A0A060D6C7_MAIZE Loading...

AP2-EREBP transcription factor

AlphaFold DB , UniProt , Accession A0A060D6C7, Species MAIZE (Zea mays, Maize), Gene EREB82, Length 322 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
1M59.5Low69.8Low243 Ų243173.3 Ų173.3100%1.19784%0.837SS**  0900-70.9170.3-178.600106.3
2E61.3Low69Low192 Ų192168.2 Ų168.290%0.89783%0.832SS**  trans-150134.8-179.5-148.9153.9109.500108.2
3L72.3Confident68Low158 Ų158172.3 Ų172.383%0.82784%0.835SS**  trans-87.5118.3-172.1-78.5162.4000109.9F5L3-F5 VanDerWaalsContact C-N 3.33Å; L3-F5 PolarHBondContact O-N 3.06Å
4Q75.6Confident67.6Low162 Ų162172 Ų17276%0.75783%0.832SS**  trans-70.580.9-177.4-15880.635.500111.7H6Q4-H6 PolarHBondContact O-N 3.47Å; Q4-H6 VanDerWaalsContact O-N 3.1Å; Q4-H6 PolarHBondContact O-ND1 2.97Å; Q4-H6 VanDerWaalsContact O-ND1 3.09Å
5F72.4Confident67Low191 Ų191172.5 Ų172.584%0.83883%0.832SS**  trans-65.1108172.6-105.2-94.3000110.3L3L3-F5 VanDerWaalsContact C-N 3.33Å; L3-F5 PolarHBondContact O-N 3.06Å
6H76.8Confident66.6Low154 Ų154172.1 Ų172.171%0.71383%0.828SS**  trans-84.8122.6172.4-76.271.6000109.6Q4 Q8Q4-H6 PolarHBondContact O-N 3.47Å; Q4-H6 VanDerWaalsContact O-N 3.1Å; Q4-H6 PolarHBondContact O-ND1 2.97Å; Q4-H6 VanDerWaalsContact O-ND1 3.09Å; H6-Q8 PolarHBondContact O-N 3.21Å; H6-Q8 VanDerWaalsContact O-N 3.17Å
7P76.3Confident65.9Low122 Ų122172.6 Ų172.679%0.79283%0.83SS**  trans-71.7109.9175.928-32.6000110.3Q9P7-Q9 PolarHBondContact O-N 3Å
8Q67.4Low65.1Low182 Ų182172.9 Ų172.985%0.8583%0.83SS**  trans-68.7123.2173-172.7-179.12.300109.6H6 H10H6-Q8 PolarHBondContact O-N 3.21Å; H6-Q8 VanDerWaalsContact O-N 3.17Å; Q8-H10 PolarHBondContact O-N 3.01Å
9Q69.7Low65.3Low161 Ų161169.7 Ų169.775%0.75282%0.824SS**  trans-71.5131-178.2-65.1-164.2-0.400111.9P7 H11P7-Q9 PolarHBondContact O-N 3Å; Q9-H11 PolarHBondContact O-N 3.05Å; Q9-H11 PolarHBondContact O-ND1 2.83Å
10H69Low65.9Low190 Ų190166.9 Ų166.988%0.8882%0.82SS**  trans-60.9101.9172.3-74.6-97.2000110.1Q8 S12Q8-H10 PolarHBondContact O-N 3.01Å; H10-S12 PolarHBondContact O-N 2.83Å
11H67.5Low66.4Low151 Ų151164.4 Ų164.470%0.69982%0.816SS**  trans-72.4112.7169.3-76.958.1000108.2Q9 Y13Q9-H11 PolarHBondContact O-N 3.05Å; Q9-H11 PolarHBondContact O-ND1 2.83Å; H11-Y13 PolarHBondContact O-N 3.01Å
12S60.3Low66.9Low112 Ų112158 Ų15878%0.78379%0.793SS**  trans-59.1108.417350.20000109.5H10 Q14H10-S12 PolarHBondContact O-N 2.83Å; S12-Q14 VanDerWaalsContact C-N 3.29Å; S12-Q14 PolarHBondContact O-N 3.28Å
13Y55.3Low66.7Low222 Ų222154.1 Ų154.187%0.87179%0.794SS**  trans-65.791.4171.7-74.9-82.7000109.3H11 Q15H11-Y13 PolarHBondContact O-N 3.01Å; Y13-Q15 PolarHBondContact O-N 3.17Å
14Q62.9Low66.1Low168 Ų168151.5 Ų151.579%0.78578%0.784SS**  trans-65.8105.1171.5-161.9179.552.200107.3S12 Q16S12-Q14 VanDerWaalsContact C-N 3.29Å; S12-Q14 PolarHBondContact O-N 3.28Å; Q14-Q16 VanDerWaalsContact C-N 3.31Å; Q14-Q16 PolarHBondContact O-N 2.82Å
15Q58.8Low65.3Low180 Ų180152.6 Ų152.684%0.84179%0.786SS**  trans-69.787.1-174.8-168.5175.279.900109.1Y13 Q17Y13-Q15 PolarHBondContact O-N 3.17Å; Q15-Q17 PolarHBondContact O-N 3.17Å
16Q60.2Low64.6Low165 Ų165151.8 Ų151.877%0.77179%0.785SS**  trans-62.9110.6175.2-77.1-175.9-4.300108.9Q14 Q18Q14-Q16 VanDerWaalsContact C-N 3.31Å; Q14-Q16 PolarHBondContact O-N 2.82Å; Q16-Q18 PolarHBondContact O-N 3.09Å
17Q54.7Low63.9Low182 Ų182150.4 Ų150.485%0.8579%0.79SS**  trans-66.3102.4175.4-61.8176.126.300107.9Q15Q15-Q17 PolarHBondContact O-N 3.17Å
18Q51.1Low63.1Low178 Ų178153.4 Ų153.483%0.83279%0.791SS**PPolyproline II helixtrans-65.3132.5172.4-69.5-172.8-8.900108.8Q16Q16-Q18 PolarHBondContact O-N 3.09Å
19P69.7Low62.8Low112 Ų112150.5 Ų150.573%0.72779%0.787SS**PPolyproline II helixtrans-62.2144.6175.726.6-33.8000109.8
20P76.3Confident62.4Low113 Ų113151.8 Ų151.873%0.73479%0.79SS**PPolyproline II helixtrans-60.2143.6178.525.9-34.3000110.3
21P76.6Confident61.7Low115 Ų115148 Ų14875%0.74778%0.783SS**PPolyproline II helixtrans-59.7140.9177.125.7-34.1000110A23P21-A23 PolarHBondContact O-N 2.85Å; P21-A23 VanDerWaalsContact O-N 3.17Å
22P71.1Confident60.9Low109 Ų109152.4 Ų152.471%0.70879%0.793SS**PPolyproline II helixtrans-61122.8-176.323.8-33.3000110.5T24P22-T24 VanDerWaalsContact C-N 3.3Å; P22-T24 PolarHBondContact O-N 3.38Å; P22-T24 PolarHBondContact O-OG1 2.84Å
23A57.3Low60.4Low110 Ų110152.6 Ų152.691%0.90979%0.79SS**  trans-65.489174.500000109.9P21P21-A23 PolarHBondContact O-N 2.85Å; P21-A23 VanDerWaalsContact O-N 3.17Å
24T59.4Low59.9Low102 Ų102153.6 Ų153.663%0.62679%0.792SS**  trans-108.9115.9176.529.80000112.3P22P22-T24 VanDerWaalsContact C-N 3.3Å; P22-T24 PolarHBondContact O-N 3.38Å; P22-T24 PolarHBondContact O-OG1 2.84Å
25K59.6Low59.2Low185 Ų185151.1 Ų151.180%0.80479%0.788SS**  trans77.586.5150.9-55.7164.8-172.5175.60115.9
