A0A096NSE8_PAPAN Loading...

Forkhead box E3

AlphaFold DB (A0A2K5NVF9), UniProt , Accession A0A096NSE8, Species PAPAN (Papio anubis, Olive baboon), Gene FOXE3, Length 318 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.3Very low52.4Low243 Ų243143.9 Ų143.9100%1.19785%0.847SS**  0170.20-106.358.6172.800110
2A44.4Very low52.1Low106 Ų106140 Ų14088%0.87684%0.843SS**  trans-51.8161.5-178.700000115
3G44.1Very low51.4Low75 Ų75144.2 Ų144.277%0.77384%0.844SS**  cis174.3162.2-200000112
4R53.2Low51.4Low232 Ų232142.2 Ų142.288%0.87584%0.841SS**  trans-98.6140.6176.3-73.1177.8172.2174-4.6111.3
5S59.1Low50.7Low115 Ų115136.4 Ų136.480%0.80482%0.823SS**  trans-152.7111.9153.6-52.30000105
6D51.8Low50.5Low142 Ų142141.1 Ų141.176%0.75983%0.83SS**  61.9100.564.1-63.8-69.2000111.9
7M61.3Low50.7Low192 Ų192139.6 Ų139.695%0.94683%0.825SS**  trans-152.486.3171-161.6163.4-163.300109.8
8D53.7Low50.6Low154 Ų154137.3 Ų137.382%0.82482%0.824SS**PPolyproline II helixtrans-70157.6177.2-101.3-54.3000113
9P62.8Low50.9Low106 Ų106138.6 Ų138.669%0.68883%0.825SS**PPolyproline II helixtrans-94.1149-171.436.2-34.4000114.2
10P56.3Low50.8Low131 Ų131137.5 Ų137.585%0.85182%0.822SS**PPolyproline II helixtrans-81118.8163.231.3-30.6000111.2
11A50.3Low50.4Low87 Ų87135.8 Ų135.872%0.71982%0.823SS**PPolyproline II helixtrans-49.5146-17600000116.6F13A11-F13 PolarHBondContact O-N 3.29Å
12A48.7Very low50.8Low97 Ų97131 Ų13180%0.80281%0.807SS**  trans-69.9112160.300000109.7S14A12-S14 PolarHBondContact O-N 3.14Å; A12-S14 VanDerWaalsContact O-N 3.14Å
13F43.8Very low51.1Low195 Ų195129.7 Ų129.786%0.85580%0.796SS**  trans-86.885.4-173.7-151.9-85.6000112.6A11A11-F13 PolarHBondContact O-N 3.29Å
14S51.3Low51.4Low116 Ų116132.5 Ų132.581%0.81180%0.801SS**  trans-74.4120.7163.939.70000110.1A12A12-S14 PolarHBondContact O-N 3.14Å; A12-S14 VanDerWaalsContact O-N 3.14Å
15G39.9Very low50.7Low55 Ų55127.2 Ų127.257%0.56780%0.799SS**  trans178.363.7-174.700000116.5
16F48.2Very low50.2Low211 Ų211125 Ų12593%0.92579%0.794SS**  trans-114.1121.5161.2-94.6-83000109.6A18F16-A18 PolarHBondContact O-N 3.32Å
17P53.2Low50.6Low117 Ų117124 Ų12476%0.7680%0.796SS**PPolyproline II helixtrans-71.3119.4175.128.5-32.7000110.1
18A49.2Very low50.3Low97 Ų97120.3 Ų120.380%0.80279%0.787SS**PPolyproline II helixtrans-71.2128.2171.800000110F16F16-A18 PolarHBondContact O-N 3.32Å
19L55.6Low50.1Low162 Ų162119 Ų11985%0.84879%0.786SS**PPolyproline II helixtrans-75.9141.2172.2-66.3173.9000109.9
20P49.7Very low49.3Very low117 Ų117119.5 Ų119.576%0.7679%0.792SS**PPolyproline II helixtrans-66.8137.2-175.926.8-34.7000112
21A41.7Very low48.8Very low101 Ų101119.2 Ų119.284%0.83579%0.79SS**PPolyproline II helixtrans-77.4121.5175.500000110.7A23A21-A23 PolarHBondContact O-N 3.41Å
22V48.6Very low48.1Very low142 Ų142123.2 Ų123.286%0.86180%0.799SS**  trans-81.6109.5169.5176.40000108.7
23A50.7Low47.6Very low80 Ų80123.5 Ų123.566%0.66180%0.801SS**  trans-82.7135.4171.400000110.7A21A21-A23 PolarHBondContact O-N 3.41Å
24P49.7Very low47.2Very low133 Ų133118.2 Ų118.286%0.86480%0.801SS**  trans-84.2114.8172.831.9-31.1000110.9
25S38.7Very low46.4Very low121 Ų121117.5 Ų117.585%0.84680%0.802SS**  trans-115.7127.8167.9-67.10000110.4
26G48.3Very low46.3Very low68 Ų68123.5 Ų123.570%0.70182%0.816SS**  trans163.799178.500000112.1
27P60.9Low46.1Very low123 Ų123119.1 Ų119.180%0.79981%0.808SS**PPolyproline II helixtrans-73.1152.1171.931.4-34.1000111.3
28P55.5Low45.1Very low114 Ų114116.8 Ų116.874%0.7481%0.806SS**PPolyproline II helixtrans-76.9149.4178.832.2-35.2000112.2
29P49.7Very low44.6Very low126 Ų126124.1 Ų124.182%0.81881%0.813SS**PPolyproline II helixtrans-76.4138.3170.931.5-33.7000111.7
30S45.8Very low43.9Very low117 Ų117124.7 Ų124.782%0.81881%0.811SS**PPolyproline II helixtrans-77.3137.4173.7-55.90000111.9
31P45.3Very low43.9Very low124 Ų124125.4 Ų125.481%0.80582%0.815SS**PPolyproline II helixtrans-84.1139.4167.233.3-32000111.3
32L36.6Very low43.7Very low172 Ų172128.7 Ų128.790%0.90181%0.814SS**  trans-145.9147.7167.2-160.874.5000109.1
33A37.9Very low43.1Very low103 Ų103130.2 Ų130.285%0.85181%0.812SS**  trans64.8131.1-164.400000114.1
34G35.4Very low42.3Very low83 Ų83130.2 Ų130.286%0.85681%0.811SS**  cis118.172-1000000114.7
35A34.8Very low41.7Very low101 Ų101128.3 Ų128.384%0.83581%0.807SS**  trans-159.8133.6159.100000110.8
36E36.3Very low41.4Very low181 Ų181127.7 Ų127.785%0.84681%0.809SS**  trans-136163.7168.5-81.8-76.8164.100106
37P44.5Very low40.9Very low119 Ų119128.4 Ų128.477%0.77382%0.817SS**  cis-123.4-176.9-22.939.3-26.1000111.2
38G32.4Very low40Very low68 Ų68135 Ų13570%0.70183%0.825SS**  trans169.8114.115900000121.2
39R38.8Very low39.2Very low251 Ų251133 Ų13395%0.94783%0.826SS**  trans75122.9144.1-57.2-178.8-178.2178.40.5120
40E40.4Very low38.6Very low175 Ų175136.6 Ų136.682%0.81883%0.832SS**  trans-76.3176.5156.3-55.4-177150.900110.7
41P49.4Very low38.4Very low131 Ų131135.8 Ų135.885%0.85183%0.832SS**  -137.4169.999.339.8-30.2000115.8
42E37.7Very low38.5Very low171 Ų171134.2 Ų134.280%0.79983%0.83SS**  trans-81.8-171.8175-150.3-167.913000112.7
43E36.8Very low39.1Very low174 Ų174132.2 Ų132.281%0.81383%0.827SS**  trans72.8143.3168.5-70-148.8102.400118.4
44A34Very low39.9Very low79 Ų79133.5 Ų133.565%0.65383%0.825SS**  cis-164.1-177.3-11.200000112
45A36.9Very low40.7Very low93 Ų93135.4 Ų135.477%0.76982%0.822SS**  trans76.998.2151.200000120.9
46A33Very low41.5Very low109 Ų109134.7 Ų134.790%0.90182%0.816SS**  41.9114.3123.200000121.2
47G36.4Very low42.2Very low83 Ų83132.4 Ų132.486%0.85682%0.816SS**  trans-140.598.7159.300000111.5G49G47-G49 PolarHBondContact O-N 3.05Å
48R42.2Very low42.6Very low261 Ų261129.6 Ų129.699%0.98581%0.809SS**  trans-89.595.9-177-160.8178.6-163.6-1078.7110
49G38.1Very low43.5Very low73 Ų73132.7 Ų132.775%0.75382%0.817SS**PPolyproline II helixtrans-96.9142.917900000113.2G47G47-G49 PolarHBondContact O-N 3.05Å
50E38.4Very low44.1Very low200 Ų200124 Ų12494%0.93581%0.805SS**PPolyproline II helixtrans-86.9163.2-171-150.7154113.600113.8
51A41.6Very low44.8Very low101 Ų101127.2 Ų127.284%0.83581%0.81SS**PPolyproline II helixtrans-83.2135.2-170.400000113.4
52A47.3Very low45.3Very low91 Ų91131.7 Ų131.775%0.75281%0.81SS**  trans-110.9139.8167.200000110.5
53P48Very low46.2Very low129 Ų129135.5 Ų135.584%0.83882%0.817SS**PPolyproline II helixtrans-72.4151.2-174.728.9-35000113.3
54T54.8Low47.4Very low131 Ų131138.6 Ų138.680%0.80482%0.821SS**PPolyproline II helixtrans-78.4136.1-17431.40000113.9A56T54-A56 PolarHBondContact O-N 3.42Å
55P53.3Low48.6Very low122 Ų122145.6 Ų145.679%0.79283%0.831SS**PPolyproline II helixtrans-69.7124.8158.529.7-31.8000109.3
56A50.8Low49.6Very low86 Ų86146.5 Ų146.571%0.71183%0.829SS**PPolyproline II helixtrans-64.1142.2-173.300000113T54 G58T54-A56 PolarHBondContact O-N 3.42Å; A56-G58 PolarHBondContact O-N 3.33Å
57P51.1Low51Low133 Ų133148.3 Ų148.386%0.86482%0.822SS**  trans-71.396.5177.529.2-34.2000111
58G53.5Low52.4Low60 Ų60150.9 Ų150.962%0.61981%0.812SS**  trans-53.9151.2-178.800000114.5A56 G60A56-G58 PolarHBondContact O-N 3.33Å; G58-G60 PolarHBondContact O-N 2.99Å
59P51.6Low53.4Low133 Ų133150.8 Ų150.886%0.86481%0.812SS**THydrogen-bonded Turntrans-64.5124.5-161.123.6-34.5000113.8R61P59-R61 PolarHBondContact O-N 3.17Å; P59-R61 VanDerWaalsContact O-N 3.17Å
60G51Low55.3Low68 Ų68150.5 Ų150.570%0.70181%0.809SS**THydrogen-bonded Turntrans69.823.5143.700000117.9G58 R62G58-G60 PolarHBondContact O-N 2.99Å; G60-R62 PolarHBondContact O-N 2.84Å
61R55.5Low57.6Low244 Ų244144.2 Ų144.292%0.92178%0.779SS**  trans-62.581.7158.7-85.1-166.2176.5-165.41.3109.1P59 R63P59-R61 PolarHBondContact O-N 3.17Å; P59-R61 VanDerWaalsContact O-N 3.17Å; R61-R63 PolarHBondContact O-N 3.07Å
62R59.7Low59.7Low224 Ų224140.4 Ų140.485%0.84575%0.745SS**  trans-43.1113.7179.2-70.3-173.9179.5-141.90.1108.5G60 R64G60-R62 PolarHBondContact O-N 2.84Å; R62-R64 PolarHBondContact O-N 3.41Å
63R57.2Low61.7Low251 Ų251140.7 Ų140.795%0.94774%0.739SS**  trans-49.2100.4-174.3-68.4-172.2-176.8-169.71.9109.2R61 R65R61-R63 PolarHBondContact O-N 3.07Å; R63-R65 PolarHBondContact O-N 3.45Å
64R61Low63.7Low239 Ų239138.4 Ų138.490%0.90271%0.714SS**  trans-69.990174.9-74.7-74.4-171.3159.45.1105.1R62 P66R62-R64 PolarHBondContact O-N 3.41Å; R64-P66 VanDerWaalsContact O-N 3.13Å
65R60.3Low65.5Low227 Ų227133.9 Ų133.986%0.85769%0.688SS**  trans-43.2122.1176.8-154.2-180-161.1168.86.6107R63 L67R63-R65 PolarHBondContact O-N 3.45Å; R65-L67 PolarHBondContact O-N 3.12Å; R65-L67 VanDerWaalsContact O-N 3.15Å
66P57.4Low67.5Low112 Ų112131 Ų13173%0.72766%0.662SS**  trans-47.1126.5-172.2-32.236000110.2R64 Q68R64-P66 VanDerWaalsContact O-N 3.13Å; P66-Q68 PolarHBondContact O-N 3.25Å
67L61.9Low69.6Low146 Ų146128.9 Ų128.976%0.76464%0.639SS**  trans-63.6109177.1-72.9171.4000106.3R65 R69R65-L67 PolarHBondContact O-N 3.12Å; R65-L67 VanDerWaalsContact O-N 3.15Å; L67-R69 PolarHBondContact O-N 2.86Å
68Q65.8Low71.6Confident138 Ų138122.6 Ų122.665%0.64560%0.598SS**  trans-46.6118.9176.1-73.2-73.75400107.8P66 G70 K71 F107P66-Q68 PolarHBondContact O-N 3.25Å; Q68-G70 PolarHBondContact O-N 3.23Å; Q68-K71 HydrophobicContact CB-CB 4.12Å; Q68-K71 WeakPolarHBondContact O-CB 3.21Å; Q68-K71 PolarHBondContact O-N 3.48Å; Q68-F107 HydrophobicContact CB-CE2 4.38Å
69R62.6Low73.6Confident258 Ų258119.8 Ų119.897%0.97457%0.568SS**THydrogen-bonded Turntrans-53.1126.6-173.2-106174.3167.5159.6-5.7108.9L67L67-R69 PolarHBondContact O-N 2.86Å
70G78.3Confident75.7Confident67 Ų67113.4 Ų113.469%0.69153%0.527SS*.THydrogen-bonded Turntrans86.8-9.7-175.200000116.7Q68 P72Q68-G70 PolarHBondContact O-N 3.23Å; G70-P72 WeakPolarHBondContact O-CD 3.37Å
71K85.9Confident77.8Confident69 Ų69110.2 Ų110.230%0.349%0.494SS..  trans-73.3123.8175.5-174.5164-175.3152.80111.1Q68 F107 Y108Q68-K71 HydrophobicContact CB-CB 4.12Å; Q68-K71 WeakPolarHBondContact O-CB 3.21Å; Q68-K71 PolarHBondContact O-N 3.48Å; K71-F107 HydrophobicContact CB-CD1 4.19Å; K71-F107 HydrophobicContact CB-CD2 3.96Å; K71-F107 HydrophobicContact CB-CE1 4Å; K71-F107 HydrophobicContact CB-CE2 3.73Å; K71-F107 HydrophobicContact CB-CG 4.2Å; K71-F107 HydrophobicContact CB-CZ 3.76Å; K71-F107 HydrophobicContact CD-CD1 4.38Å; K71-F107 HydrophobicContact CD-CE1 3.61Å; K71-F107 HydrophobicContact CD-CZ 3.72Å; K71-F107 HydrophobicContact CG-CD1 3.95Å; K71-F107 HydrophobicContact CG-CE1 3.66Å; K71-F107 HydrophobicContact CG-CE2 4.33Å; K71-F107 HydrophobicContact CG-CG 4.44Å; K71-F107 HydrophobicContact CG-CZ 3.87Å; K71-Y108 WeakPolarHBondContact CE-OH 3.32Å
