A0A087Y3L4_POEFO Loading...

EGF-like-domain, multiple 7

AlphaFold DB , UniProt , Accession A0A087Y3L4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 290 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
1M48.9Very low44.9Very low229 Ų229143.4 Ų143.4100%1.12876%0.756SS**  0117.90-56.4-175.6-66.400106.5
2Y45.2Very low44.8Very low208 Ų208145.1 Ų145.182%0.81677%0.765SS**  cis-135.7116.94.5-86.6-108.8000108.9
3Q44.9Very low44.8Very low173 Ų173147.1 Ų147.181%0.80876%0.764SS**SBendtrans-158.2-28.9169-151.889.616.700113.2V5Q3-V5 PolarHBondContact O-N 3.07Å
4E46.3Very low44.9Very low172 Ų172147.4 Ų147.480%0.80477%0.766SS**THydrogen-bonded Turntrans-100.341.9-170.4-64.1-58.8149.600115.1
5V44.5Very low44.3Very low105 Ų105149.3 Ų149.364%0.63677%0.769SS**THydrogen-bonded Turntrans-133.8-4.6-176.5-167.40000113.4Q3Q3-V5 PolarHBondContact O-N 3.07Å
6L45.1Very low44.3Very low154 Ų154146.7 Ų146.781%0.80676%0.762SS**SBendtrans-96.85.2-173.7-71.5172.9000115.3
7L41Very low44.1Very low152 Ų152147.5 Ų147.580%0.79676%0.763SS**SBendtrans-107.3-15.5179.6-84.6160.9000114.5
8S40.9Very low43.8Very low95 Ų95142.6 Ų142.666%0.66476%0.755SS**G310 helixtrans-83.3-14.5-179.5500000114.3
9S43.9Very low43.9Very low86 Ų86141.2 Ų141.260%0.60175%0.753SS**G310 helixtrans-83.7-11.8-179.950.80000114.5
10A47.2Very low44Very low65 Ų65138.8 Ų138.854%0.53775%0.745SS.*G310 helixtrans-87.1-6-174.900000114.8
11L46.4Very low44Very low138 Ų138139.1 Ų139.172%0.72374%0.742SS**G310 helixtrans-97.814-176.6-73.4174.8000114.8F13L11-F13 HydrophobicContact CD2-CD2 4.03Å; L11-F13 HydrophobicContact CD2-CE2 4.17Å; L11-F13 PolarHBondContact O-N 3.45Å
12L43.8Very low44Very low164 Ų164132.7 Ų132.786%0.85971%0.708SS**  trans-76.356.8157.6-80168.6000110.4L14L12-L14 PolarHBondContact O-N 2.78Å
13F44.7Very low44.1Very low171 Ų171131.1 Ų131.175%0.7571%0.706SS**  trans-62.5124.4168-91.5-81.9000108.9L11 H15L11-F13 HydrophobicContact CD2-CD2 4.03Å; L11-F13 HydrophobicContact CD2-CE2 4.17Å; L11-F13 PolarHBondContact O-N 3.45Å; F13-H15 PolarHBondContact O-N 2.93Å
14L46.1Very low44Very low151 Ų151124.5 Ų124.579%0.79168%0.684SS**  trans-6191.9-178.7-75.3159.3000111L12 V16L12-L14 PolarHBondContact O-N 2.78Å; L14-V16 HydrophobicContact CB-CG2 4.17Å; L14-V16 HydrophobicContact CD2-CG2 4.15Å; L14-V16 PolarHBondContact O-N 3.16Å
15H36.3Very low44Very low177 Ų177122.8 Ų122.882%0.81968%0.676SS**  trans-69.661.9148.8-89.3-36.5000109.6F13 M17F13-H15 PolarHBondContact O-N 2.93Å; H15-M17 PolarHBondContact O-N 3.36Å
16V43.5Very low44.1Very low107 Ų107127.6 Ų127.665%0.64869%0.691SS**  trans-61.293.8146.2171.60000104.9L14 G18L14-V16 HydrophobicContact CB-CG2 4.17Å; L14-V16 HydrophobicContact CD2-CG2 4.15Å; L14-V16 PolarHBondContact O-N 3.16Å; V16-G18 PolarHBondContact O-N 3.07Å
17M40.4Very low44.7Very low160 Ų160124 Ų12479%0.78869%0.691SS**  trans-58.792.2159.3-78.9-67.3-159.100106.2H15 T19H15-M17 PolarHBondContact O-N 3.36Å; M17-T19 VanDerWaalsContact C-N 3.29Å; M17-T19 PolarHBondContact O-N 2.9Å
18G40Very low46Very low60 Ų60124.8 Ų124.862%0.61968%0.683SS**  trans-64.291.8-179.200000109V16 P20V16-G18 PolarHBondContact O-N 3.07Å; G18-P20 VanDerWaalsContact O-N 3.11Å
19T45.9Very low47.7Very low116 Ų116125.3 Ų125.371%0.71267%0.671SS**  trans-51.5120169.649.40000107M17 Q21M17-T19 VanDerWaalsContact C-N 3.29Å; M17-T19 PolarHBondContact O-N 2.9Å; T19-Q21 PolarHBondContact O-N 2.76Å
20P45Very low49.4Very low93 Ų93123.1 Ų123.160%0.60466%0.658SS**  trans-56120-17219-31000108.9G18 F22G18-P20 VanDerWaalsContact O-N 3.11Å; P20-F22 VanDerWaalsContact C-N 3.27Å; P20-F22 HydrophobicContact CB-CE2 4.41Å; P20-F22 HydrophobicContact CB-CZ 4.49Å; P20-F22 HydrophobicContact CG-CE2 3.85Å; P20-F22 HydrophobicContact CG-CZ 4.06Å; P20-F22 VanDerWaalsContact O-CD2 3.24Å; P20-F22 WeakPolarHBondContact O-CD2 3.41Å; P20-F22 PolarHBondContact O-N 3.46Å
21Q44.6Very low50.7Low146 Ų146120.5 Ų120.568%0.68264%0.636SS**  trans-73.286.6-176-72.3-174.1-15.700108.7T19 F23T19-Q21 PolarHBondContact O-N 2.76Å; Q21-F23 HydrophobicContact CB-CD2 4.19Å; Q21-F23 HydrophobicContact CB-CE2 3.69Å; Q21-F23 HydrophobicContact CB-CZ 4.24Å; Q21-F23 WeakPolarHBondContact O-CD2 3.45Å; Q21-F23 PolarHBondContact O-N 2.91Å
22F49Very low51.7Low93 Ų93117.5 Ų117.541%0.40863%0.626SS.*  trans-64.895.2172.7-66.5-73000109.1P20 G24 C31 P93P20-F22 VanDerWaalsContact C-N 3.27Å; P20-F22 HydrophobicContact CB-CE2 4.41Å; P20-F22 HydrophobicContact CB-CZ 4.49Å; P20-F22 HydrophobicContact CG-CE2 3.85Å; P20-F22 HydrophobicContact CG-CZ 4.06Å; P20-F22 VanDerWaalsContact O-CD2 3.24Å; P20-F22 WeakPolarHBondContact O-CD2 3.41Å; P20-F22 PolarHBondContact O-N 3.46Å; F22-G24 PolarHBondContact O-N 3.4Å; F22-C31 HydrophobicContact CD1-CB 3.91Å; F22-P93 HydrophobicContact CD2-CG 4.1Å; F22-P93 HydrophobicContact CE2-CG 3.77Å; F22-P93 HydrophobicContact CZ-CG 4.23Å
23F45.7Very low52.3Low175 Ų175112 Ų11277%0.76860%0.601SS**  trans-71.458.8176.2-76.9-81.1000112.1Q21Q21-F23 HydrophobicContact CB-CD2 4.19Å; Q21-F23 HydrophobicContact CB-CE2 3.69Å; Q21-F23 HydrophobicContact CB-CZ 4.24Å; Q21-F23 WeakPolarHBondContact O-CD2 3.45Å; Q21-F23 PolarHBondContact O-N 2.91Å
24G43.3Very low52.5Low34 Ų34110.7 Ų110.735%0.35160%0.602SS.*  trans-85.7108.2171.400000111F22 H26F22-G24 PolarHBondContact O-N 3.4Å; G24-H26 PolarHBondContact O-N 2.04Å
25H47.4Very low52.8Low137 Ų137107.3 Ų107.363%0.63458%0.584SS**  trans-51.6136.1164.2-70.4-84.9000110.2G27 R28H25-G27 PolarHBondContact O-N 3.48Å; H25-G27 VanDerWaalsContact O-N 3.11Å; H25-R28 HydrophobicContact CB-CG 4.46Å; H25-R28 PolarHBondContact O-N 2.98Å
26H46.8Very low53.5Low205 Ų205109.1 Ų109.195%0.94958%0.584SS**THydrogen-bonded Turntrans-47.6119.5-179.9-67.3-66000111.6G24G24-H26 PolarHBondContact O-N 2.04Å
27G57.1Low53.9Low78 Ų78110.5 Ų110.580%0.80458%0.583SS**THydrogen-bonded Turntrans108.7-19.8-178.700000115.2H25H25-G27 PolarHBondContact O-N 3.48Å; H25-G27 VanDerWaalsContact O-N 3.11Å
28R67.4Low54.6Low169 Ų169107.2 Ų107.264%0.63857%0.569SS**  trans-71.9138.2171.8-62.6-169.2-175.6-155.33.7110.7H25H25-R28 HydrophobicContact CB-CG 4.46Å; H25-R28 PolarHBondContact O-N 2.98Å
29R77.6Confident55.4Low107 Ų107108.3 Ų108.340%0.40456%0.563SS.*  trans-110.1-10.1176.3-55.6-174.9-169.6-170.76.4113.8C92 W95 C103 N104R29-C92 PolarHBondContact O-N 2.9Å; R29-C92 PolarHBondContact O-SG 2.84Å; R29-W95 HydrophobicContact CB-CD2 4.31Å; R29-W95 HydrophobicContact CB-CG 4.28Å; R29-W95 HydrophobicContact CG-CD2 4.2Å; R29-W95 HydrophobicContact CG-CZ2 4.35Å; R29-C103 HydrophobicContact CB-CB 4.06Å; R29-C103 WeakPolarHBondContact CB-O 3.46Å; R29-C103 WeakPolarHBondContact CD-O 3.47Å; R29-C103 VanDerWaalsContact O-CB 3.32Å; R29-C103 WeakPolarHBondContact O-CB 3.19Å; R29-N104 PolarHBondContact NH1-O 3.29Å
30A79.1Confident56.3Low39 Ų39105.9 Ų105.932%0.32255%0.545SS..BIsolated β-bridgetrans-102.9133.1166.800000108.5P89 D90A30-P89 HydrophobicContact CB-CB 4.25Å; A30-P89 HydrophobicContact CB-CG 4.01Å; A30-D90 CarbonylContact C-O 3.28Å; A30-D90 VanDerWaalsContact CA-O 3.28Å; A30-D90 WeakPolarHBondContact CA-O 3.46Å
31C75.3Confident57.1Low11 Ų11106.5 Ų106.57%0.07454%0.543CS..  trans-127.1120.7-179.5-76.20000106.9F22 D90 C92F22-C31 HydrophobicContact CD1-CB 3.91Å; C31-D90 PolarHBondContact N-O 2.94Å; C31-D90 PolarHBondContact O-N 2.95Å; C31-D90 VanDerWaalsContact O-O 3.07Å; C31-C92 HydrophobicContact CB-CB 3.95Å; C31-C92 WeakPolarHBondContact CB-SG 3.44Å; C31-C92 PolarHBondContact N-SG 3.15Å; C31-C92 WeakPolarHBondContact SG-CB 3.4Å; C31-C92 CovalentContact SG-SG 2.04Å; C31-C92 PolarHBondContact SG-SG 2.91Å
32S66.6Low58.1Low75 Ų75100.9 Ų100.952%0.52452%0.521SS..  trans-68.7140.1161-160.10000107.8
33S56.8Low59.2Low47 Ų47101.2 Ų101.233%0.32953%0.531SS..  trans-59.8150.3147.248.40000108.2L35S33-L35 PolarHBondContact O-N 2.64Å
34D48.5Very low60.5Low145 Ų14593.9 Ų93.978%0.77550%0.499SS*.  trans-7189.9167-177.424.4000107.8R36D34-R36 PolarHBondContact O-N 2.82Å
35L53.5Low61.9Low79 Ų7993.6 Ų93.641%0.41449%0.492SS..  trans-68.284.4170.3-72.3176.7000107.9S33 H37S33-L35 PolarHBondContact O-N 2.64Å; L35-H37 VanDerWaalsContact C-N 3.25Å; L35-H37 PolarHBondContact O-N 2.9Å
36R49.1Very low63.2Low215 Ų21590.6 Ų90.681%0.81148%0.476SS*.  trans-40.6106.6135.3-81.2-172.4169.5-154.3-2.3105.9D34 N38D34-R36 PolarHBondContact O-N 2.82Å; R36-N38 PolarHBondContact O-N 2.93Å; R36-N38 VanDerWaalsContact O-N 3.09Å
37H52.8Low64.6Low137 Ų13782 Ų8263%0.63444%0.44SS*.  trans-44.9122.3-179.3-66.374.3000108L35 V39 I81L35-H37 VanDerWaalsContact C-N 3.25Å; L35-H37 PolarHBondContact O-N 2.9Å; H37-V39 PolarHBondContact O-N 2.9Å; H37-I81 HydrophobicContact CB-CG2 4.31Å
38N54.2Low65.6Low91 Ų9182.4 Ų82.449%0.48742%0.421SS..  trans-66.891.7176.8-81.8-17.9000107.2R36 I40 E82R36-N38 PolarHBondContact O-N 2.93Å; R36-N38 VanDerWaalsContact O-N 3.09Å; N38-I40 HydrophobicContact CB-CG1 4.31Å; N38-I40 PolarHBondContact O-N 2.04Å; N38-E82 HydrophobicContact CB-CB 4.3Å; N38-E82 PolarHBondContact O-N 3.08Å; N38-E82 VanDerWaalsContact O-N 3.15Å
39V58.6Low66.2Low82 Ų8277.6 Ų77.650%0.49741%0.412SS..EExtended strand (participates in β ladder)trans-77.283.3172.2-178.30000106H37 L41H37-V39 PolarHBondContact O-N 2.9Å; V39-L41 PolarHBondContact O-N 2.03Å
40I63.9Low66.4Low65 Ų6574.9 Ų74.933%0.33341%0.407SS..EExtended strand (participates in β ladder)trans-70.7120.2177.8-60.7-178.8000107N38 A42 R80 E82N38-I40 HydrophobicContact CB-CG1 4.31Å; N38-I40 PolarHBondContact O-N 2.04Å; I40-A42 PolarHBondContact O-N 3.21Å; I40-A42 VanDerWaalsContact O-N 3.09Å; I40-R80 PolarHBondContact N-O 2.81Å; I40-R80 PolarHBondContact O-N 2.9Å; I40-E82 HydrophobicContact CD1-CB 4.03Å; I40-E82 HydrophobicContact CD1-CG 4.31Å; I40-E82 HydrophobicContact CG1-CB 4.47Å
41L61.8Low66.5Low106 Ų10678.7 Ų78.756%0.55542%0.418SS*.EExtended strand (participates in β ladder)trans-7297164.8-113.369.4000107.6V39 Q77V39-L41 PolarHBondContact O-N 2.03Å; L41-Q77 HydrophobicContact CD2-CB 4.5Å
42A66.3Low66.7Low29 Ų2983.6 Ų83.624%0.2444%0.438CS..EExtended strand (participates in β ladder)trans-89.7136.5172.500000109.4I40 V78I40-A42 PolarHBondContact O-N 3.21Å; I40-A42 VanDerWaalsContact O-N 3.09Å; A42-V78 HydrophobicContact CB-CG2 4.19Å; A42-V78 PolarHBondContact N-O 3.45Å; A42-V78 PolarHBondContact O-N 3.39Å
43T72.1Confident67.3Low100 Ų10084.7 Ų84.761%0.61344%0.443SS*.EExtended strand (participates in β ladder)trans-80.9117.8165.5-58.30000108.2Y75T43-Y75 HydrophobicContact CG2-CD1 4.07Å; T43-Y75 HydrophobicContact CG2-CG 4.48Å
44E71.6Confident68.1Low20 Ų2086.2 Ų86.29%0.09344%0.442CS..EExtended strand (participates in β ladder)trans-109.1128.1178.5-179.8175.7-90.300109.4Y75 R76 V78 R80 P238E44-Y75 WeakPolarHBondContact O-CA 3.03Å; E44-R76 HydrophobicContact CB-CG 4.33Å; E44-R76 PolarHBondContact N-O 3.28Å; E44-R76 PolarHBondContact O-N 3.27Å; E44-R76 IonicContact OE2-CZ 3.53Å; E44-R76 IonicContact OE2-NE 3.58Å; E44-R76 PolarHBondContact OE2-NE 2.79Å; E44-R76 IonicContact OE2-NH2 2.73Å; E44-R76 PolarHBondContact OE2-NH2 2.86Å; E44-V78 HydrophobicContact CB-CG1 4.2Å; E44-V78 HydrophobicContact CB-CG2 3.65Å; E44-V78 HydrophobicContact CG-CG2 4.48Å; E44-R80 IonicContact OE1-CZ 3.44Å; E44-R80 IonicContact OE1-NE 3.61Å; E44-R80 IonicContact OE1-NH2 2.75Å; E44-R80 PolarHBondContact OE1-NH2 3.41Å; E44-P238 HydrophobicContact CG-CB 4.36Å
45S72.8Confident69.4Low29 Ų2984.3 Ų84.320%0.20343%0.431CS..EExtended strand (participates in β ladder)trans-85.4149.5172.448.40000111.4A74S45-A74 CarbonylContact C-O 3.49Å; S45-A74 VanDerWaalsContact CA-O 3.29Å; S45-A74 WeakPolarHBondContact CA-O 3.03Å
46Y74.6Confident70.4Confident73 Ų7382.4 Ų82.429%0.28642%0.423SS..EExtended strand (participates in β ladder)trans-150160176.169.9-78.9000110.1Q48 A74 R76Y46-Q48 HydrophobicContact CE2-CB 4Å; Y46-Q48 PolarHBondContact OH-OE1 2.8Å; Y46-A74 HydrophobicContact CD1-CB 4.14Å; Y46-A74 WeakPolarHBondContact CD1-O 3.35Å; Y46-A74 HydrophobicContact CD2-CB 4.44Å; Y46-A74 HydrophobicContact CE1-CB 3.58Å; Y46-A74 HydrophobicContact CE2-CB 3.93Å; Y46-A74 VanDerWaalsContact CZ-CB 3.45Å; Y46-A74 PolarHBondContact N-O 2.88Å; Y46-A74 PolarHBondContact O-N 3.15Å; Y46-R76 HydrophobicContact CD1-CB 4.45Å; Y46-R76 HydrophobicContact CD1-CG 4Å; Y46-R76 HydrophobicContact CE1-CB 4.1Å; Y46-R76 HydrophobicContact CE1-CG 4.14Å
47A76.5Confident71.6Confident25 Ų2577.8 Ų77.821%0.20741%0.414CS..EExtended strand (participates in β ladder)trans-83.9128168.100000110.3Y71 S72 L236A47-Y71 HydrophobicContact CB-CD1 4.07Å; A47-Y71 HydrophobicContact CB-CG 4.48Å; A47-S72 CarbonylContact C-O 3.5Å; A47-S72 WeakPolarHBondContact CA-O 3.35Å; A47-L236 HydrophobicContact CB-CD1 3.25Å
48Q78.3Confident72.6Confident87 Ų8772.2 Ų72.241%0.40739%0.39SS..EExtended strand (participates in β ladder)trans-97.7128.5167.7-174.2168.5-3900108.9Y46 S72 A74Y46-Q48 HydrophobicContact CE2-CB 4Å; Y46-Q48 PolarHBondContact OH-OE1 2.8Å; Q48-S72 PolarHBondContact N-O 2.73Å; Q48-S72 PolarHBondContact O-N 3.02Å; Q48-A74 HydrophobicContact CB-CB 3.92Å
