.4101145.2-75.1-90.2000109.6
229Y42.2Very low43.5Very low226 Ų226131.7 Ų131.789%0.88681%0.814SS**  trans-170.7103.3149.7-127.6-91000110.6
230A46.9Very low43.5Very low94 Ų94130.9 Ų130.978%0.77781%0.806SS**  trans-174.7108.6149.800000110
231P47.8Very low43.9Very low114 Ų114134.9 Ų134.974%0.7481%0.807SS**PPolyproline II helixtrans-81.5133.8163.131.3-27.5000110
232L47.7Very low44.2Very low175 Ų175138.3 Ų138.392%0.91681%0.807SS**PPolyproline II helixtrans-62.7133.1179.3-67.7168.3000111.9
233L44.2Very low43.9Very low168 Ų168140.3 Ų140.388%0.8881%0.805SS**PPolyproline II helixtrans-60.8137.6163.5-63.7113000110.6
234S43.7Very low43.8Very low113 Ų113145 Ų14579%0.7981%0.814SS**  trans-171.1102.9139-81.90000111.7
235S41.9Very low43.4Very low119 Ų119147.2 Ų147.283%0.83282%0.821SS**  trans51.6112.6131.1-50.40000120.6
236S41.4Very low43.1Very low109 Ų109146.5 Ų146.576%0.76282%0.824SS**  -172.3113.2117.8-156.50000113.3
237L43.9Very low42.8Very low154 Ų154147.8 Ų147.881%0.80682%0.823SS**  trans25.8119.5145.2-82.261.6000121.2
238V44.7Very low42.5Very low148 Ų148147.1 Ų147.190%0.89782%0.824SS**  -147.5128.8125.3-176.90000109
239P38.6Very low42.3Very low124 Ų124145.1 Ų145.181%0.80582%0.818SS**  trans-96.8146.8-179.634.9-29.9000113.6
240G37Very low41.9Very low72 Ų72138.7 Ų138.774%0.74281%0.811SS**  trans148.8122.5157.200000116.7
241L42.1Very low41.7Very low164 Ų164139.3 Ų139.386%0.85982%0.816SS**  trans78.191.8166.7-74.5140.8000116.5
242E49.3Very low41.2Very low171 Ų171137.4 Ų137.480%0.79982%0.817SS**  73.288.683.3-158.9164.211500110.2
243E38.7Very low40.9Very low169 Ų169134.5 Ų134.579%0.7982%0.818SS**  89.5103.596.5-166.5167.2138.300110.9
244L41.6Very low40.8Very low165 Ų165130.3 Ų130.386%0.86482%0.816SS**  trans-170.794.1141.2-100.6162.2000108.8
245H37.9Very low40.7Very low189 Ų189132.3 Ų132.388%0.87582%0.817SS**  trans-67.6122.7160.9-86.3100.2000109
246V45.2Very low40.9Very low138 Ų138136 Ų13684%0.83682%0.821SS**  trans-132.1131.1152.7-178.40000109.2
247K35.9Very low40.8Very low176 Ų176139 Ų13977%0.76582%0.823SS**  trans-103140.6-165.4160.2171.1177.6166.80110
248A38.5Very low40.3Very low92 Ų92140.1 Ų140.176%0.7682%0.824SS**  trans-179.4100.7149.800000107.9
249E39.3Very low39.9Very low168 Ų168142.7 Ų142.779%0.78582%0.823SS**  45.7105.793.3-74.7-150.6103.900113.8
250A34.3Very low39.9Very low90 Ų90142.3 Ų142.374%0.74482%0.821SS**  84.110672.200000113.4
251A41.4Very low40Very low107 Ų107144.4 Ų144.488%0.88482%0.824SS**  trans177.4113.9150.700000106.4
252G37.9Very low40.1Very low75 Ų75141.3 Ų141.377%0.77382%0.817SS**  111.3101.87900000107.4
253A42.6Very low39.7Very low113 Ų113143.3 Ų143.393%0.93482%0.817SS**  96.8128.498.500000112.4