72P87.1Confident79.7Confident20 Ų2099 Ų9913%0.1345%0.452CS..  trans-61.5147.9178.9-23.333.4000113G70 Y74 F105 Y108G70-P72 WeakPolarHBondContact O-CD 3.37Å; P72-Y74 HydrophobicContact CB-CD2 3.76Å; P72-Y74 HydrophobicContact CB-CE2 4.38Å; P72-Y74 PolarHBondContact O-N 2.84Å; P72-F105 HydrophobicContact CB-CD1 3.93Å; P72-F105 HydrophobicContact CB-CE1 4.01Å; P72-F105 HydrophobicContact CG-CB 3.95Å; P72-F105 HydrophobicContact CG-CD1 3.34Å; P72-F105 HydrophobicContact CG-CE1 3.95Å; P72-F105 HydrophobicContact CG-CG 3.75Å; P72-Y108 HydrophobicContact CG-CE2 4.22Å
73P87.9Confident81.4Confident97 Ų9788.4 Ų88.463%0.6341%0.412SS*.SBendtrans-73.416.6-178.432.1-37000114.5
74Y90.7Very high83.2Confident81 Ų8176.5 Ų76.532%0.31837%0.368SS..  trans-99.1144.1-173.8-57.5-60.7000112.8P72 L79 M82 F105 F160P72-Y74 HydrophobicContact CB-CD2 3.76Å; P72-Y74 HydrophobicContact CB-CE2 4.38Å; P72-Y74 PolarHBondContact O-N 2.84Å; Y74-L79 HydrophobicContact CD2-CD2 4.5Å; Y74-M82 HydrophobicContact CD1-CE 4.16Å; Y74-M82 HydrophobicContact CD2-CE 3.77Å; Y74-M82 HydrophobicContact CE2-CE 4.19Å; Y74-M82 HydrophobicContact CG-CE 3.76Å; Y74-F105 HydrophobicContact CD2-CE1 4.1Å; Y74-F105 AromaticContact CD2-CZ 3.82Å; Y74-F105 HydrophobicContact CD2-CZ 3.82Å; Y74-F105 HydrophobicContact CE2-CE1 4.01Å; Y74-F105 AromaticContact CE2-CZ 3.88Å; Y74-F105 HydrophobicContact CE2-CZ 3.88Å; Y74-F160 HydrophobicContact CD1-CB 3.83Å; Y74-F160 HydrophobicContact CE1-CB 3.82Å
75S93.2Very high84.7Confident37 Ų3767.5 Ų67.526%0.25935%0.345SS..  trans-76.8160.3169.370.50000111.3I77 A78 L79S75-I77 PolarHBondContact O-N 3.2Å; S75-A78 WeakPolarHBondContact O-CB 3.39Å; S75-A78 PolarHBondContact O-N 3.04Å; S75-A78 PolarHBondContact OG-N 2.95Å; S75-A78 VanDerWaalsContact OG-N 3.17Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.03Å
76Y95.3Very high86.2Confident61 Ų6162.3 Ų62.324%0.23933%0.33CS..Hα-helixtrans-58.8-35.5174.9-63.7-57.4000112.7L79 I80 Y108 W115 S118 I119Y76-L79 HydrophobicContact CD1-CD1 4.02Å; Y76-L79 PolarHBondContact O-N 3.02Å; Y76-I80 WeakPolarHBondContact O-CD1 3.42Å; Y76-I80 VanDerWaalsContact O-CG1 3.25Å; Y76-I80 WeakPolarHBondContact O-CG1 3.36Å; Y76-I80 PolarHBondContact O-N 2.82Å; Y76-Y108 HydrophobicContact CE1-CE1 4.04Å; Y76-W115 HydrophobicContact CE1-CB 4.37Å; Y76-S118 WeakPolarHBondContact CE2-OG 3.4Å; Y76-S118 VanDerWaalsContact CZ-OG 3.25Å; Y76-I119 HydrophobicContact CD1-CD1 3.94Å; Y76-I119 HydrophobicContact CD1-CG1 4.45Å; Y76-I119 HydrophobicContact CG-CD1 4.4Å
77I94.4Very high87.9Confident42 Ų4257.5 Ų57.522%0.21530%0.3CS..Hα-helixtrans-58.9-47.4171.9-61.2164.3000110.3S75 L79 I80 A81 N122 F129 F155S75-I77 PolarHBondContact O-N 3.2Å; I77-L79 PolarHBondContact O-N 2.82Å; I77-I80 PolarHBondContact O-N 3.08Å; I77-A81 WeakPolarHBondContact O-CB 3.46Å; I77-A81 PolarHBondContact O-N 2.91Å; I77-N122 WeakPolarHBondContact CG1-OD1 3.5Å; I77-F129 HydrophobicContact CB-CE2 4.35Å; I77-F129 HydrophobicContact CB-CZ 4.4Å; I77-F129 HydrophobicContact CG1-CE2 4.34Å; I77-F129 HydrophobicContact CG2-CE2 3.99Å; I77-F129 HydrophobicContact CG2-CZ 3.79Å; I77-F155 HydrophobicContact CG2-CE1 4.19Å; I77-F155 HydrophobicContact CG2-CZ 3.75Å
78A93.8Very high89.2Confident1 Ų156.5 Ų56.51%0.00830%0.302CS..Hα-helixtrans-66.1-36.4178.300000113S75 A81 M82 F160S75-A78 WeakPolarHBondContact O-CB 3.39Å; S75-A78 PolarHBondContact O-N 3.04Å; S75-A78 PolarHBondContact OG-N 2.95Å; S75-A78 VanDerWaalsContact OG-N 3.17Å; A78-A81 PolarHBondContact O-N 2.99Å; A78-M82 WeakPolarHBondContact O-CB 3.3Å; A78-M82 WeakPolarHBondContact O-CE 3.43Å; A78-M82 WeakPolarHBondContact O-CG 3.45Å; A78-M82 PolarHBondContact O-N 2.95Å; A78-F160 HydrophobicContact CB-CB 4.08Å; A78-F160 HydrophobicContact CB-CD1 4.45Å; A78-F160 VanDerWaalsContact CB-O 3.28Å; A78-F160 WeakPolarHBondContact CB-O 3.04Å
79L95.1Very high90.3Very high0 Ų053.1 Ų53.10%030%0.304CS..Hα-helixtrans-62.8-42.2174.2-67.4174.3000112Y74 S75 Y76 I77 M82 A83 I101 F105 Y108Y74-L79 HydrophobicContact CD2-CD2 4.5Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.03Å; Y76-L79 HydrophobicContact CD1-CD1 4.02Å; Y76-L79 PolarHBondContact O-N 3.02Å; I77-L79 PolarHBondContact O-N 2.82Å; L79-M82 HydrophobicContact CD2-CE 3.87Å; L79-A83 PolarHBondContact O-N 2.78Å; L79-A83 VanDerWaalsContact O-N 3.16Å; L79-I101 HydrophobicContact CB-CD1 3.95Å; L79-I101 HydrophobicContact CB-CG1 4.21Å; L79-F105 HydrophobicContact CD2-CD2 3.67Å; L79-F105 HydrophobicContact CD2-CE2 3.37Å; L79-F105 HydrophobicContact CD2-CZ 4.13Å; L79-Y108 HydrophobicContact CD1-CE2 3.71Å
80I96.3Very high91.7Very high0 Ų045.2 Ų45.20%027%0.274CS..Hα-helixtrans-67.7-44.6175.6-63.3158.8000110.5Y76 I77 M82 A83 L84 I97 I119 N122 L123 F129Y76-I80 WeakPolarHBondContact O-CD1 3.42Å; Y76-I80 VanDerWaalsContact O-CG1 3.25Å; Y76-I80 WeakPolarHBondContact O-CG1 3.36Å; Y76-I80 PolarHBondContact O-N 2.82Å; I77-I80 PolarHBondContact O-N 3.08Å; I80-M82 PolarHBondContact O-N 3.49Å; I80-A83 WeakPolarHBondContact O-CB 3.35Å; I80-A83 PolarHBondContact O-N 2.95Å; I80-A83 VanDerWaalsContact O-N 3.17Å; I80-L84 HydrophobicContact CG2-CD1 3.9Å; I80-L84 HydrophobicContact CG2-CG 4.43Å; I80-L84 WeakPolarHBondContact O-CG 3.33Å; I80-L84 PolarHBondContact O-N 3.44Å; I80-I97 HydrophobicContact CG1-CG2 4.16Å; I80-I97 HydrophobicContact CG2-CD1 4.42Å; I80-I119 HydrophobicContact CD1-CD1 4.06Å; I80-I119 HydrophobicContact CD1-CG2 4.35Å; I80-I119 HydrophobicContact CG1-CD1 3.87Å; I80-I119 HydrophobicContact CG1-CG2 4.37Å; I80-N122 HydrophobicContact CD1-CB 3.98Å; I80-L123 HydrophobicContact CD1-CD2 3.99Å; I80-L123 HydrophobicContact CD1-CG 3.97Å; I80-L123 HydrophobicContact CG1-CD2 4.42Å; I80-L123 HydrophobicContact CG2-CD2 3.7Å; I80-F129 HydrophobicContact CB-CE1 4Å; I80-F129 HydrophobicContact CB-CE2 4.18Å; I80-F129 HydrophobicContact CB-CZ 3.67Å; I80-F129 HydrophobicContact CD1-CD2 4.43Å; I80-F129 HydrophobicContact CD1-CE2 3.91Å; I80-F129 HydrophobicContact CD1-CZ 4.29Å; I80-F129 HydrophobicContact CG2-CD1 3.77Å; I80-F129 HydrophobicContact CG2-CD2 4.4Å; I80-F129 HydrophobicContact CG2-CE1 3.39Å; I80-F129 HydrophobicContact CG2-CE2 4.05Å; I80-F129 HydrophobicContact CG2-CG 4.27Å; I80-F129 HydrophobicContact CG2-CZ 3.54Å
81A94.6Very high92.5Very high1 Ų146.7 Ų46.71%0.00826%0.259CS..Hα-helixtrans-61.3-43.4178.900000112.2I77 A78 A83 L84 A85 F155I77-A81 WeakPolarHBondContact O-CB 3.46Å; I77-A81 PolarHBondContact O-N 2.91Å; A78-A81 PolarHBondContact O-N 2.99Å; A81-A83 PolarHBondContact O-N 3.17Å; A81-L84 PolarHBondContact O-N 2.9Å; A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 2.67Å; A81-F155 HydrophobicContact CB-CB 4.39Å; A81-F155 HydrophobicContact CB-CD1 3.7Å; A81-F155 HydrophobicContact CB-CD2 4.25Å; A81-F155 HydrophobicContact CB-CE1 3.95Å; A81-F155 HydrophobicContact CB-CE2 4.48Å; A81-F155 HydrophobicContact CB-CG 3.85Å; A81-F155 HydrophobicContact CB-CZ 4.33Å
82M94.8Very high93Very high8 Ų844.7 Ų44.74%0.03925%0.251CS..Hα-helixtrans-60.9-42.3172.7-75.2-174.6-70.800112.1Y74 A78 L79 I80 L84 A85 H86 F100 F105 F160Y74-M82 HydrophobicContact CD1-CE 4.16Å; Y74-M82 HydrophobicContact CD2-CE 3.77Å; Y74-M82 HydrophobicContact CE2-CE 4.19Å; Y74-M82 HydrophobicContact CG-CE 3.76Å; A78-M82 WeakPolarHBondContact O-CB 3.3Å; A78-M82 WeakPolarHBondContact O-CE 3.43Å; A78-M82 WeakPolarHBondContact O-CG 3.45Å; A78-M82 PolarHBondContact O-N 2.95Å; L79-M82 HydrophobicContact CD2-CE 3.87Å; I80-M82 PolarHBondContact O-N 3.49Å; M82-L84 PolarHBondContact O-N 3.13Å; M82-A85 PolarHBondContact O-N 3.26Å; M82-H86 PolarHBondContact O-CD2 2.97Å; M82-H86 VanDerWaalsContact O-CD2 3.25Å; M82-H86 PolarHBondContact O-N 2.75Å; M82-H86 VanDerWaalsContact O-N 3.12Å; M82-F100 HydrophobicContact CB-CE1 4.01Å; M82-F100 HydrophobicContact CB-CZ 4.17Å; M82-F105 HydrophobicContact CE-CE2 4.07Å; M82-F105 HydrophobicContact CE-CZ 3.99Å; M82-F160 HydrophobicContact CB-CE1 4.49Å; M82-F160 HydrophobicContact CG-CD1 3.6Å; M82-F160 HydrophobicContact CG-CD2 4.12Å; M82-F160 HydrophobicContact CG-CE1 3.45Å; M82-F160 VanDerWaalsContact CG-CE1 3.45Å; M82-F160 HydrophobicContact CG-CE2 3.97Å; M82-F160 HydrophobicContact CG-CG 3.95Å; M82-F160 HydrophobicContact CG-CZ 3.65Å; M82-F160 HydrophobicContact SD-CD1 4.41Å; M82-F160 HydrophobicContact SD-CD2 4.18Å; M82-F160 HydrophobicContact SD-CE2 4.42Å; M82-F160 HydrophobicContact SD-CG 4.19Å
83A95.7Very high93.4Very high1 Ų145 Ų451%0.00825%0.253CS..Hα-helixtrans-60.9-45177.700000111.6L79 I80 A81 H86 A87 L92 F100L79-A83 PolarHBondContact O-N 2.78Å; L79-A83 VanDerWaalsContact O-N 3.16Å; I80-A83 WeakPolarHBondContact O-CB 3.35Å; I80-A83 PolarHBondContact O-N 2.95Å; I80-A83 VanDerWaalsContact O-N 3.17Å; A81-A83 PolarHBondContact O-N 3.17Å; A83-H86 PolarHBondContact O-N 3Å; A83-A87 PolarHBondContact O-N 3.46Å; A83-L92 HydrophobicContact CB-CD1 3.77Å; A83-L92 VanDerWaalsContact O-CD1 3.3Å; A83-L92 WeakPolarHBondContact O-CD1 3.39Å; A83-F100 HydrophobicContact CB-CB 4.16Å; A83-F100 HydrophobicContact CB-CD1 3.44Å; A83-F100 VanDerWaalsContact CB-CD1 3.44Å; A83-F100 HydrophobicContact CB-CD2 4.5Å; A83-F100 HydrophobicContact CB-CE1 3.9Å; A83-F100 HydrophobicContact CB-CG 3.79Å
84L94.9Very high93.8Very high1 Ų142.9 Ų42.91%0.00524%0.236CC..Hα-helixtrans-67.9-37.8178.1-67.3168.7000112.5I80 A81 M82 H86 A87 R90 L92 F129 W145 L147I80-L84 HydrophobicContact CG2-CD1 3.9Å; I80-L84 HydrophobicContact CG2-CG 4.43Å; I80-L84 WeakPolarHBondContact O-CG 3.33Å; I80-L84 PolarHBondContact O-N 3.44Å; A81-L84 PolarHBondContact O-N 2.9Å; M82-L84 PolarHBondContact O-N 3.13Å; L84-H86 VanDerWaalsContact C-N 3.31Å; L84-H86 PolarHBondContact O-N 3.13Å; L84-A87 WeakPolarHBondContact O-CB 3.28Å; L84-A87 PolarHBondContact O-N 2.75Å; L84-R90 WeakPolarHBondContact O-CA 3.48Å; L84-L92 HydrophobicContact CD2-CB 3.91Å; L84-L92 HydrophobicContact CD2-CG 4.17Å; L84-F129 HydrophobicContact CD1-CD1 3.9Å; L84-F129 HydrophobicContact CD1-CE1 4Å; L84-W145 WeakPolarHBondContact CD2-O 3.29Å; L84-L147 HydrophobicContact CD1-CB 4.38Å
85A92.5Very high94.1Very high51 Ų5141.4 Ų41.442%0.42124%0.241SC..Hα-helixtrans-66.1-31.6177.200000113.1A81 M82 A87A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 2.67Å; M82-A85 PolarHBondContact O-N 3.26Å; A85-A87 VanDerWaalsContact C-N 3.33Å
86H92.3Very high94.3Very high117 Ų11740.9 Ų40.954%0.54224%0.239SC..THydrogen-bonded Turntrans-84.90.7175.1-78.2-69000114.3M82 A83 L84 F100 R104M82-H86 PolarHBondContact O-CD2 2.97Å; M82-H86 VanDerWaalsContact O-CD2 3.25Å; M82-H86 PolarHBondContact O-N 2.75Å; M82-H86 VanDerWaalsContact O-N 3.12Å; A83-H86 PolarHBondContact O-N 3Å; L84-H86 VanDerWaalsContact C-N 3.31Å; L84-H86 PolarHBondContact O-N 3.13Å; H86-F100 HydrophobicContact CB-CE2 3.77Å; H86-F100 HydrophobicContact CB-CZ 4.38Å; H86-F100 AromaticContact CD2-CE2 3.83Å; H86-F100 AromaticContact CD2-CZ 3.7Å; H86-F100 AromaticContact CG-CE2 3.99Å; H86-R104 PolarHBondContact CD2-NH1 2.95Å; H86-R104 PolarHBondContact NE2-NH1 3.21Å