49P80Confident73.8Confident67 Ų6775.1 Ų75.144%0.43540%0.4SS..EExtended strand (participates in β ladder)trans-69.5135.7170.328.9-33000110.1T69 Y71P49-T69 HydrophobicContact CB-CG2 3.99Å; P49-Y71 HydrophobicContact CB-CD1 4.32Å; P49-Y71 HydrophobicContact CB-CE1 4.07Å
50V81.9Confident74.5Confident51 Ų5174.7 Ų74.731%0.30941%0.413SS..EExtended strand (participates in β ladder)trans-131.7104.6179.5-179.80000107.7K52 T70 S72V50-K52 HydrophobicContact CG1-CG 4.34Å; V50-K52 PolarHBondContact O-N 2.91Å; V50-T70 WeakPolarHBondContact CA-O 3.42Å; V50-T70 PolarHBondContact N-O 2.75Å; V50-T70 PolarHBondContact O-N 3.07Å; V50-T70 PolarHBondContact O-OG1 3.09Å; V50-S72 WeakPolarHBondContact CG2-OG 3.3Å
51H81.9Confident74.5Confident119 Ų11979.4 Ų79.455%0.55143%0.433SS*.EExtended strand (participates in β ladder)trans-75.6114.5177-54.1-64.9000109.6Y67 K68 T69H51-Y67 HydrophobicContact CB-CD1 4.48Å; H51-K68 WeakPolarHBondContact CA-O 3.38Å; H51-T69 PolarHBondContact CE1-OG1 3.02Å; H51-T69 PolarHBondContact ND1-OG1 3.03Å; H51-T69 VanDerWaalsContact ND1-OG1 3.12Å
52K79.9Confident75Confident113 Ų11383.6 Ų83.649%0.49144%0.442SS..EExtended strand (participates in β ladder)trans-102.9140.6175.8-67.1177.3-175.8161.20109.2V50 Y54 Y67 K68 T70V50-K52 HydrophobicContact CG1-CG 4.34Å; V50-K52 PolarHBondContact O-N 2.91Å; K52-Y54 PolarHBondContact O-N 2.77Å; K52-Y67 WeakPolarHBondContact O-CA 3.38Å; K52-K68 PolarHBondContact N-O 2.87Å; K52-K68 PolarHBondContact O-N 2.91Å; K52-T70 HydrophobicContact CD-CG2 3.98Å; K52-T70 WeakPolarHBondContact CD-OG1 3.06Å; K52-T70 WeakPolarHBondContact CE-OG1 3.42Å; K52-T70 PolarHBondContact NZ-OG1 3.02Å
53P77.4Confident75.3Confident99 Ų9987.7 Ų87.764%0.64346%0.459SS*.EExtended strand (participates in β ladder)trans-64.5130.2173.427.9-33.6000109.6Y67P53-Y67 HydrophobicContact CB-CE1 4.43Å
54Y74.1Confident75.5Confident78 Ų7884.4 Ų84.431%0.30644%0.439SS..EExtended strand (participates in β ladder)trans-114.4129.6171.9-175.9-128.3000108.4K52 T56 S65 T66 E280K52-Y54 PolarHBondContact O-N 2.77Å; Y54-T56 WeakPolarHBondContact CE1-OG1 3Å; Y54-S65 WeakPolarHBondContact O-CA 3.06Å; Y54-T66 HydrophobicContact CD1-CG2 4.06Å; Y54-T66 PolarHBondContact N-O 3.13Å; Y54-T66 PolarHBondContact O-N 2.62Å; Y54-T66 VanDerWaalsContact O-O 3.11Å; Y54-E280 PolarHBondContact OH-OE1 2.79Å
55I76.4Confident75.5Confident106 Ų10687.8 Ų87.854%0.54447%0.465SS..EExtended strand (participates in β ladder)trans-130.4116.8-176.5-54.8178.7000108.4L63 C64I55-L63 HydrophobicContact CG2-CB 4.37Å; I55-L63 HydrophobicContact CG2-CD2 3.91Å; I55-C64 CarbonylContact C-O 3.58Å; I55-C64 WeakPolarHBondContact CA-O 3.47Å
56T73.5Confident75.6Confident38 Ų3888.3 Ų88.323%0.23347%0.468CS..EExtended strand (participates in β ladder)trans-105.9134.6176.3-47.20000109.1Y54 C64Y54-T56 WeakPolarHBondContact CE1-OG1 3Å; T56-C64 PolarHBondContact N-O 3.47Å; T56-C64 PolarHBondContact O-N 3.08Å
57L74.9Confident75.6Confident119 Ų11993 Ų9362%0.62349%0.486SS*.EExtended strand (participates in β ladder)trans-88.8110.3173.8-150.379.5000109L63L57-L63 HydrophobicContact CD1-CD2 4.22Å; L57-L63 HydrophobicContact CD1-CG 3.96Å
58C74.1Confident75.5Confident19 Ų1994.3 Ų94.313%0.12849%0.487CS..  trans-77.7162.6172.1-60.60000110.9H61 R62 C287C58-H61 PolarHBondContact O-N 2.99Å; C58-R62 HydrophobicContact CB-CB 4.31Å; C58-R62 VanDerWaalsContact CB-O 3.31Å; C58-R62 WeakPolarHBondContact CB-O 3.49Å; C58-R62 PolarHBondContact N-O 3.01Å; C58-C287 WeakPolarHBondContact CA-SG 3.37Å; C58-C287 HydrophobicContact CB-CB 3.73Å; C58-C287 WeakPolarHBondContact CB-SG 3.47Å; C58-C287 WeakPolarHBondContact SG-CB 3.2Å; C58-C287 CovalentContact SG-SG 2.04Å; C58-C287 PolarHBondContact SG-SG 3Å
59Q78.3Confident75.4Confident152 Ų15291.4 Ų91.471%0.7148%0.475SS*.G310 helixtrans-52.2143.7169.2-60.3-176.728.300110.6E289Q59-E289 PolarHBondContact NE2-OE1 3.33Å
60G74.4Confident75.2Confident74 Ų7489 Ų8976%0.76346%0.459SS*.G310 helixtrans77.122.4-177.100000115.6R62G60-R62 PolarHBondContact O-N 2.9Å
61H63.2Low75Confident163 Ų16388.7 Ų88.776%0.75545%0.453SS*.G310 helixtrans63.215178.5-57.790.5000115.7C58C58-H61 PolarHBondContact O-N 2.99Å
62R72.2Confident74.7Confident195 Ų19585.2 Ų85.274%0.73644%0.442SS*.  trans-77.5127.1174.7-176.3177.5-179.5-176.4-1.1110C58 G60C58-R62 HydrophobicContact CB-CB 4.31Å; C58-R62 VanDerWaalsContact CB-O 3.31Å; C58-R62 WeakPolarHBondContact CB-O 3.49Å; C58-R62 PolarHBondContact N-O 3.01Å; G60-R62 PolarHBondContact O-N 2.9Å
63L73.9Confident74.5Confident115 Ų11581.2 Ų81.260%0.60243%0.426SS*.EExtended strand (participates in β ladder)trans-89.3132.5176.3-5896.7000110.6I55 L57I55-L63 HydrophobicContact CG2-CB 4.37Å; I55-L63 HydrophobicContact CG2-CD2 3.91Å; L57-L63 HydrophobicContact CD1-CD2 4.22Å; L57-L63 HydrophobicContact CD1-CG 3.96Å
64C74.6Confident74.4Confident30 Ų3077.2 Ų77.220%0.20340%0.401CS..EExtended strand (participates in β ladder)trans-103.5115.2164.2-159.70000107.6I55 T56 C285I55-C64 CarbonylContact C-O 3.58Å; I55-C64 WeakPolarHBondContact CA-O 3.47Å; T56-C64 PolarHBondContact N-O 3.47Å; T56-C64 PolarHBondContact O-N 3.08Å; C64-C285 HydrophobicContact CB-CB 4.1Å; C64-C285 WeakPolarHBondContact CB-SG 3.33Å; C64-C285 WeakPolarHBondContact SG-CB 3.46Å; C64-C285 CovalentContact SG-SG 2.05Å; C64-C285 PolarHBondContact SG-SG 3.23Å
65S72.3Confident74.5Confident91 Ų9180 Ų8064%0.63641%0.412SS*.EExtended strand (participates in β ladder)trans-114.1125.8177.359.50000110.7Y54Y54-S65 WeakPolarHBondContact O-CA 3.06Å
66T75.8Confident74.5Confident41 Ų4181.1 Ų81.125%0.25241%0.409SS..EExtended strand (participates in β ladder)trans-138.2-179.2177.3-168.80000110Y54 C285Y54-T66 HydrophobicContact CD1-CG2 4.06Å; Y54-T66 PolarHBondContact N-O 3.13Å; Y54-T66 PolarHBondContact O-N 2.62Å; Y54-T66 VanDerWaalsContact O-O 3.11Å; T66-C285 HydrophobicContact CG2-CB 4.06Å
67Y72.8Confident74.5Confident171 Ų17186.1 Ų86.167%0.67143%0.43SS*.EExtended strand (participates in β ladder)trans-114123.5175.6-68.4-84.5000110.2H51 K52 P53H51-Y67 HydrophobicContact CB-CD1 4.48Å; K52-Y67 WeakPolarHBondContact O-CA 3.38Å; P53-Y67 HydrophobicContact CB-CE1 4.43Å
68K75.4Confident74.5Confident52 Ų5281.8 Ų81.823%0.22641%0.408CS..EExtended strand (participates in β ladder)trans-94.2131174.1-179.7166.5179.7159.10109.5H51 K52 T70 G276H51-K68 WeakPolarHBondContact CA-O 3.38Å; K52-K68 PolarHBondContact N-O 2.87Å; K52-K68 PolarHBondContact O-N 2.91Å; K68-T70 HydrophobicContact CG-CG2 4.49Å; K68-T70 PolarHBondContact O-N 3.32Å; K68-G276 VanDerWaalsContact NZ-C 3.34Å; K68-G276 PolarHBondContact NZ-O 2.94Å
69T76.1Confident74.2Confident26 Ų2685 Ų8516%0.1643%0.431CS..EExtended strand (participates in β ladder)trans-81118.5174.6-570000108.8P49 H51 Y71P49-T69 HydrophobicContact CB-CG2 3.99Å; H51-T69 PolarHBondContact CE1-OG1 3.02Å; H51-T69 PolarHBondContact ND1-OG1 3.03Å; H51-T69 VanDerWaalsContact ND1-OG1 3.12Å; T69-Y71 HydrophobicContact CG2-CE1 4.36Å; T69-Y71 HydrophobicContact CG2-CE2 4.21Å
70T76.3Confident73.5Confident16 Ų1682.8 Ų82.810%0.09842%0.416CS..EExtended strand (participates in β ladder)trans-112.2148.2168.6590000108.9V50 K52 K68V50-T70 WeakPolarHBondContact CA-O 3.42Å; V50-T70 PolarHBondContact N-O 2.75Å; V50-T70 PolarHBondContact O-N 3.07Å; V50-T70 PolarHBondContact O-OG1 3.09Å; K52-T70 HydrophobicContact CD-CG2 3.98Å; K52-T70 WeakPolarHBondContact CD-OG1 3.06Å; K52-T70 WeakPolarHBondContact CE-OG1 3.42Å; K52-T70 PolarHBondContact NZ-OG1 3.02Å; K68-T70 HydrophobicContact CG-CG2 4.49Å; K68-T70 PolarHBondContact O-N 3.32Å
71Y77.1Confident72.8Confident46 Ų4684.6 Ų84.618%0.1841%0.407CS..EExtended strand (participates in β ladder)trans-105.4132.9179.9-66.7-81.8000109.7A47 P49 T69 L232 I268 I275A47-Y71 HydrophobicContact CB-CD1 4.07Å; A47-Y71 HydrophobicContact CB-CG 4.48Å; P49-Y71 HydrophobicContact CB-CD1 4.32Å; P49-Y71 HydrophobicContact CB-CE1 4.07Å; T69-Y71 HydrophobicContact CG2-CE1 4.36Å; T69-Y71 HydrophobicContact CG2-CE2 4.21Å; Y71-L232 HydrophobicContact CD1-CD2 4.36Å; Y71-L232 HydrophobicContact CD2-CD2 3.69Å; Y71-L232 HydrophobicContact CE2-CD2 4.24Å; Y71-L232 HydrophobicContact CG-CD2 3.77Å; Y71-I268 WeakPolarHBondContact O-CG2 2.93Å; Y71-I275 HydrophobicContact CE2-CD1 4.39Å
72S76.1Confident72.5Confident46 Ų4681.1 Ų81.132%0.32239%0.391SS..EExtended strand (participates in β ladder)trans-118.5154.1174.564.40000111.3A47 Q48 V50A47-S72 CarbonylContact C-O 3.5Å; A47-S72 WeakPolarHBondContact CA-O 3.35Å; Q48-S72 PolarHBondContact N-O 2.73Å; Q48-S72 PolarHBondContact O-N 3.02Å; V50-S72 WeakPolarHBondContact CG2-OG 3.3Å
73L75.2Confident71.6Confident29 Ų2977 Ų7715%0.15239%0.392CS..EExtended strand (participates in β ladder)trans-77.5123.5176.4-170.160.4000110.4Y75 L236 L265 I268L73-Y75 WeakPolarHBondContact CD2-OH 3.02Å; L73-Y75 HydrophobicContact CG-CE2 4.38Å; L73-L236 HydrophobicContact CD1-CD2 3.78Å; L73-L265 HydrophobicContact CB-CD2 3.61Å; L73-L265 HydrophobicContact CD2-CD2 3.67Å; L73-L265 HydrophobicContact CD2-CG 4.02Å; L73-L265 HydrophobicContact CG-CD2 4.31Å; L73-I268 HydrophobicContact CB-CD1 4.08Å; L73-I268 HydrophobicContact CD1-CD1 3.84Å; L73-I268 HydrophobicContact CD2-CD1 4.48Å; L73-I268 HydrophobicContact CG-CD1 4.36Å
74A76.4Confident70.6Confident14 Ų1473.8 Ų73.812%0.11638%0.383CS..EExtended strand (participates in β ladder)trans-125.4163.3175.200000110.4S45 Y46 Q48S45-A74 CarbonylContact C-O 3.49Å; S45-A74 VanDerWaalsContact CA-O 3.29Å; S45-A74 WeakPolarHBondContact CA-O 3.03Å; Y46-A74 HydrophobicContact CD1-CB 4.14Å; Y46-A74 WeakPolarHBondContact CD1-O 3.35Å; Y46-A74 HydrophobicContact CD2-CB 4.44Å; Y46-A74 HydrophobicContact CE1-CB 3.58Å; Y46-A74 HydrophobicContact CE2-CB 3.93Å; Y46-A74 VanDerWaalsContact CZ-CB 3.45Å; Y46-A74 PolarHBondContact N-O 2.88Å; Y46-A74 PolarHBondContact O-N 3.15Å; Q48-A74 HydrophobicContact CB-CB 3.92Å
75Y74.8Confident69.4Low137 Ų13777.5 Ų77.554%0.53741%0.409SS..EExtended strand (participates in β ladder)trans-129.9142.6-175.5-58.4-87000110.8T43 E44 L73T43-Y75 HydrophobicContact CG2-CD1 4.07Å; T43-Y75 HydrophobicContact CG2-CG 4.48Å; E44-Y75 WeakPolarHBondContact O-CA 3.03Å; L73-Y75 WeakPolarHBondContact CD2-OH 3.02Å; L73-Y75 HydrophobicContact CG-CE2 4.38Å
76R76.8Confident68.3Low129 Ų12981.4 Ų81.449%0.48742%0.416SS..EExtended strand (participates in β ladder)trans-137149.8173.761179-174.8-163.12.5110.6E44 Y46 V78E44-R76 HydrophobicContact CB-CG 4.33Å; E44-R76 PolarHBondContact N-O 3.28Å; E44-R76 PolarHBondContact O-N 3.27Å; E44-R76 IonicContact OE2-CZ 3.53Å; E44-R76 IonicContact OE2-NE 3.58Å; E44-R76 PolarHBondContact OE2-NE 2.79Å; E44-R76 IonicContact OE2-NH2 2.73Å; E44-R76 PolarHBondContact OE2-NH2 2.86Å; Y46-R76 HydrophobicContact CD1-CB 4.45Å; Y46-R76 HydrophobicContact CD1-CG 4Å; Y46-R76 HydrophobicContact CE1-CB 4.1Å; Y46-R76 HydrophobicContact CE1-CG 4.14Å; R76-V78 HydrophobicContact CG-CG1 4.11Å
77Q74.3Confident67.4Low144 Ų14485.9 Ų85.967%0.67343%0.433SS*.EExtended strand (participates in β ladder)trans-81.8130.9167.6-70.6-179.9-17.100109.1L41L41-Q77 HydrophobicContact CD2-CB 4.5Å
78V73.9Confident66.6Low27 Ų2783.7 Ų83.716%0.16442%0.424CS..EExtended strand (participates in β ladder)trans-123.7128.1173-65.90000110.1A42 E44 R76 R80A42-V78 HydrophobicContact CB-CG2 4.19Å; A42-V78 PolarHBondContact N-O 3.45Å; A42-V78 PolarHBondContact O-N 3.39Å; E44-V78 HydrophobicContact CB-CG1 4.2Å; E44-V78 HydrophobicContact CB-CG2 3.65Å; E44-V78 HydrophobicContact CG-CG2 4.48Å; R76-V78 HydrophobicContact CG-CG1 4.11Å; V78-R80 HydrophobicContact CG2-CG 4.12Å; V78-R80 PolarHBondContact O-N 3.22Å
79S67.4Low66.3Low88 Ų8884 Ų8462%0.61543%0.432SS*.EExtended strand (participates in β ladder)trans-74100.3171.351.90000109.3
80R65.1Low66.3Low105 Ų10586.7 Ų86.740%0.39645%0.445SS..EExtended strand (participates in β ladder)trans-98.7125.9174-74.8176.1173.6-99.7-3.1109I40 E44 V78 E82I40-R80 PolarHBondContact N-O 2.81Å; I40-R80 PolarHBondContact O-N 2.9Å; E44-R80 IonicContact OE1-CZ 3.44Å; E44-R80 IonicContact OE1-NE 3.61Å; E44-R80 IonicContact OE1-NH2 2.75Å; E44-R80 PolarHBondContact OE1-NH2 3.41Å; V78-R80 HydrophobicContact CG2-CG 4.12Å; V78-R80 PolarHBondContact O-N 3.22Å; R80-E82 PolarHBondContact O-N 2.88Å
81I59.4Low66.7Low112 Ų11287.3 Ų87.357%0.57445%0.45SS*.EExtended strand (participates in β ladder)trans-69.3118.5165.6-56.7-178.9000106.2H37 S83H37-I81 HydrophobicContact CB-CG2 4.31Å; I81-S83 PolarHBondContact O-N 3.31Å
82E57.4Low67.1Low90 Ų9085.7 Ų85.742%0.42145%0.445SS..  trans-65.8103.8169.7-174.2170.6-134.500109N38 I40 R80 A84N38-E82 HydrophobicContact CB-CB 4.3Å; N38-E82 PolarHBondContact O-N 3.08Å; N38-E82 VanDerWaalsContact O-N 3.15Å; I40-E82 HydrophobicContact CD1-CB 4.03Å; I40-E82 HydrophobicContact CD1-CG 4.31Å; I40-E82 HydrophobicContact CG1-CB 4.47Å; R80-E82 PolarHBondContact O-N 2.88Å; E82-A84 PolarHBondContact O-N 3.46Å