26E56.5Low58.5Low175 Ų175151 Ų15182%0.81879%0.785SS**  30.4101.7121.1-73.8-79.8117.600115.8K28E26-K28 VanDerWaalsContact C-N 3.29Å; E26-K28 PolarHBondContact O-N 3.1Å
27P61.9Low57.6Low125 Ų125146 Ų14681%0.81277%0.767SS**  trans-73.283.6173.131.2-34000110.4P29P27-P29 WeakPolarHBondContact O-CD 3.42Å; P27-P29 VanDerWaalsContact O-N 3.15Å
28K59.2Low57.1Low185 Ų185139.7 Ų139.780%0.80475%0.751SS**  trans-54.4118.2176-154172-166.8172.90109.5E26 K30E26-K28 VanDerWaalsContact C-N 3.29Å; E26-K28 PolarHBondContact O-N 3.1Å; K28-K30 PolarHBondContact O-N 2.94Å
29P61.9Low56.7Low120 Ų120135 Ų13578%0.77975%0.751SS**  trans-68.4103.8-175.225.8-33.3000109.6P27P27-P29 WeakPolarHBondContact O-CD 3.42Å; P27-P29 VanDerWaalsContact O-N 3.15Å
30K60.6Low55.5Low188 Ų188133.5 Ų133.582%0.81776%0.756SS**  trans-63.6130.4172.2-66.6-177.3-179.5179.90108.3K28 R32K28-K30 PolarHBondContact O-N 2.94Å; K30-R32 PolarHBondContact O-N 3.29Å
31P55.8Low53.9Low111 Ų111132 Ų13272%0.72176%0.761SS**  trans-57.7132.2177.423.8-33.1000109.3T33P31-T33 PolarHBondContact O-N 2.83Å
32R49.4Very low52.4Low244 Ų244130.3 Ų130.392%0.92176%0.764SS**  trans-7566.6179.8-70.1172.763.1172-0.8110.6K30 R34K30-R32 PolarHBondContact O-N 3.29Å; R32-R34 PolarHBondContact O-N 2.86Å; R32-R34 VanDerWaalsContact O-N 3.16Å
33T50.4Low51.4Low116 Ų116128.9 Ų128.971%0.71277%0.769SS**  trans-57.6119.3162.227.60000108.2P31 T35P31-T33 PolarHBondContact O-N 2.83Å; T33-T35 PolarHBondContact O-N 3.16Å
34R44Very low51.5Low242 Ų242128.6 Ų128.691%0.91376%0.761SS**SBendtrans-8163.8-165.2-167.7-178.165.6-175.4-1.3111.9R32R32-R34 PolarHBondContact O-N 2.86Å; R32-R34 VanDerWaalsContact O-N 3.16Å
35T48.8Very low51.8Low116 Ų116126.4 Ų126.471%0.71275%0.75SS**  trans-120.146.1170.9350000111.2T33 C37T33-T35 PolarHBondContact O-N 3.16Å; T35-C37 PolarHBondContact O-N 3.41Å
36K44.8Very low52.9Low179 Ų179123.4 Ų123.478%0.77874%0.737SS**  trans-69.584.1163.9-174.482.6175.1-172.20108.9G38 R99K36-G38 PolarHBondContact O-N 2.88Å; K36-R99 PolarHBondContact O-NH1 2.97Å
37C40.2Very low54.6Low58 Ų58117.1 Ų117.139%0.39271%0.707SS.*  trans-71.8114.7157.5-65.80000107.4T35 V48T35-C37 PolarHBondContact O-N 3.41Å; C37-V48 HydrophobicContact CB-CG2 3.98Å
38G45.1Very low56Low50 Ų50113.3 Ų113.352%0.51568%0.681SS.*  trans-72.4150177.900000110.3K36K36-G38 PolarHBondContact O-N 2.88Å
39G42.7Very low57.5Low79 Ų79105.9 Ų105.981%0.81466%0.657SS**  cis153.3119.7-1.900000110.3
40G43.6Very low59.1Low81 Ų81100.7 Ų100.784%0.83562%0.623SS**  trans138.190.8174.200000114.7
41G43.8Very low60.6Low82 Ų8296.2 Ų96.285%0.84560%0.601SS**SBendtrans81117.9148.800000119.4
42G44.8Very low62.5Low79 Ų7995.6 Ų95.681%0.81459%0.588SS**  trans84117160.600000115.3
43G50Low64.5Low79 Ų7991.4 Ų91.481%0.81457%0.573SS**SBendtrans-73.9135.5-174.500000114.2
44S59.2Low66.6Low104 Ų10492.6 Ų92.673%0.72758%0.583SS**  trans166.7-20.4143.545.90000113.6
45S65Low68.8Low56 Ų5685.1 Ų85.139%0.39257%0.567SS.*  trans-82.1123.1-178.4-163.90000113.3F47 V50S45-F47 PolarHBondContact OG-O 3.16Å; S45-V50 WeakPolarHBondContact CB-O 3.45Å; S45-V50 PolarHBondContact OG-O 2.77Å
46K84.3Confident70.9Confident123 Ų12381.3 Ų81.354%0.53555%0.551SS.*  trans-80.4-13.4178.852.4174.7170.8176.90114.7E80K46-E80 WeakPolarHBondContact CE-OE1 3.48Å; K46-E80 IonicContact NZ-OE1 2.6Å; K46-E80 PolarHBondContact NZ-OE1 2.6Å; K46-E80 IonicContact NZ-OE2 3.69Å
47F91.7Very high73.2Confident42 Ų4278.1 Ų78.118%0.18453%0.534CS..SBendtrans-130.7144.6-175.8-58.2-55.5000112.1S45 V50 A79 E80 A83 N101 F102S45-F47 PolarHBondContact OG-O 3.16Å; F47-V50 HydrophobicContact CB-CB 4.29Å; F47-V50 HydrophobicContact CB-CG2 4.01Å; F47-A79 HydrophobicContact CD2-CB 3.9Å; F47-A79 WeakPolarHBondContact CD2-O 3.47Å; F47-A79 HydrophobicContact CE2-CB 3.92Å; F47-E80 HydrophobicContact CE2-CG 4.01Å; F47-E80 HydrophobicContact CZ-CG 4.15Å; F47-A83 HydrophobicContact CB-CB 3.59Å; F47-A83 HydrophobicContact CD1-CB 4.25Å; F47-A83 HydrophobicContact CD2-CB 3.66Å; F47-A83 HydrophobicContact CE2-CB 4.39Å; F47-A83 HydrophobicContact CG-CB 3.59Å; F47-N101 HydrophobicContact CD1-CB 4.31Å; F47-F102 HydrophobicContact CE1-CE1 4.2Å; F47-F102 HydrophobicContact CE1-CZ 4.08Å; F47-F102 HydrophobicContact CE2-CZ 4.48Å; F47-F102 HydrophobicContact CZ-CE1 4.32Å; F47-F102 HydrophobicContact CZ-CZ 4.05Å
48V90.9Very high75.9Confident46 Ų4677.2 Ų77.228%0.27952%0.523SS..THydrogen-bonded Turntrans-65.9135175.9-176.60000109.7C37 V50 Y86 N101C37-V48 HydrophobicContact CB-CG2 3.98Å; V48-V50 VanDerWaalsContact C-N 3.26Å; V48-V50 PolarHBondContact O-N 2.94Å; V48-Y86 HydrophobicContact CB-CE1 4.42Å; V48-Y86 HydrophobicContact CG1-CE1 3.88Å; V48-Y86 WeakPolarHBondContact O-CD1 3.33Å; V48-N101 WeakPolarHBondContact CB-OD1 3.36Å; V48-N101 PolarHBondContact N-OD1 3.14Å; V48-N101 PolarHBondContact O-ND2 2.81Å
49G91.2Very high78.2Confident29 Ų2975.2 Ų75.230%0.29950%0.5SS..THydrogen-bonded Turntrans80.2017700000115.4