87A92.6Very high94.3Very high12 Ų1238 Ų3810%0.09923%0.227CC..SBendtrans-94.5134.2-177.400000112.3A83 L84 A85 G89 R90 L92A83-A87 PolarHBondContact O-N 3.46Å; L84-A87 WeakPolarHBondContact O-CB 3.28Å; L84-A87 PolarHBondContact O-N 2.75Å; A85-A87 VanDerWaalsContact C-N 3.33Å; A87-G89 PolarHBondContact O-N 2.9Å; A87-R90 PolarHBondContact O-N 3.36Å; A87-L92 HydrophobicContact CB-CD1 4.15Å; A87-L92 HydrophobicContact CB-CD2 3.48Å; A87-L92 VanDerWaalsContact CB-CD2 3.48Å; A87-L92 HydrophobicContact CB-CG 3.54Å
88P88.8Confident94.5Very high125 Ų12537.7 Ų37.781%0.81222%0.224SC*.G310 helixtrans-59.4125171.525.5-33.1000109.9
89G89.6Confident94.6Very high66 Ų6645.3 Ų45.368%0.6825%0.252SS*.G310 helixtrans74.917.1-17500000115.5A87 R91A87-G89 PolarHBondContact O-N 2.9Å; G89-R91 PolarHBondContact O-N 3.37Å
90R92.4Very high94.7Very high92 Ų9246.8 Ų46.835%0.34726%0.259SS..G310 helixtrans52.322.2175.8-55.5-176.473.7149.16.3115.1L84 A87 D156L84-R90 WeakPolarHBondContact O-CA 3.48Å; A87-R90 PolarHBondContact O-N 3.36Å; R90-D156 IonicContact CZ-OD1 3.41Å; R90-D156 IonicContact CZ-OD2 3.64Å; R90-D156 IonicContact NH1-OD1 2.75Å; R90-D156 IonicContact NH1-OD2 2.91Å; R90-D156 PolarHBondContact NH1-OD2 3.02Å; R90-D156 VanDerWaalsContact NH2-CG 3.32Å; R90-D156 IonicContact NH2-OD1 3.13Å; R90-D156 PolarHBondContact NH2-OD1 3.49Å; R90-D156 IonicContact NH2-OD2 3.34Å; R90-D156 PolarHBondContact NH2-OD2 3.35Å; R90-D156 VanDerWaalsContact NH2-OD2 3.13Å
91R94.4Very high94.7Very high98 Ų9846.8 Ų46.837%0.3726%0.259SS..EExtended strand (participates in β ladder)trans-126131.3-176.268.9-177.4-1801630.8112.3G89 E135 Y144 W145 T146G89-R91 PolarHBondContact O-N 3.37Å; R91-E135 IonicContact CZ-OE1 3.62Å; R91-E135 IonicContact NH1-OE1 3.72Å; R91-E135 PolarHBondContact NH1-OE1 2.93Å; R91-E135 IonicContact NH2-OE1 2.67Å; R91-E135 PolarHBondContact NH2-OE1 3.48Å; R91-Y144 HydrophobicContact CB-CD1 4.32Å; R91-Y144 HydrophobicContact CG-CD1 4.17Å; R91-W145 WeakPolarHBondContact CA-O 3.37Å; R91-T146 HydrophobicContact CB-CG2 3.64Å
92L96.3Very high94.7Very high28 Ų2848.6 Ų48.615%0.14727%0.269CS..EExtended strand (participates in β ladder)trans-135.2153.2178-73.8-175.8000113.2A83 L84 A87 A96 I97 Y144 W145A83-L92 HydrophobicContact CB-CD1 3.77Å; A83-L92 VanDerWaalsContact O-CD1 3.3Å; A83-L92 WeakPolarHBondContact O-CD1 3.39Å; L84-L92 HydrophobicContact CD2-CB 3.91Å; L84-L92 HydrophobicContact CD2-CG 4.17Å; A87-L92 HydrophobicContact CB-CD1 4.15Å; A87-L92 HydrophobicContact CB-CD2 3.48Å; A87-L92 VanDerWaalsContact CB-CD2 3.48Å; A87-L92 HydrophobicContact CB-CG 3.54Å; L92-A96 HydrophobicContact CB-CB 4.38Å; L92-A96 HydrophobicContact CD2-CB 3.88Å; L92-I97 HydrophobicContact CB-CD1 4.38Å; L92-I97 HydrophobicContact CB-CG1 3.87Å; L92-I97 HydrophobicContact CD1-CG1 3.95Å; L92-Y144 CarbonylContact O-C 3.57Å; L92-W145 PolarHBondContact N-O 2.75Å; L92-W145 PolarHBondContact O-N 2.99Å
93T96.6Very high94.8Very high26 Ų2654 Ų5416%0.1630%0.295CS..EExtended strand (participates in β ladder)trans-81.8157.6165.266.80000110.9A95 A96 I97 Y144T93-A95 PolarHBondContact O-N 3.41Å; T93-A95 VanDerWaalsContact O-N 3.15Å; T93-A96 PolarHBondContact O-N 2.88Å; T93-A96 PolarHBondContact OG1-N 3.49Å; T93-I97 PolarHBondContact O-N 3.29Å; T93-I97 VanDerWaalsContact O-N 3.07Å; T93-Y144 HydrophobicContact CG2-CD1 4.09Å; T93-Y144 HydrophobicContact CG2-CE1 3.93Å
94L96.3Very high94.7Very high52 Ų5260.3 Ų60.327%0.27232%0.318SS..Hα-helixtrans-52.1-36.9174.9178.963.8000113Y98 I119 R120 L123L94-Y98 HydrophobicContact CD1-CD1 4.37Å; L94-Y98 HydrophobicContact CD1-CE1 3.58Å; L94-Y98 HydrophobicContact CG-CE1 4.05Å; L94-Y98 HydrophobicContact CG-CE2 4.12Å; L94-Y98 PolarHBondContact O-N 3.02Å; L94-I119 HydrophobicContact CD1-CG2 4.24Å; L94-R120 HydrophobicContact CD1-CG 4.09Å; L94-R120 HydrophobicContact CD2-CG 3.97Å; L94-L123 HydrophobicContact CD1-CD1 3.57Å
95A96.5Very high94.7Very high51 Ų5161.6 Ų61.642%0.42132%0.324SS..Hα-helixtrans-68.6-37.9178.100000112.7T93 Y98 R99T93-A95 PolarHBondContact O-N 3.41Å; T93-A95 VanDerWaalsContact O-N 3.15Å; A95-Y98 PolarHBondContact O-N 2.93Å; A95-R99 WeakPolarHBondContact O-CG 3.47Å; A95-R99 PolarHBondContact O-N 3.15Å
96A96.2Very high94.7Very high26 Ų2662 Ų6222%0.21533%0.327CS..Hα-helixtrans-70.3-36.7176.200000112.2L92 T93 Y98 R99 F100L92-A96 HydrophobicContact CB-CB 4.38Å; L92-A96 HydrophobicContact CD2-CB 3.88Å; T93-A96 PolarHBondContact O-N 2.88Å; T93-A96 PolarHBondContact OG1-N 3.49Å; A96-Y98 VanDerWaalsContact C-N 3.29Å; A96-Y98 PolarHBondContact O-N 3.33Å; A96-R99 PolarHBondContact O-N 2.92Å; A96-F100 PolarHBondContact O-N 2.83Å
97I97.1Very high94.7Very high0 Ų059.7 Ų59.70%032%0.316CS..Hα-helixtrans-59.8-40.3173-63.3167.9000110.8I80 L92 T93 I101 I119 L123 W145I80-I97 HydrophobicContact CG1-CG2 4.16Å; I80-I97 HydrophobicContact CG2-CD1 4.42Å; L92-I97 HydrophobicContact CB-CD1 4.38Å; L92-I97 HydrophobicContact CB-CG1 3.87Å; L92-I97 HydrophobicContact CD1-CG1 3.95Å; T93-I97 PolarHBondContact O-N 3.29Å; T93-I97 VanDerWaalsContact O-N 3.07Å; I97-I101 HydrophobicContact CG2-CD1 4.01Å; I97-I101 WeakPolarHBondContact O-CD1 3.42Å; I97-I101 VanDerWaalsContact O-CG1 3.29Å; I97-I101 WeakPolarHBondContact O-CG1 3.45Å; I97-I101 PolarHBondContact O-N 3.38Å; I97-I119 HydrophobicContact CG2-CG2 4.07Å; I97-L123 HydrophobicContact CD1-CD1 4.26Å; I97-L123 HydrophobicContact CD1-CD2 4.22Å; I97-W145 HydrophobicContact CD1-CB 4.28Å
98Y96.8Very high94.8Very high36 Ų3659.2 Ų59.214%0.14131%0.311CS..Hα-helixtrans-62.9-47.9174.9-62.2-20.8000112.1L94 A95 A96 I101 T102 W115 Q116 I119 R120L94-Y98 HydrophobicContact CD1-CD1 4.37Å; L94-Y98 HydrophobicContact CD1-CE1 3.58Å; L94-Y98 HydrophobicContact CG-CE1 4.05Å; L94-Y98 HydrophobicContact CG-CE2 4.12Å; L94-Y98 PolarHBondContact O-N 3.02Å; A95-Y98 PolarHBondContact O-N 2.93Å; A96-Y98 VanDerWaalsContact C-N 3.29Å; A96-Y98 PolarHBondContact O-N 3.33Å; Y98-I101 PolarHBondContact O-N 3.21Å; Y98-T102 PolarHBondContact O-N 3.17Å; Y98-T102 PolarHBondContact O-OG1 3.03Å; Y98-T102 VanDerWaalsContact O-OG1 3.11Å; Y98-W115 HydrophobicContact CD1-CH2 4.18Å; Y98-W115 AromaticContact CD1-CZ3 3.91Å; Y98-W115 HydrophobicContact CD1-CZ3 3.91Å; Y98-W115 HydrophobicContact CG-CH2 4.33Å; Y98-Q116 HydrophobicContact CD1-CB 4.42Å; Y98-Q116 HydrophobicContact CD1-CG 3.84Å; Y98-Q116 HydrophobicContact CD2-CG 4.21Å; Y98-Q116 HydrophobicContact CE1-CB 3.78Å; Y98-Q116 HydrophobicContact CE1-CG 3.7Å; Y98-Q116 HydrophobicContact CE2-CB 4.43Å; Y98-Q116 HydrophobicContact CE2-CG 4.1Å; Y98-Q116 HydrophobicContact CG-CG 4.09Å; Y98-I119 HydrophobicContact CD1-CG2 4.28Å; Y98-I119 HydrophobicContact CE1-CB 4.23Å; Y98-I119 HydrophobicContact CE1-CG2 3.93Å; Y98-R120 WeakPolarHBondContact OH-CG 3.47Å; Y98-R120 PolarHBondContact OH-NH1 3.49Å
99R97Very high95Very high160 Ų16060.4 Ų60.460%0.60430%0.3SS*.Hα-helixtrans-55.4-55.9179.6-72.8-176.9-158.2177.33.2111.8A95 A96 I101 T102 E103A95-R99 WeakPolarHBondContact O-CG 3.47Å; A95-R99 PolarHBondContact O-N 3.15Å; A96-R99 PolarHBondContact O-N 2.92Å; R99-I101 PolarHBondContact O-N 2.98Å; R99-T102 WeakPolarHBondContact CA-OG1 3.46Å; R99-T102 CarbonylContact O-C 3.57Å; R99-T102 PolarHBondContact O-N 3.16Å; R99-T102 PolarHBondContact O-OG1 3.4Å; R99-E103 WeakPolarHBondContact CB-OE1 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.45Å; R99-E103 VanDerWaalsContact O-CG 3.3Å; R99-E103 WeakPolarHBondContact O-CG 3.46Å; R99-E103 PolarHBondContact O-N 3.23Å
100F96.7Very high95.1Very high32 Ų3262.8 Ų62.814%0.1430%0.297CS..Hα-helixtrans-52.3-42.3179.4176.8-88.3000112.7M82 A83 H86 A96 E103 R104M82-F100 HydrophobicContact CB-CE1 4.01Å; M82-F100 HydrophobicContact CB-CZ 4.17Å; A83-F100 HydrophobicContact CB-CB 4.16Å; A83-F100 HydrophobicContact CB-CD1 3.44Å; A83-F100 VanDerWaalsContact CB-CD1 3.44Å; A83-F100 HydrophobicContact CB-CD2 4.5Å; A83-F100 HydrophobicContact CB-CE1 3.9Å; A83-F100 HydrophobicContact CB-CG 3.79Å; H86-F100 HydrophobicContact CB-CE2 3.77Å; H86-F100 HydrophobicContact CB-CZ 4.38Å; H86-F100 AromaticContact CD2-CE2 3.83Å; H86-F100 AromaticContact CD2-CZ 3.7Å; H86-F100 AromaticContact CG-CE2 3.99Å; A96-F100 PolarHBondContact O-N 2.83Å; F100-E103 WeakPolarHBondContact CA-OE2 3.3Å; F100-R104 WeakPolarHBondContact O-CB 3.47Å; F100-R104 PolarHBondContact O-N 2.98Å; F100-R104 VanDerWaalsContact O-N 3.08Å
101I96.5Very high95Very high0 Ų062.7 Ų62.70%031%0.31CS..Hα-helixtrans-67.3-44.1178.3-67.6171000111L79 I97 Y98 R99 F105 Y108 W115 I119L79-I101 HydrophobicContact CB-CD1 3.95Å; L79-I101 HydrophobicContact CB-CG1 4.21Å; I97-I101 HydrophobicContact CG2-CD1 4.01Å; I97-I101 WeakPolarHBondContact O-CD1 3.42Å; I97-I101 VanDerWaalsContact O-CG1 3.29Å; I97-I101 WeakPolarHBondContact O-CG1 3.45Å; I97-I101 PolarHBondContact O-N 3.38Å; Y98-I101 PolarHBondContact O-N 3.21Å; R99-I101 PolarHBondContact O-N 2.98Å; I101-F105 WeakPolarHBondContact O-CB 3.44Å; I101-F105 PolarHBondContact O-N 3.06Å; I101-Y108 HydrophobicContact CG2-CD2 3.6Å; I101-Y108 HydrophobicContact CG2-CE2 4.34Å; I101-Y108 HydrophobicContact CG2-CG 3.72Å; I101-W115 HydrophobicContact CB-CH2 4.38Å; I101-W115 HydrophobicContact CB-CZ3 4.33Å; I101-W115 HydrophobicContact CD1-CZ3 4.24Å; I101-W115 HydrophobicContact CG2-CE3 4.49Å; I101-W115 HydrophobicContact CG2-CH2 4.22Å; I101-W115 HydrophobicContact CG2-CZ3 4.07Å; I101-I119 HydrophobicContact CD1-CD1 3.6Å; I101-I119 HydrophobicContact CD1-CG1 4.18Å
102T95.8Very high94.9Very high38 Ų3860.9 Ų60.923%0.23331%0.311CS..Hα-helixtrans-70.4-32.9178.146.90000114Y98 R99 Y108 R109 W115Y98-T102 PolarHBondContact O-N 3.17Å; Y98-T102 PolarHBondContact O-OG1 3.03Å; Y98-T102 VanDerWaalsContact O-OG1 3.11Å; R99-T102 WeakPolarHBondContact CA-OG1 3.46Å; R99-T102 CarbonylContact O-C 3.57Å; R99-T102 PolarHBondContact O-N 3.16Å; R99-T102 PolarHBondContact O-OG1 3.4Å; T102-Y108 WeakPolarHBondContact CG2-O 3.17Å; T102-R109 PolarHBondContact O-NE 2.96Å; T102-R109 PolarHBondContact O-NH2 3.11Å; T102-W115 HydrophobicContact CG2-CH2 4.02Å; T102-W115 HydrophobicContact CG2-CZ2 3.59Å
103E95.9Very high94.9Very high122 Ų12270.2 Ų70.257%0.5735%0.345SS*.Hα-helixtrans-67.2-56.4177.1-73.5153-173.400109.6R99 F100 R109R99-E103 WeakPolarHBondContact CB-OE1 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.45Å; R99-E103 VanDerWaalsContact O-CG 3.3Å; R99-E103 WeakPolarHBondContact O-CG 3.46Å; R99-E103 PolarHBondContact O-N 3.23Å; F100-E103 WeakPolarHBondContact CA-OE2 3.3Å; E103-R109 PolarHBondContact O-NH2 2.71Å