83S52.7Low67.5Low107 Ų10787.7 Ų87.775%0.74846%0.457SS*.  trans-72.581174.657.30000109.2I81 S85I81-S83 PolarHBondContact O-N 3.31Å; S83-S85 PolarHBondContact O-N 2.04Å
84A51.8Low68Low49 Ų4987.5 Ų87.541%0.40546%0.462SS..  trans-50.8102.9-172.100000112.3E82 H86 F87E82-A84 PolarHBondContact O-N 3.46Å; A84-H86 PolarHBondContact O-N 2.03Å; A84-F87 HydrophobicContact CB-CB 4.39Å; A84-F87 HydrophobicContact CB-CD2 4.37Å
85S50.6Low68.5Low107 Ų10788.8 Ų88.875%0.74846%0.463SS*.THydrogen-bonded Turntrans-70.8103.4-174.541.50000110.7S83 F87S83-S85 PolarHBondContact O-N 2.04Å; S85-F87 PolarHBondContact O-N 3.48Å
86H48.9Very low69.1Low173 Ų17388.1 Ų88.180%0.80146%0.46SS*.THydrogen-bonded Turntrans55.845.1175.4-60.5-85.6000114.9A84 Y88A84-H86 PolarHBondContact O-N 2.03Å; H86-Y88 VanDerWaalsContact C-N 3.29Å; H86-Y88 PolarHBondContact O-N 3.39Å
87F56.8Low69.6Low136 Ų13685.5 Ų85.560%0.59645%0.45SS*.  trans-64.592.3162.7-121.8-85.5000109.9A84 S85A84-F87 HydrophobicContact CB-CB 4.39Å; A84-F87 HydrophobicContact CB-CD2 4.37Å; S85-F87 PolarHBondContact O-N 3.48Å
88Y57.1Low70Confident124 Ų12483.9 Ų83.949%0.48644%0.441SS..PPolyproline II helixtrans-57.3127.6159-79.4-83.6000107.1H86 D90 H101H86-Y88 VanDerWaalsContact C-N 3.29Å; H86-Y88 PolarHBondContact O-N 3.39Å; Y88-D90 PolarHBondContact O-N 3.45Å; Y88-H101 HydrophobicContact CD1-CB 4.25Å; Y88-H101 HydrophobicContact CE1-CB 3.78Å; Y88-H101 AromaticContact CE1-ND1 3.93Å; Y88-H101 AromaticContact CE2-ND1 3.48Å; Y88-H101 WeakPolarHBondContact CE2-ND1 3.1Å; Y88-H101 AromaticContact CZ-CG 3.83Å; Y88-H101 AromaticContact CZ-ND1 3.34Å; Y88-H101 VanDerWaalsContact CZ-ND1 3.34Å; Y88-H101 PolarHBondContact OH-ND1 2.97Å
89P67.8Low70.1Confident60 Ų6090.9 Ų90.939%0.3947%0.472SS..PPolyproline II helixtrans-57.4137-177.421.6-32.8000110.6A30 R97A30-P89 HydrophobicContact CB-CB 4.25Å; A30-P89 HydrophobicContact CB-CG 4.01Å; P89-R97 PolarHBondContact O-NH2 3.3Å
90D76.7Confident70.6Confident82 Ų8289.3 Ų89.344%0.43946%0.46SS..PPolyproline II helixtrans-57155.9-178.1-77.8-55.9000111.8A30 C31 Y88A30-D90 CarbonylContact C-O 3.28Å; A30-D90 VanDerWaalsContact CA-O 3.28Å; A30-D90 WeakPolarHBondContact CA-O 3.46Å; C31-D90 PolarHBondContact N-O 2.94Å; C31-D90 PolarHBondContact O-N 2.95Å; C31-D90 VanDerWaalsContact O-O 3.07Å; Y88-D90 PolarHBondContact O-N 3.45Å
91C83.6Confident71.2Confident29 Ų2989.6 Ų89.620%0.19647%0.466CS..BIsolated β-bridgetrans-74.7133.8173.4-60.90000109.4W95 C103C91-W95 HydrophobicContact CB-CB 3.99Å; C91-W95 WeakPolarHBondContact CB-O 3.29Å; C91-C103 WeakPolarHBondContact CA-SG 3.37Å; C91-C103 HydrophobicContact CB-CB 3.71Å; C91-C103 WeakPolarHBondContact CB-SG 3.46Å; C91-C103 WeakPolarHBondContact SG-CB 3.22Å; C91-C103 CovalentContact SG-SG 2.04Å; C91-C103 PolarHBondContact SG-SG 3.34Å
92C85.5Confident72.2Confident12 Ų1288.6 Ų88.68%0.08146%0.462CS..PPolyproline II helixtrans-56.1150175.4-58.80000110.1R29 C31 G94 W95R29-C92 PolarHBondContact O-N 2.9Å; R29-C92 PolarHBondContact O-SG 2.84Å; C31-C92 HydrophobicContact CB-CB 3.95Å; C31-C92 WeakPolarHBondContact CB-SG 3.44Å; C31-C92 PolarHBondContact N-SG 3.15Å; C31-C92 WeakPolarHBondContact SG-CB 3.4Å; C31-C92 CovalentContact SG-SG 2.04Å; C31-C92 PolarHBondContact SG-SG 2.91Å; C92-G94 PolarHBondContact O-N 3.48Å; C92-W95 WeakPolarHBondContact O-CB 3.23Å; C92-W95 PolarHBondContact O-N 3.1Å
93P84.6Confident73.6Confident88 Ų8884.6 Ų84.657%0.57144%0.444SS*.THydrogen-bonded Turntrans-46.4128-179-31.436.1000113.5F22F22-P93 HydrophobicContact CD2-CG 4.1Å; F22-P93 HydrophobicContact CE2-CG 3.77Å; F22-P93 HydrophobicContact CZ-CG 4.23Å
94G85.9Confident75.2Confident24 Ų2484.2 Ų84.225%0.24743%0.433CS..THydrogen-bonded Turntrans857.6-17500000115.9C92 L107C92-G94 PolarHBondContact O-N 3.48Å; G94-L107 PolarHBondContact O-N 2.83Å
95W87.7Confident76.9Confident41 Ų4185 Ų8516%0.15543%0.429CS..EExtended strand (participates in β ladder)trans-119.7153171.5-63.494.6000111.8R29 C91 C92 C103 N104 Q105 A106 P121R29-W95 HydrophobicContact CB-CD2 4.31Å; R29-W95 HydrophobicContact CB-CG 4.28Å; R29-W95 HydrophobicContact CG-CD2 4.2Å; R29-W95 HydrophobicContact CG-CZ2 4.35Å; C91-W95 HydrophobicContact CB-CB 3.99Å; C91-W95 WeakPolarHBondContact CB-O 3.29Å; C92-W95 WeakPolarHBondContact O-CB 3.23Å; C92-W95 PolarHBondContact O-N 3.1Å; W95-C103 HydrophobicContact CB-CB 4.37Å; W95-N104 WeakPolarHBondContact CZ3-O 3.37Å; W95-Q105 CarbonylContact C-O 3.57Å; W95-Q105 WeakPolarHBondContact CA-O 3.42Å; W95-A106 HydrophobicContact CE3-CB 4.06Å; W95-A106 HydrophobicContact CH2-CB 4.12Å; W95-A106 HydrophobicContact CZ3-CB 3.68Å; W95-P121 HydrophobicContact CZ2-CG 4.35Å
96R86.8Confident78.7Confident124 Ų12480.2 Ų80.247%0.46840%0.395SS..EExtended strand (participates in β ladder)trans-142166.7171.866.3174.9-85-175.81112.5C103 N104 Q105 L107R96-C103 CarbonylContact O-C 3.32Å; R96-N104 PolarHBondContact O-N 3.19Å; R96-Q105 HydrophobicContact CG-CB 3.81Å; R96-Q105 HydrophobicContact CG-CG 3.75Å; R96-Q105 PolarHBondContact N-O 3.25Å; R96-Q105 PolarHBondContact O-N 3.27Å; R96-L107 HydrophobicContact CB-CD1 4.17Å; R96-L107 HydrophobicContact CB-CG 4.31Å; R96-L107 HydrophobicContact CG-CD1 4.42Å; R96-L107 HydrophobicContact CG-CD2 4.14Å; R96-L107 HydrophobicContact CG-CG 4.04Å
97R87.6Confident80.7Confident73 Ų7375.6 Ų75.628%0.27538%0.376SS..  trans-78.2145.9166.6-69.4145-167.6-79-14.4110.1P89 H101P89-R97 PolarHBondContact O-NH2 3.3Å; R97-H101 PolarHBondContact NH1-O 2.8Å
98F82Confident82.3Confident110 Ų11070.2 Ų70.248%0.48236%0.355SS..SBendtrans-154.5116176.7-174.9-108.7000108.2S100 Q105F98-S100 PolarHBondContact O-N 2.05Å; F98-Q105 HydrophobicContact CB-CB 3.72Å; F98-Q105 HydrophobicContact CB-CG 4.18Å; F98-Q105 HydrophobicContact CG-CB 4.5Å
99H77.1Confident83.8Confident175 Ų17568.7 Ų68.781%0.8137%0.369SS*.SBendtrans51.715.4-177.2-60.893.3000116.4
100S78.6Confident84.8Confident54 Ų5470.8 Ų70.838%0.37837%0.373SS..SBendtrans-164.7160.4-174.6-170.20000111.6F98 N102F98-S100 PolarHBondContact O-N 2.05Å; S100-N102 PolarHBondContact O-N 2.76Å; S100-N102 VanDerWaalsContact O-N 3.15Å; S100-N102 PolarHBondContact OG-ND2 3.19Å
101H75.9Confident85.5Confident112 Ų11271.3 Ų71.352%0.51938%0.381SS..SBendtrans-7511172.8-57.6-94.2000113.8Y88 R97Y88-H101 HydrophobicContact CD1-CB 4.25Å; Y88-H101 HydrophobicContact CE1-CB 3.78Å; Y88-H101 AromaticContact CE1-ND1 3.93Å; Y88-H101 AromaticContact CE2-ND1 3.48Å; Y88-H101 WeakPolarHBondContact CE2-ND1 3.1Å; Y88-H101 AromaticContact CZ-CG 3.83Å; Y88-H101 AromaticContact CZ-ND1 3.34Å; Y88-H101 VanDerWaalsContact CZ-ND1 3.34Å; Y88-H101 PolarHBondContact OH-ND1 2.97Å; R97-H101 PolarHBondContact NH1-O 2.8Å
102N82.3Confident86Confident90 Ų9071.2 Ų71.248%0.48138%0.38SS..SBendtrans-107.8137.8-178.1-65.3-54.5000111.5S100 N104S100-N102 PolarHBondContact O-N 2.76Å; S100-N102 VanDerWaalsContact O-N 3.15Å; S100-N102 PolarHBondContact OG-ND2 3.19Å; N102-N104 WeakPolarHBondContact CB-OD1 3.22Å; N102-N104 PolarHBondContact O-N 3.35Å
103C85.9Confident86.5Confident7 Ų772 Ų725%0.04739%0.388CS..  trans-77.959.4179.8-64.20000112.1R29 C91 W95 R96R29-C103 HydrophobicContact CB-CB 4.06Å; R29-C103 WeakPolarHBondContact CB-O 3.46Å; R29-C103 WeakPolarHBondContact CD-O 3.47Å; R29-C103 VanDerWaalsContact O-CB 3.32Å; R29-C103 WeakPolarHBondContact O-CB 3.19Å; C91-C103 WeakPolarHBondContact CA-SG 3.37Å; C91-C103 HydrophobicContact CB-CB 3.71Å; C91-C103 WeakPolarHBondContact CB-SG 3.46Å; C91-C103 WeakPolarHBondContact SG-CB 3.22Å; C91-C103 CovalentContact SG-SG 2.04Å; C91-C103 PolarHBondContact SG-SG 3.34Å; W95-C103 HydrophobicContact CB-CB 4.37Å; R96-C103 CarbonylContact O-C 3.32Å
104N85.4Confident87Confident98 Ų9871.5 Ų71.552%0.52438%0.38SS..  trans-91.2-26.1-168.2-70.6-5.9000113.7R29 W95 R96 N102R29-N104 PolarHBondContact NH1-O 3.29Å; W95-N104 WeakPolarHBondContact CZ3-O 3.37Å; R96-N104 PolarHBondContact O-N 3.19Å; N102-N104 WeakPolarHBondContact CB-OD1 3.22Å; N102-N104 PolarHBondContact O-N 3.35Å
105Q87.5Confident87.3Confident67 Ų6773.6 Ų73.631%0.31340%0.402SS..EExtended strand (participates in β ladder)trans-90.4122.6-173.4177.661.746.600110.2W95 R96 F98W95-Q105 CarbonylContact C-O 3.57Å; W95-Q105 WeakPolarHBondContact CA-O 3.42Å; R96-Q105 HydrophobicContact CG-CB 3.81Å; R96-Q105 HydrophobicContact CG-CG 3.75Å; R96-Q105 PolarHBondContact N-O 3.25Å; R96-Q105 PolarHBondContact O-N 3.27Å; F98-Q105 HydrophobicContact CB-CB 3.72Å; F98-Q105 HydrophobicContact CB-CG 4.18Å; F98-Q105 HydrophobicContact CG-CB 4.5Å
106A89.8Confident87.7Confident5 Ų572.3 Ų72.34%0.04140%0.402CS..EExtended strand (participates in β ladder)trans-75.8149.6173.300000111.3W95 C118W95-A106 HydrophobicContact CE3-CB 4.06Å; W95-A106 HydrophobicContact CH2-CB 4.12Å; W95-A106 HydrophobicContact CZ3-CB 3.68Å; A106-C118 HydrophobicContact CB-CB 4.39Å
107L90.3Very high88Confident76 Ų7670.6 Ų70.640%0.39841%0.405SS..  trans-108.8131.1170.5-74.1173.8000109.8G94 R96 P121 N122G94-L107 PolarHBondContact O-N 2.83Å; R96-L107 HydrophobicContact CB-CD1 4.17Å; R96-L107 HydrophobicContact CB-CG 4.31Å; R96-L107 HydrophobicContact CG-CD1 4.42Å; R96-L107 HydrophobicContact CG-CD2 4.14Å; R96-L107 HydrophobicContact CG-CG 4.04Å; L107-P121 WeakPolarHBondContact O-CA 3.03Å; L107-N122 PolarHBondContact O-N 2.04Å
108C90.4Very high88.3Confident23 Ų2368.3 Ų68.316%0.15540%0.4CS..  trans-111.3124.9169.2-71.20000105.8E110 C118 K123C108-E110 CarbonylContact C-O 3.47Å; C108-E110 VanDerWaalsContact CB-O 3.24Å; C108-E110 WeakPolarHBondContact CB-O 3.21Å; C108-E110 PolarHBondContact O-N 2.81Å; C108-C118 HydrophobicContact CB-CB 3.99Å; C108-C118 WeakPolarHBondContact CB-SG 3.34Å; C108-C118 PolarHBondContact N-SG 2.83Å; C108-C118 WeakPolarHBondContact SG-CB 3.14Å; C108-C118 CovalentContact SG-SG 2.05Å; C108-C118 PolarHBondContact SG-SG 3.19Å; C108-K123 PolarHBondContact SG-N 2.95Å
109A87.9Confident88.7Confident93 Ų9368.5 Ų68.577%0.76941%0.405SS*.SBendtrans-60.5-34.8-173.900000112N122A109-N122 WeakPolarHBondContact CB-OD1 3.04Å; A109-N122 PolarHBondContact N-OD1 3.34Å
110E89.9Confident89.2Confident104 Ų10466.6 Ų66.649%0.48640%0.395SS..SBendtrans-106144.1161-59.7-16498.400110.3C108 R134C108-E110 CarbonylContact C-O 3.47Å; C108-E110 VanDerWaalsContact CB-O 3.24Å; C108-E110 WeakPolarHBondContact CB-O 3.21Å; C108-E110 PolarHBondContact O-N 2.81Å; E110-R134 IonicContact OE1-CZ 2.88Å; E110-R134 IonicContact OE1-NH1 3.91Å; E110-R134 PolarHBondContact OE1-NH1 2.8Å; E110-R134 VanDerWaalsContact OE2-CD 3.22Å; E110-R134 WeakPolarHBondContact OE2-CD 2.99Å; E110-R134 IonicContact OE2-CZ 3.65Å; E110-R134 IonicContact OE2-NE 2.68Å; E110-R134 IonicContact OE2-NH1 3.2Å; E110-R134 PolarHBondContact OE2-NH1 2.93Å
111P91.3Very high89.6Confident93 Ų9366.4 Ų66.460%0.60439%0.392SS*.PPolyproline II helixtrans-70.1145.9178.828.7-34.6000112.2R134P111-R134 PolarHBondContact O-NE 3.04Å; P111-R134 PolarHBondContact O-NH2 2.77Å; P111-R134 VanDerWaalsContact O-NH2 3.15Å
112C94.8Very high90.2Very high27 Ų2766.5 Ų66.518%0.18240%0.397CS..PPolyproline II helixtrans-66135.2168.5-51.70000110.1G116 C124C112-G116 VanDerWaalsContact CB-O 3.31Å; C112-G116 WeakPolarHBondContact CB-O 3.24Å; C112-C124 VanDerWaalsContact CA-SG 3.54Å; C112-C124 HydrophobicContact CB-CB 3.87Å; C112-C124 WeakPolarHBondContact CB-SG 3.18Å; C112-C124 WeakPolarHBondContact SG-CB 2.99Å; C112-C124 CovalentContact SG-SG 2.03Å; C112-C124 PolarHBondContact SG-SG 3.4Å
113A95.2Very high90.6Very high29 Ų2968.9 Ų68.924%0.2440%0.403CS..SBendtrans-84.1169.8176.100000111.7G115 G116 R134 Q136A113-G115 VanDerWaalsContact C-N 3.28Å; A113-G115 PolarHBondContact O-N 2.83Å; A113-G115 VanDerWaalsContact O-N 3.08Å; A113-G116 PolarHBondContact O-N 3.25Å; A113-R134 PolarHBondContact N-O 3.48Å; A113-Q136 HydrophobicContact CB-CB 4.26Å
114N95.1Very high91.1Very high76 Ų7669.3 Ų69.341%0.40641%0.405SS..THydrogen-bonded Turntrans53.336.1163.6-53.3-43.3000115.6G116 P127 W130 C135N114-G116 VanDerWaalsContact C-N 3.3Å; N114-G116 PolarHBondContact O-N 3.12Å; N114-P127 VanDerWaalsContact O-CG 3.25Å; N114-P127 WeakPolarHBondContact O-CG 3.26Å; N114-W130 HydrophobicContact CB-CD2 3.59Å; N114-W130 HydrophobicContact CB-CE3 4Å; N114-W130 HydrophobicContact CB-CG 3.99Å; N114-W130 HydrophobicContact CB-CH2 4.32Å; N114-W130 HydrophobicContact CB-CZ2 3.95Å; N114-W130 HydrophobicContact CB-CZ3 4.36Å; N114-W130 WeakPolarHBondContact ND2-CZ3 3.25Å; N114-C135 PolarHBondContact ND2-O 3.02Å
115G92.8Very high91.5Very high69 Ų6966 Ų6671%0.71139%0.392SS*.THydrogen-bonded Turntrans78.77.1-178.900000115.1A113A113-G115 VanDerWaalsContact C-N 3.28Å; A113-G115 PolarHBondContact O-N 2.83Å; A113-G115 VanDerWaalsContact O-N 3.08Å
116G94.4Very high92Very high14 Ų1465 Ų6514%0.14439%0.392CS..  trans-61.9151.2172.500000113C112 A113 N114 A125C112-G116 VanDerWaalsContact CB-O 3.31Å; C112-G116 WeakPolarHBondContact CB-O 3.24Å; A113-G116 PolarHBondContact O-N 3.25Å; N114-G116 VanDerWaalsContact C-N 3.3Å; N114-G116 PolarHBondContact O-N 3.12Å; G116-A125 CarbonylContact C-O 3.45Å; G116-A125 WeakPolarHBondContact CA-O 3.13Å