50V93.9Very high80.7Confident11 Ų1171.4 Ų71.47%0.06746%0.462CS..EExtended strand (participates in β ladder)trans-107.7132.2-179.5179.70000110.5S45 F47 V48 W58 A82 A83S45-V50 WeakPolarHBondContact CB-O 3.45Å; S45-V50 PolarHBondContact OG-O 2.77Å; F47-V50 HydrophobicContact CB-CB 4.29Å; F47-V50 HydrophobicContact CB-CG2 4.01Å; V48-V50 VanDerWaalsContact C-N 3.26Å; V48-V50 PolarHBondContact O-N 2.94Å; V50-W58 HydrophobicContact CG1-CB 4.35Å; V50-W58 HydrophobicContact CG1-CD2 4.43Å; V50-W58 HydrophobicContact CG1-CE3 3.61Å; V50-W58 HydrophobicContact CG1-CZ3 4.33Å; V50-A82 HydrophobicContact CB-CB 4.42Å; V50-A82 HydrophobicContact CG1-CB 3.83Å; V50-A82 HydrophobicContact CG2-CB 3.72Å; V50-A83 HydrophobicContact CG2-CB 3.86Å
51R94.1Very high83.1Confident93 Ų9371.5 Ų71.535%0.35144%0.44SS..EExtended strand (participates in β ladder)trans-127.5146.5172.559.7179.717573.3-1.5111.5V59 E61R51-V59 HydrophobicContact CG-CB 4.08Å; R51-V59 PolarHBondContact N-O 3.29Å; R51-V59 PolarHBondContact O-N 2.68Å; R51-E61 IonicContact CZ-OE1 3.69Å; R51-E61 IonicContact CZ-OE2 3.42Å; R51-E61 IonicContact NE-OE1 2.92Å; R51-E61 PolarHBondContact NE-OE1 3.3Å; R51-E61 IonicContact NE-OE2 3.37Å; R51-E61 PolarHBondContact NE-OE2 3.45Å; R51-E61 IonicContact NH2-OE1 3.53Å; R51-E61 IonicContact NH2-OE2 2.9Å; R51-E61 PolarHBondContact NH2-OE2 2.8Å
52Q93.8Very high85.5Confident98 Ų9867.9 Ų67.946%0.45840%0.401SS..EExtended strand (participates in β ladder)trans-98.9138.3174.2-158.4174.817.900110G56 W58Q52-G56 PolarHBondContact NE2-O 2.86Å; Q52-W58 HydrophobicContact CB-CE3 3.94Å; Q52-W58 HydrophobicContact CB-CH2 4.32Å; Q52-W58 HydrophobicContact CB-CZ3 3.83Å; Q52-W58 HydrophobicContact CG-CD2 4.3Å; Q52-W58 HydrophobicContact CG-CE3 4.16Å; Q52-W58 HydrophobicContact CG-CH2 4.26Å; Q52-W58 HydrophobicContact CG-CZ2 4.36Å; Q52-W58 HydrophobicContact CG-CZ3 4.16Å
53R92.3Very high87.8Confident156 Ų15671 Ų7159%0.58939%0.393SS*.  trans-97.9152170.8-179.4171.6-92-122.1-4.2108.7S55 G56 R57R53-S55 PolarHBondContact O-N 3.41Å; R53-G56 PolarHBondContact O-N 2.92Å; R53-R57 PolarHBondContact N-O 2.88Å; R53-R57 VanDerWaalsContact N-O 3.16Å
54P93.4Very high89.7Confident142 Ų14267.4 Ų67.492%0.92236%0.355SS*.THydrogen-bonded Turntrans-50.6-21172.214.6-32.4000115.6G56P54-G56 PolarHBondContact O-N 2.98Å; P54-G56 VanDerWaalsContact O-N 3.14Å
55S91.3Very high91.1Very high85 Ų8567.9 Ų67.959%0.59435%0.353SS*.THydrogen-bonded Turntrans-64.4-2.5167.9169.60000114.7R53 R57R53-S55 PolarHBondContact O-N 3.41Å; S55-R57 PolarHBondContact O-N 3.37Å; S55-R57 VanDerWaalsContact O-N 3.14Å
56G92.1Very high92.2Very high36 Ų3670.2 Ų70.237%0.37137%0.365SS..SBendtrans81.4-27.6-175.400000114.7Q52 R53 P54Q52-G56 PolarHBondContact NE2-O 2.86Å; R53-G56 PolarHBondContact O-N 2.92Å; P54-G56 PolarHBondContact O-N 2.98Å; P54-G56 VanDerWaalsContact O-N 3.14Å
57R94.7Very high92.3Very high111 Ų11167.4 Ų67.442%0.41935%0.354SS..  trans-64.7144.2-179.4-57.6-167.177-166.53.9112.9R53 S55 T75R53-R57 PolarHBondContact N-O 2.88Å; R53-R57 VanDerWaalsContact N-O 3.16Å; S55-R57 PolarHBondContact O-N 3.37Å; S55-R57 VanDerWaalsContact O-N 3.14Å; R57-T75 PolarHBondContact NH1-OG1 2.88Å; R57-T75 PolarHBondContact NH2-OG1 3.42Å
58W95.3Very high92.1Very high39 Ų3974.4 Ų74.415%0.14838%0.384CS..EExtended strand (participates in β ladder)trans-91.5143176.3-56.788.7000110.1V50 Q52 T75 F76 A79 A82V50-W58 HydrophobicContact CG1-CB 4.35Å; V50-W58 HydrophobicContact CG1-CD2 4.43Å; V50-W58 HydrophobicContact CG1-CE3 3.61Å; V50-W58 HydrophobicContact CG1-CZ3 4.33Å; Q52-W58 HydrophobicContact CB-CE3 3.94Å; Q52-W58 HydrophobicContact CB-CH2 4.32Å; Q52-W58 HydrophobicContact CB-CZ3 3.83Å; Q52-W58 HydrophobicContact CG-CD2 4.3Å; Q52-W58 HydrophobicContact CG-CE3 4.16Å; Q52-W58 HydrophobicContact CG-CH2 4.26Å; Q52-W58 HydrophobicContact CG-CZ2 4.36Å; Q52-W58 HydrophobicContact CG-CZ3 4.16Å; W58-T75 CarbonylContact O-C 3.51Å; W58-T75 VanDerWaalsContact O-CA 3.32Å; W58-T75 WeakPolarHBondContact O-CA 3.4Å; W58-F76 PolarHBondContact N-O 3.48Å; W58-F76 PolarHBondContact O-N 3.14Å; W58-A79 HydrophobicContact CD2-CB 3.64Å; W58-A79 HydrophobicContact CE3-CB 3.75Å; W58-A79 HydrophobicContact CG-CB 4.24Å; W58-A79 HydrophobicContact CH2-CB 4.02Å; W58-A79 HydrophobicContact CZ2-CB 3.94Å; W58-A79 HydrophobicContact CZ3-CB 3.93Å; W58-A82 HydrophobicContact CB-CB 4.08Å
59V94.6Very high92.1Very high8 Ų872.8 Ų72.85%0.04837%0.374CS..EExtended strand (participates in β ladder)trans-128.5135.5179-169.30000108.9R51 T75R51-V59 HydrophobicContact CG-CB 4.08Å; R51-V59 PolarHBondContact N-O 3.29Å; R51-V59 PolarHBondContact O-N 2.68Å; V59-T75 HydrophobicContact CG1-CG2 4.2Å; V59-T75 HydrophobicContact CG2-CG2 3.94Å