104R94.3Very high94.8Very high133 Ų13377.4 Ų77.450%0.50237%0.373SS..Hα-helixtrans-79.5-22.4-172.4-165.3164.5-173.6161.3-5.7115.1H86 F100H86-R104 PolarHBondContact CD2-NH1 2.95Å; H86-R104 PolarHBondContact NE2-NH1 3.21Å; F100-R104 WeakPolarHBondContact O-CB 3.47Å; F100-R104 PolarHBondContact O-N 2.98Å; F100-R104 VanDerWaalsContact O-N 3.08Å
105F93.5Very high94.7Very high29 Ų2975.5 Ų75.513%0.12736%0.363CS..  trans-134.292.9-176.5-58.9-66.5000111.2P72 Y74 L79 M82 I101 F107 Y108P72-F105 HydrophobicContact CB-CD1 3.93Å; P72-F105 HydrophobicContact CB-CE1 4.01Å; P72-F105 HydrophobicContact CG-CB 3.95Å; P72-F105 HydrophobicContact CG-CD1 3.34Å; P72-F105 HydrophobicContact CG-CE1 3.95Å; P72-F105 HydrophobicContact CG-CG 3.75Å; Y74-F105 HydrophobicContact CD2-CE1 4.1Å; Y74-F105 AromaticContact CD2-CZ 3.82Å; Y74-F105 HydrophobicContact CD2-CZ 3.82Å; Y74-F105 HydrophobicContact CE2-CE1 4.01Å; Y74-F105 AromaticContact CE2-CZ 3.88Å; Y74-F105 HydrophobicContact CE2-CZ 3.88Å; L79-F105 HydrophobicContact CD2-CD2 3.67Å; L79-F105 HydrophobicContact CD2-CE2 3.37Å; L79-F105 HydrophobicContact CD2-CZ 4.13Å; M82-F105 HydrophobicContact CE-CE2 4.07Å; M82-F105 HydrophobicContact CE-CZ 3.99Å; I101-F105 WeakPolarHBondContact O-CB 3.44Å; I101-F105 PolarHBondContact O-N 3.06Å; F105-F107 PolarHBondContact O-N 3.35Å; F105-Y108 HydrophobicContact CB-CD2 3.79Å; F105-Y108 HydrophobicContact CB-CE2 4.35Å; F105-Y108 PolarHBondContact O-N 3.17Å
106A92.9Very high94.7Very high59 Ų5975.1 Ų75.149%0.48835%0.352SS..G310 helixtrans-51-33.7-176.800000114.3Y108 R109A106-Y108 PolarHBondContact O-N 3.31Å; A106-R109 WeakPolarHBondContact O-CB 3.41Å; A106-R109 WeakPolarHBondContact O-CG 3.35Å; A106-R109 PolarHBondContact O-N 3.19Å
107F92.8Very high94.8Very high69 Ų6978.2 Ų78.230%0.30337%0.365SS..G310 helixtrans-50.8-24.1173.8178.3-88.8000115Q68 K71 F105Q68-F107 HydrophobicContact CB-CE2 4.38Å; K71-F107 HydrophobicContact CB-CD1 4.19Å; K71-F107 HydrophobicContact CB-CD2 3.96Å; K71-F107 HydrophobicContact CB-CE1 4Å; K71-F107 HydrophobicContact CB-CE2 3.73Å; K71-F107 HydrophobicContact CB-CG 4.2Å; K71-F107 HydrophobicContact CB-CZ 3.76Å; K71-F107 HydrophobicContact CD-CD1 4.38Å; K71-F107 HydrophobicContact CD-CE1 3.61Å; K71-F107 HydrophobicContact CD-CZ 3.72Å; K71-F107 HydrophobicContact CG-CD1 3.95Å; K71-F107 HydrophobicContact CG-CE1 3.66Å; K71-F107 HydrophobicContact CG-CE2 4.33Å; K71-F107 HydrophobicContact CG-CG 4.44Å; K71-F107 HydrophobicContact CG-CZ 3.87Å; F105-F107 PolarHBondContact O-N 3.35Å
108Y94.4Very high94.8Very high2 Ų279.4 Ų79.41%0.00837%0.373CS..G310 helixtrans-98.52.9178.9-66.4-70.2000113.8K71 P72 Y76 L79 I101 T102 F105 A106 D110 W115K71-Y108 WeakPolarHBondContact CE-OH 3.32Å; P72-Y108 HydrophobicContact CG-CE2 4.22Å; Y76-Y108 HydrophobicContact CE1-CE1 4.04Å; L79-Y108 HydrophobicContact CD1-CE2 3.71Å; I101-Y108 HydrophobicContact CG2-CD2 3.6Å; I101-Y108 HydrophobicContact CG2-CE2 4.34Å; I101-Y108 HydrophobicContact CG2-CG 3.72Å; T102-Y108 WeakPolarHBondContact CG2-O 3.17Å; F105-Y108 HydrophobicContact CB-CD2 3.79Å; F105-Y108 HydrophobicContact CB-CE2 4.35Å; F105-Y108 PolarHBondContact O-N 3.17Å; A106-Y108 PolarHBondContact O-N 3.31Å; Y108-D110 VanDerWaalsContact C-N 3.31Å; Y108-W115 HydrophobicContact CD1-CB 3.94Å; Y108-W115 AromaticContact CD1-CD1 3.78Å; Y108-W115 AromaticContact CD1-CD2 3.97Å; Y108-W115 HydrophobicContact CD1-CD2 3.97Å; Y108-W115 AromaticContact CD1-CG 3.64Å; Y108-W115 HydrophobicContact CD1-CG 3.64Å; Y108-W115 HydrophobicContact CE1-CB 4.15Å; Y108-W115 HydrophobicContact CE1-CG 4.34Å; Y108-W115 HydrophobicContact CG-CD2 4.49Å; Y108-W115 VanDerWaalsContact O-CZ2 3.32Å; Y108-W115 WeakPolarHBondContact O-CZ2 3.5Å; Y108-W115 PolarHBondContact O-NE1 2.76Å
109R93.7Very high94.8Very high149 Ų14977.7 Ų77.756%0.56237%0.367SS*.THydrogen-bonded Turntrans-67.5-38.1171.8-64.4175.8-174-177.62.7110.4T102 E103 A106T102-R109 PolarHBondContact O-NE 2.96Å; T102-R109 PolarHBondContact O-NH2 3.11Å; E103-R109 PolarHBondContact O-NH2 2.71Å; A106-R109 WeakPolarHBondContact O-CB 3.41Å; A106-R109 WeakPolarHBondContact O-CG 3.35Å; A106-R109 PolarHBondContact O-N 3.19Å
110D91.3Very high94.8Very high117 Ų11774.5 Ų74.563%0.62636%0.355SS*.SBendtrans-75.3147.2179.2-51.5-45.7000113.2Y108Y108-D110 VanDerWaalsContact C-N 3.31Å
111S91Very high94.8Very high90 Ų9077.8 Ų77.863%0.62937%0.37SS*.  trans49.150.7173.4-65.40000115.4R113 K114S111-R113 VanDerWaalsContact C-N 3.3Å; S111-R113 PolarHBondContact O-N 3.3Å; S111-R113 VanDerWaalsContact O-N 3.11Å; S111-K114 PolarHBondContact O-N 3.17Å
112P92.4Very high94.8Very high60 Ų6079 Ų7939%0.3938%0.377SS..Hα-helixtrans-50.8-43.5-170.816.2-30.7000114.4K114 W115 Q116P112-K114 PolarHBondContact O-N 3.1Å; P112-W115 PolarHBondContact O-N 3.06Å; P112-Q116 HydrophobicContact CB-CG 4.48Å; P112-Q116 VanDerWaalsContact O-CB 3.23Å; P112-Q116 WeakPolarHBondContact O-CB 3.32Å; P112-Q116 WeakPolarHBondContact O-CG 3.29Å; P112-Q116 PolarHBondContact O-N 3.3Å
113R95.4Very high94.9Very high224 Ų22477.3 Ų77.385%0.84537%0.366SS*.Hα-helixtrans-49.2-34.6180-179174.9168.9-1341113.8S111S111-R113 VanDerWaalsContact C-N 3.3Å; S111-R113 PolarHBondContact O-N 3.3Å; S111-R113 VanDerWaalsContact O-N 3.11Å
114K93.7Very high94.8Very high176 Ų17676.6 Ų76.677%0.76537%0.37SS*.Hα-helixtrans-75.6-52.3-175.3-169.7170.8-173.9168.60112.3S111 P112S111-K114 PolarHBondContact O-N 3.17Å; P112-K114 PolarHBondContact O-N 3.1Å
115W94.9Very high94.8Very high12 Ų1273.8 Ų73.85%0.04537%0.365CS..Hα-helixtrans-82.2-30.9-176.866.4-101.7000112.8Y76 Y98 I101 T102 Y108 P112 N117 S118 I119Y76-W115 HydrophobicContact CE1-CB 4.37Å; Y98-W115 HydrophobicContact CD1-CH2 4.18Å; Y98-W115 AromaticContact CD1-CZ3 3.91Å; Y98-W115 HydrophobicContact CD1-CZ3 3.91Å; Y98-W115 HydrophobicContact CG-CH2 4.33Å; I101-W115 HydrophobicContact CB-CH2 4.38Å; I101-W115 HydrophobicContact CB-CZ3 4.33Å; I101-W115 HydrophobicContact CD1-CZ3 4.24Å; I101-W115 HydrophobicContact CG2-CE3 4.49Å; I101-W115 HydrophobicContact CG2-CH2 4.22Å; I101-W115 HydrophobicContact CG2-CZ3 4.07Å; T102-W115 HydrophobicContact CG2-CH2 4.02Å; T102-W115 HydrophobicContact CG2-CZ2 3.59Å; Y108-W115 HydrophobicContact CD1-CB 3.94Å; Y108-W115 AromaticContact CD1-CD1 3.78Å; Y108-W115 AromaticContact CD1-CD2 3.97Å; Y108-W115 HydrophobicContact CD1-CD2 3.97Å; Y108-W115 AromaticContact CD1-CG 3.64Å; Y108-W115 HydrophobicContact CD1-CG 3.64Å; Y108-W115 HydrophobicContact CE1-CB 4.15Å; Y108-W115 HydrophobicContact CE1-CG 4.34Å; Y108-W115 HydrophobicContact CG-CD2 4.49Å; Y108-W115 VanDerWaalsContact O-CZ2 3.32Å; Y108-W115 WeakPolarHBondContact O-CZ2 3.5Å; Y108-W115 PolarHBondContact O-NE1 2.76Å; P112-W115 PolarHBondContact O-N 3.06Å; W115-N117 PolarHBondContact O-N 2.84Å; W115-S118 WeakPolarHBondContact CA-OG 3.36Å; W115-S118 PolarHBondContact O-N 3.18Å; W115-S118 VanDerWaalsContact O-N 3.1Å; W115-S118 PolarHBondContact O-OG 3.01Å; W115-I119 HydrophobicContact CE3-CG1 3.76Å; W115-I119 HydrophobicContact CZ3-CG1 3.99Å; W115-I119 PolarHBondContact O-N 2.71Å
116Q97.3Very high94.8Very high43 Ų4372.9 Ų72.920%0.20136%0.361CS..Hα-helixtrans-60.9-32.6173.7-71.5178.4-0.300111.6Y98 P112 I119 R120Y98-Q116 HydrophobicContact CD1-CB 4.42Å; Y98-Q116 HydrophobicContact CD1-CG 3.84Å; Y98-Q116 HydrophobicContact CD2-CG 4.21Å; Y98-Q116 HydrophobicContact CE1-CB 3.78Å; Y98-Q116 HydrophobicContact CE1-CG 3.7Å; Y98-Q116 HydrophobicContact CE2-CB 4.43Å; Y98-Q116 HydrophobicContact CE2-CG 4.1Å; Y98-Q116 HydrophobicContact CG-CG 4.09Å; P112-Q116 HydrophobicContact CB-CG 4.48Å; P112-Q116 VanDerWaalsContact O-CB 3.23Å; P112-Q116 WeakPolarHBondContact O-CB 3.32Å; P112-Q116 WeakPolarHBondContact O-CG 3.29Å; P112-Q116 PolarHBondContact O-N 3.3Å; Q116-I119 PolarHBondContact O-N 3.33Å; Q116-R120 WeakPolarHBondContact O-CG 3.4Å; Q116-R120 PolarHBondContact O-N 3.02Å
117N97.2Very high94.7Very high92 Ų9272.9 Ų72.949%0.49235%0.353SS..Hα-helixtrans-64.4-44.5173.9-158.145.9000111.8W115 I119 R120 H121W115-N117 PolarHBondContact O-N 2.84Å; N117-I119 VanDerWaalsContact C-N 3.31Å; N117-I119 PolarHBondContact O-N 3.34Å; N117-R120 PolarHBondContact O-N 3.47Å; N117-R120 PolarHBondContact OD1-NH2 3.17Å; N117-H121 WeakPolarHBondContact O-CB 3.21Å; N117-H121 PolarHBondContact O-N 3.4Å
118S96.9Very high94.7Very high24 Ų2470 Ų7017%0.16834%0.341CS..Hα-helixtrans-64.9-30.4172.942.80000113.5Y76 W115 N122Y76-S118 WeakPolarHBondContact CE2-OG 3.4Å; Y76-S118 VanDerWaalsContact CZ-OG 3.25Å; W115-S118 WeakPolarHBondContact CA-OG 3.36Å; W115-S118 PolarHBondContact O-N 3.18Å; W115-S118 VanDerWaalsContact O-N 3.1Å; W115-S118 PolarHBondContact O-OG 3.01Å; S118-N122 WeakPolarHBondContact O-CB 3.38Å; S118-N122 PolarHBondContact O-N 3.21Å; S118-N122 PolarHBondContact O-ND2 3.07Å
119I97.1Very high94.7Very high0 Ų070.3 Ų70.30%034%0.343CS..Hα-helixtrans-66.5-51173-68.7-70.1000110.9Y76 I80 L94 I97 Y98 I101 W115 Q116 N117 H121 N122 L123Y76-I119 HydrophobicContact CD1-CD1 3.94Å; Y76-I119 HydrophobicContact CD1-CG1 4.45Å; Y76-I119 HydrophobicContact CG-CD1 4.4Å; I80-I119 HydrophobicContact CD1-CD1 4.06Å; I80-I119 HydrophobicContact CD1-CG2 4.35Å; I80-I119 HydrophobicContact CG1-CD1 3.87Å; I80-I119 HydrophobicContact CG1-CG2 4.37Å; L94-I119 HydrophobicContact CD1-CG2 4.24Å; I97-I119 HydrophobicContact CG2-CG2 4.07Å; Y98-I119 HydrophobicContact CD1-CG2 4.28Å; Y98-I119 HydrophobicContact CE1-CB 4.23Å; Y98-I119 HydrophobicContact CE1-CG2 3.93Å; I101-I119 HydrophobicContact CD1-CD1 3.6Å; I101-I119 HydrophobicContact CD1-CG1 4.18Å; W115-I119 HydrophobicContact CE3-CG1 3.76Å; W115-I119 HydrophobicContact CZ3-CG1 3.99Å; W115-I119 PolarHBondContact O-N 2.71Å; Q116-I119 PolarHBondContact O-N 3.33Å; N117-I119 VanDerWaalsContact C-N 3.31Å; N117-I119 PolarHBondContact O-N 3.34Å; I119-H121 VanDerWaalsContact C-N 3.29Å; I119-H121 PolarHBondContact O-N 2.91Å; I119-N122 PolarHBondContact O-N 2.99Å; I119-N122 VanDerWaalsContact O-N 3.09Å; I119-L123 HydrophobicContact CG2-CD1 4.08Å; I119-L123 WeakPolarHBondContact O-CG 3.34Å; I119-L123 PolarHBondContact O-N 3.01Å
120R97.4Very high94.8Very high93 Ų9365.6 Ų65.635%0.35133%0.33SS..Hα-helixtrans-54.2-47.3175.8-69.9-174.5-61.7-93.611.2111.8L94 Y98 Q116 N117 L123 T124L94-R120 HydrophobicContact CD1-CG 4.09Å; L94-R120 HydrophobicContact CD2-CG 3.97Å; Y98-R120 WeakPolarHBondContact OH-CG 3.47Å; Y98-R120 PolarHBondContact OH-NH1 3.49Å; Q116-R120 WeakPolarHBondContact O-CG 3.4Å; Q116-R120 PolarHBondContact O-N 3.02Å; N117-R120 PolarHBondContact O-N 3.47Å; N117-R120 PolarHBondContact OD1-NH2 3.17Å; R120-L123 PolarHBondContact O-N 3.15Å; R120-T124 PolarHBondContact O-N 2.97Å; R120-T124 PolarHBondContact O-OG1 2.72Å