117T93.9Very high92.3Very high88 Ų8866.8 Ų66.854%0.5440%0.403SS..EExtended strand (participates in β ladder)trans-121138.6-177.552.10000111.3L119 C124 A125T117-L119 PolarHBondContact O-N 3.03Å; T117-C124 CarbonylContact O-C 3.59Å; T117-C124 WeakPolarHBondContact O-CA 3.33Å; T117-A125 PolarHBondContact N-O 2.92Å; T117-A125 PolarHBondContact O-N 3.15Å
118C93.5Very high92.5Very high25 Ų2569.1 Ų69.117%0.16942%0.423CS..EExtended strand (participates in β ladder)trans-74.5108.6179.1-167.30000110.1A106 C108 K120A106-C118 HydrophobicContact CB-CB 4.39Å; C108-C118 HydrophobicContact CB-CB 3.99Å; C108-C118 WeakPolarHBondContact CB-SG 3.34Å; C108-C118 PolarHBondContact N-SG 2.83Å; C108-C118 WeakPolarHBondContact SG-CB 3.14Å; C108-C118 CovalentContact SG-SG 2.05Å; C108-C118 PolarHBondContact SG-SG 3.19Å; C118-K120 PolarHBondContact SG-O 2.82Å
119L90.7Very high92.7Very high114 Ų11468.4 Ų68.460%0.59742%0.419SS*.EExtended strand (participates in β ladder)trans-86-35.5-178.6-91.7-175.7000113.1T117 K123 A125T117-L119 PolarHBondContact O-N 3.03Å; L119-K123 PolarHBondContact N-O 2.04Å; L119-A125 HydrophobicContact CD1-CB 3.65Å; L119-A125 HydrophobicContact CG-CB 3.74Å
120K87.6Confident93.1Very high134 Ų13466.4 Ų66.458%0.58339%0.392SS*.EExtended strand (participates in β ladder)trans-145.5161.4-177.7-65.9-171.1-178.5-173.70108.2C118 N122 K123C118-K120 PolarHBondContact SG-O 2.82Å; K120-N122 PolarHBondContact O-N 3.48Å; K120-N122 VanDerWaalsContact O-N 3.1Å; K120-K123 HydrophobicContact CB-CB 4.32Å; K120-K123 PolarHBondContact N-O 2.87Å; K120-K123 PolarHBondContact O-N 3.03Å
121P87.6Confident93.3Very high50 Ų5064.8 Ų64.833%0.32539%0.389SS..THydrogen-bonded Turntrans-42.3119.8172.7-31.534.4000112.1W95 L107 K123W95-P121 HydrophobicContact CZ2-CG 4.35Å; L107-P121 WeakPolarHBondContact O-CA 3.03Å; P121-K123 PolarHBondContact O-N 3.19Å; P121-K123 VanDerWaalsContact O-N 3.15Å
122N87.5Confident93.4Very high115 Ų11561.8 Ų61.862%0.61538%0.375SS*.THydrogen-bonded Turntrans5229.9-178.2-59.5-23.5000116L107 A109 K120L107-N122 PolarHBondContact O-N 2.04Å; A109-N122 WeakPolarHBondContact CB-OD1 3.04Å; A109-N122 PolarHBondContact N-OD1 3.34Å; K120-N122 PolarHBondContact O-N 3.48Å; K120-N122 VanDerWaalsContact O-N 3.1Å
123K91.4Very high93.4Very high139 Ų13966.6 Ų66.660%0.60440%0.395SS*.EExtended strand (participates in β ladder)trans-137.2114.6173.8-173.5167.5-176.1166.60113C108 L119 K120 P121C108-K123 PolarHBondContact SG-N 2.95Å; L119-K123 PolarHBondContact N-O 2.04Å; K120-K123 HydrophobicContact CB-CB 4.32Å; K120-K123 PolarHBondContact N-O 2.87Å; K120-K123 PolarHBondContact O-N 3.03Å; P121-K123 PolarHBondContact O-N 3.19Å; P121-K123 VanDerWaalsContact O-N 3.15Å
124C95.3Very high93.3Very high16 Ų1668.3 Ų68.311%0.10840%0.395CS..EExtended strand (participates in β ladder)trans-80147.9175.7-57.70000112.6C112 T117 C135C112-C124 VanDerWaalsContact CA-SG 3.54Å; C112-C124 HydrophobicContact CB-CB 3.87Å; C112-C124 WeakPolarHBondContact CB-SG 3.18Å; C112-C124 WeakPolarHBondContact SG-CB 2.99Å; C112-C124 CovalentContact SG-SG 2.03Å; C112-C124 PolarHBondContact SG-SG 3.4Å; T117-C124 CarbonylContact O-C 3.59Å; T117-C124 WeakPolarHBondContact O-CA 3.33Å; C124-C135 VanDerWaalsContact CB-SG 3.56Å
125A95.6Very high93.4Very high29 Ų2964.7 Ų64.724%0.2438%0.376CS..EExtended strand (participates in β ladder)trans-87.8137.8148.400000108.7G116 T117 L119 C135G116-A125 CarbonylContact C-O 3.45Å; G116-A125 WeakPolarHBondContact CA-O 3.13Å; T117-A125 PolarHBondContact N-O 2.92Å; T117-A125 PolarHBondContact O-N 3.15Å; L119-A125 HydrophobicContact CD1-CB 3.65Å; L119-A125 HydrophobicContact CG-CB 3.74Å; A125-C135 VanDerWaalsContact C-SG 3.58Å; A125-C135 PolarHBondContact O-SG 2.9Å; A125-C135 VanDerWaalsContact O-SG 3.39Å
126C96.6Very high93.5Very high46 Ų4665.1 Ų65.131%0.31136%0.359SS..  trans-104.5141.1176.5-52.40000110.1W130 C135C126-W130 HydrophobicContact CB-CB 4.2Å; C126-W130 VanDerWaalsContact CB-O 3.26Å; C126-W130 WeakPolarHBondContact CB-O 3.31Å; C126-C135 WeakPolarHBondContact CA-SG 3.2Å; C126-C135 HydrophobicContact CB-CB 3.62Å; C126-C135 WeakPolarHBondContact CB-SG 3.11Å; C126-C135 PolarHBondContact N-SG 2.77Å; C126-C135 WeakPolarHBondContact SG-CA 3.5Å; C126-C135 WeakPolarHBondContact SG-CB 3.08Å; C126-C135 CovalentContact SG-SG 2.04Å; C126-C135 PolarHBondContact SG-SG 3.4Å
127P96Very high93.6Very high43 Ų4367.6 Ų67.628%0.27937%0.372SS..  trans-65.4164.1166.725.7-28.1000110.4N114 W130N114-P127 VanDerWaalsContact O-CG 3.25Å; N114-P127 WeakPolarHBondContact O-CG 3.26Å; P127-W130 HydrophobicContact CG-CG 4.46Å; P127-W130 PolarHBondContact O-N 3.41Å
128P94.2Very high93.7Very high125 Ų12565.8 Ų65.881%0.81236%0.359SS*.THydrogen-bonded Turntrans-50.6148.4170.2-25.235.2000111.9W130P128-W130 VanDerWaalsContact C-N 3.26Å; P128-W130 PolarHBondContact O-N 3.08Å
129G94.4Very high93.8Very high8 Ų867 Ų678%0.08237%0.365CS..THydrogen-bonded Turntrans79.2-5.4-17400000115.3V139G129-V139 WeakPolarHBondContact O-CB 3.46Å; G129-V139 PolarHBondContact O-N 3.42Å
130W97.2Very high94Very high51 Ų5165.6 Ų65.619%0.19336%0.359CS..EExtended strand (participates in β ladder)trans-127.6145.1-177.1-63.495.1000113.9N114 C126 P127 P128 C135 D138 A156 G157N114-W130 HydrophobicContact CB-CD2 3.59Å; N114-W130 HydrophobicContact CB-CE3 4Å; N114-W130 HydrophobicContact CB-CG 3.99Å; N114-W130 HydrophobicContact CB-CH2 4.32Å; N114-W130 HydrophobicContact CB-CZ2 3.95Å; N114-W130 HydrophobicContact CB-CZ3 4.36Å; N114-W130 WeakPolarHBondContact ND2-CZ3 3.25Å; C126-W130 HydrophobicContact CB-CB 4.2Å; C126-W130 VanDerWaalsContact CB-O 3.26Å; C126-W130 WeakPolarHBondContact CB-O 3.31Å; P127-W130 HydrophobicContact CG-CG 4.46Å; P127-W130 PolarHBondContact O-N 3.41Å; P128-W130 VanDerWaalsContact C-N 3.26Å; P128-W130 PolarHBondContact O-N 3.08Å; W130-C135 HydrophobicContact CB-CB 4.34Å; W130-D138 HydrophobicContact CE3-CB 4.49Å; W130-D138 HydrophobicContact CZ3-CB 4.06Å; W130-A156 HydrophobicContact CH2-CB 3.91Å; W130-A156 HydrophobicContact CZ2-CB 4.01Å; W130-G157 VanDerWaalsContact NE1-CA 3.26Å
131T94.7Very high94.3Very high69 Ų6961.3 Ų61.342%0.42334%0.34SS..EExtended strand (participates in β ladder)trans-147.2-179-176.9-166.70000112.3C135 Q136 T137 V139T131-C135 CarbonylContact O-C 3.59Å; T131-C135 VanDerWaalsContact O-C 3.28Å; T131-C135 WeakPolarHBondContact O-CA 3.38Å; T131-Q136 PolarHBondContact O-N 3.01Å; T131-T137 HydrophobicContact CG2-CG2 3.86Å; T131-T137 PolarHBondContact N-O 2.88Å; T131-T137 PolarHBondContact O-N 2.82Å; T131-V139 HydrophobicContact CG2-CG2 3.64Å
132G93.7Very high94.6Very high31 Ų3160 Ų6032%0.3233%0.332SS..SBendtrans86.5164.2-172.800000113.3R134 C135G132-R134 PolarHBondContact O-N 2.98Å; G132-R134 VanDerWaalsContact O-N 3.09Å; G132-C135 PolarHBondContact O-N 3Å
133H93Very high94.6Very high128 Ų12857.6 Ų57.659%0.59334%0.335SS*.THydrogen-bonded Turntrans-57.8-27.2-171.971-72000114.8
134R94.4Very high94.1Very high64 Ų6454.3 Ų54.324%0.24234%0.34CS..THydrogen-bonded Turntrans-116.713.6176.6-79.3171.866.1-163.20.2113.4E110 P111 A113 G132 Q136E110-R134 IonicContact OE1-CZ 2.88Å; E110-R134 IonicContact OE1-NH1 3.91Å; E110-R134 PolarHBondContact OE1-NH1 2.8Å; E110-R134 VanDerWaalsContact OE2-CD 3.22Å; E110-R134 WeakPolarHBondContact OE2-CD 2.99Å; E110-R134 IonicContact OE2-CZ 3.65Å; E110-R134 IonicContact OE2-NE 2.68Å; E110-R134 IonicContact OE2-NH1 3.2Å; E110-R134 PolarHBondContact OE2-NH1 2.93Å; P111-R134 PolarHBondContact O-NE 3.04Å; P111-R134 PolarHBondContact O-NH2 2.77Å; P111-R134 VanDerWaalsContact O-NH2 3.15Å; A113-R134 PolarHBondContact N-O 3.48Å; G132-R134 PolarHBondContact O-N 2.98Å; G132-R134 VanDerWaalsContact O-N 3.09Å; R134-Q136 HydrophobicContact CB-CB 4.44Å; R134-Q136 PolarHBondContact O-N 3.11Å
135C96.5Very high93.2Very high0 Ų064.2 Ų64.20%038%0.375CS..SBendtrans6224.4-175.3-440000113.5N114 C124 A125 C126 W130 T131 G132N114-C135 PolarHBondContact ND2-O 3.02Å; C124-C135 VanDerWaalsContact CB-SG 3.56Å; A125-C135 VanDerWaalsContact C-SG 3.58Å; A125-C135 PolarHBondContact O-SG 2.9Å; A125-C135 VanDerWaalsContact O-SG 3.39Å; C126-C135 WeakPolarHBondContact CA-SG 3.2Å; C126-C135 HydrophobicContact CB-CB 3.62Å; C126-C135 WeakPolarHBondContact CB-SG 3.11Å; C126-C135 PolarHBondContact N-SG 2.77Å; C126-C135 WeakPolarHBondContact SG-CA 3.5Å; C126-C135 WeakPolarHBondContact SG-CB 3.08Å; C126-C135 CovalentContact SG-SG 2.04Å; C126-C135 PolarHBondContact SG-SG 3.4Å; W130-C135 HydrophobicContact CB-CB 4.34Å; T131-C135 CarbonylContact O-C 3.59Å; T131-C135 VanDerWaalsContact O-C 3.28Å; T131-C135 WeakPolarHBondContact O-CA 3.38Å; G132-C135 PolarHBondContact O-N 3Å
136Q95.4Very high92.6Very high79 Ų7970.4 Ų70.437%0.36940%0.399SS..  trans-87.3-8.5-173.781.7-61-25.900113.6A113 T131 R134A113-Q136 HydrophobicContact CB-CB 4.26Å; T131-Q136 PolarHBondContact O-N 3.01Å; R134-Q136 HydrophobicContact CB-CB 4.44Å; R134-Q136 PolarHBondContact O-N 3.11Å
137T96Very high92.3Very high66 Ų6669.4 Ų69.441%0.40539%0.392SS..EExtended strand (participates in β ladder)trans-109.1128.8-178.3-60.80000109.4T131T131-T137 HydrophobicContact CG2-CG2 3.86Å; T131-T137 PolarHBondContact N-O 2.88Å; T131-T137 PolarHBondContact O-N 2.82Å
138D96.6Very high92.1Very high49 Ų4968.1 Ų68.126%0.26238%0.384SS..EExtended strand (participates in β ladder)trans-67.7149.7174.3-171.851.2000111.4W130 N154 A156 G157W130-D138 HydrophobicContact CE3-CB 4.49Å; W130-D138 HydrophobicContact CZ3-CB 4.06Å; D138-N154 PolarHBondContact OD2-ND2 2.87Å; D138-A156 WeakPolarHBondContact OD1-CA 3.17Å; D138-G157 PolarHBondContact OD1-N 2.79Å
139V95.4Very high92.1Very high51 Ų5165.3 Ų65.331%0.30937%0.371SS..  trans-104.2100.1176.7178.70000109.3G129 T131 E141G129-V139 WeakPolarHBondContact O-CB 3.46Å; G129-V139 PolarHBondContact O-N 3.42Å; T131-V139 HydrophobicContact CG2-CG2 3.64Å; V139-E141 HydrophobicContact CG1-CG 4.37Å; V139-E141 PolarHBondContact O-N 2.77Å
140D94.6Very high92Very high85 Ų8567.8 Ų67.846%0.45538%0.381SS..  trans-66.696.2174.8-179.97.1000111.4C142 G143D140-C142 VanDerWaalsContact C-N 3.26Å; D140-C142 PolarHBondContact O-N 3.37Å; D140-C142 WeakPolarHBondContact OD1-CA 3.41Å; D140-C142 VanDerWaalsContact OD1-CB 3.3Å; D140-C142 WeakPolarHBondContact OD1-CB 3.43Å; D140-C142 PolarHBondContact OD1-N 2.79Å; D140-G143 VanDerWaalsContact CG-N 3.28Å; D140-G143 PolarHBondContact OD1-N 3.22Å; D140-G143 WeakPolarHBondContact OD2-CA 3.07Å; D140-G143 PolarHBondContact OD2-N 2.87Å
141E94.1Very high91.9Very high43 Ų4369 Ų6920%0.20139%0.39CS..SBendtrans-72-21.1176.8-69117.1161.300112.9V139 R145 P147 S158 Y159V139-E141 HydrophobicContact CG1-CG 4.37Å; V139-E141 PolarHBondContact O-N 2.77Å; E141-R145 PolarHBondContact O-N 2.91Å; E141-P147 HydrophobicContact CB-CG 4.29Å; E141-P147 VanDerWaalsContact O-CD 3.23Å; E141-P147 WeakPolarHBondContact O-CD 3.24Å; E141-S158 VanDerWaalsContact OE2-C 3.29Å; E141-Y159 HydrophobicContact CB-CD1 3.66Å; E141-Y159 HydrophobicContact CB-CE1 4.19Å; E141-Y159 HydrophobicContact CB-CG 4.23Å; E141-Y159 HydrophobicContact CG-CD1 3.98Å; E141-Y159 HydrophobicContact CG-CE1 4.33Å; E141-Y159 VanDerWaalsContact OE2-CD1 3.29Å; E141-Y159 WeakPolarHBondContact OE2-CD1 3.1Å
142C93.3Very high91.9Very high23 Ų2367.6 Ų67.616%0.15538%0.383CS..Hα-helixtrans-77.4-36.1177.9-59.60000112.3D140 G144 C152 M153 N154D140-C142 VanDerWaalsContact C-N 3.26Å; D140-C142 PolarHBondContact O-N 3.37Å; D140-C142 WeakPolarHBondContact OD1-CA 3.41Å; D140-C142 VanDerWaalsContact OD1-CB 3.3Å; D140-C142 WeakPolarHBondContact OD1-CB 3.43Å; D140-C142 PolarHBondContact OD1-N 2.79Å; C142-G144 PolarHBondContact O-N 2.78Å; C142-G144 VanDerWaalsContact O-N 3.07Å; C142-C152 WeakPolarHBondContact CA-SG 3.03Å; C142-C152 HydrophobicContact CB-CB 3.72Å; C142-C152 WeakPolarHBondContact CB-SG 3.41Å; C142-C152 WeakPolarHBondContact SG-CB 3.21Å; C142-C152 CovalentContact SG-SG 2.04Å; C142-C152 PolarHBondContact SG-SG 3.22Å; C142-M153 PolarHBondContact SG-N 3.41Å; C142-N154 PolarHBondContact SG-N 2.75Å; C142-N154 VanDerWaalsContact SG-N 3.4Å
143G89Confident91.9Very high65 Ų6570.1 Ų70.167%0.6739%0.388SS*.Hα-helixtrans-65-7.5-17500000116.5D140D140-G143 VanDerWaalsContact CG-N 3.28Å; D140-G143 PolarHBondContact OD1-N 3.22Å; D140-G143 WeakPolarHBondContact OD2-CA 3.07Å; D140-G143 PolarHBondContact OD2-N 2.87Å
144G80Confident92.1Very high69 Ų6966.6 Ų66.671%0.71137%0.373SS*.Hα-helixtrans-152.9-35.3176.700000116.9C142C142-G144 PolarHBondContact O-N 2.78Å; C142-G144 VanDerWaalsContact O-N 3.07Å
145R75.9Confident92.1Very high224 Ų22465.9 Ų65.985%0.84538%0.376SS*.Hα-helixtrans-91.8-13.4-172.3-164.1171.3179.6-174.10.9114.3E141E141-R145 PolarHBondContact O-N 2.91Å
146Q83.6Confident91.9Very high160 Ų16069.8 Ų69.875%0.74841%0.408SS*.  trans37.962.8-173.7-66.9-162.7-20.600113.7C148Q146-C148 PolarHBondContact O-N 3.13Å