60A95.3Very high92.2Very high0 Ų081 Ų810%040%0.397CS..EExtended strand (participates in β ladder)trans-120.2135.4172.700000110.7L73 G74 F76 A82A60-L73 HydrophobicContact CB-CB 4.28Å; A60-L73 HydrophobicContact CB-CD1 4.07Å; A60-L73 WeakPolarHBondContact O-CB 3.45Å; A60-L73 PolarHBondContact O-N 3.2Å; A60-L73 VanDerWaalsContact O-N 3.07Å; A60-G74 PolarHBondContact N-O 3.39Å; A60-G74 PolarHBondContact O-N 2.96Å; A60-F76 HydrophobicContact CB-CD2 4.4Å; A60-F76 HydrophobicContact CB-CE2 3.99Å; A60-A82 HydrophobicContact CB-CB 4.14Å; A60-A82 WeakPolarHBondContact CB-O 3.45Å
61E93.9Very high92.2Very high83 Ų8380.8 Ų80.839%0.38840%0.395SS..EExtended strand (participates in β ladder)trans-149.4147.9178.663.2-157.4-169.600109R51 V71R51-E61 IonicContact CZ-OE1 3.69Å; R51-E61 IonicContact CZ-OE2 3.42Å; R51-E61 IonicContact NE-OE1 2.92Å; R51-E61 PolarHBondContact NE-OE1 3.3Å; R51-E61 IonicContact NE-OE2 3.37Å; R51-E61 PolarHBondContact NE-OE2 3.45Å; R51-E61 IonicContact NH2-OE1 3.53Å; R51-E61 IonicContact NH2-OE2 2.9Å; R51-E61 PolarHBondContact NH2-OE2 2.8Å; E61-V71 WeakPolarHBondContact CA-O 3.45Å
62I93.5Very high92.1Very high5 Ų583.9 Ų83.93%0.02641%0.407CS..EExtended strand (participates in β ladder)trans-124134179.1-168.1157.4000110.4R70 V71 L73 Y86 A89 A90 L93I62-R70 WeakPolarHBondContact O-CA 3.5Å; I62-V71 HydrophobicContact CG2-CB 3.86Å; I62-V71 HydrophobicContact CG2-CG2 4.25Å; I62-V71 PolarHBondContact N-O 2.89Å; I62-V71 PolarHBondContact O-N 2.96Å; I62-L73 HydrophobicContact CB-CD1 4.44Å; I62-L73 HydrophobicContact CG2-CD1 4.47Å; I62-L73 HydrophobicContact CG2-CD2 3.89Å; I62-L73 HydrophobicContact CG2-CG 4.42Å; I62-Y86 HydrophobicContact CB-CD2 4.23Å; I62-Y86 HydrophobicContact CB-CE2 3.91Å; I62-Y86 HydrophobicContact CD1-CD2 4.37Å; I62-Y86 HydrophobicContact CD1-CE2 3.87Å; I62-Y86 HydrophobicContact CG1-CE2 3.82Å; I62-A89 HydrophobicContact CD1-CB 4.31Å; I62-A89 HydrophobicContact CG2-CB 4.15Å; I62-A90 HydrophobicContact CD1-CB 3.74Å; I62-L93 HydrophobicContact CD1-CD1 4.03Å; I62-L93 HydrophobicContact CG1-CD1 4.1Å; I62-L93 HydrophobicContact CG2-CD1 3.65Å
63K93.9Very high92.1Very high146 Ų14679.5 Ų79.564%0.63539%0.387SS*.EExtended strand (participates in β ladder)trans-121.7106.4174175.7-177.9177.6-176.60106.5R70K63-R70 HydrophobicContact CG-CG 4.39Å
64D89.3Confident92.2Very high3 Ų372.8 Ų72.82%0.01637%0.366CS..EExtended strand (participates in β ladder)trans-103.5120.5173.8-157.2-60000109.8T66 K68 V69 L93 R94D64-T66 VanDerWaalsContact C-N 3.29Å; D64-T66 WeakPolarHBondContact OD1-CA 3.32Å; D64-T66 WeakPolarHBondContact OD1-CB 3.38Å; D64-T66 PolarHBondContact OD1-N 2.83Å; D64-T66 PolarHBondContact OD1-OG1 2.91Å; D64-K68 WeakPolarHBondContact O-CA 3.32Å; D64-K68 PolarHBondContact O-N 3.24Å; D64-K68 VanDerWaalsContact O-N 3.1Å; D64-V69 PolarHBondContact N-O 2.84Å; D64-V69 VanDerWaalsContact N-O 3.08Å; D64-V69 PolarHBondContact O-N 3.12Å; D64-L93 HydrophobicContact CB-CD1 4.34Å; D64-R94 IonicContact OD2-CZ 2.68Å; D64-R94 IonicContact OD2-NE 3.68Å; D64-R94 IonicContact OD2-NH2 3.58Å; D64-R94 PolarHBondContact OD2-NH2 3.45Å
65T89.3Confident92.4Very high113 Ų11368.6 Ų68.669%0.69334%0.337SS*.THydrogen-bonded Turntrans-71.3-25.5178.6480000112.6
66T88.1Confident92.5Very high106 Ų10667 Ų6765%0.6532%0.32SS*.THydrogen-bonded Turntrans-71.3-49.5-178.1-32.30000110.4D64 K68D64-T66 VanDerWaalsContact C-N 3.29Å; D64-T66 WeakPolarHBondContact OD1-CA 3.32Å; D64-T66 WeakPolarHBondContact OD1-CB 3.38Å; D64-T66 PolarHBondContact OD1-N 2.83Å; D64-T66 PolarHBondContact OD1-OG1 2.91Å; T66-K68 VanDerWaalsContact C-N 3.33Å
67Q85.1Confident92.6Very high64 Ų6473.1 Ų73.130%0.29934%0.339SS..THydrogen-bonded Turntrans-83.3-11.7178.4-57.6-61.9-1100112.8V69 L93 L120 N123Q67-V69 HydrophobicContact CB-CB 4.28Å; Q67-V69 HydrophobicContact CB-CG2 3.92Å; Q67-V69 WeakPolarHBondContact O-CG2 3.47Å; Q67-V69 PolarHBondContact O-N 3.34Å; Q67-L93 HydrophobicContact CG-CD2 4.44Å; Q67-L93 PolarHBondContact NE2-O 3.39Å; Q67-L120 HydrophobicContact CG-CD1 4.43Å; Q67-N123 PolarHBondContact O-ND2 3.19Å; Q67-N123 VanDerWaalsContact O-ND2 3.12Å
68K89.2Confident92.7Very high188 Ų18870.9 Ų70.982%0.81734%0.338SS*.THydrogen-bonded Turntrans57.222.6-169.4-56.1179.6179-178.90113.8D64 T66D64-K68 WeakPolarHBondContact O-CA 3.32Å; D64-K68 PolarHBondContact O-N 3.24Å; D64-K68 VanDerWaalsContact O-N 3.1Å; T66-K68 VanDerWaalsContact C-N 3.33Å
69V90.1Very high92.6Very high12 Ų1269.1 Ų69.17%0.07333%0.331CS..EExtended strand (participates in β ladder)trans-98.5140.6-177.7179.90000111.1D64 Q67 V71 I119D64-V69 PolarHBondContact N-O 2.84Å; D64-V69 VanDerWaalsContact N-O 3.08Å; D64-V69 PolarHBondContact O-N 3.12Å; Q67-V69 HydrophobicContact CB-CB 4.28Å; Q67-V69 HydrophobicContact CB-CG2 3.92Å; Q67-V69 WeakPolarHBondContact O-CG2 3.47Å; Q67-V69 PolarHBondContact O-N 3.34Å; V69-V71 HydrophobicContact CG1-CG2 3.51Å; V69-I119 HydrophobicContact CG1-CG2 3.62Å; V69-I119 HydrophobicContact CG2-CG2 4.4Å