121H97.3Very high95Very high102 Ų10266 Ų6647%0.47233%0.327SS..Hα-helixtrans-62.9-39176.6170.968.5000113N117 I119 T124 L125N117-H121 WeakPolarHBondContact O-CB 3.21Å; N117-H121 PolarHBondContact O-N 3.4Å; I119-H121 VanDerWaalsContact C-N 3.29Å; I119-H121 PolarHBondContact O-N 2.91Å; H121-T124 PolarHBondContact O-N 2.94Å; H121-T124 PolarHBondContact O-OG1 3.1Å; H121-L125 WeakPolarHBondContact CE1-CD1 3.18Å; H121-L125 WeakPolarHBondContact O-CB 3.37Å; H121-L125 PolarHBondContact O-N 3.29Å
122N96.8Very high95.2Very high25 Ų2563.8 Ų63.813%0.13431%0.309CS..Hα-helixtrans-71.5-29.6178.4-87.2-100.7000113.1I77 I80 S118 I119 N126I77-N122 WeakPolarHBondContact CG1-OD1 3.5Å; I80-N122 HydrophobicContact CD1-CB 3.98Å; S118-N122 WeakPolarHBondContact O-CB 3.38Å; S118-N122 PolarHBondContact O-N 3.21Å; S118-N122 PolarHBondContact O-ND2 3.07Å; I119-N122 PolarHBondContact O-N 2.99Å; I119-N122 VanDerWaalsContact O-N 3.09Å; N122-N126 PolarHBondContact O-N 3.4Å; N122-N126 PolarHBondContact O-ND2 3.11Å
123L96.1Very high95.2Very high3 Ų365.4 Ų65.42%0.01632%0.319CS..Hα-helixtrans-68-41.3173.9-71.5166.6000112I80 L94 I97 I119 R120 F129 W145I80-L123 HydrophobicContact CD1-CD2 3.99Å; I80-L123 HydrophobicContact CD1-CG 3.97Å; I80-L123 HydrophobicContact CG1-CD2 4.42Å; I80-L123 HydrophobicContact CG2-CD2 3.7Å; L94-L123 HydrophobicContact CD1-CD1 3.57Å; I97-L123 HydrophobicContact CD1-CD1 4.26Å; I97-L123 HydrophobicContact CD1-CD2 4.22Å; I119-L123 HydrophobicContact CG2-CD1 4.08Å; I119-L123 WeakPolarHBondContact O-CG 3.34Å; I119-L123 PolarHBondContact O-N 3.01Å; R120-L123 PolarHBondContact O-N 3.15Å; L123-F129 HydrophobicContact CD2-CB 4.02Å; L123-F129 HydrophobicContact CD2-CD2 4.19Å; L123-F129 HydrophobicContact CD2-CG 4.01Å; L123-W145 HydrophobicContact CB-CD2 4.22Å; L123-W145 HydrophobicContact CB-CE3 4.09Å; L123-W145 HydrophobicContact CB-CH2 3.91Å; L123-W145 HydrophobicContact CB-CZ2 4.05Å; L123-W145 HydrophobicContact CB-CZ3 3.93Å; L123-W145 HydrophobicContact CD1-CD2 4.29Å; L123-W145 HydrophobicContact CD1-CG 4.41Å; L123-W145 HydrophobicContact CD2-CB 4.29Å; L123-W145 HydrophobicContact CD2-CD2 3.9Å; L123-W145 HydrophobicContact CD2-CE3 3.98Å; L123-W145 HydrophobicContact CD2-CG 4.04Å; L123-W145 HydrophobicContact CG-CD2 4.37Å; L123-W145 WeakPolarHBondContact O-CZ3 3.25Å
124T95.3Very high95Very high106 Ų10658 Ų5865%0.6529%0.292SS*.Hα-helixtrans-85.4-24.1178.8580000114.1R120 H121 W145R120-T124 PolarHBondContact O-N 2.97Å; R120-T124 PolarHBondContact O-OG1 2.72Å; H121-T124 PolarHBondContact O-N 2.94Å; H121-T124 PolarHBondContact O-OG1 3.1Å; T124-W145 HydrophobicContact CG2-CH2 4.1Å
125L94.1Very high94.7Very high75 Ų7554 Ų5439%0.39328%0.276SS..Hα-helixtrans-80.3-30.2-178.8179.9141000112.9H121 R166H121-L125 WeakPolarHBondContact CE1-CD1 3.18Å; H121-L125 WeakPolarHBondContact O-CB 3.37Å; H121-L125 PolarHBondContact O-N 3.29Å; L125-R166 VanDerWaalsContact CD2-NH2 3.31Å; L125-R166 PolarHBondContact O-NH2 3.48Å
126N92.7Very high93.9Very high10 Ų1060.1 Ų60.15%0.05332%0.317CS..  trans-110.3121.6-172.4-59.1-77.1000113.7N122 C128 F129 R166N122-N126 PolarHBondContact O-N 3.4Å; N122-N126 PolarHBondContact O-ND2 3.11Å; N126-C128 PolarHBondContact O-N 2.9Å; N126-F129 HydrophobicContact CB-CD2 4.24Å; N126-F129 PolarHBondContact O-N 3.26Å; N126-R166 PolarHBondContact OD1-NE 3.03Å; N126-R166 PolarHBondContact OD1-NH2 3.35Å
127D91.9Very high93.1Very high59 Ų5961.2 Ų61.232%0.31634%0.34SS..THydrogen-bonded Turntrans-53.4-22.3176.3-32.53.7000113.1F129 F167 K168 R169D127-F129 PolarHBondContact O-N 3.07Å; D127-F167 HydrophobicContact CB-CD1 4.17Å; D127-F167 HydrophobicContact CB-CE1 4.08Å; D127-K168 VanDerWaalsContact OD2-CA 3.25Å; D127-K168 WeakPolarHBondContact OD2-CA 3.38Å; D127-R169 HydrophobicContact CB-CB 4.16Å; D127-R169 PolarHBondContact OD2-N 3.23Å
128C92.3Very high92.2Very high7 Ų760.9 Ų60.95%0.04734%0.338CS..THydrogen-bonded Turntrans-57.7-23.2172-52.60000113.4N126 L147 D148 A151 F167N126-C128 PolarHBondContact O-N 2.9Å; C128-L147 HydrophobicContact CB-CD1 4.41Å; C128-L147 CarbonylContact O-C 3.58Å; C128-L147 WeakPolarHBondContact O-CA 3.23Å; C128-D148 PolarHBondContact O-N 3.34Å; C128-A151 HydrophobicContact CB-CB 4.11Å; C128-F167 VanDerWaalsContact SG-CD1 3.52Å
129F94.9Very high91.1Very high9 Ų965.8 Ų65.84%0.03937%0.369CS..EExtended strand (participates in β ladder)trans-114.3106.9-174.1-57.7-52.9000111.2I77 I80 L84 L123 N126 D127 W145 T146 L147I77-F129 HydrophobicContact CB-CE2 4.35Å; I77-F129 HydrophobicContact CB-CZ 4.4Å; I77-F129 HydrophobicContact CG1-CE2 4.34Å; I77-F129 HydrophobicContact CG2-CE2 3.99Å; I77-F129 HydrophobicContact CG2-CZ 3.79Å; I80-F129 HydrophobicContact CB-CE1 4Å; I80-F129 HydrophobicContact CB-CE2 4.18Å; I80-F129 HydrophobicContact CB-CZ 3.67Å; I80-F129 HydrophobicContact CD1-CD2 4.43Å; I80-F129 HydrophobicContact CD1-CE2 3.91Å; I80-F129 HydrophobicContact CD1-CZ 4.29Å; I80-F129 HydrophobicContact CG2-CD1 3.77Å; I80-F129 HydrophobicContact CG2-CD2 4.4Å; I80-F129 HydrophobicContact CG2-CE1 3.39Å; I80-F129 HydrophobicContact CG2-CE2 4.05Å; I80-F129 HydrophobicContact CG2-CG 4.27Å; I80-F129 HydrophobicContact CG2-CZ 3.54Å; L84-F129 HydrophobicContact CD1-CD1 3.9Å; L84-F129 HydrophobicContact CD1-CE1 4Å; L123-F129 HydrophobicContact CD2-CB 4.02Å; L123-F129 HydrophobicContact CD2-CD2 4.19Å; L123-F129 HydrophobicContact CD2-CG 4.01Å; N126-F129 HydrophobicContact CB-CD2 4.24Å; N126-F129 PolarHBondContact O-N 3.26Å; D127-F129 PolarHBondContact O-N 3.07Å; F129-W145 HydrophobicContact CB-CE3 4.14Å; F129-W145 HydrophobicContact CB-CZ3 4.47Å; F129-T146 CarbonylContact C-O 3.6Å; F129-T146 WeakPolarHBondContact CA-O 3.49Å; F129-L147 HydrophobicContact CD1-CD1 4.28Å; F129-L147 HydrophobicContact CE1-CD1 3.97Å
130V95.3Very high90.5Very high50 Ų5067.7 Ų67.730%0.30339%0.389SS..EExtended strand (participates in β ladder)trans-93.9127.7-177.4-174.30000109.9V132 W145 T146 D148V130-V132 PolarHBondContact O-N 3.15Å; V130-W145 WeakPolarHBondContact O-CA 3.41Å; V130-T146 PolarHBondContact N-O 3.01Å; V130-T146 PolarHBondContact O-N 2.83Å; V130-T146 PolarHBondContact O-OG1 3.36Å; V130-D148 HydrophobicContact CG2-CB 3.88Å
131K96.1Very high90Very high127 Ų12773.1 Ų73.155%0.55242%0.415SS*.EExtended strand (participates in β ladder)trans-76.8111.7172.2178.3-162.8170.1-163.50109.1N143 W145K131-N143 WeakPolarHBondContact CE-ND2 3.38Å; K131-N143 WeakPolarHBondContact CE-OD1 3.31Å; K131-N143 HydrophobicContact CG-CB 3.9Å; K131-W145 HydrophobicContact CB-CE3 4.2Å; K131-W145 HydrophobicContact CB-CH2 3.94Å; K131-W145 HydrophobicContact CB-CZ2 4.36Å; K131-W145 HydrophobicContact CB-CZ3 3.85Å
132V94.4Very high89.7Confident43 Ų4370.2 Ų70.226%0.26141%0.413SS..EExtended strand (participates in β ladder)trans-101.5126.5178.3-1800000109.2V130 Y144 T146V130-V132 PolarHBondContact O-N 3.15Å; V132-Y144 PolarHBondContact N-O 2.9Å; V132-Y144 PolarHBondContact O-N 2.88Å; V132-T146 HydrophobicContact CG2-CG2 3.77Å; V132-T146 VanDerWaalsContact CG2-OG1 3.31Å; V132-T146 WeakPolarHBondContact CG2-OG1 3.34Å
133P92.9Very high89.5Confident93 Ų9371.9 Ų71.960%0.60442%0.422SS*.PPolyproline II helixtrans-62.8160.5176.328-34.8000111.3
134R89.8Confident89.5Confident69 Ų6974.1 Ų74.126%0.2643%0.431SS..PPolyproline II helixtrans-77.6145.8169.9-77.3-176.2156.8-100.9-14.6110.3N138 G140 G142 Y144R134-N138 PolarHBondContact NH1-O 3.34Å; R134-G140 WeakPolarHBondContact CD-O 3.44Å; R134-G140 PolarHBondContact NE-O 2.96Å; R134-G142 VanDerWaalsContact CD-O 3.29Å; R134-G142 WeakPolarHBondContact CD-O 3.35Å; R134-G142 PolarHBondContact NE-O 2.93Å; R134-Y144 HydrophobicContact CG-CD2 4.1Å; R134-Y144 HydrophobicContact CG-CE2 3.96Å; R134-Y144 PolarHBondContact NH2-OH 3.38Å
135E87.3Confident89.6Confident92 Ų9270.7 Ų70.743%0.4341%0.406SS..PPolyproline II helixtrans-59.2135.5164-65.3146.1-141.600109R91 G137 N138R91-E135 IonicContact CZ-OE1 3.62Å; R91-E135 IonicContact NH1-OE1 3.72Å; R91-E135 PolarHBondContact NH1-OE1 2.93Å; R91-E135 IonicContact NH2-OE1 2.67Å; R91-E135 PolarHBondContact NH2-OE1 3.48Å; E135-G137 PolarHBondContact O-N 2.97Å; E135-G137 VanDerWaalsContact O-N 3.15Å; E135-N138 PolarHBondContact O-N 3.17Å; E135-N138 PolarHBondContact OE2-ND2 2.94Å
136P79.3Confident89.7Confident140 Ų14068.5 Ų68.591%0.90940%0.396SS*.THydrogen-bonded Turntrans-65.1-22.4-168.423.7-33.8000114.4N138P136-N138 VanDerWaalsContact C-N 3.29Å; P136-N138 PolarHBondContact O-N 2.85Å
137G79.9Confident89.7Confident67 Ų6768.9 Ų68.969%0.69140%0.398SS*.THydrogen-bonded Turntrans-78.6-1.2174.200000115.4E135 P139E135-G137 PolarHBondContact O-N 2.97Å; E135-G137 VanDerWaalsContact O-N 3.15Å; G137-P139 VanDerWaalsContact C-CD 3.44Å; G137-P139 WeakPolarHBondContact O-CD 3.42Å
138N78.5Confident89.8Confident84 Ų8466.5 Ų66.545%0.44939%0.385SS..  trans-114.771.5-173.8-92.2-68.5000112.4R134 E135 P136 G140R134-N138 PolarHBondContact NH1-O 3.34Å; E135-N138 PolarHBondContact O-N 3.17Å; E135-N138 PolarHBondContact OE2-ND2 2.94Å; P136-N138 VanDerWaalsContact C-N 3.29Å; P136-N138 PolarHBondContact O-N 2.85Å; N138-G140 PolarHBondContact O-N 3.22Å; N138-G140 VanDerWaalsContact O-N 3.11Å
139P74.7Confident89.7Confident127 Ų12771.3 Ų71.383%0.82542%0.416SS*.  trans-62.1114.2-178.226.6-34.7000110.8G137G137-P139 VanDerWaalsContact C-CD 3.44Å; G137-P139 WeakPolarHBondContact O-CD 3.42Å
140G84.4Confident89.3Confident41 Ų4174 Ų7442%0.42344%0.44SS..  trans-172158.5-176.200000113.8R134 N138 G142R134-G140 WeakPolarHBondContact CD-O 3.44Å; R134-G140 PolarHBondContact NE-O 2.96Å; N138-G140 PolarHBondContact O-N 3.22Å; N138-G140 VanDerWaalsContact O-N 3.11Å; G140-G142 PolarHBondContact O-N 3.43Å; G140-G142 VanDerWaalsContact O-N 3.12Å
141K86.1Confident88.8Confident206 Ų20671.6 Ų71.690%0.89643%0.425SS*.SBendtrans-71.6107.5-166.6-169.7168-174.2166.30113
142G90.2Very high88.3Confident42 Ų4266.1 Ų66.143%0.43340%0.404SS..SBendtrans83170.6167.900000115.1R134 G140R134-G142 VanDerWaalsContact CD-O 3.29Å; R134-G142 WeakPolarHBondContact CD-O 3.35Å; R134-G142 PolarHBondContact NE-O 2.93Å; G140-G142 PolarHBondContact O-N 3.43Å; G140-G142 VanDerWaalsContact O-N 3.12Å
143N94.4Very high87.8Confident59 Ų5970.2 Ų70.232%0.31642%0.424SS..  trans-80.6160.1-173.9-63.4-94.2000111.7K131K131-N143 WeakPolarHBondContact CE-ND2 3.38Å; K131-N143 WeakPolarHBondContact CE-OD1 3.31Å; K131-N143 HydrophobicContact CG-CB 3.9Å
144Y95.3Very high87.3Confident50 Ų5068 Ų6820%0.19641%0.407CS..EExtended strand (participates in β ladder)trans-79.1153164.9-71.9-81.4000110R91 L92 T93 V132 R134R91-Y144 HydrophobicContact CB-CD1 4.32Å; R91-Y144 HydrophobicContact CG-CD1 4.17Å; L92-Y144 CarbonylContact O-C 3.57Å; T93-Y144 HydrophobicContact CG2-CD1 4.09Å; T93-Y144 HydrophobicContact CG2-CE1 3.93Å; V132-Y144 PolarHBondContact N-O 2.9Å; V132-Y144 PolarHBondContact O-N 2.88Å; R134-Y144 HydrophobicContact CG-CD2 4.1Å; R134-Y144 HydrophobicContact CG-CE2 3.96Å; R134-Y144 PolarHBondContact NH2-OH 3.38Å