147P89.3Confident91.9Very high25 Ų2566.9 Ų66.916%0.16240%0.4CS..  trans-72.44.8-17332.4-39.7000115.2E141 Y159 R174E141-P147 HydrophobicContact CB-CG 4.29Å; E141-P147 VanDerWaalsContact O-CD 3.23Å; E141-P147 WeakPolarHBondContact O-CD 3.24Å; P147-Y159 HydrophobicContact CB-CD2 4.31Å; P147-Y159 HydrophobicContact CB-CE1 4.28Å; P147-Y159 HydrophobicContact CB-CE2 3.59Å; P147-Y159 HydrophobicContact CG-CD1 4.26Å; P147-Y159 HydrophobicContact CG-CD2 3.62Å; P147-Y159 HydrophobicContact CG-CE1 4.09Å; P147-Y159 HydrophobicContact CG-CE2 3.42Å; P147-Y159 VanDerWaalsContact CG-CE2 3.42Å; P147-Y159 HydrophobicContact CG-CG 4.04Å; P147-R174 WeakPolarHBondContact O-CD 3.28Å
148C93.5Very high91.8Very high16 Ų1666.6 Ų66.611%0.10840%0.4CS..SBendtrans-123.4143.2-173.2-59.90000110.9Q146 Q150 L151 C152 C161Q146-C148 PolarHBondContact O-N 3.13Å; C148-Q150 VanDerWaalsContact C-N 3.29Å; C148-Q150 PolarHBondContact O-N 3.36Å; C148-L151 WeakPolarHBondContact CB-O 3.32Å; C148-C152 HydrophobicContact CB-CB 4.02Å; C148-C152 VanDerWaalsContact SG-SG 3.68Å; C148-C161 WeakPolarHBondContact CA-SG 3.06Å; C148-C161 HydrophobicContact CB-CB 3.6Å; C148-C161 WeakPolarHBondContact CB-SG 3.19Å; C148-C161 WeakPolarHBondContact SG-CA 3.39Å; C148-C161 WeakPolarHBondContact SG-CB 3.1Å; C148-C161 CovalentContact SG-SG 2.03Å; C148-C161 PolarHBondContact SG-SG 2.92Å
149A93.1Very high91.7Very high66 Ų6666.5 Ų66.555%0.54540%0.396SS..SBendtrans-71.2-16.5-176.900000115.1R174A149-R174 WeakPolarHBondContact CB-O 3.35Å; A149-R174 PolarHBondContact N-O 3.4Å
150Q93.4Very high91.7Very high59 Ų5970.1 Ų70.128%0.27641%0.405SS..SBendtrans-141.8-69-178.8-66.6-172.81.400113.8C148 C176C148-Q150 VanDerWaalsContact C-N 3.29Å; C148-Q150 PolarHBondContact O-N 3.36Å; Q150-C176 HydrophobicContact CG-CB 4.06Å
151L93.6Very high91.7Very high76 Ų7666.7 Ų66.740%0.39839%0.387SS..EExtended strand (participates in β ladder)trans-117.3132.2179.8-67.6157.3000109.1C148 C161 A162 R164C148-L151 WeakPolarHBondContact CB-O 3.32Å; L151-C161 WeakPolarHBondContact O-CA 3.4Å; L151-A162 HydrophobicContact CB-CB 3.95Å; L151-A162 WeakPolarHBondContact CB-O 3.48Å; L151-A162 HydrophobicContact CD1-CB 4.36Å; L151-A162 PolarHBondContact N-O 2.9Å; L151-A162 VanDerWaalsContact N-O 3.07Å; L151-A162 PolarHBondContact O-N 3.33Å; L151-R164 HydrophobicContact CD1-CG 4.07Å
152C95.4Very high91.7Very high40 Ų4066.2 Ų66.227%0.2739%0.39SS..EExtended strand (participates in β ladder)trans-113.6131.8174.3-169.10000108.6C142 C148C142-C152 WeakPolarHBondContact CA-SG 3.03Å; C142-C152 HydrophobicContact CB-CB 3.72Å; C142-C152 WeakPolarHBondContact CB-SG 3.41Å; C142-C152 WeakPolarHBondContact SG-CB 3.21Å; C142-C152 CovalentContact SG-SG 2.04Å; C142-C152 PolarHBondContact SG-SG 3.22Å; C148-C152 HydrophobicContact CB-CB 4.02Å; C148-C152 VanDerWaalsContact SG-SG 3.68Å
153M94.5Very high91.8Very high84 Ų8466.4 Ų66.441%0.41439%0.392SS..EExtended strand (participates in β ladder)trans-125.6109.9176.3-53.6-173.382.800109.1C142 Y159 R160C142-M153 PolarHBondContact SG-N 3.41Å; M153-Y159 WeakPolarHBondContact O-CA 3.26Å; M153-R160 HydrophobicContact CB-CG 3.9Å; M153-R160 PolarHBondContact N-O 2.86Å; M153-R160 PolarHBondContact O-N 3.19Å; M153-R160 PolarHBondContact SD-NH2 3.29Å
154N95.4Very high92Very high55 Ų5571.1 Ų71.129%0.29439%0.389SS..EExtended strand (participates in β ladder)trans-66.6151177-168.647.7000111.5D138 C142 S158D138-N154 PolarHBondContact OD2-ND2 2.87Å; C142-N154 PolarHBondContact SG-N 2.75Å; C142-N154 VanDerWaalsContact SG-N 3.4Å; N154-S158 PolarHBondContact OD1-O 3.09Å
155T94.6Very high92.6Very high49 Ų4975.6 Ų75.630%0.30140%0.397SS..EExtended strand (participates in β ladder)trans-148.6160178.5490000110.6G157 S158T155-G157 PolarHBondContact O-N 3.09Å; T155-S158 CarbonylContact C-O 3.56Å; T155-S158 WeakPolarHBondContact CA-O 3.42Å; T155-S158 WeakPolarHBondContact CB-O 3.38Å; T155-S158 PolarHBondContact N-O 2.85Å; T155-S158 PolarHBondContact O-N 2.97Å; T155-S158 VanDerWaalsContact O-N 3.08Å; T155-S158 PolarHBondContact OG1-O 2.98Å
156A94Very high93.2Very high82 Ų8267.2 Ų67.268%0.67838%0.381SS*.THydrogen-bonded Turntrans-58.5105.9179.900000112.2W130 D138W130-A156 HydrophobicContact CH2-CB 3.91Å; W130-A156 HydrophobicContact CZ2-CB 4.01Å; D138-A156 WeakPolarHBondContact OD1-CA 3.17Å
157G93.6Very high93.6Very high18 Ų1862.8 Ų62.819%0.18636%0.359CS..THydrogen-bonded Turntrans82.311.4179.700000116.4W130 D138 T155W130-G157 VanDerWaalsContact NE1-CA 3.26Å; D138-G157 PolarHBondContact OD1-N 2.79Å; T155-G157 PolarHBondContact O-N 3.09Å
158S94.8Very high93.8Very high59 Ų5963.6 Ų63.641%0.41336%0.363SS..EExtended strand (participates in β ladder)trans-172-179.2-179.9-163.20000111.9E141 N154 T155E141-S158 VanDerWaalsContact OE2-C 3.29Å; N154-S158 PolarHBondContact OD1-O 3.09Å; T155-S158 CarbonylContact C-O 3.56Å; T155-S158 WeakPolarHBondContact CA-O 3.42Å; T155-S158 WeakPolarHBondContact CB-O 3.38Å; T155-S158 PolarHBondContact N-O 2.85Å; T155-S158 PolarHBondContact O-N 2.97Å; T155-S158 VanDerWaalsContact O-N 3.08Å; T155-S158 PolarHBondContact OG1-O 2.98Å
159Y95.1Very high93.7Very high47 Ų4766 Ų6618%0.18438%0.375CS..EExtended strand (participates in β ladder)trans-129.9161.1167.463.3-77.4000110.9E141 P147 M153 R174E141-Y159 HydrophobicContact CB-CD1 3.66Å; E141-Y159 HydrophobicContact CB-CE1 4.19Å; E141-Y159 HydrophobicContact CB-CG 4.23Å; E141-Y159 HydrophobicContact CG-CD1 3.98Å; E141-Y159 HydrophobicContact CG-CE1 4.33Å; E141-Y159 VanDerWaalsContact OE2-CD1 3.29Å; E141-Y159 WeakPolarHBondContact OE2-CD1 3.1Å; P147-Y159 HydrophobicContact CB-CD2 4.31Å; P147-Y159 HydrophobicContact CB-CE1 4.28Å; P147-Y159 HydrophobicContact CB-CE2 3.59Å; P147-Y159 HydrophobicContact CG-CD1 4.26Å; P147-Y159 HydrophobicContact CG-CD2 3.62Å; P147-Y159 HydrophobicContact CG-CE1 4.09Å; P147-Y159 HydrophobicContact CG-CE2 3.42Å; P147-Y159 VanDerWaalsContact CG-CE2 3.42Å; P147-Y159 HydrophobicContact CG-CG 4.04Å; M153-Y159 WeakPolarHBondContact O-CA 3.26Å; Y159-R174 PolarHBondContact OH-NE 2.99Å; Y159-R174 PolarHBondContact OH-NH2 2.99Å
160R94.3Very high93.7Very high128 Ų12864 Ų6448%0.48336%0.359SS..EExtended strand (participates in β ladder)trans-121.7141.4164.368.1-177.1-175.7-77.84.5110.7M153M153-R160 HydrophobicContact CB-CG 3.9Å; M153-R160 PolarHBondContact N-O 2.86Å; M153-R160 PolarHBondContact O-N 3.19Å; M153-R160 PolarHBondContact SD-NH2 3.29Å
161C95.8Very high93.5Very high13 Ų1365.5 Ų65.59%0.08839%0.39CS..EExtended strand (participates in β ladder)trans-90.3144.2171.1-57.30000110.4C148 L151 L169 G173C148-C161 WeakPolarHBondContact CA-SG 3.06Å; C148-C161 HydrophobicContact CB-CB 3.6Å; C148-C161 WeakPolarHBondContact CB-SG 3.19Å; C148-C161 WeakPolarHBondContact SG-CA 3.39Å; C148-C161 WeakPolarHBondContact SG-CB 3.1Å; C148-C161 CovalentContact SG-SG 2.03Å; C148-C161 PolarHBondContact SG-SG 2.92Å; L151-C161 WeakPolarHBondContact O-CA 3.4Å; C161-L169 HydrophobicContact CB-CD1 3.87Å; C161-G173 WeakPolarHBondContact CB-O 3.28Å; C161-G173 PolarHBondContact SG-O 3.15Å
162A93.7Very high93.4Very high32 Ų3265.9 Ų65.926%0.26439%0.392SS..EExtended strand (participates in β ladder)trans-127.5160.5171.200000110L151L151-A162 HydrophobicContact CB-CB 3.95Å; L151-A162 WeakPolarHBondContact CB-O 3.48Å; L151-A162 HydrophobicContact CD1-CB 4.36Å; L151-A162 PolarHBondContact N-O 2.9Å; L151-A162 VanDerWaalsContact N-O 3.07Å; L151-A162 PolarHBondContact O-N 3.33Å
163C95.3Very high93.1Very high28 Ų2865.5 Ų65.519%0.18940%0.395CS..  trans-116.3154.6176.4-56.20000109.6F167 C176C163-F167 HydrophobicContact CB-CB 3.7Å; C163-C176 VanDerWaalsContact CA-SG 3.51Å; C163-C176 HydrophobicContact CB-CB 3.81Å; C163-C176 WeakPolarHBondContact CB-SG 3.35Å; C163-C176 VanDerWaalsContact SG-CA 3.52Å; C163-C176 WeakPolarHBondContact SG-CB 3.29Å; C163-C176 CovalentContact SG-SG 2.04Å; C163-C176 PolarHBondContact SG-SG 2.93Å
164R93.7Very high93Very high164 Ų16467.5 Ų67.562%0.61940%0.398SS*.  trans-74.3164.8172.3-60.1179.3-174.9-170.51.6110.1L151 F167L151-R164 HydrophobicContact CD1-CG 4.07Å; R164-F167 WeakPolarHBondContact O-CB 3.5Å; R164-F167 PolarHBondContact O-N 2.93Å; R164-F167 VanDerWaalsContact O-N 3.16Å
165D91.6Very high92.9Very high162 Ų16267.4 Ų67.487%0.86640%0.402SS*.THydrogen-bonded Turntrans-54.3142.4-178-54.6-68.6000112.6F167D165-F167 VanDerWaalsContact C-N 3.32Å
166G89Confident92.9Very high49 Ų4966.3 Ų66.351%0.50540%0.395SS..THydrogen-bonded Turntrans83.9-3-172.600000115.2Q178 L179G166-Q178 WeakPolarHBondContact O-CA 3.22Å; G166-L179 PolarHBondContact O-N 3.28Å
167F92.6Very high92.8Very high66 Ų6669.6 Ų69.629%0.28939%0.39SS..EExtended strand (participates in β ladder)trans-118.4146.4176-65.1-106000112.2C163 R164 D165 C176 R177 Q178C163-F167 HydrophobicContact CB-CB 3.7Å; R164-F167 WeakPolarHBondContact O-CB 3.5Å; R164-F167 PolarHBondContact O-N 2.93Å; R164-F167 VanDerWaalsContact O-N 3.16Å; D165-F167 VanDerWaalsContact C-N 3.32Å; F167-C176 HydrophobicContact CB-CB 4.2Å; F167-C176 HydrophobicContact CD1-CB 4.02Å; F167-C176 HydrophobicContact CG-CB 4.42Å; F167-R177 CarbonylContact C-O 3.5Å; F167-R177 WeakPolarHBondContact CA-O 3.08Å; F167-R177 WeakPolarHBondContact CB-O 3.46Å; F167-Q178 HydrophobicContact CD1-CG 3.76Å; F167-Q178 HydrophobicContact CE1-CG 3.42Å; F167-Q178 VanDerWaalsContact CE1-CG 3.42Å; F167-Q178 HydrophobicContact CE2-CG 4.3Å; F167-Q178 HydrophobicContact CG-CG 4.34Å; F167-Q178 HydrophobicContact CZ-CG 3.72Å
168T92Very high92.7Very high42 Ų4275.7 Ų75.726%0.25841%0.414SS..EExtended strand (participates in β ladder)trans-104.1152.1161.639.80000111C176 R177 L179T168-C176 WeakPolarHBondContact O-CA 3.42Å; T168-R177 PolarHBondContact N-O 3.06Å; T168-R177 PolarHBondContact O-N 2.83Å; T168-R177 WeakPolarHBondContact OG1-CG 3.27Å; T168-R177 PolarHBondContact OG1-NE 3.4Å; T168-L179 HydrophobicContact CG2-CD1 4.05Å; T168-L179 HydrophobicContact CG2-CD2 3.54Å; T168-L179 HydrophobicContact CG2-CG 3.71Å
169L93.4Very high92.1Very high67 Ų6777.6 Ų77.635%0.35142%0.419SS..EExtended strand (participates in β ladder)trans-63136.2164-159.367.2000109.2C161C161-L169 HydrophobicContact CB-CD1 3.87Å
170A91.3Very high91.2Very high25 Ų2580 Ų8021%0.20744%0.44CS..  trans-79.5170.4174.200000111D172 G173 S175A170-D172 PolarHBondContact O-N 3.03Å; A170-D172 VanDerWaalsContact O-N 3.07Å; A170-G173 PolarHBondContact O-N 2.8Å; A170-S175 WeakPolarHBondContact CB-O 3.39Å; A170-S175 PolarHBondContact N-O 2.88Å
171G89.4Confident89.9Confident90 Ų9079.6 Ų79.693%0.92845%0.454SS*.THydrogen-bonded Turntrans-66.3-6.6-17800000115.3G173G171-G173 VanDerWaalsContact C-N 3.31Å
172D91.1Very high88.1Confident83 Ų8385 Ų8544%0.44449%0.489SS..THydrogen-bonded Turntrans-82-8.7171.772.3-20.2000113.2A170 R174 S175A170-D172 PolarHBondContact O-N 3.03Å; A170-D172 VanDerWaalsContact O-N 3.07Å; D172-R174 PolarHBondContact O-N 3.19Å; D172-R174 PolarHBondContact OD1-N 3.02Å; D172-S175 PolarHBondContact OD1-N 3.23Å; D172-S175 WeakPolarHBondContact OD2-CB 3.22Å; D172-S175 PolarHBondContact OD2-N 2.94Å; D172-S175 VanDerWaalsContact OD2-N 3.13Å; D172-S175 PolarHBondContact OD2-OG 3.18Å
173G90.1Very high86.7Confident32 Ų3289 Ų8933%0.3351%0.513SS..SBendtrans69.811.7-176.500000114.9C161 A170 G171C161-G173 WeakPolarHBondContact CB-O 3.28Å; C161-G173 PolarHBondContact SG-O 3.15Å; A170-G173 PolarHBondContact O-N 2.8Å; G171-G173 VanDerWaalsContact C-N 3.31Å
174R92.1Very high84.5Confident127 Ų12794.1 Ų94.148%0.47955%0.545SS..SBendtrans-137.4-35.8-172.6-65.2-179-178.7163.28.9114.8P147 A149 Y159 D172P147-R174 WeakPolarHBondContact O-CD 3.28Å; A149-R174 WeakPolarHBondContact CB-O 3.35Å; A149-R174 PolarHBondContact N-O 3.4Å; Y159-R174 PolarHBondContact OH-NE 2.99Å; Y159-R174 PolarHBondContact OH-NH2 2.99Å; D172-R174 PolarHBondContact O-N 3.19Å; D172-R174 PolarHBondContact OD1-N 3.02Å
175S93.8Very high82.3Confident53 Ų5391.8 Ų91.837%0.37155%0.554SS.*  trans-87.8151-179-60.90000111.3A170 D172A170-S175 WeakPolarHBondContact CB-O 3.39Å; A170-S175 PolarHBondContact N-O 2.88Å; D172-S175 PolarHBondContact OD1-N 3.23Å; D172-S175 WeakPolarHBondContact OD2-CB 3.22Å; D172-S175 PolarHBondContact OD2-N 2.94Å; D172-S175 VanDerWaalsContact OD2-N 3.13Å; D172-S175 PolarHBondContact OD2-OG 3.18Å
176C94.1Very high80.3Confident25 Ų2590.5 Ų90.517%0.16955%0.554CS.*EExtended strand (participates in β ladder)trans-113.6121.2179.1-66.70000110.5Q150 C163 F167 T168Q150-C176 HydrophobicContact CG-CB 4.06Å; C163-C176 VanDerWaalsContact CA-SG 3.51Å; C163-C176 HydrophobicContact CB-CB 3.81Å; C163-C176 WeakPolarHBondContact CB-SG 3.35Å; C163-C176 VanDerWaalsContact SG-CA 3.52Å; C163-C176 WeakPolarHBondContact SG-CB 3.29Å; C163-C176 CovalentContact SG-SG 2.04Å; C163-C176 PolarHBondContact SG-SG 2.93Å; F167-C176 HydrophobicContact CB-CB 4.2Å; F167-C176 HydrophobicContact CD1-CB 4.02Å; F167-C176 HydrophobicContact CG-CB 4.42Å; T168-C176 WeakPolarHBondContact O-CA 3.42Å