254G42Very low40Very low80 Ų80142.3 Ų142.383%0.82582%0.817SS**  trans147.270.816500000115.7
255D41.6Very low40Very low155 Ų155142.3 Ų142.383%0.82981%0.812SS**  trans-64.8132.5166.2-136.7-71.7000110.4
256H44.9Very low40.1Very low196 Ų196142.2 Ų142.291%0.90781%0.812SS**  trans-146.7117.2155.2-108.5-50.6000112.7
257Q40.5Very low40Very low174 Ų174140.4 Ų140.481%0.81381%0.806SS**  trans-58.1146.3-175.9-168.9-153.868.700116.1
258Q32.8Very low39.8Very low177 Ų177136.1 Ų136.183%0.82780%0.803SS**  trans-59.8151.8167.7-59.7169.9-24.200114.5
259K35.2Very low39.7Very low201 Ų201136.5 Ų136.587%0.87480%0.801SS**  -166.1137.6126.7-157.6167.2-179.2-1780113.8
260P38.8Very low39.6Very low116 Ų116138.8 Ų138.875%0.75380%0.802SS**  trans-108.7163.1-17940-31.6000114.5
261S40.3Very low39.8Very low116 Ų116140.2 Ų140.281%0.81180%0.797SS**  trans-178.6141.8162.6-1700000106.6
262S43.8Very low39.7Very low100 Ų100146.3 Ų146.370%0.69980%0.797SS**  cis-172.3150.218.311.30000108.4
263R40.2Very low39.9Very low213 Ų213151 Ų15180%0.80480%0.799SS**  trans18.7130.2146.6-89.3164153.4117.1-4.2118
264D46.4Very low40.1Very low148 Ų148153.2 Ų153.279%0.79180%0.795SS**  -156.5154.771.1-95.8-56.3000115.2
265Q40.2Very low40.6Very low165 Ų165155.4 Ų155.477%0.77179%0.794SS**  trans-71.4134.7178.5-65.8161.858.800111.5
266Q41.5Very low41.1Very low186 Ų186154 Ų15487%0.86979%0.791SS**  trans-151109.6141.8-150.7140.313.900111.6
267S41.2Very low40.9Very low100 Ų100151 Ų15170%0.69979%0.789SS**  trans21125.6149.156.30000120.2
268A32.7Very low40.9Very low86 Ų86148.4 Ų148.471%0.71179%0.79SS**  trans-38.4131.9160.900000115
269S36.5Very low41.2Very low101 Ų101145 Ų14571%0.70679%0.786SS**  trans-146.4111.4148.3-170.70000107.5D271S269-D271 PolarHBondContact O-N 2.86Å
270W38Very low41.7Very low216 Ų216140.4 Ų140.482%0.81878%0.779SS**  trans-90.584.5175.14.3-77.5000106.9
271D38.2Very low41.9Very low119 Ų119141.3 Ų141.364%0.63678%0.778SS**  trans-92.2115.4174.7-141.5-66.2000109.7S269 E273S269-D271 PolarHBondContact O-N 2.86Å; D271-E273 PolarHBondContact O-N 2.9Å
272W39.7Very low42.2Very low235 Ų235141.3 Ų141.389%0.8977%0.773SS**  trans-87.175.8179.9-72.7100.8000109.8
273E41.5Very low41.9Very low173 Ų173143.6 Ų143.681%0.80878%0.777SS**  trans-94.3106171.3-89.9-177.180.500112.1D271D271-E273 PolarHBondContact O-N 2.9Å
274L45.6Very low41.9Very low161 Ų161138 Ų13884%0.84378%0.776SS**  trans-69.3127.4165.2-73.1150.4000110.2T276L274-T276 PolarHBondContact O-N 3.28Å
275P53.3Low41.6Very low126 Ų126138.2 Ų138.282%0.81878%0.777SS**  trans-76.2115.5167.1-13.929.2000110.8
276T52.6Low41.6Very low124 Ų124136.4 Ų136.476%0.76178%0.777SS**  trans-61.6139.4171.450.80000112.2L274L274-T276 PolarHBondContact O-N 3.28Å