145W96.8Very high86.8Confident34 Ų3465.3 Ų65.313%0.12940%0.397CS..EExtended strand (participates in β ladder)trans-119.4139.4168.7-6891.4000108L84 R91 L92 I97 L123 T124 F129 V130 K131L84-W145 WeakPolarHBondContact CD2-O 3.29Å; R91-W145 WeakPolarHBondContact CA-O 3.37Å; L92-W145 PolarHBondContact N-O 2.75Å; L92-W145 PolarHBondContact O-N 2.99Å; I97-W145 HydrophobicContact CD1-CB 4.28Å; L123-W145 HydrophobicContact CB-CD2 4.22Å; L123-W145 HydrophobicContact CB-CE3 4.09Å; L123-W145 HydrophobicContact CB-CH2 3.91Å; L123-W145 HydrophobicContact CB-CZ2 4.05Å; L123-W145 HydrophobicContact CB-CZ3 3.93Å; L123-W145 HydrophobicContact CD1-CD2 4.29Å; L123-W145 HydrophobicContact CD1-CG 4.41Å; L123-W145 HydrophobicContact CD2-CB 4.29Å; L123-W145 HydrophobicContact CD2-CD2 3.9Å; L123-W145 HydrophobicContact CD2-CE3 3.98Å; L123-W145 HydrophobicContact CD2-CG 4.04Å; L123-W145 HydrophobicContact CG-CD2 4.37Å; L123-W145 WeakPolarHBondContact O-CZ3 3.25Å; T124-W145 HydrophobicContact CG2-CH2 4.1Å; F129-W145 HydrophobicContact CB-CE3 4.14Å; F129-W145 HydrophobicContact CB-CZ3 4.47Å; V130-W145 WeakPolarHBondContact O-CA 3.41Å; K131-W145 HydrophobicContact CB-CE3 4.2Å; K131-W145 HydrophobicContact CB-CH2 3.94Å; K131-W145 HydrophobicContact CB-CZ2 4.36Å; K131-W145 HydrophobicContact CB-CZ3 3.85Å
146T95.6Very high86.2Confident29 Ų2964.6 Ų64.618%0.17840%0.396CS..EExtended strand (participates in β ladder)trans-130.4163.2178.450.60000109.7R91 F129 V130 V132R91-T146 HydrophobicContact CB-CG2 3.64Å; F129-T146 CarbonylContact C-O 3.6Å; F129-T146 WeakPolarHBondContact CA-O 3.49Å; V130-T146 PolarHBondContact N-O 3.01Å; V130-T146 PolarHBondContact O-N 2.83Å; V130-T146 PolarHBondContact O-OG1 3.36Å; V132-T146 HydrophobicContact CG2-CG2 3.77Å; V132-T146 VanDerWaalsContact CG2-OG1 3.31Å; V132-T146 WeakPolarHBondContact CG2-OG1 3.34Å
147L94.5Very high85.9Confident18 Ų1864.9 Ų64.99%0.09439%0.39CS..EExtended strand (participates in β ladder)trans-84.3132.9167.2-168.167.4000108.1L84 C128 F129 A151 A152 F155L84-L147 HydrophobicContact CD1-CB 4.38Å; C128-L147 HydrophobicContact CB-CD1 4.41Å; C128-L147 CarbonylContact O-C 3.58Å; C128-L147 WeakPolarHBondContact O-CA 3.23Å; F129-L147 HydrophobicContact CD1-CD1 4.28Å; F129-L147 HydrophobicContact CE1-CD1 3.97Å; L147-A151 HydrophobicContact CD1-CB 4.34Å; L147-A151 HydrophobicContact CG-CB 4.47Å; L147-A152 HydrophobicContact CD2-CB 4.38Å; L147-F155 HydrophobicContact CD1-CD2 4.02Å; L147-F155 HydrophobicContact CD1-CE2 4.03Å; L147-F155 HydrophobicContact CD2-CD2 4.16Å
148D93Very high85.3Confident10 Ų1063.9 Ų63.95%0.05338%0.38CS..  trans-59.6133.5171.9-170.1-59.9000108.9C128 V130 A150 A151 A152 R169C128-D148 PolarHBondContact O-N 3.34Å; V130-D148 HydrophobicContact CG2-CB 3.88Å; D148-A150 PolarHBondContact O-N 3.03Å; D148-A150 WeakPolarHBondContact OD1-CB 3.15Å; D148-A150 PolarHBondContact OD1-N 3.15Å; D148-A151 HydrophobicContact CB-CB 4.21Å; D148-A151 CarbonylContact O-C 3.57Å; D148-A151 WeakPolarHBondContact O-CA 3.34Å; D148-A151 WeakPolarHBondContact O-CB 3.14Å; D148-A151 PolarHBondContact O-N 2.91Å; D148-A152 PolarHBondContact O-N 3.39Å; D148-R169 WeakPolarHBondContact OD2-CD 3.36Å; D148-R169 IonicContact OD2-NH1 3.15Å; D148-R169 PolarHBondContact OD2-NH1 3.09Å; D148-R169 VanDerWaalsContact OD2-NH1 3.15Å
149P90.2Very high85.2Confident108 Ų10862.5 Ų62.570%0.70138%0.376SS*.G310 helixtrans-53.7-38.9177.8-28.436.2000113.5A151 A152P149-A151 PolarHBondContact O-N 2.78Å; P149-A152 WeakPolarHBondContact O-CB 3.34Å; P149-A152 PolarHBondContact O-N 2.9Å; P149-A152 VanDerWaalsContact O-N 3.1Å
150A87.1Confident85.3Confident64 Ų6458.6 Ų58.653%0.52935%0.346SS..G310 helixtrans-69.8-2.617600000113.4D148 F167D148-A150 PolarHBondContact O-N 3.03Å; D148-A150 WeakPolarHBondContact OD1-CB 3.15Å; D148-A150 PolarHBondContact OD1-N 3.15Å; A150-F167 HydrophobicContact CB-CE2 4.42Å; A150-F167 HydrophobicContact CB-CZ 4.17Å; A150-F167 VanDerWaalsContact O-CE2 3.32Å; A150-F167 WeakPolarHBondContact O-CE2 3.25Å
151A85.4Confident84.8Confident0 Ų062.9 Ų62.90%036%0.359CS..G310 helixtrans-111.5-4173.600000114.3C128 L147 D148 P149 M154 F155 F167C128-A151 HydrophobicContact CB-CB 4.11Å; L147-A151 HydrophobicContact CD1-CB 4.34Å; L147-A151 HydrophobicContact CG-CB 4.47Å; D148-A151 HydrophobicContact CB-CB 4.21Å; D148-A151 CarbonylContact O-C 3.57Å; D148-A151 WeakPolarHBondContact O-CA 3.34Å; D148-A151 WeakPolarHBondContact O-CB 3.14Å; D148-A151 PolarHBondContact O-N 2.91Å; P149-A151 PolarHBondContact O-N 2.78Å; A151-M154 VanDerWaalsContact CA-CE 3.45Å; A151-M154 HydrophobicContact CB-CE 3.4Å; A151-M154 PolarHBondContact O-N 3.42Å; A151-F155 VanDerWaalsContact O-CD2 3.29Å; A151-F155 WeakPolarHBondContact O-CD2 3.38Å; A151-F167 HydrophobicContact CB-CE1 4.29Å; A151-F167 HydrophobicContact CB-CE2 4.4Å; A151-F167 HydrophobicContact CB-CZ 4.16Å
152A84.6Confident84Confident13 Ų1363.9 Ų63.911%0.10736%0.357CS..THydrogen-bonded Turntrans-63.2-56.7-175.100000112.9L147 D148 P149 M154 F155 D156L147-A152 HydrophobicContact CD2-CB 4.38Å; D148-A152 PolarHBondContact O-N 3.39Å; P149-A152 WeakPolarHBondContact O-CB 3.34Å; P149-A152 PolarHBondContact O-N 2.9Å; P149-A152 VanDerWaalsContact O-N 3.1Å; A152-M154 PolarHBondContact O-N 3.27Å; A152-F155 PolarHBondContact O-N 2.83Å; A152-D156 PolarHBondContact O-N 2.99Å; A152-D156 VanDerWaalsContact O-N 3.13Å
153D84.4Confident83.2Confident129 Ų12966.5 Ų66.569%0.6935%0.354SS*.Hα-helixtrans-50.8-30.5-179.7-46.6-14.4000113F155D153-F155 PolarHBondContact O-N 3.44Å
154M81.5Confident81.9Confident47 Ų4776.1 Ų76.123%0.23239%0.386CS..Hα-helixtrans-70.8-7.1-179.1-49.4-165.2-75.800114.4A151 A152 R163 F167A151-M154 VanDerWaalsContact CA-CE 3.45Å; A151-M154 HydrophobicContact CB-CE 3.4Å; A151-M154 PolarHBondContact O-N 3.42Å; A152-M154 PolarHBondContact O-N 3.27Å; M154-R163 VanDerWaalsContact CB-NH2 3.34Å; M154-R163 PolarHBondContact O-NH2 3.11Å; M154-R163 PolarHBondContact SD-NH1 3.41Å; M154-F167 HydrophobicContact CE-CB 3.67Å; M154-F167 HydrophobicContact CE-CD1 4.35Å; M154-F167 HydrophobicContact CE-CD2 3.35Å; M154-F167 HydrophobicContact CE-CE2 3.99Å; M154-F167 HydrophobicContact CE-CG 3.55Å; M154-F167 HydrophobicContact SD-CB 4.27Å; M154-F167 HydrophobicContact SD-CD2 3.88Å; M154-F167 HydrophobicContact SD-CG 4.41Å
155F79.8Confident81Confident11 Ų1182.7 Ų82.75%0.04842%0.415CS..Hα-helixtrans-130.2-25.9179.4-61.1-76.4000113.4I77 A81 L147 A151 A152 D153 N157 G158 F160I77-F155 HydrophobicContact CG2-CE1 4.19Å; I77-F155 HydrophobicContact CG2-CZ 3.75Å; A81-F155 HydrophobicContact CB-CB 4.39Å; A81-F155 HydrophobicContact CB-CD1 3.7Å; A81-F155 HydrophobicContact CB-CD2 4.25Å; A81-F155 HydrophobicContact CB-CE1 3.95Å; A81-F155 HydrophobicContact CB-CE2 4.48Å; A81-F155 HydrophobicContact CB-CG 3.85Å; A81-F155 HydrophobicContact CB-CZ 4.33Å; L147-F155 HydrophobicContact CD1-CD2 4.02Å; L147-F155 HydrophobicContact CD1-CE2 4.03Å; L147-F155 HydrophobicContact CD2-CD2 4.16Å; A151-F155 VanDerWaalsContact O-CD2 3.29Å; A151-F155 WeakPolarHBondContact O-CD2 3.38Å; A152-F155 PolarHBondContact O-N 2.83Å; D153-F155 PolarHBondContact O-N 3.44Å; F155-N157 VanDerWaalsContact C-N 3.32Å; F155-N157 PolarHBondContact O-N 3.17Å; F155-G158 PolarHBondContact O-N 3.29Å; F155-F160 HydrophobicContact CB-CE1 4.28Å; F155-F160 HydrophobicContact CD1-CD1 4.29Å; F155-F160 HydrophobicContact CD1-CE1 4.49Å
156D75.1Confident80Confident77 Ų7787.1 Ų87.141%0.41243%0.432SS..Hα-helixtrans-65.4-32.3-172.1-71.74.8000112.8R90 A152 G158R90-D156 IonicContact CZ-OD1 3.41Å; R90-D156 IonicContact CZ-OD2 3.64Å; R90-D156 IonicContact NH1-OD1 2.75Å; R90-D156 IonicContact NH1-OD2 2.91Å; R90-D156 PolarHBondContact NH1-OD2 3.02Å; R90-D156 VanDerWaalsContact NH2-CG 3.32Å; R90-D156 IonicContact NH2-OD1 3.13Å; R90-D156 PolarHBondContact NH2-OD1 3.49Å; R90-D156 IonicContact NH2-OD2 3.34Å; R90-D156 PolarHBondContact NH2-OD2 3.35Å; R90-D156 VanDerWaalsContact NH2-OD2 3.13Å; A152-D156 PolarHBondContact O-N 2.99Å; A152-D156 VanDerWaalsContact O-N 3.13Å; D156-G158 PolarHBondContact O-N 3.12Å
157N72Confident79.1Confident147 Ų14787.4 Ų87.479%0.78643%0.431SS*.THydrogen-bonded Turntrans-77.327.2172.1-62.936.3000113.5F155 S159F155-N157 VanDerWaalsContact C-N 3.32Å; F155-N157 PolarHBondContact O-N 3.17Å; N157-S159 PolarHBondContact O-N 2.84Å; N157-S159 VanDerWaalsContact O-N 3.17Å
158G68.3Low78.4Confident46 Ų4694.3 Ų94.347%0.47446%0.46SS..SBendtrans69.49.4177.400000115.9F155 D156 F160F155-G158 PolarHBondContact O-N 3.29Å; D156-G158 PolarHBondContact O-N 3.12Å; G158-F160 WeakPolarHBondContact O-CD2 3.38Å; G158-F160 PolarHBondContact O-N 2.9Å
159S75.8Confident77.5Confident54 Ų54100.8 Ų100.838%0.37848%0.484SS..  trans-79.263-172.5-1620000113.3N157 L161N157-S159 PolarHBondContact O-N 2.84Å; N157-S159 VanDerWaalsContact O-N 3.17Å; S159-L161 PolarHBondContact O-N 2.65Å
160F77.3Confident76.8Confident46 Ų4699.6 Ų99.620%0.20248%0.483CS..  trans-77.63.6179.2-59.4-61.3000114.1Y74 A78 M82 F155 G158Y74-F160 HydrophobicContact CD1-CB 3.83Å; Y74-F160 HydrophobicContact CE1-CB 3.82Å; A78-F160 HydrophobicContact CB-CB 4.08Å; A78-F160 HydrophobicContact CB-CD1 4.45Å; A78-F160 VanDerWaalsContact CB-O 3.28Å; A78-F160 WeakPolarHBondContact CB-O 3.04Å; M82-F160 HydrophobicContact CB-CE1 4.49Å; M82-F160 HydrophobicContact CG-CD1 3.6Å; M82-F160 HydrophobicContact CG-CD2 4.12Å; M82-F160 HydrophobicContact CG-CE1 3.45Å; M82-F160 VanDerWaalsContact CG-CE1 3.45Å; M82-F160 HydrophobicContact CG-CE2 3.97Å; M82-F160 HydrophobicContact CG-CG 3.95Å; M82-F160 HydrophobicContact CG-CZ 3.65Å; M82-F160 HydrophobicContact SD-CD1 4.41Å; M82-F160 HydrophobicContact SD-CD2 4.18Å; M82-F160 HydrophobicContact SD-CE2 4.42Å; M82-F160 HydrophobicContact SD-CG 4.19Å; F155-F160 HydrophobicContact CB-CE1 4.28Å; F155-F160 HydrophobicContact CD1-CD1 4.29Å; F155-F160 HydrophobicContact CD1-CE1 4.49Å; G158-F160 WeakPolarHBondContact O-CD2 3.38Å; G158-F160 PolarHBondContact O-N 2.9Å
161L73.9Confident75.7Confident131 Ų131105 Ų10569%0.68650%0.497SS*.SBendtrans-72.7151176.8-74.2170000112.3S159 R163S159-L161 PolarHBondContact O-N 2.65Å; L161-R163 PolarHBondContact O-N 3.4Å
162R68.3Low74.5Confident226 Ų226112.4 Ų112.485%0.85354%0.536SS*.  trans-71.299.1-179.6-177.9-174.7169.7-167.3-2.4111.4
163R73.7Confident72.9Confident97 Ų97117.2 Ų117.237%0.36657%0.566SS.*  trans-59152.4168.9-82174.1-90.5127.4-4.1112.6M154 L161M154-R163 VanDerWaalsContact CB-NH2 3.34Å; M154-R163 PolarHBondContact O-NH2 3.11Å; M154-R163 PolarHBondContact SD-NH1 3.41Å; L161-R163 PolarHBondContact O-N 3.4Å