177R92.6Very high77.9Confident152 Ų15293.8 Ų93.857%0.57457%0.57SS**EExtended strand (participates in β ladder)trans-108.1146.5175.863.7179.9178.4-178.8-3.7110F167 T168F167-R177 CarbonylContact C-O 3.5Å; F167-R177 WeakPolarHBondContact CA-O 3.08Å; F167-R177 WeakPolarHBondContact CB-O 3.46Å; T168-R177 PolarHBondContact N-O 3.06Å; T168-R177 PolarHBondContact O-N 2.83Å; T168-R177 WeakPolarHBondContact OG1-CG 3.27Å; T168-R177 PolarHBondContact OG1-NE 3.4Å
178Q90.9Very high76Confident145 Ų14596.6 Ų96.668%0.67860%0.595SS**EExtended strand (participates in β ladder)trans-68149176.1-70.3-179-51.400111.6G166 F167G166-Q178 WeakPolarHBondContact O-CA 3.22Å; F167-Q178 HydrophobicContact CD1-CG 3.76Å; F167-Q178 HydrophobicContact CE1-CG 3.42Å; F167-Q178 VanDerWaalsContact CE1-CG 3.42Å; F167-Q178 HydrophobicContact CE2-CG 4.3Å; F167-Q178 HydrophobicContact CG-CG 4.34Å; F167-Q178 HydrophobicContact CZ-CG 3.72Å
179L82.6Confident73.5Confident99 Ų99101.4 Ų101.452%0.51862%0.624SS.*PPolyproline II helixtrans-81.5129.6178.5-94.9165.3000112G166 T168G166-L179 PolarHBondContact O-N 3.28Å; T168-L179 HydrophobicContact CG2-CD1 4.05Å; T168-L179 HydrophobicContact CG2-CD2 3.54Å; T168-L179 HydrophobicContact CG2-CG 3.71Å
180P75.8Confident71.6Confident97 Ų97104 Ų10463%0.6365%0.645SS**PPolyproline II helixtrans-76158.9158.733.5-33.7000111
181P68Low69.3Low121 Ų121109.8 Ų109.879%0.78668%0.678SS**PPolyproline II helixtrans-69.1150.6177.928.1-34.7000113.3
182P57.8Low67.4Low127 Ų127114.9 Ų114.983%0.82568%0.678SS**PPolyproline II helixtrans-95.3142.2-164.735.2-36.4000116.9
183P63.5Low65.1Low116 Ų116114.7 Ų114.775%0.75370%0.695SS**  trans-115.5167.516338.3-28.8000114.4
184P49.2Very low63.1Low134 Ų134119.4 Ų119.487%0.8772%0.723SS**  trans-95.1168.7-169.236.8-37.4000117.6
185S46.9Very low60.8Low115 Ų115125.7 Ų125.780%0.80475%0.747SS**  trans-159.9160.7-171.859.50000117.6
186P49.9Very low58.6Low135 Ų135128.1 Ų128.188%0.87777%0.77SS**  trans-137.6-175.2163.237.3-19.1000116.8
187S38.2Very low56.4Low118 Ų118131.8 Ų131.883%0.82580%0.802SS**  trans-145.1172.6-158.257.70000119.6
188P54.3Low54Low126 Ų126132 Ų13282%0.81882%0.82SS**  trans-125.9-169.9-172.443.4-28.8000119.3
189T39.5Very low51.6Low143 Ų143128.8 Ų128.888%0.87783%0.826SS**  trans-146.2160.4-161.5-20.50000118
190P52.9Low49.8Very low121 Ų121127.7 Ų127.779%0.78684%0.838SS**  trans-132.7-169.3-17942.4-25.5000120
191T42.8Very low48.1Very low147 Ų147132.7 Ų132.790%0.90285%0.853SS**  trans-139.9-163.6-162.1-12.70000119.8
192Q49.6Very low46.9Very low197 Ų197130.8 Ų130.892%0.92185%0.847SS**  trans-106.8176.9-152.7-61174.2-19.300121.8
193G42.2Very low46Very low78 Ų78132.2 Ų132.280%0.80485%0.848SS**  trans173.9158.6159.800000120.1
194S49.6Very low44.9Very low132 Ų132131.3 Ų131.392%0.92385%0.85SS**  trans-163.3176.5-178.4640000118.9
195R41.8Very low44.3Very low259 Ų259129.1 Ų129.198%0.97785%0.852SS**  trans-164-178.1-178-119.1176.7-179.3-176.9-0.3119.4
196A48.3Very low43.9Very low104 Ų104128 Ų12886%0.8686%0.858SS**  trans-158.5-178.5-165.800000121.1
197A47.4Very low43.2Very low101 Ų101125.4 Ų125.484%0.83586%0.856SS**  trans113.5165.7153.200000125.1
198V43.5Very low42.8Very low156 Ų156128.7 Ų128.795%0.94586%0.864SS**  trans129.7156.9151.2175.80000123.4
199G40.9Very low42.2Very low79 Ų79125.6 Ų125.681%0.81486%0.855SS**  trans-175.5176.817000000113.8
200G43.6Very low42.1Very low75 Ų75127.3 Ų127.377%0.77386%0.858SS**  cis-179.4172.3-2.400000114.7
201H41Very low41.5Very low203 Ų203128 Ų12894%0.9486%0.859SS**  trans-165-177.8-177.2-121.2-97.2000114.6
202A41.6Very low41.6Very low80 Ų80130.1 Ų130.166%0.66186%0.859SS**  cis-160.8-159.20.900000110.4
203D38.9Very low41.4Very low157 Ų157127.7 Ų127.784%0.8485%0.852SS**  cis-172.2-169.6-6.7-128-48.4000110.1
204A41.1Very low41.7Very low97 Ų97126.7 Ų126.780%0.80283%0.831SS**  cis-172.3169-8.600000114.8
205G37Very low41.9Very low89 Ų89127.4 Ų127.492%0.91883%0.829SS**  trans136.3167.516400000119.5
206G37Very low42.8Very low90 Ų90121.3 Ų121.393%0.92881%0.812SS**  cis171.3156.6-14.200000116.7
207G35.4Very low43.2Very low81 Ų81122.6 Ų122.684%0.83580%0.8SS**  trans167167.6173.300000122.2
208L31.5Very low43.3Very low187 Ų187123.5 Ų123.598%0.97980%0.795SS**  trans-170.6-179.6177.4-116.7174.1000120.1
209G41.3Very low44.1Very low61 Ų61122.3 Ų122.363%0.62978%0.779SS**  trans-171.5179.5178.900000119.9
210L37.1Very low45.1Very low180 Ų180120.2 Ų120.294%0.94275%0.752SS**  trans-157.9-168.3-179.3-141.278000120.2
211V39.3Very low45.6Very low135 Ų135119.3 Ų119.382%0.81873%0.729SS**  trans-142.5177-150.4-175.60000116.8
212E46.6Very low46.6Very low191 Ų191117.2 Ų117.289%0.89371%0.713SS**  trans-88-178.8-169.9-55.6179112.800119.5
213N43.6Very low48Very low146 Ų146117.1 Ų117.178%0.78170%0.701SS**  trans-168.7139.6-174.8160.4108000109.8
214V48.6Very low49.7Very low58 Ų58115.6 Ų115.635%0.35268%0.684SS.*  cis-172.7151.8-2.566.50000111.1E216 E217V214-E216 HydrophobicContact CG2-CB 3.68Å; V214-E216 HydrophobicContact CG2-CG 3.81Å; V214-E217 HydrophobicContact CG1-CG 4.19Å; V214-E217 HydrophobicContact CG2-CG 4.45Å
215T54.8Low51.1Low146 Ų146112 Ų11290%0.89665%0.652SS**SBendtrans-126.14.1155.449.30000112.7E217T215-E217 VanDerWaalsContact C-N 3.31Å; T215-E217 PolarHBondContact O-N 2.82Å
216E59.7Low52.7Low131 Ų131112 Ų11261%0.61263%0.628SS**  trans-73.9-17.1-167.9-52.4-179.9133.500113.5V214 V218 Q219 S220V214-E216 HydrophobicContact CG2-CB 3.68Å; V214-E216 HydrophobicContact CG2-CG 3.81Å; E216-V218 VanDerWaalsContact C-N 3.34Å; E216-V218 PolarHBondContact O-N 3.2Å; E216-Q219 CarbonylContact O-C 3.55Å; E216-Q219 PolarHBondContact O-N 2.88Å; E216-S220 WeakPolarHBondContact O-CB 3.49Å; E216-S220 PolarHBondContact O-N 2.7Å
217E56.8Low54.4Low132 Ų132112.6 Ų112.662%0.61761%0.609SS**Hα-helixtrans-47.4-41.3-157-65.8-163.5149.200116.7V214 T215 S220 L221V214-E217 HydrophobicContact CG1-CG 4.19Å; V214-E217 HydrophobicContact CG2-CG 4.45Å; T215-E217 VanDerWaalsContact C-N 3.31Å; T215-E217 PolarHBondContact O-N 2.82Å; E217-S220 CarbonylContact O-C 3.58Å; E217-S220 WeakPolarHBondContact O-CB 3.43Å; E217-L221 WeakPolarHBondContact O-CB 3.29Å; E217-L221 VanDerWaalsContact O-CG 3.28Å; E217-L221 WeakPolarHBondContact O-CG 3.19Å; E217-L221 PolarHBondContact O-N 2.88Å
218V51Low56Low120 Ų120109.9 Ų109.973%0.72758%0.575SS**Hα-helixtrans-78.4-43-179.2-178.70000111.8E216 S220 L221 R222E216-V218 VanDerWaalsContact C-N 3.34Å; E216-V218 PolarHBondContact O-N 3.2Å; V218-S220 PolarHBondContact O-N 3.01Å; V218-L221 PolarHBondContact O-N 2.76Å; V218-R222 PolarHBondContact O-N 2.92Å
219Q59.5Low57.8Low130 Ų130103.9 Ų103.961%0.60754%0.542SS*.Hα-helixtrans-62.3-39.9171.2-161.874.39.200109.9E216 R222 N223E216-Q219 CarbonylContact O-C 3.55Å; E216-Q219 PolarHBondContact O-N 2.88Å; Q219-R222 PolarHBondContact O-N 2.91Å; Q219-N223 VanDerWaalsContact O-CB 3.22Å; Q219-N223 WeakPolarHBondContact O-CB 3.5Å; Q219-N223 PolarHBondContact O-N 2.99Å; Q219-N223 PolarHBondContact O-ND2 2.89Å; Q219-N223 PolarHBondContact O-OD1 3.41Å
220S62.6Low59.1Low35 Ų35107 Ų10725%0.24554%0.539CS..Hα-helixtrans-61.8-40.4173.7-1790000111.3E216 E217 V218 N223 R224E216-S220 WeakPolarHBondContact O-CB 3.49Å; E216-S220 PolarHBondContact O-N 2.7Å; E217-S220 CarbonylContact O-C 3.58Å; E217-S220 WeakPolarHBondContact O-CB 3.43Å; V218-S220 PolarHBondContact O-N 3.01Å; S220-N223 CarbonylContact O-C 3.52Å; S220-N223 PolarHBondContact O-N 2.98Å; S220-R224 WeakPolarHBondContact O-CA 3.47Å; S220-R224 WeakPolarHBondContact O-CB 3.3Å; S220-R224 VanDerWaalsContact O-CD 3.24Å; S220-R224 WeakPolarHBondContact O-CD 3.5Å; S220-R224 WeakPolarHBondContact O-CG 3.34Å; S220-R224 PolarHBondContact O-N 3.38Å; S220-R224 WeakPolarHBondContact OG-CD 3.13Å
221L53.8Low60.7Low57 Ų57103 Ų10330%0.29851%0.514SS..Hα-helixtrans-63.9-41.8175.4-81.1166000112.3E217 V218 R224 V225 L278E217-L221 WeakPolarHBondContact O-CB 3.29Å; E217-L221 VanDerWaalsContact O-CG 3.28Å; E217-L221 WeakPolarHBondContact O-CG 3.19Å; E217-L221 PolarHBondContact O-N 2.88Å; V218-L221 PolarHBondContact O-N 2.76Å; L221-R224 WeakPolarHBondContact O-CB 3.49Å; L221-R224 PolarHBondContact O-N 3.27Å; L221-V225 PolarHBondContact O-N 2.77Å; L221-V225 VanDerWaalsContact O-N 3.09Å; L221-L278 HydrophobicContact CD2-CD2 3.94Å
222R62.5Low61.9Low159 Ų15996.8 Ų96.860%0.648%0.476SS*.Hα-helixtrans-66.8-51.3173-178178.4179.3144.66.4111.8V218 Q219 R224 V225 E226V218-R222 PolarHBondContact O-N 2.92Å; Q219-R222 PolarHBondContact O-N 2.91Å; R222-R224 PolarHBondContact O-N 3.01Å; R222-R224 VanDerWaalsContact O-N 3.12Å; R222-V225 PolarHBondContact O-N 3.1Å; R222-E226 IonicContact CZ-OE1 3.03Å; R222-E226 IonicContact NE-OE1 3.86Å; R222-E226 PolarHBondContact NE-OE1 2.68Å; R222-E226 IonicContact NH2-OE1 2.7Å; R222-E226 PolarHBondContact O-N 3.25Å; R222-E226 VanDerWaalsContact O-N 3.07Å
223N70Confident62.8Low77 Ų7794.1 Ų94.141%0.41246%0.463SS..Hα-helixtrans-57.7-25.9174.4-66-3.9000111.4Q219 S220 L227Q219-N223 VanDerWaalsContact O-CB 3.22Å; Q219-N223 WeakPolarHBondContact O-CB 3.5Å; Q219-N223 PolarHBondContact O-N 2.99Å; Q219-N223 PolarHBondContact O-ND2 2.89Å; Q219-N223 PolarHBondContact O-OD1 3.41Å; S220-N223 CarbonylContact O-C 3.52Å; S220-N223 PolarHBondContact O-N 2.98Å; N223-L227 WeakPolarHBondContact O-CA 3.35Å; N223-L227 WeakPolarHBondContact O-CB 3.34Å; N223-L227 PolarHBondContact O-N 2.88Å
224R75.3Confident63.7Low126 Ų12692.4 Ų92.448%0.47545%0.454SS..Hα-helixtrans-77.9-32.3174.8-81.5160.663.9174.92.8112.2S220 L221 R222 L228S220-R224 WeakPolarHBondContact O-CA 3.47Å; S220-R224 WeakPolarHBondContact O-CB 3.3Å; S220-R224 VanDerWaalsContact O-CD 3.24Å; S220-R224 WeakPolarHBondContact O-CD 3.5Å; S220-R224 WeakPolarHBondContact O-CG 3.34Å; S220-R224 PolarHBondContact O-N 3.38Å; S220-R224 WeakPolarHBondContact OG-CD 3.13Å; L221-R224 WeakPolarHBondContact O-CB 3.49Å; L221-R224 PolarHBondContact O-N 3.27Å; R222-R224 PolarHBondContact O-N 3.01Å; R222-R224 VanDerWaalsContact O-N 3.12Å; R224-L228 WeakPolarHBondContact O-CB 3.4Å; R224-L228 VanDerWaalsContact O-CD1 3.31Å; R224-L228 WeakPolarHBondContact O-CD1 3.23Å; R224-L228 WeakPolarHBondContact O-CG 3.3Å; R224-L228 PolarHBondContact O-N 2.87Å
225V69.7Low64.3Low20 Ų2090.1 Ų90.112%0.12144%0.44CS..Hα-helixtrans-63.3-55.8167.2177.90000108.6L221 R222 L227 L228 E229 L278L221-V225 PolarHBondContact O-N 2.77Å; L221-V225 VanDerWaalsContact O-N 3.09Å; R222-V225 PolarHBondContact O-N 3.1Å; V225-L227 VanDerWaalsContact C-N 3.25Å; V225-L227 PolarHBondContact O-N 3.33Å; V225-L228 PolarHBondContact O-N 2.96Å; V225-E229 WeakPolarHBondContact O-CG 3.22Å; V225-E229 PolarHBondContact O-N 2.86Å; V225-L278 HydrophobicContact CG2-CB 3.74Å; V225-L278 HydrophobicContact CG2-CD1 3.75Å; V225-L278 HydrophobicContact CG2-CG 4.34Å
226E71.6Confident64.2Low91 Ų9183.9 Ų83.943%0.42540%0.401SS..Hα-helixtrans-60.1-34-179.3-62.4174.9-158.500111.9R222 K230R222-E226 IonicContact CZ-OE1 3.03Å; R222-E226 IonicContact NE-OE1 3.86Å; R222-E226 PolarHBondContact NE-OE1 2.68Å; R222-E226 IonicContact NH2-OE1 2.7Å; R222-E226 PolarHBondContact O-N 3.25Å; R222-E226 VanDerWaalsContact O-N 3.07Å; E226-K230 WeakPolarHBondContact O-CB 3.37Å; E226-K230 PolarHBondContact O-N 2.94Å
227L71.4Confident63.7Low102 Ų10279.3 Ų79.353%0.53439%0.386SS..Hα-helixtrans-77.3-32.5173.1179.564.5000113.1N223 V225 K231N223-L227 WeakPolarHBondContact O-CA 3.35Å; N223-L227 WeakPolarHBondContact O-CB 3.34Å; N223-L227 PolarHBondContact O-N 2.88Å; V225-L227 VanDerWaalsContact C-N 3.25Å; V225-L227 PolarHBondContact O-N 3.33Å; L227-K231 WeakPolarHBondContact O-CA 3.49Å; L227-K231 WeakPolarHBondContact O-CB 3.45Å; L227-K231 PolarHBondContact O-N 2.89Å
228L69.9Low63.1Low23 Ų2375.8 Ų75.812%0.1237%0.374CS..Hα-helixtrans-71.3-37.7174.4-76.1165.6000110.4R224 V225 K231 L232 L271 I275 L278R224-L228 WeakPolarHBondContact O-CB 3.4Å; R224-L228 VanDerWaalsContact O-CD1 3.31Å; R224-L228 WeakPolarHBondContact O-CD1 3.23Å; R224-L228 WeakPolarHBondContact O-CG 3.3Å; R224-L228 PolarHBondContact O-N 2.87Å; V225-L228 PolarHBondContact O-N 2.96Å; L228-K231 HydrophobicContact CD2-CD 4.4Å; L228-K231 PolarHBondContact O-N 2.77Å; L228-L232 VanDerWaalsContact O-CB 3.27Å; L228-L232 WeakPolarHBondContact O-CB 3.11Å; L228-L232 PolarHBondContact O-N 3.09Å; L228-L271 HydrophobicContact CD2-CD2 3.52Å; L228-I275 HydrophobicContact CB-CD1 4.47Å; L228-I275 HydrophobicContact CB-CG1 4.16Å; L228-L278 HydrophobicContact CD1-CD1 4.01Å
229E69.7Low62.8Low61 Ų6177.8 Ų77.829%0.28537%0.373SS..Hα-helixtrans-63.4-47.9169.1-68178.3130.100111.3V225 K231 L232 Q233 I275V225-E229 WeakPolarHBondContact O-CG 3.22Å; V225-E229 PolarHBondContact O-N 2.86Å; E229-K231 VanDerWaalsContact C-N 3.29Å; E229-K231 PolarHBondContact O-N 3.27Å; E229-L232 WeakPolarHBondContact O-CB 3.26Å; E229-L232 PolarHBondContact O-N 3.21Å; E229-Q233 WeakPolarHBondContact O-CG 3.25Å; E229-Q233 PolarHBondContact O-N 2.93Å; E229-I275 HydrophobicContact CG-CD1 4.04Å