70R93.1Very high92.5Very high203 Ų20371.8 Ų71.877%0.76634%0.343SS*.EExtended strand (participates in β ladder)trans-114.1123.8165.4-57-178.3-169.1-177.65.6108.2I62 K63I62-R70 WeakPolarHBondContact O-CA 3.5Å; K63-R70 HydrophobicContact CG-CG 4.39Å
71V93Very high92.5Very high6 Ų672.8 Ų72.84%0.03635%0.352CS..EExtended strand (participates in β ladder)trans-123.4122.7176.2-1660000109.9E61 I62 V69 L73 I116 I119E61-V71 WeakPolarHBondContact CA-O 3.45Å; I62-V71 HydrophobicContact CG2-CB 3.86Å; I62-V71 HydrophobicContact CG2-CG2 4.25Å; I62-V71 PolarHBondContact N-O 2.89Å; I62-V71 PolarHBondContact O-N 2.96Å; V69-V71 HydrophobicContact CG1-CG2 3.51Å; V71-L73 HydrophobicContact CB-CD2 4.15Å; V71-L73 HydrophobicContact CG1-CD2 3.97Å; V71-I116 HydrophobicContact CG1-CG1 4.17Å; V71-I119 HydrophobicContact CG1-CD1 3.98Å; V71-I119 HydrophobicContact CG2-CD1 4.11Å
72W93.5Very high92.5Very high158 Ų15868.9 Ų68.960%0.59833%0.333SS*.EExtended strand (participates in β ladder)trans-80.3115.3165.4176.347.9000109.1T75 R115W72-T75 HydrophobicContact CZ2-CG2 4.11Å; W72-R115 PolarHBondContact O-NH2 3.46Å
73L93.8Very high92.5Very high6 Ų668.6 Ų68.63%0.03133%0.332CS..EExtended strand (participates in β ladder)trans-81.4-48.8-171.8-52.2176.7000109.7A60 I62 V71 Y86 A89 L112 R115 I116A60-L73 HydrophobicContact CB-CB 4.28Å; A60-L73 HydrophobicContact CB-CD1 4.07Å; A60-L73 WeakPolarHBondContact O-CB 3.45Å; A60-L73 PolarHBondContact O-N 3.2Å; A60-L73 VanDerWaalsContact O-N 3.07Å; I62-L73 HydrophobicContact CB-CD1 4.44Å; I62-L73 HydrophobicContact CG2-CD1 4.47Å; I62-L73 HydrophobicContact CG2-CD2 3.89Å; I62-L73 HydrophobicContact CG2-CG 4.42Å; V71-L73 HydrophobicContact CB-CD2 4.15Å; V71-L73 HydrophobicContact CG1-CD2 3.97Å; L73-Y86 HydrophobicContact CD1-CD2 4.18Å; L73-A89 HydrophobicContact CD1-CB 3.79Å; L73-A89 HydrophobicContact CD2-CB 3.48Å; L73-A89 VanDerWaalsContact CD2-CB 3.48Å; L73-A89 HydrophobicContact CG-CB 4.3Å; L73-L112 HydrophobicContact CB-CD1 4.19Å; L73-L112 HydrophobicContact CB-CD2 4.29Å; L73-L112 HydrophobicContact CD2-CD1 3.88Å; L73-L112 HydrophobicContact CD2-CD2 4.26Å; L73-L112 HydrophobicContact CD2-CG 4.46Å; L73-R115 PolarHBondContact O-NH1 3.16Å; L73-I116 HydrophobicContact CD2-CD1 4.1Å
74G94.8Very high92.5Very high14 Ų1467.7 Ų67.714%0.14432%0.324CS..EExtended strand (participates in β ladder)trans164.2-169.5172.400000113.2A60A60-G74 PolarHBondContact N-O 3.39Å; A60-G74 PolarHBondContact O-N 2.96Å
75T95.7Very high92.7Very high54 Ų5467.8 Ų67.833%0.33133%0.326SS..EExtended strand (participates in β ladder)trans-118.9134.4169.558.60000109.9R57 W58 V59 W72R57-T75 PolarHBondContact NH1-OG1 2.88Å; R57-T75 PolarHBondContact NH2-OG1 3.42Å; W58-T75 CarbonylContact O-C 3.51Å; W58-T75 VanDerWaalsContact O-CA 3.32Å; W58-T75 WeakPolarHBondContact O-CA 3.4Å; V59-T75 HydrophobicContact CG1-CG2 4.2Å; V59-T75 HydrophobicContact CG2-CG2 3.94Å; W72-T75 HydrophobicContact CZ2-CG2 4.11Å
76F95Very high93Very high51 Ų5164.3 Ų64.322%0.22430%0.301CS..EExtended strand (participates in β ladder)trans-127.6155.5-170.5-55.6-91.6000110.4W58 A60 A81 A82 A85W58-F76 PolarHBondContact N-O 3.48Å; W58-F76 PolarHBondContact O-N 3.14Å; A60-F76 HydrophobicContact CB-CD2 4.4Å; A60-F76 HydrophobicContact CB-CE2 3.99Å; F76-A81 HydrophobicContact CB-CB 4.3Å; F76-A81 HydrophobicContact CD1-CB 3.96Å; F76-A81 HydrophobicContact CG-CB 4.38Å; F76-A82 HydrophobicContact CB-CB 4.05Å; F76-A82 VanDerWaalsContact CD2-CA 3.49Å; F76-A82 HydrophobicContact CD2-CB 3.64Å; F76-A82 HydrophobicContact CE2-CB 4.43Å; F76-A82 HydrophobicContact CG-CB 4.03Å; F76-A85 HydrophobicContact CE1-CB 4Å; F76-A85 HydrophobicContact CE2-CB 3.94Å; F76-A85 HydrophobicContact CZ-CB 3.37Å
77E94.4Very high93.2Very high166 Ų16659.5 Ų59.578%0.77627%0.271SS*.SBendtrans-82.8-25.7176.9-69.6164.4-16700112.2
78T95Very high93.6Very high64 Ų6458 Ų5839%0.39326%0.264SS..SBendtrans-116.1146.4176.760.20000111.5E80 A81 A82T78-E80 PolarHBondContact O-N 3.06Å; T78-A81 WeakPolarHBondContact OG1-CB 3.47Å; T78-A81 PolarHBondContact OG1-N 3.41Å; T78-A82 PolarHBondContact O-N 3.01Å
79A94Very high93.8Very high1 Ų149 Ų491%0.00823%0.225CC..Hα-helixtrans-65.2-33.417400000111.4F47 W58 A82 A83F47-A79 HydrophobicContact CD2-CB 3.9Å; F47-A79 WeakPolarHBondContact CD2-O 3.47Å; F47-A79 HydrophobicContact CE2-CB 3.92Å; W58-A79 HydrophobicContact CD2-CB 3.64Å; W58-A79 HydrophobicContact CE3-CB 3.75Å; W58-A79 HydrophobicContact CG-CB 4.24Å; W58-A79 HydrophobicContact CH2-CB 4.02Å; W58-A79 HydrophobicContact CZ2-CB 3.94Å; W58-A79 HydrophobicContact CZ3-CB 3.93Å; A79-A82 WeakPolarHBondContact O-CB 3.28Å; A79-A82 PolarHBondContact O-N 2.77Å; A79-A83 VanDerWaalsContact O-CB 3.32Å; A79-A83 WeakPolarHBondContact O-CB 3.43Å; A79-A83 PolarHBondContact O-N 2.94Å