164R67.7Low71.4Confident261 Ų261115.3 Ų115.399%0.98557%0.569SS**SBendtrans-84.7-44.6178.6-65.5-175.8-173.61743.8112.8
165K76.1Confident70.1Confident189 Ų189121.7 Ų121.782%0.82260%0.597SS**SBendtrans-81.1134.3174.1-168174.5-178.1-179.80109
166R76.1Confident68.7Low127 Ų127126.8 Ų126.848%0.47963%0.632SS.*PPolyproline II helixtrans-83.3139.7176.3-164.5-178.2178.8-121.5-18.3109.2L125 N126L125-R166 VanDerWaalsContact CD2-NH2 3.31Å; L125-R166 PolarHBondContact O-NH2 3.48Å; N126-R166 PolarHBondContact OD1-NE 3.03Å; N126-R166 PolarHBondContact OD1-NH2 3.35Å
167F77.3Confident67.7Low35 Ų35127.6 Ų127.615%0.15465%0.649CS.*PPolyproline II helixtrans-67133.3164.9178.4-99.7000108.7D127 C128 A150 A151 M154 R169D127-F167 HydrophobicContact CB-CD1 4.17Å; D127-F167 HydrophobicContact CB-CE1 4.08Å; C128-F167 VanDerWaalsContact SG-CD1 3.52Å; A150-F167 HydrophobicContact CB-CE2 4.42Å; A150-F167 HydrophobicContact CB-CZ 4.17Å; A150-F167 VanDerWaalsContact O-CE2 3.32Å; A150-F167 WeakPolarHBondContact O-CE2 3.25Å; A151-F167 HydrophobicContact CB-CE1 4.29Å; A151-F167 HydrophobicContact CB-CE2 4.4Å; A151-F167 HydrophobicContact CB-CZ 4.16Å; M154-F167 HydrophobicContact CE-CB 3.67Å; M154-F167 HydrophobicContact CE-CD1 4.35Å; M154-F167 HydrophobicContact CE-CD2 3.35Å; M154-F167 HydrophobicContact CE-CE2 3.99Å; M154-F167 HydrophobicContact CE-CG 3.55Å; M154-F167 HydrophobicContact SD-CB 4.27Å; M154-F167 HydrophobicContact SD-CD2 3.88Å; M154-F167 HydrophobicContact SD-CG 4.41Å; F167-R169 HydrophobicContact CE1-CB 4.22Å; F167-R169 HydrophobicContact CZ-CB 4.43Å
168K78.1Confident67.1Low163 Ų163124.8 Ų124.871%0.70965%0.646SS**  trans-117.6142156.7-74.9-175.4168.6-168.30105.3D127 A170D127-K168 VanDerWaalsContact OD2-CA 3.25Å; D127-K168 WeakPolarHBondContact OD2-CA 3.38Å; K168-A170 PolarHBondContact O-N 2.85Å
169R75Confident66.9Low146 Ų146128 Ų12855%0.55166%0.659SS**  trans-64.4131.4165.5-164.116094.3169.67.6107.8D127 D148 F167 E171D127-R169 HydrophobicContact CB-CB 4.16Å; D127-R169 PolarHBondContact OD2-N 3.23Å; D148-R169 WeakPolarHBondContact OD2-CD 3.36Å; D148-R169 IonicContact OD2-NH1 3.15Å; D148-R169 PolarHBondContact OD2-NH1 3.09Å; D148-R169 VanDerWaalsContact OD2-NH1 3.15Å; F167-R169 HydrophobicContact CE1-CB 4.22Å; F167-R169 HydrophobicContact CZ-CB 4.43Å; R169-E171 PolarHBondContact O-N 3.01Å; R169-E171 VanDerWaalsContact O-N 3.17Å
170A75.2Confident66.3Low83 Ų83131.6 Ų131.669%0.68668%0.681SS**  trans-67.7112.9165.300000106.6K168 L172K168-A170 PolarHBondContact O-N 2.85Å; A170-L172 VanDerWaalsContact C-N 3.33Å; A170-L172 PolarHBondContact O-N 3.49Å
171E63.7Low65.6Low176 Ų176132.4 Ų132.482%0.82270%0.702SS**  trans-64.4106.7154-67.5-166.6148.300105.8R169 P173R169-E171 PolarHBondContact O-N 3.01Å; R169-E171 VanDerWaalsContact O-N 3.17Å; E171-P173 WeakPolarHBondContact O-CD 3.46Å
172L59.8Low65.2Low157 Ų157131.3 Ų131.382%0.82270%0.703SS**PPolyproline II helixtrans-47.4123.3150.7-72168.4000105.3A170 A174A170-L172 VanDerWaalsContact C-N 3.33Å; A170-L172 PolarHBondContact O-N 3.49Å; L172-A174 PolarHBondContact O-N 2.93Å
173P51.5Low64.6Low113 Ų113126.6 Ų126.673%0.73470%0.702SS**PPolyproline II helixtrans-52.7116.5178.9-26.334.5000108E171 H175E171-P173 WeakPolarHBondContact O-CD 3.46Å; P173-H175 PolarHBondContact O-N 3.06Å; P173-H175 VanDerWaalsContact O-N 3.09Å
174A53.6Low64.1Low90 Ų90129.4 Ų129.474%0.74472%0.723SS**PPolyproline II helixtrans-52.3124.2169.500000105.9L172L172-A174 PolarHBondContact O-N 2.93Å
175H54Low63.7Low180 Ų180122.5 Ų122.583%0.83371%0.712SS**  trans-41.6120.6-172.4-72.3-89.4000108.6P173 A177P173-H175 PolarHBondContact O-N 3.06Å; P173-H175 VanDerWaalsContact O-N 3.09Å; H175-A177 PolarHBondContact O-N 3.11Å
176P49.7Very low62.5Low118 Ų118123.2 Ų123.277%0.76672%0.715SS**  trans-54.7112.8-166.920.4-32.5000107.7A178P176-A178 PolarHBondContact O-N 2.78Å
177A53.7Low61.5Low94 Ų94122.7 Ų122.778%0.77773%0.729SS**PPolyproline II helixtrans-54.3120.8-171.500000107.2H175H175-A177 PolarHBondContact O-N 3.11Å
178A59.4Low59.8Low88 Ų88131 Ų13173%0.72776%0.761SS**PPolyproline II helixtrans-51.4130.4-168.500000108.9P176P176-A178 PolarHBondContact O-N 2.78Å
179P66.1Low58.2Low113 Ų113127.9 Ų127.973%0.73477%0.765SS**PPolyproline II helixtrans-56137.8-17323.3-33.8000109G181P179-G181 PolarHBondContact O-N 3.47Å
180P61.5Low57.4Low130 Ų130125.5 Ų125.584%0.84477%0.768SS**PPolyproline II helixtrans-56.7118.8179.923.6-33000108.6
181G62.6Low56Low63 Ų63132.2 Ų132.265%0.64978%0.778SS**PPolyproline II helixtrans-59.3149.2-177.600000111.2P179P179-G181 PolarHBondContact O-N 3.47Å
182P66.8Low55.1Low109 Ų109127.7 Ų127.771%0.70877%0.77SS**PPolyproline II helixtrans-60.5142179.126.7-34.6000110.4L184P182-L184 PolarHBondContact O-N 3.09Å
183P55.6Low54.8Low127 Ų127126.1 Ų126.183%0.82577%0.77SS**PPolyproline II helixtrans-64.5121.9176.327.1-33.5000109.7
184L63.9Low54.8Low156 Ų156125.1 Ų125.182%0.81777%0.771SS**PPolyproline II helixtrans-70.3135175.1-63.2178.1000109.9P182P182-L184 PolarHBondContact O-N 3.09Å
185P57.8Low54.7Low116 Ų116127.2 Ų127.275%0.75378%0.777SS**PPolyproline II helixtrans-70147.217329.6-33.8000111.3
186F52Low54.2Low203 Ų203122 Ų12289%0.8977%0.772SS**PPolyproline II helixtrans-58.5164.6177.6-52.8-91.6000112.8
187P55.2Low54.5Low117 Ų117123 Ų12376%0.7678%0.778SS**  -144.7170.698.439.2-26000116.5
188Y41.6Very low54.2Low209 Ų209123.1 Ų123.182%0.8278%0.779SS**  trans84.595151.5-118.8-90.4000120.9P190Y188-P190 HydrophobicContact CE1-CG 4.22Å
189A44Very low53.7Low97 Ų97127.1 Ų127.180%0.80279%0.787SS**  trans-144.2123.8138.700000108.4
190P58.7Low52.9Low96 Ų96130.3 Ų130.362%0.62380%0.797SS**  trans-92.4177.5-177.536.7-35.7000113.4Y188Y188-P190 HydrophobicContact CE1-CG 4.22Å
191Y44.3Very low52.6Low224 Ų224128.2 Ų128.288%0.87879%0.791SS**  trans72.996.9177.9-122.6-98.1000113.7
192A46.5Very low52.9Low81 Ų81130.7 Ų130.767%0.66980%0.796SS**  73.5147.45900000114.2
193P52Low52.9Low125 Ų125130.9 Ų130.981%0.81280%0.797SS**  cis-122.7-178.91.542-28.6000114.6
194A52.5Low53.6Low91 Ų91130.4 Ų130.475%0.75279%0.794SS**  trans-110.4161.9166.900000111.3
195P51.8Low53.5Low135 Ų135129 Ų12988%0.87779%0.794SS**  -143.9156.9121.938.4-26.1000114.6
196G42.5Very low53.5Low70 Ų70128.4 Ų128.472%0.72280%0.799SS**  trans131.9100.3166.100000114.9
197P57Low53.7Low138 Ų138121.7 Ų121.790%0.89679%0.787SS**  trans-85.6113.6176.832.1-31000111.6
198A46.8Very low53.9Low97 Ų97122.8 Ų122.880%0.80279%0.794SS**  trans-109.3128.2169.300000110.1
199L49Very low54.4Low172 Ų172115.8 Ų115.890%0.90179%0.786SS**  trans-51.4140.7-165.1-62.6169.1000115.5A201L199-A201 PolarHBondContact O-N 3.21Å
200L49.5Very low55.1Low180 Ų180117.6 Ų117.694%0.94279%0.789SS**  trans-62.1124.7168-135.975000110.2
201A54.1Low55.2Low87 Ų87117.3 Ų117.372%0.71980%0.795SS**  trans-131.5118168.600000109.1L199L199-A201 PolarHBondContact O-N 3.21Å
202P69.4Low56.2Low114 Ų114112.1 Ų112.174%0.7479%0.789SS**PPolyproline II helixtrans-74.6145.1178.230.7-34000111
203P67.8Low56.7Low114 Ų114114.2 Ų114.274%0.7480%0.795SS**PPolyproline II helixtrans-68.7144.2171.929.8-34.3000110.7
204P69Low56.7Low116 Ų116112.3 Ų112.375%0.75379%0.79SS**PPolyproline II helixtrans-68.8150.5174.929.7-34.9000111.3A206P204-A206 PolarHBondContact O-N 3.12Å
205P62.7Low56.9Low127 Ų127118.2 Ų118.283%0.82579%0.793SS**PPolyproline II helixtrans-67.4133.2178.628.2-34.4000111.4G207P205-G207 PolarHBondContact O-N 3.04Å
206A56.6Low57.2Low103 Ų103119.3 Ų119.385%0.85179%0.791SS**PPolyproline II helixtrans-69.9119.7172.600000110.2P204P204-A206 PolarHBondContact O-N 3.12Å
207G57.1Low57.6Low63 Ų63123.8 Ų123.865%0.64979%0.791SS**PPolyproline II helixtrans-67.2151.7172.900000112.1P205 G209P205-G207 PolarHBondContact O-N 3.04Å; G207-G209 PolarHBondContact O-N 3.02Å; G207-G209 VanDerWaalsContact O-N 3.13Å
208P58.1Low57.5Low139 Ų139121 Ų12190%0.90377%0.774SS**  trans-68.1111.4-179.427.6-33.9000111
209G53.8Low58.1Low63 Ų63121.8 Ų121.865%0.64977%0.769SS**PPolyproline II helixtrans-66.1148.8170.700000111.8G207 A211G207-G209 PolarHBondContact O-N 3.02Å; G207-G209 VanDerWaalsContact O-N 3.13Å; G209-A211 PolarHBondContact O-N 3.12Å
210P58.6Low58.5Low134 Ų134119 Ų11987%0.8776%0.755SS**PPolyproline II helixtrans-64.6135.7-178.126.8-34.5000111.7
211A60.2Low58.7Low90 Ų90114.7 Ų114.774%0.74474%0.74SS**PPolyproline II helixtrans-66.2145.8179.400000112G209G209-A211 PolarHBondContact O-N 3.12Å
212P64.7Low58.7Low115 Ų115118 Ų11875%0.74774%0.744SS**PPolyproline II helixtrans-66.2145173.429.1-34.9000110.8A214P212-A214 PolarHBondContact O-N 2.86Å
213P58.1Low58Low125 Ų125118.5 Ų118.581%0.81275%0.746SS**PPolyproline II helixtrans-65.2121.1-178.426-34000111.3R215P213-R215 PolarHBondContact O-N 2.97Å
214A51.8Low57.2Low85 Ų85117.9 Ų117.970%0.70274%0.744SS**PPolyproline II helixtrans-61.1121.1176.700000110.6P212 L216P212-A214 PolarHBondContact O-N 2.86Å; A214-L216 PolarHBondContact O-N 3Å
215R57.3Low56.4Low216 Ų216119.5 Ų119.582%0.81575%0.745SS**  trans-75.492.4175.1-77.2-173.8169.1-139.8-3.7109.9P213 F217P213-R215 PolarHBondContact O-N 2.97Å; R215-F217 VanDerWaalsContact C-N 3.27Å; R215-F217 HydrophobicContact CB-CD2 3.98Å; R215-F217 HydrophobicContact CB-CE2 3.94Å; R215-F217 HydrophobicContact CG-CE2 4.25Å; R215-F217 PolarHBondContact O-N 2.83Å
216L56.6Low55.7Low158 Ų158122.1 Ų122.183%0.82775%0.747SS**  trans-67.379.1178-68176.1000112.1A214A214-L216 PolarHBondContact O-N 3Å
217F51.4Low55.4Low164 Ų164122.1 Ų122.172%0.71974%0.738SS**  trans-129.242.3170-49.6-54.2000111R215R215-F217 VanDerWaalsContact C-N 3.27Å; R215-F217 HydrophobicContact CB-CD2 3.98Å; R215-F217 HydrophobicContact CB-CE2 3.94Å; R215-F217 HydrophobicContact CG-CE2 4.25Å; R215-F217 PolarHBondContact O-N 2.83Å
218S55.5Low54.5Low78 Ų78126.4 Ų126.455%0.54574%0.741SS.*  trans-77.2144167.5-1540000110.1D220S218-D220 VanDerWaalsContact C-N 3.33Å; S218-D220 PolarHBondContact OG-OD2 3.23Å
219V58.9Low53.7Low114 Ų114127.7 Ų127.769%0.69174%0.739SS**G310 helixtrans-73.4-28.5-175.6-179.70000111.6S221 L222V219-S221 VanDerWaalsContact C-N 3.25Å; V219-S221 PolarHBondContact O-N 3.02Å; V219-L222 PolarHBondContact O-N 3.25Å; V219-L222 VanDerWaalsContact O-N 3.12Å
220D57.7Low53Low115 Ų115129.1 Ų129.162%0.61575%0.745SS**G310 helixtrans-60.3-29.5-176-52-92.6000113.8S218 L222 V223S218-D220 VanDerWaalsContact C-N 3.33Å; S218-D220 PolarHBondContact OG-OD2 3.23Å; D220-L222 PolarHBondContact O-N 3.22Å; D220-L222 VanDerWaalsContact O-N 3.12Å; D220-V223 PolarHBondContact O-N 3.49Å; D220-V223 VanDerWaalsContact O-N 3.11Å
221S52.5Low51.8Low89 Ų89126.1 Ų126.162%0.62274%0.739SS**G310 helixtrans-67.2-10.2178.2-570000114.2V219V219-S221 VanDerWaalsContact C-N 3.25Å; V219-S221 PolarHBondContact O-N 3.02Å