230K68.6Low62Low128 Ų12873.7 Ų73.756%0.55736%0.359SS*.Hα-helixtrans-64.9-32.4175.6-168.1172.4-173.7173.80112.5E226 Q233 L234E226-K230 WeakPolarHBondContact O-CB 3.37Å; E226-K230 PolarHBondContact O-N 2.94Å; K230-Q233 PolarHBondContact O-N 3.01Å; K230-L234 HydrophobicContact CG-CD1 4.45Å; K230-L234 WeakPolarHBondContact O-CB 3.48Å; K230-L234 VanDerWaalsContact O-CG 3.24Å; K230-L234 WeakPolarHBondContact O-CG 3.49Å; K230-L234 PolarHBondContact O-N 3.3Å
231K69.7Low60.9Low95 Ų9576.5 Ų76.541%0.41338%0.379SS..Hα-helixtrans-73.9-35.5174.5-177.9179.5-177.6-178.30111.5L227 L228 E229 L234 V235L227-K231 WeakPolarHBondContact O-CA 3.49Å; L227-K231 WeakPolarHBondContact O-CB 3.45Å; L227-K231 PolarHBondContact O-N 2.89Å; L228-K231 HydrophobicContact CD2-CD 4.4Å; L228-K231 PolarHBondContact O-N 2.77Å; E229-K231 VanDerWaalsContact C-N 3.29Å; E229-K231 PolarHBondContact O-N 3.27Å; K231-L234 CarbonylContact O-C 3.57Å; K231-L234 PolarHBondContact O-N 3.14Å; K231-V235 WeakPolarHBondContact O-CB 3.24Å; K231-V235 VanDerWaalsContact O-CG2 3.24Å; K231-V235 WeakPolarHBondContact O-CG2 3.43Å; K231-V235 PolarHBondContact O-N 3.09Å
232L65Low60.2Low4 Ų481.4 Ų81.42%0.02140%0.398CS..Hα-helixtrans-60.8-51.4168.7-178.462.1000109Y71 L228 E229 L234 V235 L236 I268 L271 I275Y71-L232 HydrophobicContact CD1-CD2 4.36Å; Y71-L232 HydrophobicContact CD2-CD2 3.69Å; Y71-L232 HydrophobicContact CE2-CD2 4.24Å; Y71-L232 HydrophobicContact CG-CD2 3.77Å; L228-L232 VanDerWaalsContact O-CB 3.27Å; L228-L232 WeakPolarHBondContact O-CB 3.11Å; L228-L232 PolarHBondContact O-N 3.09Å; E229-L232 WeakPolarHBondContact O-CB 3.26Å; E229-L232 PolarHBondContact O-N 3.21Å; L232-L234 PolarHBondContact O-N 3.48Å; L232-V235 PolarHBondContact O-N 2.85Å; L232-V235 VanDerWaalsContact O-N 3.09Å; L232-L236 HydrophobicContact CD1-CD1 3.91Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 WeakPolarHBondContact O-CB 3.25Å; L232-L236 VanDerWaalsContact O-CD1 3.25Å; L232-L236 WeakPolarHBondContact O-CD1 3.45Å; L232-L236 VanDerWaalsContact O-CG 3.22Å; L232-L236 WeakPolarHBondContact O-CG 3.47Å; L232-L236 PolarHBondContact O-N 2.83Å; L232-I268 HydrophobicContact CD1-CB 4.3Å; L232-I268 HydrophobicContact CD1-CG1 3.89Å; L232-I268 HydrophobicContact CD1-CG2 4.3Å; L232-L271 HydrophobicContact CB-CD1 4.18Å; L232-L271 HydrophobicContact CD1-CB 4.3Å; L232-L271 HydrophobicContact CD1-CD1 3.89Å; L232-I275 HydrophobicContact CD2-CD1 4.36Å
233Q65Low59Low135 Ų13581.9 Ų81.963%0.63141%0.405SS*.Hα-helixtrans-57.3-30.2173.1-69.5174.59.600113.8E229 K230 L236 A237E229-Q233 WeakPolarHBondContact O-CG 3.25Å; E229-Q233 PolarHBondContact O-N 2.93Å; K230-Q233 PolarHBondContact O-N 3.01Å; Q233-L236 CarbonylContact O-C 3.59Å; Q233-A237 PolarHBondContact O-N 3.37Å
234L62.8Low57.4Low110 Ų11082.7 Ų82.758%0.57641%0.414SS*.Hα-helixtrans-84.8-25.2175.4-73.8167.4000114.1K230 K231 L232 L236 A237K230-L234 HydrophobicContact CG-CD1 4.45Å; K230-L234 WeakPolarHBondContact O-CB 3.48Å; K230-L234 VanDerWaalsContact O-CG 3.24Å; K230-L234 WeakPolarHBondContact O-CG 3.49Å; K230-L234 PolarHBondContact O-N 3.3Å; K231-L234 CarbonylContact O-C 3.57Å; K231-L234 PolarHBondContact O-N 3.14Å; L232-L234 PolarHBondContact O-N 3.48Å; L234-L236 VanDerWaalsContact C-N 3.27Å; L234-A237 HydrophobicContact CD2-CB 4.48Å; L234-A237 WeakPolarHBondContact O-CB 3.34Å; L234-A237 PolarHBondContact O-N 2.9Å
235V60.7Low55.4Low10 Ų1084.1 Ų84.16%0.06143%0.431CS..Hα-helixtrans-73.6-25.1168.61660000111.3K231 L232 Q264 R267K231-V235 WeakPolarHBondContact O-CB 3.24Å; K231-V235 VanDerWaalsContact O-CG2 3.24Å; K231-V235 WeakPolarHBondContact O-CG2 3.43Å; K231-V235 PolarHBondContact O-N 3.09Å; L232-V235 PolarHBondContact O-N 2.85Å; L232-V235 VanDerWaalsContact O-N 3.09Å; V235-Q264 PolarHBondContact O-NE2 3.25Å; V235-R267 HydrophobicContact CG1-CG 4.37Å; V235-R267 VanDerWaalsContact CG2-CZ 3.4Å
236L53Low53.8Low15 Ų1588.4 Ų88.48%0.07946%0.459CS..SBendtrans-97.9-5.7174.2-63.7159.7000112.9A47 L73 L232 Q233 L234 I268A47-L236 HydrophobicContact CB-CD1 3.25Å; L73-L236 HydrophobicContact CD1-CD2 3.78Å; L232-L236 HydrophobicContact CD1-CD1 3.91Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 WeakPolarHBondContact O-CB 3.25Å; L232-L236 VanDerWaalsContact O-CD1 3.25Å; L232-L236 WeakPolarHBondContact O-CD1 3.45Å; L232-L236 VanDerWaalsContact O-CG 3.22Å; L232-L236 WeakPolarHBondContact O-CG 3.47Å; L232-L236 PolarHBondContact O-N 2.83Å; Q233-L236 CarbonylContact O-C 3.59Å; L234-L236 VanDerWaalsContact C-N 3.27Å; L236-I268 HydrophobicContact CD2-CD1 3.77Å; L236-I268 HydrophobicContact CD2-CG1 4.29Å
237A49.3Very low52.4Low36 Ų3693 Ų9330%0.29849%0.485SS..SBendtrans-61.1134.8171.700000107.1Q233 L234 F239Q233-A237 PolarHBondContact O-N 3.37Å; L234-A237 HydrophobicContact CD2-CB 4.48Å; L234-A237 WeakPolarHBondContact O-CB 3.34Å; L234-A237 PolarHBondContact O-N 2.9Å; A237-F239 PolarHBondContact O-N 2.89Å
238P45.1Very low50.7Low57 Ų5795.3 Ų95.337%0.3750%0.498SS..  trans-67.996.8-169.924.4-33.2000110.5E44 S240E44-P238 HydrophobicContact CG-CB 4.36Å; P238-S240 PolarHBondContact O-N 3.38Å; P238-S240 PolarHBondContact O-OG 3.46Å
239F43.2Very low49.6Very low162 Ų162100.2 Ų100.271%0.71152%0.524SS*.  trans-58.880.8147.4-68.9-79.4000106.8A237 S241A237-F239 PolarHBondContact O-N 2.89Å; F239-S241 PolarHBondContact O-N 3.35Å
240S42.8Very low48Very low45 Ų45101 Ų10132%0.31554%0.537SS..  trans-64109.4-179.911.70000106.4P238 F242P238-S240 PolarHBondContact O-N 3.38Å; P238-S240 PolarHBondContact O-OG 3.46Å; S240-F242 WeakPolarHBondContact O-CD2 3.49Å; S240-F242 PolarHBondContact O-N 2.92Å; S240-F242 VanDerWaalsContact OG-CE2 3.27Å; S240-F242 WeakPolarHBondContact OG-CE2 3.37Å
241S40.8Very low47Very low93 Ų93101.4 Ų101.465%0.6554%0.539SS*.  trans-63.986.8164.851.90000107.3F239 F243F239-S241 PolarHBondContact O-N 3.35Å; S241-F243 PolarHBondContact O-N 2.74Å
242F38.3Very low45.6Very low161 Ų161100.6 Ų100.671%0.70654%0.543SS*.  trans-70.759.8179-77.2-73.6000110.9S240S240-F242 WeakPolarHBondContact O-CD2 3.49Å; S240-F242 PolarHBondContact O-N 2.92Å; S240-F242 VanDerWaalsContact OG-CE2 3.27Å; S240-F242 WeakPolarHBondContact OG-CE2 3.37Å
243F36.8Very low44.6Very low168 Ų168106.7 Ų106.774%0.73757%0.572SS**  trans-135.995.7180-69-70.2000109.1S241 L245S241-F243 PolarHBondContact O-N 2.74Å; F243-L245 PolarHBondContact O-N 2.85Å
244P36.2Very low43.5Very low95 Ų95105 Ų10562%0.61756%0.562SS**  trans-64.3114.116227.9-31.5000107.6P246P244-P246 WeakPolarHBondContact O-CD 3.27Å
245L34.6Very low42.8Very low156 Ų156104.1 Ų104.182%0.81756%0.561SS**  trans-55.6117.5-176.2-72.3166.6000111.5F243F243-L245 PolarHBondContact O-N 2.85Å
246P35.4Very low42.2Very low109 Ų109107.7 Ų107.771%0.70858%0.583SS**  trans-69.1142.3155.5-7.526.1000108.3P244 D248P244-P246 WeakPolarHBondContact O-CD 3.27Å; P246-D248 VanDerWaalsContact C-N 3.35Å; P246-D248 PolarHBondContact O-N 3.5Å; P246-D248 VanDerWaalsContact O-N 3.12Å
247L41.3Very low42.1Very low187 Ų187111.8 Ų111.898%0.97961%0.605SS**  trans-78.586.8165-78.7163000108.8
248D37Very low42.2Very low151 Ų151114.9 Ų114.981%0.80762%0.616SS**  trans-146.2152.9160.7-146.7-15.3000111.6P246 S250P246-D248 VanDerWaalsContact C-N 3.35Å; P246-D248 PolarHBondContact O-N 3.5Å; P246-D248 VanDerWaalsContact O-N 3.12Å; D248-S250 PolarHBondContact O-N 3.23Å
249D45.2Very low42.6Very low126 Ų126114.8 Ų114.867%0.67462%0.616SS**  trans-94.296.8-157.7-159.411.8000113.2F251D249-F251 WeakPolarHBondContact OD1-CE2 3.42Å
250S37.7Very low43.2Very low79 Ų79111.6 Ų111.655%0.55260%0.604SS**  trans-139.8132.3176-165.10000111.5D248 P252D248-S250 PolarHBondContact O-N 3.23Å; S250-P252 WeakPolarHBondContact OG-CD 3.36Å
251F47.1Very low43.9Very low136 Ų136111.4 Ų111.460%0.59660%0.602SS**  trans-98.8-1.3-172.7-86.1-98.4000119D249 K254D249-F251 WeakPolarHBondContact OD1-CE2 3.42Å; F251-K254 HydrophobicContact CD1-CD 3.86Å; F251-K254 HydrophobicContact CE1-CD 3.98Å
252P39.6Very low44.7Very low78 Ų78113 Ų11351%0.50660%0.598SS.*Hα-helixtrans-76.6-23.8-17732.8-34.3000113.9S250 T255S250-P252 WeakPolarHBondContact OG-CD 3.36Å; P252-T255 PolarHBondContact O-OG1 3.34Å
253E44.1Very low45.9Very low132 Ų132114 Ų11462%0.61760%0.597SS**Hα-helixtrans-81.1-25.5-175.6-60.1-171.6157.600113.2T255 T256 L257E253-T255 VanDerWaalsContact C-N 3.3Å; E253-T255 PolarHBondContact O-N 3.27Å; E253-T256 PolarHBondContact O-N 3.39Å; E253-T256 PolarHBondContact O-OG1 2.91Å; E253-L257 WeakPolarHBondContact O-CB 3.24Å; E253-L257 WeakPolarHBondContact O-CG 3.47Å; E253-L257 PolarHBondContact O-N 3.26Å
254K42.9Very low47.1Very low98 Ų98107.4 Ų107.443%0.42657%0.568SS.*Hα-helixtrans-66.3-33.7178.5-66.4166.6-173.4159.50111.3F251 L258F251-K254 HydrophobicContact CD1-CD 3.86Å; F251-K254 HydrophobicContact CE1-CD 3.98Å; K254-L258 WeakPolarHBondContact O-CB 3.11Å; K254-L258 VanDerWaalsContact O-CG 3.26Å; K254-L258 WeakPolarHBondContact O-CG 3.46Å; K254-L258 PolarHBondContact O-N 3.18Å; K254-L258 VanDerWaalsContact O-N 3.08Å
255T46.7Very low48.3Very low92 Ų92105.7 Ų105.756%0.56455%0.553SS**Hα-helixtrans-79.5-33.4179.959.20000112.7P252 E253 S259P252-T255 PolarHBondContact O-OG1 3.34Å; E253-T255 VanDerWaalsContact C-N 3.3Å; E253-T255 PolarHBondContact O-N 3.27Å; T255-S259 WeakPolarHBondContact O-CB 3.36Å; T255-S259 PolarHBondContact O-N 2.92Å; T255-S259 PolarHBondContact O-OG 2.89Å
256T49.2Very low49.8Very low85 Ų85103.1 Ų103.152%0.52154%0.541SS..Hα-helixtrans-70.7-39.9172.556.60000111.5E253 S259 H260E253-T256 PolarHBondContact O-N 3.39Å; E253-T256 PolarHBondContact O-OG1 2.91Å; T256-S259 PolarHBondContact O-OG 2.89Å; T256-H260 VanDerWaalsContact O-CB 3.29Å; T256-H260 WeakPolarHBondContact O-CB 3.49Å; T256-H260 PolarHBondContact O-N 3.12Å
257L50.8Low51.5Low102 Ų102104 Ų10453%0.53453%0.53SS..Hα-helixtrans-62.9-45.2173.1-78.6168000112.9E253 H260 S261E253-L257 WeakPolarHBondContact O-CB 3.24Å; E253-L257 WeakPolarHBondContact O-CG 3.47Å; E253-L257 PolarHBondContact O-N 3.26Å; L257-H260 PolarHBondContact O-N 2.87Å; L257-S261 WeakPolarHBondContact O-CB 3.47Å; L257-S261 PolarHBondContact O-N 2.77Å; L257-S261 PolarHBondContact O-OG 2.95Å
258L51.7Low52.8Low101 Ų10195.2 Ų95.253%0.52948%0.484SS..Hα-helixtrans-63.6-48.3177-76.5169.6000111.5K254 H260 S261 F262K254-L258 WeakPolarHBondContact O-CB 3.11Å; K254-L258 VanDerWaalsContact O-CG 3.26Å; K254-L258 WeakPolarHBondContact O-CG 3.46Å; K254-L258 PolarHBondContact O-N 3.18Å; K254-L258 VanDerWaalsContact O-N 3.08Å; L258-H260 VanDerWaalsContact C-N 3.29Å; L258-H260 PolarHBondContact O-N 3.4Å; L258-S261 WeakPolarHBondContact O-CB 2.98Å; L258-S261 PolarHBondContact O-N 2.75Å; L258-S261 VanDerWaalsContact O-N 3.13Å; L258-F262 HydrophobicContact CB-CE2 4.29Å; L258-F262 HydrophobicContact CD2-CE2 4.46Å; L258-F262 WeakPolarHBondContact O-CD2 3.42Å; L258-F262 PolarHBondContact O-N 3.41Å
259S53Low54.3Low54 Ų5492.2 Ų92.238%0.37847%0.468SS..Hα-helixtrans-67.2-26.4178.256.70000113.5T255 T256 R263T255-S259 WeakPolarHBondContact O-CB 3.36Å; T255-S259 PolarHBondContact O-N 2.92Å; T255-S259 PolarHBondContact O-OG 2.89Å; T256-S259 PolarHBondContact O-OG 2.89Å; S259-R263 WeakPolarHBondContact O-CB 3.39Å; S259-R263 WeakPolarHBondContact O-CD 3.36Å; S259-R263 WeakPolarHBondContact O-CG 3.36Å; S259-R263 PolarHBondContact O-N 2.83Å
260H55.7Low55.7Low95 Ų9588.5 Ų88.544%0.4445%0.452SS..Hα-helixtrans-69.4-45167.8-169.5-84.9000111.9T256 L257 L258 R263 Q264T256-H260 VanDerWaalsContact O-CB 3.29Å; T256-H260 WeakPolarHBondContact O-CB 3.49Å; T256-H260 PolarHBondContact O-N 3.12Å; L257-H260 PolarHBondContact O-N 2.87Å; L258-H260 VanDerWaalsContact C-N 3.29Å; L258-H260 PolarHBondContact O-N 3.4Å; H260-R263 PolarHBondContact O-N 3.43Å; H260-Q264 VanDerWaalsContact CE1-CD 3.42Å; H260-Q264 PolarHBondContact CE1-OE1 2.85Å; H260-Q264 VanDerWaalsContact CE1-OE1 3.23Å; H260-Q264 PolarHBondContact ND1-OE1 3.44Å; H260-Q264 WeakPolarHBondContact O-CG 3.21Å; H260-Q264 PolarHBondContact O-N 2.84Å
261S58Low57.2Low41 Ų4185.1 Ų85.129%0.28743%0.428SS..Hα-helixtrans-62-44.2178.8-59.20000112.1L257 L258 Q264 L265L257-S261 WeakPolarHBondContact O-CB 3.47Å; L257-S261 PolarHBondContact O-N 2.77Å; L257-S261 PolarHBondContact O-OG 2.95Å; L258-S261 WeakPolarHBondContact O-CB 2.98Å; L258-S261 PolarHBondContact O-N 2.75Å; L258-S261 VanDerWaalsContact O-N 3.13Å; S261-Q264 PolarHBondContact O-N 2.87Å; S261-L265 PolarHBondContact O-N 2.9Å
262F58.1Low58.4Low126 Ų12679.1 Ų79.155%0.55340%0.403SS*.Hα-helixtrans-62-46.3173.8-70.7-60.1000111.6L258 Q264 L265 D266L258-F262 HydrophobicContact CB-CE2 4.29Å; L258-F262 HydrophobicContact CD2-CE2 4.46Å; L258-F262 WeakPolarHBondContact O-CD2 3.42Å; L258-F262 PolarHBondContact O-N 3.41Å; F262-Q264 PolarHBondContact O-N 2.6Å; F262-L265 HydrophobicContact CD1-CD1 4.34Å; F262-L265 WeakPolarHBondContact O-CA 3.44Å; F262-L265 WeakPolarHBondContact O-CB 3.45Å; F262-L265 PolarHBondContact O-N 2.97Å; F262-D266 PolarHBondContact O-N 3.27Å
263R62.2Low60.1Low183 Ų18381.7 Ų81.769%0.69141%0.408SS*.Hα-helixtrans-61.8-24.2174.5-75.6172.3174.7179.6-0.6114.3S259 H260 R267S259-R263 WeakPolarHBondContact O-CB 3.39Å; S259-R263 WeakPolarHBondContact O-CD 3.36Å; S259-R263 WeakPolarHBondContact O-CG 3.36Å; S259-R263 PolarHBondContact O-N 2.83Å; H260-R263 PolarHBondContact O-N 3.43Å; R263-R267 VanDerWaalsContact O-CB 3.23Å; R263-R267 WeakPolarHBondContact O-CB 3.43Å