277P39.6Very low41.4Very low133 Ų133134 Ų13486%0.86478%0.775SS**  trans-88.1119172.633.2-27.7000109.7
278S41.7Very low41.3Very low120 Ų120134.6 Ų134.684%0.83978%0.775SS**  trans-127.1130.1170.1-152.50000111.6
279S38.2Very low41.5Very low107 Ų107135.1 Ų135.175%0.74878%0.779SS**  trans-69.9148.5-170.1-47.90000113.9
280S46.6Very low41.9Very low104 Ų104136.6 Ų136.673%0.72779%0.789SS**  161.2149124.4500000112.1
281N42.2Very low41.8Very low134 Ų134134.3 Ų134.372%0.71779%0.793SS**  trans85.789.8170.1-58.5-56000116
282V46Very low42Very low117 Ų117132.9 Ų132.971%0.70980%0.798SS**  78.6115.683.6-64.80000114.3
283D38.2Very low42.2Very low148 Ų148129.6 Ų129.679%0.79180%0.797SS**  trans71.9108.8142.9-62.5-52.3000121.8
284A40.3Very low42.5Very low95 Ų95130.1 Ų130.179%0.78580%0.801SS**  76.1126.4123.900000119.1
285N40.9Very low42Very low152 Ų152127.4 Ų127.481%0.81380%0.803SS**  trans88.677.3153.9-147.928.2000116.5
286V39.5Very low41.2Very low127 Ų127126.2 Ų126.277%0.7780%0.803SS**  trans-147.593.9141.9121.70000109.2
287V37.2Very low40.6Very low137 Ų137125.6 Ų125.683%0.8381%0.811SS**  trans-81.795.9158.3170.10000105.1
288T38.6Very low40.3Very low112 Ų112124.3 Ų124.369%0.68781%0.811SS**  trans-165.1136.216727.20000111.4
289A37.1Very low40Very low96 Ų96123.4 Ų123.479%0.79381%0.811SS**SBendtrans77.570.5160.200000118.3
290S44.4Very low40.3Very low132 Ų132123.2 Ų123.292%0.92382%0.816SS**SBendtrans-149.35143.4-58.70000114.1
291D37.2Very low40Very low169 Ų169123.2 Ų123.290%0.90482%0.816SS**  trans-113.270.5-177.6-133-59.9000109.2
292A41.1Very low40.4Very low89 Ų89125.5 Ų125.574%0.73683%0.825SS**  trans-160.964.817900000111.9
293L44.4Very low40.3Very low166 Ų166127.1 Ų127.187%0.86983%0.829SS**SBendtrans-169.1127.3157.6-102.6143.1000107.4
294M47.7Very low40.8Very low183 Ų183126 Ų12690%0.90183%0.83SS**SBendtrans110.726.9177.4-56.2-59.9-178.500118.5
295A34.9Very low40.7Very low105 Ų105125.2 Ų125.287%0.86882%0.823SS**  trans-134.178.6162.700000111.6
296A37.9Very low40.8Very low101 Ų101124.4 Ų124.484%0.83582%0.824SS**  trans-157.8141164.600000110.4
297A38.2Very low40.8Very low111 Ų111122.7 Ų122.792%0.91782%0.818SS**  trans86.251.317700000117.9
298A33.3Very low41.2Very low106 Ų106123.1 Ų123.188%0.87682%0.82SS**  trans-112.587.7149.300000108.6
299A37.1Very low41.3Very low100 Ų100122.5 Ų122.583%0.82682%0.82SS**  trans-169.390.1170.800000111.6
300A44.2Very low41.5Very low103 Ų103122.4 Ų122.485%0.85181%0.814SS**  trans157.4124.3157.800000105.3
301S40.1Very low41.5Very low105 Ų105122.3 Ų122.373%0.73481%0.808SS**  cis-163.7112.823.4167.60000107.7
302M49.4Very low42.1Very low182 Ų182119.4 Ų119.490%0.89780%0.798SS**  trans31.9119.4132.4-42.4-176176.700119.5