222L54.3Low50.6Low155 Ų155130.6 Ų130.681%0.81275%0.749SS**G310 helixtrans-88.8-6.7173.7-80.7166.2000114.2V219 D220V219-L222 PolarHBondContact O-N 3.25Å; V219-L222 VanDerWaalsContact O-N 3.12Å; D220-L222 PolarHBondContact O-N 3.22Å; D220-L222 VanDerWaalsContact O-N 3.12Å
223V54.7Low48.9Very low126 Ų126129.1 Ų129.176%0.76475%0.754SS**THydrogen-bonded Turntrans-94.4-28.7-179.6-178.70000112D220 L225D220-V223 PolarHBondContact O-N 3.49Å; D220-V223 VanDerWaalsContact O-N 3.11Å; V223-L225 PolarHBondContact O-N 3.13Å
224S52.6Low48.1Very low101 Ų101127.8 Ų127.871%0.70675%0.754SS**SBendtrans-93.315.1-168.1-51.60000116.1
225L50.9Low48Very low149 Ų149129.7 Ų129.778%0.7876%0.759SS**  trans-138.691.1-179-74.3177.4000112.8V223V223-L225 PolarHBondContact O-N 3.13Å
226Q49Very low46.9Very low183 Ų183127.4 Ų127.486%0.85576%0.758SS**SBendtrans160.3139.8144.1-87.7-88.4-54.900110.1
227P49.3Very low47.3Very low102 Ų102124.8 Ų124.866%0.66275%0.75SS**  -128.8166.9-55.335.8-21.6000112.3
228E38.8Very low47.5Very low153 Ų153122.5 Ų122.572%0.71575%0.752SS**  trans-80.6128.1166.3-162.1-74.8101.900109.1A230E228-A230 PolarHBondContact OE1-N 3.49Å
229L42Very low46.6Very low166 Ų166124.5 Ų124.587%0.86976%0.764SS**  trans-161.658165.8-160.281000112.7
230A38.1Very low45.3Very low93 Ų93125.4 Ų125.477%0.76978%0.775SS**  trans-157.994.5172.200000113.3E228E228-A230 PolarHBondContact OE1-N 3.49Å
231G32.4Very low44.1Very low72 Ų72125 Ų12574%0.74279%0.787SS**  trans175.181.8168.800000118.6
232L35.1Very low43.4Very low184 Ų184125 Ų12596%0.96379%0.792SS**  trans-154.7134.3141.2-81.7-167.8000110.1
233G30.7Very low43.3Very low83 Ų83123.1 Ų123.186%0.85679%0.789SS**  trans101.2101.1163.600000117.1
234A41.3Very low42.5Very low97 Ų97124.3 Ų124.380%0.80279%0.792SS**  trans-104.1164.3153.500000108.5
235P48.8Very low41.8Very low126 Ų126123.8 Ų123.882%0.81879%0.793SS**  -146.1168.474.336-16000117.8
236E34.9Very low41Very low168 Ų168121.9 Ų121.979%0.78580%0.799SS**  trans-42.9177.9156.2-76.8-77.3104.300116.5
237P64.7Low40.3Very low103 Ų103118 Ų11867%0.66980%0.798SS**  cis-130.2-155.6-1431-6.5000110.6
238P54.7Low39.6Very low115 Ų115117.1 Ų117.175%0.74780%0.8SS**  cis-130169.8-6.442.2-25.9000117.2
239C36.6Very low39.4Very low120 Ų120119.8 Ų119.881%0.81181%0.809SS**  trans-86160.6170.552.70000113.6
240C32.4Very low40.4Very low134 Ų134117.3 Ų117.391%0.90580%0.803SS**  trans-137161.3167-84.20000109.9
241A32.9Very low41.6Very low105 Ų105118.3 Ų118.387%0.86880%0.802SS**  trans-90.8173.3-159.100000116.3
242A36.7Very low41.5Very low90 Ų90120.7 Ų120.774%0.74481%0.806SS**  trans-79.4-165.3172.900000111
243P52.7Low41.6Very low115 Ų115115.5 Ų115.575%0.74779%0.79SS**  cis-143.2-167.816.444.1-22.2000117.9
244D38.8Very low41.8Very low152 Ų152118 Ų11881%0.81379%0.788SS**  trans-22.5151.8168.9-62.7-94000121.7
245A36.1Very low41.4Very low90 Ų90118.1 Ų118.174%0.74479%0.79SS**  169.3146.395.400000115.4
246A34.1Very low40.7Very low108 Ų108116.8 Ų116.889%0.89379%0.789SS**  trans60.3146.4157.800000119.1
247A36.1Very low40.9Very low101 Ų101114.1 Ų114.184%0.83579%0.789SS**  cis-157.5-171.7-13.800000106.9
248A34.6Very low40.6Very low85 Ų85114.9 Ų114.970%0.70279%0.794SS**  cis-153.2-156.47.800000110.1
249F34.6Very low40.8Very low208 Ų208115.2 Ų115.291%0.91280%0.796SS**  trans-122-159172-62.5-86.9000112.1
250P62.1Low41.2Very low115 Ų115117.5 Ų117.575%0.74780%0.799SS**  -129.5-138.3-124.141.3-16.1000111
251P63.5Low41.7Very low114 Ų114122.2 Ų122.274%0.7480%0.8SS**  cis-128.7-162.4-30.237.8-19.1000113.1
252C30.3Very low41.8Very low121 Ų121120.9 Ų120.982%0.81878%0.784SS**  trans116124137.8-139.20000121.6
253A36.4Very low41.8Very low76 Ų76125.1 Ų125.163%0.62879%0.788SS**  trans72.9140.1135.500000127.3
254T34.8Very low41.1Very low134 Ų134124 Ų12482%0.82279%0.788SS**  trans79.5140.4138.339.80000125.2
255A33.4Very low42.2Very low101 Ų101122.4 Ų122.484%0.83579%0.787SS**  trans69152.5150.900000119.1
256A33.5Very low42.4Very low98 Ų98125 Ų12581%0.8179%0.788SS**  cis-161.6172.8-18.700000110.7
257S40.5Very low42.7Very low112 Ų112130 Ų13078%0.78378%0.784SS**  trans-78.6171.9160.7-37.20000110.3
258P58.6Low42.9Very low118 Ų118132.3 Ų132.377%0.76678%0.781SS**  cis-148.5-143.149.943.4-19.1000111.5
259P58.8Low43.2Very low122 Ų122134.6 Ų134.679%0.79279%0.786SS**  cis-130.5-171.3-15.837.6-17000116.1
260L45Very low43.7Very low168 Ų168132 Ų13288%0.8878%0.781SS**  trans-103.5163.2-178.5-73.4164.9000114
261Y42.2Very low43.3Very low234 Ų234132.6 Ų132.692%0.91879%0.785SS**  trans-162.7163.1164.4-133-94.7000109.4
262S36Very low42.4Very low76 Ų76131.7 Ų131.753%0.53179%0.787SS.*  -155.6144-64.8-173.30000109.2
263Q36.7Very low42.8Very low180 Ų180133 Ų13384%0.84179%0.791SS**  trans49130.7163.9-68.3162.9-42.100119.4
264A37.4Very low43.3Very low90 Ų90140.9 Ų140.974%0.74481%0.805SS**  cis74.7154.146.800000114.5
265P61.1Low44.1Very low120 Ų120140.6 Ų140.678%0.77981%0.805SS**  cis-135.1-177.2-2541.3-25.5000114.1
266D41.1Very low44.3Very low144 Ų144139 Ų13977%0.7780%0.798SS**  trans-168-177.4131.8-134.7-47.5000114.2
267R39.2Very low45.3Very low214 Ų214140.8 Ų140.881%0.80880%0.802SS**  trans-81.5173-168.2-66.3158.4162.6151.8-7.7113.9
268L42.1Very low45.1Very low148 Ų148138.7 Ų138.778%0.77580%0.797SS**  -162.3133.956.2-74.9163.6000111.4
269V40.1Very low44.8Very low133 Ų133139.5 Ų139.581%0.80680%0.803SS**  84.5136.6104.5176.60000117.3
270L44.7Very low44Very low153 Ų153141.2 Ų141.280%0.80181%0.805SS**  trans-98.5161177.5-82.4164.9000111.2
271P53.5Low44.3Very low128 Ų128139.2 Ų139.283%0.83180%0.801SS**  -148.7-176.687.338.5-19.1000115.4
272A45Very low44.1Very low95 Ų95132.6 Ų132.679%0.78580%0.795SS**  trans-130.7158.3179.600000112.2
273T39.5Very low44.6Very low148 Ų148137.3 Ų137.391%0.90881%0.809SS**  trans-141.9151.1175.948.50000113.6
274R46.6Very low45.2Very low242 Ų242134.3 Ų134.391%0.91381%0.805SS**  trans-135.3149.9169.3-101.1-177.8168.4-172.7-3.6105.8
275P50.5Low45.2Very low129 Ų129137.8 Ų137.884%0.83881%0.81SS**  -154.8-167.180.240-18.2000115.6
276G38.3Very low44.1Very low66 Ų66140.5 Ų140.568%0.6882%0.817SS**  trans-99.1-157.116000000111.7
277P53.7Low43.8Very low137 Ų137137.6 Ų137.689%0.8981%0.814SS**  cis-131.6-15111.442.3-22.3000114.4
278G37Very low43.8Very low67 Ų67135.5 Ų135.569%0.69182%0.817SS**  trans-89-161.5174.200000114.8
279P53.1Low43.5Very low135 Ų135133 Ų13388%0.87782%0.818SS**  cis-140.5-155.82544.4-23.6000116.6
280L40.6Very low43.3Very low159 Ų159130.2 Ų130.283%0.83282%0.816SS**  trans-71.6172.7174.4-70.1178.3000113.7
281P53Low43.8Very low125 Ų125129.3 Ų129.381%0.81282%0.819SS**  cis-133.4-154.626.736.8-11.5000113.9
282A37.7Very low43.1Very low95 Ų95127.7 Ų127.779%0.78582%0.817SS**  cis-158.1-175.213.300000114.2
283E45Very low42.7Very low175 Ų175128.1 Ų128.182%0.81882%0.82SS**  trans-106.9163.2179.1-85-84.6112.200113.5
284P50.8Low42.7Very low118 Ų118126 Ų12677%0.76682%0.818SS**  trans-140.2121.513635.8-20.8000116.2
285L37.2Very low42.7Very low162 Ų162123.3 Ų123.385%0.84882%0.821SS**  trans28.4118.6145-72.8165.2000120.4
286L38.6Very low41.9Very low177 Ų177120.8 Ų120.893%0.92782%0.819SS**  trans-103.9146147.4-133.786.5000110.5
287A33.8Very low43Very low84 Ų84123.3 Ų123.369%0.69482%0.823SS**  trans-142.7174.5178.300000111.3
288L39.6Very low42.5Very low169 Ų169125.2 Ų125.289%0.88582%0.824SS**  trans74.7111-168.6-52.7166.7000112
289A35.6Very low42.9Very low95 Ų95128.2 Ų128.279%0.78583%0.83SS**  86.5131.453.500000113.1
290G36.3Very low42.9Very low75 Ų75127.9 Ų127.977%0.77383%0.827SS**  trans-93.2-138-177.800000113.3
291P53.8Low43Very low134 Ų134124 Ų12487%0.8783%0.826SS**  cis-130.7-168.424.542.5-25.8000115.3
292A39.6Very low42.4Very low95 Ų95127.2 Ų127.279%0.78583%0.83SS**  trans-78.6162.5-178.900000114.7
293A36.5Very low42.5Very low103 Ų103126.6 Ų126.685%0.85183%0.825SS**  164.2125.111700000113.7
294A40.1Very low42.7Very low104 Ų104129.1 Ų129.186%0.8683%0.829SS**  trans-169.7133.4146.400000110.1
295L45.3Very low42.7Very low185 Ų185131.9 Ų131.997%0.96984%0.836SS**  trans-120.3146.5169.8-73.3171000109
296G34.6Very low43.1Very low77 Ų77134.4 Ų134.479%0.79483%0.834SS**  trans179.4102.3175.700000113.7
297P61.4Low43.4Very low118 Ų118134.2 Ų134.277%0.76683%0.828SS**  trans-108.9138.1177.936.3-27.7000112.8
298L42.1Very low44.1Very low177 Ų177136.1 Ų136.193%0.92783%0.834SS**  trans-145.6169.2165.2-85.7-172.2000113.4
299T45.8Very low44.7Very low130 Ų130131.7 Ų131.780%0.79883%0.829SS**  trans-88.2169.2-159.1300000115.8
300P52.8Low45.4Very low128 Ų128136.9 Ų136.983%0.83183%0.834SS**  trans-93.6147.8-171.235.7-34.7000114.6
301G43.4Very low45.9Very low77 Ų77138 Ų13879%0.79484%0.836SS**  trans130.477.9149.600000118.5
302E40.2Very low45.9Very low193 Ų193140.9 Ų140.990%0.90284%0.838SS**  trans-141.6124.9151.1-84.9-164.513600107.3
303A40.4Very low46.6Very low82 Ų82139.8 Ų139.868%0.67884%0.836SS**  81.297.968.200000114
304Y48.7Very low47.5Very low229 Ų229142 Ų14290%0.89883%0.833SS**  trans25.692.2154.4-71.5-90000119.6
305L50.3Low48.3Very low176 Ų176146 Ų14692%0.92183%0.834SS**  trans-104.795.9152.9-116.3167.4000110.4Q307L305-Q307 PolarHBondContact O-N 3.34Å
306R46.6Very low48.4Very low215 Ų215146.6 Ų146.681%0.81182%0.823SS**  trans-80.3113.7-174.7179.7-176.5-179.3-178.22111.1
307Q45.3Very low49Very low172 Ų172153 Ų15380%0.80483%0.825SS**  trans-62.1132.2169.7-70.4-74.9-17.500110.8L305L305-Q307 PolarHBondContact O-N 3.34Å
308P48.5Very low48.1Very low124 Ų124159.2 Ų159.281%0.80585%0.85SS**SBendtrans-78.7128.5174.331.3-32.3000110.6
309G52.2Low48.4Very low76 Ų76158.4 Ų158.478%0.78485%0.846SS**  trans156.9-12.4171.800000118.5
310F48.9Very low48.6Very low205 Ų205159.8 Ų159.890%0.89985%0.849SS**PPolyproline II helixtrans-99.4132.2-178.8-93.1-93.2000114
311A48.5Very low48.3Very low98 Ų98161.6 Ų161.681%0.8185%0.85SS**PPolyproline II helixtrans-72.5160.3176.700000112.6
312Q52.5Low48.6Very low194 Ų194166.6 Ų166.691%0.90785%0.853SS**PPolyproline II helixtrans-89153.4-172.6-56.4-18015.500113
313G53.8Low49.2Very low72 Ų72164.9 Ų164.974%0.74285%0.85SS**  trans114.485.5152.100000116.9
314L56.5Low49.7Very low150 Ų150170.5 Ų170.579%0.78586%0.862SS**  trans-15418.7152.5-117.3168.7000114.9R316L314-R316 PolarHBondContact O-N 3.42Å
315E56.3Low49.8Very low189 Ų189166.3 Ų166.388%0.88386%0.859SS**  trans-73.583.5173.3-71.9-62159.600111.1
316R47.9Very low49.8Very low197 Ų197165.5 Ų165.574%0.74385%0.854SS**  trans-168.335.5173.751.4-174.5-72.7174.9-4.5115.4L314L314-R316 PolarHBondContact O-N 3.42Å
317Y48.1Very low50Low212 Ų212161.4 Ų161.483%0.83186%0.858SS**  trans-153.370.6164.8-81.1-59.9000112.6
318L42.1Very low50.5Low248 Ų248160.5 Ų160.5100%1.29886%0.863SS**  trans-134.80151.3-84176.7000107.7

Retrieved 318 of 318 residues in 322.8 ms (Link to these results)