264Q61.8Low61.4Low30 Ų3079.7 Ų79.714%0.1440%0.398CS..Hα-helixtrans-76.1-41.7170.7-74.7-179-75.300111.2V235 H260 S261 F262 R267 I268V235-Q264 PolarHBondContact O-NE2 3.25Å; H260-Q264 VanDerWaalsContact CE1-CD 3.42Å; H260-Q264 PolarHBondContact CE1-OE1 2.85Å; H260-Q264 VanDerWaalsContact CE1-OE1 3.23Å; H260-Q264 PolarHBondContact ND1-OE1 3.44Å; H260-Q264 WeakPolarHBondContact O-CG 3.21Å; H260-Q264 PolarHBondContact O-N 2.84Å; S261-Q264 PolarHBondContact O-N 2.87Å; F262-Q264 PolarHBondContact O-N 2.6Å; Q264-R267 PolarHBondContact O-N 3Å; Q264-I268 VanDerWaalsContact O-CD1 3.3Å; Q264-I268 WeakPolarHBondContact O-CD1 3.42Å; Q264-I268 WeakPolarHBondContact O-CG1 3.31Å; Q264-I268 PolarHBondContact O-N 3.21Å
265L63.2Low62.7Low58 Ų5875 Ų7530%0.30438%0.378SS..Hα-helixtrans-61-55.1174.4-71.5166.5000112L73 S261 F262 R267 I268 D269L73-L265 HydrophobicContact CB-CD2 3.61Å; L73-L265 HydrophobicContact CD2-CD2 3.67Å; L73-L265 HydrophobicContact CD2-CG 4.02Å; L73-L265 HydrophobicContact CG-CD2 4.31Å; S261-L265 PolarHBondContact O-N 2.9Å; F262-L265 HydrophobicContact CD1-CD1 4.34Å; F262-L265 WeakPolarHBondContact O-CA 3.44Å; F262-L265 WeakPolarHBondContact O-CB 3.45Å; F262-L265 PolarHBondContact O-N 2.97Å; L265-R267 PolarHBondContact O-N 2.78Å; L265-I268 WeakPolarHBondContact O-CA 3.46Å; L265-I268 PolarHBondContact O-N 3.21Å; L265-D269 PolarHBondContact O-N 2.77Å
266D64.8Low63.7Low103 Ų10370.8 Ų70.855%0.55135%0.352SS*.Hα-helixtrans-50.9-36.4178.4-57.2-33.2000111.9F262 S270F262-D266 PolarHBondContact O-N 3.27Å; D266-S270 VanDerWaalsContact O-CB 3.3Å; D266-S270 WeakPolarHBondContact O-CB 3.36Å; D266-S270 PolarHBondContact O-N 3.07Å; D266-S270 VanDerWaalsContact O-N 3.1Å
267R70.7Confident64.7Low127 Ų12772 Ų7248%0.47935%0.351SS..Hα-helixtrans-80.5-30.7-179.1-169.2173.4-171.9-172.63.8113.3V235 R263 Q264 L265 L271V235-R267 HydrophobicContact CG1-CG 4.37Å; V235-R267 VanDerWaalsContact CG2-CZ 3.4Å; R263-R267 VanDerWaalsContact O-CB 3.23Å; R263-R267 WeakPolarHBondContact O-CB 3.43Å; Q264-R267 PolarHBondContact O-N 3Å; L265-R267 PolarHBondContact O-N 2.78Å; R267-L271 HydrophobicContact CG-CD1 4.25Å; R267-L271 VanDerWaalsContact O-CB 3.26Å; R267-L271 WeakPolarHBondContact O-CB 3.48Å; R267-L271 WeakPolarHBondContact O-CD1 3.01Å; R267-L271 WeakPolarHBondContact O-CG 3.38Å; R267-L271 PolarHBondContact O-N 3.45Å; R267-L271 VanDerWaalsContact O-N 3.14Å
268I68.8Low65.4Low2 Ų268.2 Ų68.21%0.0133%0.331CS..Hα-helixtrans-70.4-47.6172.2-69.1156.9000109.3Y71 L73 L232 L236 Q264 L265 L271 S272Y71-I268 WeakPolarHBondContact O-CG2 2.93Å; L73-I268 HydrophobicContact CB-CD1 4.08Å; L73-I268 HydrophobicContact CD1-CD1 3.84Å; L73-I268 HydrophobicContact CD2-CD1 4.48Å; L73-I268 HydrophobicContact CG-CD1 4.36Å; L232-I268 HydrophobicContact CD1-CB 4.3Å; L232-I268 HydrophobicContact CD1-CG1 3.89Å; L232-I268 HydrophobicContact CD1-CG2 4.3Å; L236-I268 HydrophobicContact CD2-CD1 3.77Å; L236-I268 HydrophobicContact CD2-CG1 4.29Å; Q264-I268 VanDerWaalsContact O-CD1 3.3Å; Q264-I268 WeakPolarHBondContact O-CD1 3.42Å; Q264-I268 WeakPolarHBondContact O-CG1 3.31Å; Q264-I268 PolarHBondContact O-N 3.21Å; L265-I268 WeakPolarHBondContact O-CA 3.46Å; L265-I268 PolarHBondContact O-N 3.21Å; I268-L271 PolarHBondContact O-N 2.97Å; I268-S272 WeakPolarHBondContact O-CB 3.48Å; I268-S272 PolarHBondContact O-N 3.09Å
269D69.8Low66.1Low88 Ų8865.8 Ų65.847%0.47132%0.317SS..Hα-helixtrans-60-52.6179.7-72.5-37000110.4L265 L271 S272 E273L265-D269 PolarHBondContact O-N 2.77Å; D269-L271 VanDerWaalsContact C-N 3.32Å; D269-L271 PolarHBondContact O-N 3.2Å; D269-S272 WeakPolarHBondContact O-CA 2.99Å; D269-S272 WeakPolarHBondContact O-CB 3.31Å; D269-S272 PolarHBondContact O-N 2.84Å; D269-S272 PolarHBondContact O-OG 3.4Å; D269-E273 PolarHBondContact O-N 2.05Å
270S74.5Confident66.7Low48 Ų4867.3 Ų67.334%0.33632%0.318SS..Hα-helixtrans-61.7-33.6177.6-171.20000113.8D266 Q274D266-S270 VanDerWaalsContact O-CB 3.3Å; D266-S270 WeakPolarHBondContact O-CB 3.36Å; D266-S270 PolarHBondContact O-N 3.07Å; D266-S270 VanDerWaalsContact O-N 3.1Å; S270-Q274 VanDerWaalsContact O-CG 3.25Å; S270-Q274 WeakPolarHBondContact O-CG 3.03Å; S270-Q274 PolarHBondContact O-N 3.28Å; S270-Q274 VanDerWaalsContact O-N 3.09Å; S270-Q274 PolarHBondContact OG-NE2 3.44Å
271L68.9Low67.2Low9 Ų971.1 Ų71.15%0.04733%0.328CS..Hα-helixtrans-70.6-36.7172.6-76.5171.6000111.9L228 L232 R267 I268 D269 Q274 I275L228-L271 HydrophobicContact CD2-CD2 3.52Å; L232-L271 HydrophobicContact CB-CD1 4.18Å; L232-L271 HydrophobicContact CD1-CB 4.3Å; L232-L271 HydrophobicContact CD1-CD1 3.89Å; R267-L271 HydrophobicContact CG-CD1 4.25Å; R267-L271 VanDerWaalsContact O-CB 3.26Å; R267-L271 WeakPolarHBondContact O-CB 3.48Å; R267-L271 WeakPolarHBondContact O-CD1 3.01Å; R267-L271 WeakPolarHBondContact O-CG 3.38Å; R267-L271 PolarHBondContact O-N 3.45Å; R267-L271 VanDerWaalsContact O-N 3.14Å; I268-L271 PolarHBondContact O-N 2.97Å; D269-L271 VanDerWaalsContact C-N 3.32Å; D269-L271 PolarHBondContact O-N 3.2Å; L271-Q274 PolarHBondContact O-N 3.02Å; L271-I275 WeakPolarHBondContact O-CB 3.05Å; L271-I275 WeakPolarHBondContact O-CG1 3.4Å; L271-I275 PolarHBondContact O-N 3.11Å
272S71.3Confident67.4Low10 Ų1075.3 Ų75.37%0.0735%0.347CS..Hα-helixtrans-68.7-33.6176.683.30000112.5I268 D269 G276I268-S272 WeakPolarHBondContact O-CB 3.48Å; I268-S272 PolarHBondContact O-N 3.09Å; D269-S272 WeakPolarHBondContact O-CA 2.99Å; D269-S272 WeakPolarHBondContact O-CB 3.31Å; D269-S272 PolarHBondContact O-N 2.84Å; D269-S272 PolarHBondContact O-OG 3.4Å; S272-G276 PolarHBondContact O-N 3.29Å
273E76.1Confident67.5Low132 Ų13271.2 Ų71.262%0.61734%0.34SS*.Hα-helixtrans-66-46170.5-69.9-178.415300111.3D269 G276 F277D269-E273 PolarHBondContact O-N 2.05Å; E273-G276 CarbonylContact O-C 3.5Å; E273-G276 PolarHBondContact O-N 3.26Å; E273-F277 WeakPolarHBondContact O-CB 3.14Å; E273-F277 PolarHBondContact O-N 2.04Å
274Q72.4Confident67.4Low89 Ų8966.6 Ų66.642%0.41633%0.332SS..Hα-helixtrans-64.3-45.7178.9-74.2171.136.400112.8S270 L271 G276 F277 L278S270-Q274 VanDerWaalsContact O-CG 3.25Å; S270-Q274 WeakPolarHBondContact O-CG 3.03Å; S270-Q274 PolarHBondContact O-N 3.28Å; S270-Q274 VanDerWaalsContact O-N 3.09Å; S270-Q274 PolarHBondContact OG-NE2 3.44Å; L271-Q274 PolarHBondContact O-N 3.02Å; Q274-G276 VanDerWaalsContact C-N 3.32Å; Q274-F277 PolarHBondContact O-N 3.27Å; Q274-L278 WeakPolarHBondContact O-CG 3.12Å; Q274-L278 PolarHBondContact O-N 3.03Å
275I69.9Low67.3Low1 Ų166.7 Ų66.71%0.00534%0.336CS..Hα-helixtrans-58.4-49.7171.9-72160.4000108.9Y71 L228 E229 L232 L271 F277 L278 E279Y71-I275 HydrophobicContact CE2-CD1 4.39Å; L228-I275 HydrophobicContact CB-CD1 4.47Å; L228-I275 HydrophobicContact CB-CG1 4.16Å; E229-I275 HydrophobicContact CG-CD1 4.04Å; L232-I275 HydrophobicContact CD2-CD1 4.36Å; L271-I275 WeakPolarHBondContact O-CB 3.05Å; L271-I275 WeakPolarHBondContact O-CG1 3.4Å; L271-I275 PolarHBondContact O-N 3.11Å; I275-F277 VanDerWaalsContact C-N 3.3Å; I275-F277 PolarHBondContact O-N 2.94Å; I275-L278 CarbonylContact O-C 3.59Å; I275-L278 WeakPolarHBondContact O-CA 3.47Å; I275-L278 WeakPolarHBondContact O-CB 3.22Å; I275-L278 PolarHBondContact O-N 3.12Å; I275-E279 HydrophobicContact CG2-CG 4.2Å; I275-E279 WeakPolarHBondContact O-CG 3.44Å; I275-E279 PolarHBondContact O-N 3.21Å
276G67.8Low67.2Low2 Ų268.2 Ų68.22%0.02135%0.351CS..Hα-helixtrans-64-25.3-177.800000116.3K68 S272 E273 Q274 E280K68-G276 VanDerWaalsContact NZ-C 3.34Å; K68-G276 PolarHBondContact NZ-O 2.94Å; S272-G276 PolarHBondContact O-N 3.29Å; E273-G276 CarbonylContact O-C 3.5Å; E273-G276 PolarHBondContact O-N 3.26Å; Q274-G276 VanDerWaalsContact C-N 3.32Å; G276-E280 WeakPolarHBondContact O-CB 3.46Å; G276-E280 PolarHBondContact O-N 3.33Å
277F69.3Low67.1Low111 Ų11166 Ų6649%0.48734%0.344SS..Hα-helixtrans-79.7-30.7172175.7-107.2000111.8E273 Q274 I275 R281E273-F277 WeakPolarHBondContact O-CB 3.14Å; E273-F277 PolarHBondContact O-N 2.04Å; Q274-F277 PolarHBondContact O-N 3.27Å; I275-F277 VanDerWaalsContact C-N 3.3Å; I275-F277 PolarHBondContact O-N 2.94Å; F277-R281 HydrophobicContact CZ-CG 4.46Å; F277-R281 WeakPolarHBondContact O-CG 3.07Å; F277-R281 PolarHBondContact O-N 3.21Å; F277-R281 VanDerWaalsContact O-N 3.11Å
278L66Low66.6Low23 Ų2368.3 Ų68.312%0.1236%0.36CS..Hα-helixtrans-73.5-40.8172.4-66169.5000111.1L221 V225 L228 Q274 I275 E280 R281 L282L221-L278 HydrophobicContact CD2-CD2 3.94Å; V225-L278 HydrophobicContact CG2-CB 3.74Å; V225-L278 HydrophobicContact CG2-CD1 3.75Å; V225-L278 HydrophobicContact CG2-CG 4.34Å; L228-L278 HydrophobicContact CD1-CD1 4.01Å; Q274-L278 WeakPolarHBondContact O-CG 3.12Å; Q274-L278 PolarHBondContact O-N 3.03Å; I275-L278 CarbonylContact O-C 3.59Å; I275-L278 WeakPolarHBondContact O-CA 3.47Å; I275-L278 WeakPolarHBondContact O-CB 3.22Å; I275-L278 PolarHBondContact O-N 3.12Å; L278-E280 VanDerWaalsContact C-N 3.31Å; L278-E280 PolarHBondContact O-N 2.67Å; L278-R281 CarbonylContact O-C 3.53Å; L278-R281 PolarHBondContact O-N 2.8Å; L278-L282 WeakPolarHBondContact O-CB 3.22Å; L278-L282 WeakPolarHBondContact O-CD1 3.28Å; L278-L282 VanDerWaalsContact O-CG 3.22Å; L278-L282 WeakPolarHBondContact O-CG 3.24Å; L278-L282 PolarHBondContact O-N 2.7Å
279E65.6Low66Low49 Ų4975.2 Ų75.223%0.22939%0.392CS..Hα-helixtrans-58.4-39.9171.3-71.3-177.7137.800112.5I275 L282 G283 T284I275-E279 HydrophobicContact CG2-CG 4.2Å; I275-E279 WeakPolarHBondContact O-CG 3.44Å; I275-E279 PolarHBondContact O-N 3.21Å; E279-L282 PolarHBondContact O-N 3.34Å; E279-G283 PolarHBondContact O-N 3.45Å; E279-T284 PolarHBondContact O-OG1 3.1Å
280E66.8Low65.1Low86 Ų8681.4 Ų81.440%0.40243%0.425SS..Hα-helixtrans-66.3-45.4176.3-179.5163.2-12900111.5Y54 G276 L278 L282 G283Y54-E280 PolarHBondContact OH-OE1 2.79Å; G276-E280 WeakPolarHBondContact O-CB 3.46Å; G276-E280 PolarHBondContact O-N 3.33Å; L278-E280 VanDerWaalsContact C-N 3.31Å; L278-E280 PolarHBondContact O-N 2.67Å; E280-L282 PolarHBondContact O-N 3.48Å; E280-G283 PolarHBondContact O-N 3.48Å
281R64.7Low64.6Low175 Ų17583.1 Ų83.166%0.6643%0.43SS*.Hα-helixtrans-67.6-15173.2-72.9-17763.2174-0.4114.3F277 L278 G283F277-R281 HydrophobicContact CZ-CG 4.46Å; F277-R281 WeakPolarHBondContact O-CG 3.07Å; F277-R281 PolarHBondContact O-N 3.21Å; F277-R281 VanDerWaalsContact O-N 3.11Å; L278-R281 CarbonylContact O-C 3.53Å; L278-R281 PolarHBondContact O-N 2.8Å; R281-G283 VanDerWaalsContact C-N 3.35Å
282L62.1Low64.4Low129 Ų12987 Ų8768%0.67545%0.45SS*.THydrogen-bonded Turntrans-87.6-0.9171.5-72.6165.1000113L278 E279 E280L278-L282 WeakPolarHBondContact O-CB 3.22Å; L278-L282 WeakPolarHBondContact O-CD1 3.28Å; L278-L282 VanDerWaalsContact O-CG 3.22Å; L278-L282 WeakPolarHBondContact O-CG 3.24Å; L278-L282 PolarHBondContact O-N 2.7Å; E279-L282 PolarHBondContact O-N 3.34Å; E280-L282 PolarHBondContact O-N 3.48Å
283G60.7Low64Low40 Ų4091.3 Ų91.341%0.41247%0.471SS..THydrogen-bonded Turntrans87.631.3161.800000116.5E279 E280 R281 C285E279-G283 PolarHBondContact O-N 3.45Å; E280-G283 PolarHBondContact O-N 3.48Å; R281-G283 VanDerWaalsContact C-N 3.35Å; G283-C285 VanDerWaalsContact C-N 3.26Å; G283-C285 PolarHBondContact O-N 3.25Å
284T59.6Low63.3Low86 Ų8688.9 Ų88.953%0.52846%0.462SS..SBendtrans-69.5-12.9-177.751.70000115.7E279E279-T284 PolarHBondContact O-OG1 3.1Å
285C61Low62.7Low33 Ų3388.9 Ų88.922%0.22347%0.465CS..SBendtrans-14793.6163.7-123.20000108C64 T66 G283C64-C285 HydrophobicContact CB-CB 4.1Å; C64-C285 WeakPolarHBondContact CB-SG 3.33Å; C64-C285 WeakPolarHBondContact SG-CB 3.46Å; C64-C285 CovalentContact SG-SG 2.05Å; C64-C285 PolarHBondContact SG-SG 3.23Å; T66-C285 HydrophobicContact CG2-CB 4.06Å; G283-C285 VanDerWaalsContact C-N 3.26Å; G283-C285 PolarHBondContact O-N 3.25Å
286S61.1Low62.3Low89 Ų8994.7 Ų94.762%0.62250%0.496SS*.  trans-95.4120.6178.752.90000111.8Q288S286-Q288 PolarHBondContact O-N 2.98Å; S286-Q288 VanDerWaalsContact O-N 3.1Å
287C61.3Low61.9Low57 Ų57101.4 Ų101.439%0.38553%0.53SS..  trans-75.594.6166.5-620000108.6C58 E289C58-C287 WeakPolarHBondContact CA-SG 3.37Å; C58-C287 HydrophobicContact CB-CB 3.73Å; C58-C287 WeakPolarHBondContact CB-SG 3.47Å; C58-C287 WeakPolarHBondContact SG-CB 3.2Å; C58-C287 CovalentContact SG-SG 2.04Å; C58-C287 PolarHBondContact SG-SG 3Å; C287-E289 PolarHBondContact O-N 2.73Å
288Q60.8Low61.3Low175 Ų175100.6 Ų100.682%0.81853%0.533SS*.  trans-72.5110.5179.3-160.3170.17.600109.9S286S286-Q288 PolarHBondContact O-N 2.98Å; S286-Q288 VanDerWaalsContact O-N 3.1Å
289E57.2Low60.9Low148 Ų148107.1 Ų107.169%0.69257%0.568SS**  trans-66.6145.8164.8-72.2-178.5144.500109.7Q59 C287Q59-E289 PolarHBondContact NE2-OE1 3.33Å; C287-E289 PolarHBondContact O-N 2.73Å
290N50.1Low60.5Low218 Ų218112.4 Ų112.4100%1.16660%0.598SS**  trans-151.70-170.9-169.3127.4000109.5

Retrieved 290 of 290 residues in 365.6 ms (Link to these results)