303N44.4Very low42.1Very low151 Ų151120.3 Ų120.381%0.80780%0.799SS**  trans-78.9161165.3-140.1-33.1000110.2
304P49.1Very low42.1Very low123 Ų123119.3 Ų119.380%0.79980%0.8SS**  -148.4137.910533.4-14.7000117.7
305A38.4Very low42Very low79 Ų79114.7 Ų114.765%0.65379%0.791SS**  trans-4.5143145.500000121.5
306V42.2Very low42.6Very low136 Ų136115.3 Ų115.382%0.82479%0.786SS**  151143.1125.2-80.20000108.8
307S40.6Very low42.9Very low91 Ų91117.8 Ų117.864%0.63679%0.791SS**  cis-178.8147-5.9-900000106.8
308V44.7Very low43.4Very low145 Ų145116.6 Ų116.688%0.87978%0.781SS**  trans63144.4149.1-56.40000119.4
309S40.7Very low44.1Very low99 Ų99117.8 Ų117.869%0.69278%0.78SS**  cis-166.9146.622.394.10000112.8
310S41.6Very low44.7Very low94 Ų94118 Ų11866%0.65778%0.775SS**  trans51.6109.7138.35.90000122.3
311T44.6Very low44.7Very low130 Ų130118.4 Ų118.480%0.79877%0.772SS**  71.7160.781.860.60000117.1
312P49.3Very low45.1Very low108 Ų108123 Ų12370%0.70178%0.779SS**  -143-171.2-50.942.1-23.2000114.8
313S42.3Very low45Very low108 Ų108122.7 Ų122.776%0.75578%0.78SS**  trans80.6125.8160-61.20000118.4
314T42.8Very low45.4Very low146 Ų146125.8 Ų125.890%0.89678%0.782SS**  -169.8155.167.4-550000110.9
315A47.1Very low45.1Very low86 Ų86131.6 Ų131.671%0.71179%0.788SS**  trans-85.9-151.3-164.800000116.2
316P45.9Very low45.2Very low118 Ų118129.9 Ų129.977%0.76678%0.778SS**  -127.6157.6-92.138-21.2000114.9
317T44.9Very low45.4Very low153 Ų153131.3 Ų131.394%0.93978%0.781SS**  trans-154.9147.4161-15.50000114.7
318A49.1Very low45.4Very low86 Ų86132.6 Ų132.671%0.71179%0.79SS**  trans-68.3172.2-161.600000118.2
319P47.9Very low45.6Very low131 Ų131128.9 Ų128.985%0.85178%0.781SS**  trans-91.1144.6-172.435.7-29.2000112.6
320S49.2Very low45.9Very low103 Ų103132.7 Ų132.772%0.7279%0.792SS**  trans-113.3129.4175.52.30000111.3
321S43.7Very low46.1Very low113 Ų113132.3 Ų132.379%0.7980%0.803SS**  trans-58.7134.2174.9-44.70000112.7
322F49.6Very low46Very low202 Ų202129.8 Ų129.889%0.88680%0.802SS**  trans-114.1102.2160.8-77.9-77.8000109.2
323L47.5Very low45.9Very low174 Ų174129.8 Ų129.891%0.91181%0.812SS**PPolyproline II helixtrans-80.4120.4159.3-70.6168.2000107.3
324Y51.9Low45.9Very low216 Ų216129.6 Ų129.685%0.84782%0.816SS**PPolyproline II helixtrans-102.4117.5168.7179.9-105000108.6
325W43Very low46Very low246 Ų246126.8 Ų126.893%0.93281%0.808SS**PPolyproline II helixtrans-95.4132.2176.6-172.2-48.7000108.9
326G39.9Very low46.1Very low42 Ų42127.5 Ų127.543%0.43381%0.814SS.*  trans104110.3143.200000117.6
327N46.1Very low46.5Very low166 Ų166133.2 Ų133.289%0.88882%0.821SS**  -150.5119.9123.9-158.823000110.1
328S42.4Very low47.5Very low118 Ų118131.4 Ų131.483%0.82581%0.811SS**  trans-81132.8175-63.60000109.7