80E93.6Very high93.9Very high64 Ų6448.7 Ų48.730%0.29922%0.223SC..Hα-helixtrans-66-44179.6-69.666.4-153.700111.5K46 F47 T78 A83 R84 F102K46-E80 WeakPolarHBondContact CE-OE1 3.48Å; K46-E80 IonicContact NZ-OE1 2.6Å; K46-E80 PolarHBondContact NZ-OE1 2.6Å; K46-E80 IonicContact NZ-OE2 3.69Å; F47-E80 HydrophobicContact CE2-CG 4.01Å; F47-E80 HydrophobicContact CZ-CG 4.15Å; T78-E80 PolarHBondContact O-N 3.06Å; E80-A83 PolarHBondContact O-N 2.99Å; E80-R84 WeakPolarHBondContact O-CG 3.19Å; E80-R84 PolarHBondContact O-N 2.92Å; E80-F102 HydrophobicContact CB-CZ 4.43Å
81A93.5Very high93.8Very high22 Ų2240.3 Ų40.318%0.18220%0.195CC..Hα-helixtrans-67-40.3174.700000111.7F76 T78 A83 R84 A85F76-A81 HydrophobicContact CB-CB 4.3Å; F76-A81 HydrophobicContact CD1-CB 3.96Å; F76-A81 HydrophobicContact CG-CB 4.38Å; T78-A81 WeakPolarHBondContact OG1-CB 3.47Å; T78-A81 PolarHBondContact OG1-N 3.41Å; A81-A83 VanDerWaalsContact C-N 3.33Å; A81-A83 PolarHBondContact O-N 3.4Å; A81-R84 PolarHBondContact O-N 2.68Å; A81-A85 PolarHBondContact O-N 3.22Å
82A94.6Very high93.6Very high0 Ų042.6 Ų42.60%021%0.207CC..Hα-helixtrans-59.4-43.317400000112.1V50 W58 A60 F76 T78 A79 A85 Y86V50-A82 HydrophobicContact CB-CB 4.42Å; V50-A82 HydrophobicContact CG1-CB 3.83Å; V50-A82 HydrophobicContact CG2-CB 3.72Å; W58-A82 HydrophobicContact CB-CB 4.08Å; A60-A82 HydrophobicContact CB-CB 4.14Å; A60-A82 WeakPolarHBondContact CB-O 3.45Å; F76-A82 HydrophobicContact CB-CB 4.05Å; F76-A82 VanDerWaalsContact CD2-CA 3.49Å; F76-A82 HydrophobicContact CD2-CB 3.64Å; F76-A82 HydrophobicContact CE2-CB 4.43Å; F76-A82 HydrophobicContact CG-CB 4.03Å; T78-A82 PolarHBondContact O-N 3.01Å; A79-A82 WeakPolarHBondContact O-CB 3.28Å; A79-A82 PolarHBondContact O-N 2.77Å; A82-A85 PolarHBondContact O-N 3.25Å; A82-Y86 PolarHBondContact O-N 3.42Å
83A94.2Very high93.5Very high0 Ų035.4 Ų35.40%018%0.18CC..Hα-helixtrans-69.1-37.9178.200000112.6F47 V50 A79 E80 A81 Y86 D87 N101 F102F47-A83 HydrophobicContact CB-CB 3.59Å; F47-A83 HydrophobicContact CD1-CB 4.25Å; F47-A83 HydrophobicContact CD2-CB 3.66Å; F47-A83 HydrophobicContact CE2-CB 4.39Å; F47-A83 HydrophobicContact CG-CB 3.59Å; V50-A83 HydrophobicContact CG2-CB 3.86Å; A79-A83 VanDerWaalsContact O-CB 3.32Å; A79-A83 WeakPolarHBondContact O-CB 3.43Å; A79-A83 PolarHBondContact O-N 2.94Å; E80-A83 PolarHBondContact O-N 2.99Å; A81-A83 VanDerWaalsContact C-N 3.33Å; A81-A83 PolarHBondContact O-N 3.4Å; A83-Y86 WeakPolarHBondContact O-CB 3.36Å; A83-Y86 PolarHBondContact O-N 2.68Å; A83-D87 VanDerWaalsContact O-CG 3.3Å; A83-D87 PolarHBondContact O-N 3.08Å; A83-N101 HydrophobicContact CB-CB 4.39Å; A83-F102 HydrophobicContact CB-CE2 3.53Å; A83-F102 HydrophobicContact CB-CZ 3.97Å
84R93.4Very high93.3Very high126 Ų12641.7 Ų41.748%0.47520%0.203SC..Hα-helixtrans-63.8-43.3174.2-76.1-169.4-61.4-89.35.1111.8E80 A81 Y86 D87 E88 F102E80-R84 WeakPolarHBondContact O-CG 3.19Å; E80-R84 PolarHBondContact O-N 2.92Å; A81-R84 PolarHBondContact O-N 2.68Å; R84-Y86 VanDerWaalsContact C-N 3.28Å; R84-Y86 PolarHBondContact O-N 2.9Å; R84-D87 PolarHBondContact O-N 3.39Å; R84-E88 WeakPolarHBondContact O-CG 3.35Å; R84-E88 PolarHBondContact O-N 3.41Å; R84-F102 HydrophobicContact CB-CE2 4.37Å; R84-F102 HydrophobicContact CG-CD2 3.58Å; R84-F102 HydrophobicContact CG-CE2 3.51Å; R84-F102 HydrophobicContact CG-CZ 4.4Å
85A93.7Very high93Very high6 Ų642.4 Ų42.45%0.0521%0.211CC..Hα-helixtrans-62.1-36.1174.800000112.2F76 A81 A82 A89 L112F76-A85 HydrophobicContact CE1-CB 4Å; F76-A85 HydrophobicContact CE2-CB 3.94Å; F76-A85 HydrophobicContact CZ-CB 3.37Å; A81-A85 PolarHBondContact O-N 3.22Å; A82-A85 PolarHBondContact O-N 3.25Å; A85-A89 WeakPolarHBondContact O-CB 3.43Å; A85-A89 PolarHBondContact O-N 3.34Å; A85-A89 VanDerWaalsContact O-N 3.12Å; A85-L112 HydrophobicContact CB-CD2 3.89Å; A85-L112 WeakPolarHBondContact O-CD2 3.5Å
86Y94.8Very high92.4Very high40 Ų4044.9 Ų44.916%0.15724%0.237CC..Hα-helixtrans-65.7-43.8172.4-175.6-92.2000112.3V48 I62 L73 A82 A83 R84 A89 A90V48-Y86 HydrophobicContact CB-CE1 4.42Å; V48-Y86 HydrophobicContact CG1-CE1 3.88Å; V48-Y86 WeakPolarHBondContact O-CD1 3.33Å; I62-Y86 HydrophobicContact CB-CD2 4.23Å; I62-Y86 HydrophobicContact CB-CE2 3.91Å; I62-Y86 HydrophobicContact CD1-CD2 4.37Å; I62-Y86 HydrophobicContact CD1-CE2 3.87Å; I62-Y86 HydrophobicContact CG1-CE2 3.82Å; L73-Y86 HydrophobicContact CD1-CD2 4.18Å; A82-Y86 PolarHBondContact O-N 3.42Å; A83-Y86 WeakPolarHBondContact O-CB 3.36Å; A83-Y86 PolarHBondContact O-N 2.68Å; R84-Y86 VanDerWaalsContact C-N 3.28Å; R84-Y86 PolarHBondContact O-N 2.9Å; Y86-A89 PolarHBondContact O-N 3.37Å; Y86-A90 HydrophobicContact CD1-CB 4.49Å; Y86-A90 HydrophobicContact CE1-CB 4.26Å; Y86-A90 VanDerWaalsContact O-CB 3.25Å; Y86-A90 WeakPolarHBondContact O-CB 3.38Å; Y86-A90 PolarHBondContact O-N 2.68Å