329G47.8Very low47.6Very low67 Ų67134.3 Ų134.369%0.69182%0.815SS**  trans-155.875.517800000112.2
330I47.6Very low47.7Very low179 Ų179136 Ų13692%0.91882%0.816SS**  trans18.8116141.220.3172.3000118.5
331G45.3Very low47.7Very low87 Ų87135.3 Ų135.390%0.89782%0.817SS**  trans121.4116.5144.100000116.2
332G42.1Very low48.1Very low76 Ų76136.8 Ų136.878%0.78482%0.815SS**  trans134.992.4153.400000117
333A47Very low48Very low108 Ų108132.3 Ų132.389%0.89381%0.808SS**  trans53.8127142.600000121.6
334A42.3Very low47.8Very low104 Ų104127.7 Ų127.786%0.8680%0.803SS**  trans-68.4141.8178.400000114.5
335A46.1Very low47.5Very low88 Ų88123.3 Ų123.373%0.72780%0.804SS**  trans-147.2101.5148.800000108.1
336A48.6Very low48.1Very low101 Ų101117.5 Ų117.584%0.83580%0.801SS**  trans-76.9132177.400000110.5
337W55.5Low48.5Very low238 Ų238123.6 Ų123.690%0.90282%0.821SS**  trans-109.8130.6160.7-68.976.3000107.5D339W337-D339 PolarHBondContact O-N 3.33Å
338P65.7Low48.9Very low114 Ų114120.3 Ų120.374%0.7482%0.818SS**  trans-76.2120.7174.928.8-30.6000110.5
339D50.3Low49.6Very low148 Ų148120.2 Ų120.279%0.79181%0.812SS**  trans-73.2117.8167-161-37.7000108.8W337 A341W337-D339 PolarHBondContact O-N 3.33Å; D339-A341 VanDerWaalsContact C-N 3.35Å; D339-A341 PolarHBondContact O-N 3.49Å
340L50Low50.1Low167 Ų167123.9 Ų123.987%0.87482%0.815SS**  trans-81.585169.1-87.494.9000109.2
341A48.8Very low50.6Low88 Ų88128.5 Ų128.573%0.72783%0.829SS**  trans-107.197.8153.300000107.9D339D339-A341 VanDerWaalsContact C-N 3.35Å; D339-A341 PolarHBondContact O-N 3.49Å
342N52.2Low50.9Low143 Ų143130.6 Ų130.677%0.76583%0.825SS**  trans-147.1131.5162.5-159.910.9000113.1
343C48.7Very low51.4Low109 Ų109133.4 Ų133.474%0.73683%0.828SS**  trans58.3122.9148.6640000120.1
344G43.1Very low51.6Low77 Ų77134.8 Ų134.879%0.79482%0.824SS**  trans162.626.9150.400000118.2S346G344-S346 PolarHBondContact O-N 3.34Å
345S45.3Very low52.1Low124 Ų124136.6 Ų136.687%0.86782%0.822SS**  trans-76.5118.6161.8-58.30000109.2
346S54.9Low52.5Low124 Ų124139.7 Ų139.787%0.86783%0.828SS**  trans-147.790.5157.9-79.90000108.6G344G344-S346 PolarHBondContact O-N 3.34Å
347I48.3Very low52.8Low169 Ų169142.3 Ų142.387%0.86783%0.827SS**  trans-89.9118.7149.6-97.3165.3000105
348A54.1Low52.6Low98 Ų98135.4 Ų135.481%0.8182%0.822SS**  trans-147.9103.1162.500000108.1
349T57.7Low51.6Low116 Ų116137.1 Ų137.171%0.71283%0.829SS**  trans-52.7147.4164-43.50000111.6
350L58.7Low51.7Low144 Ų144136.2 Ų136.275%0.75483%0.832SS**  trans130121.9140-67.4166.9000114.3
351F58.5Low51.9Low275 Ų275133.4 Ų133.4100%1.20683%0.828SS**  trans83.90173.3-64.8-80.1000118.4

Retrieved 351 of 351 residues in 123.6 ms (Link to these results)