87D93.3Very high92Very high5 Ų549 Ų493%0.02726%0.262CS..Hα-helixtrans-64.5-43.5178.4-70.4-8000112.1A83 R84 A89 A90 C91 T100 N101 F102A83-D87 VanDerWaalsContact O-CG 3.3Å; A83-D87 PolarHBondContact O-N 3.08Å; R84-D87 PolarHBondContact O-N 3.39Å; D87-A89 VanDerWaalsContact C-N 3.34Å; D87-A89 PolarHBondContact O-N 3.07Å; D87-A90 PolarHBondContact O-N 3.32Å; D87-C91 WeakPolarHBondContact O-CB 3.34Å; D87-C91 PolarHBondContact O-N 3.11Å; D87-C91 PolarHBondContact O-SG 3.17Å; D87-C91 VanDerWaalsContact O-SG 3.39Å; D87-T100 HydrophobicContact CB-CG2 3.75Å; D87-T100 VanDerWaalsContact CG-CB 3.46Å; D87-T100 WeakPolarHBondContact OD1-CA 3.48Å; D87-T100 WeakPolarHBondContact OD2-CB 3.03Å; D87-N101 PolarHBondContact OD1-N 2.8Å; D87-N101 PolarHBondContact OD1-ND2 3.47Å; D87-N101 WeakPolarHBondContact OD2-CA 3.34Å; D87-N101 WeakPolarHBondContact OD2-CB 3.26Å; D87-N101 PolarHBondContact OD2-N 2.83Å; D87-F102 VanDerWaalsContact OD2-CD2 3.28Å; D87-F102 WeakPolarHBondContact OD2-CD2 3.15Å; D87-F102 PolarHBondContact OD2-N 3.1Å
88E92.6Very high91.6Very high32 Ų3241.9 Ų41.915%0.1523%0.229CC..Hα-helixtrans-51-53.3169-78.6175.7-146.800110.9R84 A90 L92 P106 S110 L112R84-E88 WeakPolarHBondContact O-CG 3.35Å; R84-E88 PolarHBondContact O-N 3.41Å; E88-A90 PolarHBondContact O-N 3.19Å; E88-L92 WeakPolarHBondContact O-CD1 3.39Å; E88-L92 VanDerWaalsContact O-CG 3.26Å; E88-L92 WeakPolarHBondContact O-CG 3.24Å; E88-L92 PolarHBondContact O-N 3.39Å; E88-P106 HydrophobicContact CB-CB 4.09Å; E88-P106 HydrophobicContact CG-CB 3.41Å; E88-P106 VanDerWaalsContact CG-CB 3.41Å; E88-S110 WeakPolarHBondContact OE2-CB 3.25Å; E88-S110 PolarHBondContact OE2-OG 3.24Å; E88-L112 HydrophobicContact CB-CD2 4.49Å
89A93Very high91.3Very high0 Ų045.9 Ų45.90%024%0.237CC..Hα-helixtrans-66.1-39.2-177.100000113.6I62 L73 A85 Y86 D87 L92 L93 I116I62-A89 HydrophobicContact CD1-CB 4.31Å; I62-A89 HydrophobicContact CG2-CB 4.15Å; L73-A89 HydrophobicContact CD1-CB 3.79Å; L73-A89 HydrophobicContact CD2-CB 3.48Å; L73-A89 VanDerWaalsContact CD2-CB 3.48Å; L73-A89 HydrophobicContact CG-CB 4.3Å; A85-A89 WeakPolarHBondContact O-CB 3.43Å; A85-A89 PolarHBondContact O-N 3.34Å; A85-A89 VanDerWaalsContact O-N 3.12Å; Y86-A89 PolarHBondContact O-N 3.37Å; D87-A89 VanDerWaalsContact C-N 3.34Å; D87-A89 PolarHBondContact O-N 3.07Å; A89-L92 PolarHBondContact O-N 3.49Å; A89-L93 WeakPolarHBondContact O-CG 3.41Å; A89-L93 PolarHBondContact O-N 2.83Å; A89-I116 HydrophobicContact CB-CD1 3.38Å
90A92.4Very high91.2Very high4 Ų448 Ų483%0.03325%0.25CS..Hα-helixtrans-68.2-43.9-17900000111I62 Y86 D87 E88 L92 L93 R94 T98I62-A90 HydrophobicContact CD1-CB 3.74Å; Y86-A90 HydrophobicContact CD1-CB 4.49Å; Y86-A90 HydrophobicContact CE1-CB 4.26Å; Y86-A90 VanDerWaalsContact O-CB 3.25Å; Y86-A90 WeakPolarHBondContact O-CB 3.38Å; Y86-A90 PolarHBondContact O-N 2.68Å; D87-A90 PolarHBondContact O-N 3.32Å; E88-A90 PolarHBondContact O-N 3.19Å; A90-L92 PolarHBondContact O-N 3Å; A90-L93 PolarHBondContact O-N 3.39Å; A90-R94 PolarHBondContact O-N 3.31Å; A90-R94 VanDerWaalsContact O-N 3.11Å; A90-T98 HydrophobicContact CB-CG2 3.58Å; A90-T98 PolarHBondContact O-OG1 3.06Å
91C91.1Very high91.1Very high27 Ų2747 Ų4718%0.18225%0.247CC..Hα-helixtrans-60-31.6173.3-75.90000113.2D87 G95 T100 P106D87-C91 WeakPolarHBondContact O-CB 3.34Å; D87-C91 PolarHBondContact O-N 3.11Å; D87-C91 PolarHBondContact O-SG 3.17Å; D87-C91 VanDerWaalsContact O-SG 3.39Å; C91-G95 CarbonylContact O-C 3.21Å; C91-G95 WeakPolarHBondContact O-CA 3.07Å; C91-G95 PolarHBondContact O-N 3.25Å; C91-T100 VanDerWaalsContact SG-CG2 3.53Å; C91-P106 HydrophobicContact CB-CG 3.91Å
92L90.3Very high90.9Very high55 Ų5548.7 Ų48.729%0.28825%0.25SS..Hα-helixtrans-79.6-39.6178-68162.7000113.5E88 A89 A90 A113 I116E88-L92 WeakPolarHBondContact O-CD1 3.39Å; E88-L92 VanDerWaalsContact O-CG 3.26Å; E88-L92 WeakPolarHBondContact O-CG 3.24Å; E88-L92 PolarHBondContact O-N 3.39Å; A89-L92 PolarHBondContact O-N 3.49Å; A90-L92 PolarHBondContact O-N 3Å; L92-A113 VanDerWaalsContact CD1-CA 3.45Å; L92-A113 HydrophobicContact CD1-CB 3.46Å; L92-A113 VanDerWaalsContact CD1-CB 3.46Å; L92-A113 HydrophobicContact CD2-CB 4.33Å; L92-I116 HydrophobicContact CB-CG2 4.07Å; L92-I116 HydrophobicContact CD1-CB 4.4Å; L92-I116 HydrophobicContact CD1-CD1 4.2Å; L92-I116 HydrophobicContact CD1-CG2 4.49Å
93L89.8Confident90.3Very high6 Ų654.1 Ų54.13%0.03130%0.295CS..Hα-helixtrans-77.7-30-176.6-73.5173.8000113.7I62 D64 Q67 A89 A90 I116I62-L93 HydrophobicContact CD1-CD1 4.03Å; I62-L93 HydrophobicContact CG1-CD1 4.1Å; I62-L93 HydrophobicContact CG2-CD1 3.65Å; D64-L93 HydrophobicContact CB-CD1 4.34Å; Q67-L93 HydrophobicContact CG-CD2 4.44Å; Q67-L93 PolarHBondContact NE2-O 3.39Å; A89-L93 WeakPolarHBondContact O-CG 3.41Å; A89-L93 PolarHBondContact O-N 2.83Å; A90-L93 PolarHBondContact O-N 3.39Å; L93-I116 HydrophobicContact CD2-CG2 3.82Å; L93-I116 HydrophobicContact CG-CG2 3.99Å
94R89.8Confident89.4Confident138 Ų13858 Ų5852%0.52133%0.327SS..Hα-helixtrans-119.5-16.6-175.2177.2-177.5-50.4177.28.8113.9D64 A90 N97 T98D64-R94 IonicContact OD2-CZ 2.68Å; D64-R94 IonicContact OD2-NE 3.68Å; D64-R94 IonicContact OD2-NH2 3.58Å; D64-R94 PolarHBondContact OD2-NH2 3.45Å; A90-R94 PolarHBondContact O-N 3.31Å; A90-R94 VanDerWaalsContact O-N 3.11Å; R94-N97 PolarHBondContact O-OD1 3.18Å; R94-T98 HydrophobicContact CB-CG2 4.49Å; R94-T98 VanDerWaalsContact CB-OG1 3.24Å; R94-T98 WeakPolarHBondContact CB-OG1 3.41Å; R94-T98 WeakPolarHBondContact CD-OG1 3.49Å; R94-T98 WeakPolarHBondContact CG-OG1 3.45Å
95G87.9Confident88.2Confident29 Ų2956.3 Ų56.330%0.29934%0.34SS..  trans100.4-179.9178.700000113.6C91 N97 T98C91-G95 CarbonylContact O-C 3.21Å; C91-G95 WeakPolarHBondContact O-CA 3.07Å; C91-G95 PolarHBondContact O-N 3.25Å; G95-N97 PolarHBondContact O-N 3.12Å; G95-T98 WeakPolarHBondContact O-CB 3.41Å; G95-T98 PolarHBondContact O-N 3.4Å; G95-T98 PolarHBondContact O-OG1 2.89Å
96A84.9Confident87.1Confident107 Ų10757.9 Ų57.988%0.88435%0.35SS*.THydrogen-bonded Turntrans-65.5-9.3-174.400000115.3T98A96-T98 VanDerWaalsContact C-N 3.27Å
97N85.3Confident85.9Confident138 Ų13859.6 Ų59.674%0.73837%0.366SS*.THydrogen-bonded Turntrans-87.49.1175.866-0.8000113.4R94 G95R94-N97 PolarHBondContact O-OD1 3.18Å; G95-N97 PolarHBondContact O-N 3.12Å
98T87.2Confident84.7Confident16 Ų1663.4 Ų63.410%0.09839%0.391CS..  trans-78.2137.6-174.7-57.30000111.7A90 R94 G95 A96 T100A90-T98 HydrophobicContact CB-CG2 3.58Å; A90-T98 PolarHBondContact O-OG1 3.06Å; R94-T98 HydrophobicContact CB-CG2 4.49Å; R94-T98 VanDerWaalsContact CB-OG1 3.24Å; R94-T98 WeakPolarHBondContact CB-OG1 3.41Å; R94-T98 WeakPolarHBondContact CD-OG1 3.49Å; R94-T98 WeakPolarHBondContact CG-OG1 3.45Å; G95-T98 WeakPolarHBondContact O-CB 3.41Å; G95-T98 PolarHBondContact O-N 3.4Å; G95-T98 PolarHBondContact O-OG1 2.89Å; A96-T98 VanDerWaalsContact C-N 3.27Å; T98-T100 PolarHBondContact O-N 2.84Å; T98-T100 VanDerWaalsContact O-N 3.12Å
99R89Confident83.8Confident147 Ų14768.3 Ų68.356%0.55542%0.418SS*.  trans-74103.6174.3-178.7175.162.1-169.4-6.7110.4K36K36-R99 PolarHBondContact O-NH1 2.97Å
100T91.6Very high83.4Confident46 Ų4669.1 Ų69.128%0.28242%0.424SS..  trans-84.3168.2172.852.30000112.4D87 C91 T98 F102D87-T100 HydrophobicContact CB-CG2 3.75Å; D87-T100 VanDerWaalsContact CG-CB 3.46Å; D87-T100 WeakPolarHBondContact OD1-CA 3.48Å; D87-T100 WeakPolarHBondContact OD2-CB 3.03Å; C91-T100 VanDerWaalsContact SG-CG2 3.53Å; T98-T100 PolarHBondContact O-N 2.84Å; T98-T100 VanDerWaalsContact O-N 3.12Å; T100-F102 WeakPolarHBondContact CB-O 3.37Å; T100-F102 PolarHBondContact OG1-O 2.8Å
101N91.6Very high83.2Confident44 Ų4474.2 Ų74.224%0.23546%0.456CS..SBendtrans-80.7-37.6169.1-63.6-80.5000111.7F47 V48 A83 D87F47-N101 HydrophobicContact CD1-CB 4.31Å; V48-N101 WeakPolarHBondContact CB-OD1 3.36Å; V48-N101 PolarHBondContact N-OD1 3.14Å; V48-N101 PolarHBondContact O-ND2 2.81Å; A83-N101 HydrophobicContact CB-CB 4.39Å; D87-N101 PolarHBondContact OD1-N 2.8Å; D87-N101 PolarHBondContact OD1-ND2 3.47Å; D87-N101 WeakPolarHBondContact OD2-CA 3.34Å; D87-N101 WeakPolarHBondContact OD2-CB 3.26Å; D87-N101 PolarHBondContact OD2-N 2.83Å
102F89.3Confident83.1Confident57 Ų5773.6 Ų73.625%0.2545%0.451CS..SBendtrans-105.7147.8-179.9-56.2-71.9000112.2F47 E80 A83 R84 D87 T100 A104F47-F102 HydrophobicContact CE1-CE1 4.2Å; F47-F102 HydrophobicContact CE1-CZ 4.08Å; F47-F102 HydrophobicContact CE2-CZ 4.48Å; F47-F102 HydrophobicContact CZ-CE1 4.32Å; F47-F102 HydrophobicContact CZ-CZ 4.05Å; E80-F102 HydrophobicContact CB-CZ 4.43Å; A83-F102 HydrophobicContact CB-CE2 3.53Å; A83-F102 HydrophobicContact CB-CZ 3.97Å; R84-F102 HydrophobicContact CB-CE2 4.37Å; R84-F102 HydrophobicContact CG-CD2 3.58Å; R84-F102 HydrophobicContact CG-CE2 3.51Å; R84-F102 HydrophobicContact CG-CZ 4.4Å; D87-F102 VanDerWaalsContact OD2-CD2 3.28Å; D87-F102 WeakPolarHBondContact OD2-CD2 3.15Å; D87-F102 PolarHBondContact OD2-N 3.1Å; T100-F102 WeakPolarHBondContact CB-O 3.37Å; T100-F102 PolarHBondContact OG1-O 2.8Å; F102-A104 VanDerWaalsContact C-N 3.34Å
103A81.7Confident83Confident114 Ų11471 Ų7194%0.94244%0.438SS*.SBendtrans-80-15.317500000113.4
104A75.1Confident83Confident80 Ų8073.4 Ų73.466%0.66146%0.459SS*.SBendtrans-73.7127.8173.500000109.8F102F102-A104 VanDerWaalsContact C-N 3.34Å
105A67.5Low83.1Confident92 Ų9272.5 Ų72.576%0.7646%0.455SS*.PPolyproline II helixtrans-63.7135.6176.600000110.6
106P70.5Confident83.2Confident38 Ų3871.2 Ų71.225%0.24744%0.442CS..PPolyproline II helixtrans-63.7145.6176.121.7-30.3000112.2E88 C91E88-P106 HydrophobicContact CB-CB 4.09Å; E88-P106 HydrophobicContact CG-CB 3.41Å; E88-P106 VanDerWaalsContact CG-CB 3.41Å; C91-P106 HydrophobicContact CB-CG 3.91Å
107P71.2Confident83.5Confident77 Ų7770.7 Ų70.750%0.542%0.417SS..PPolyproline II helixtrans-66129.6172.828-33.3000110.3D109P107-D109 PolarHBondContact O-N 3.33Å
108P67.6Low83.7Confident85 Ų8565.2 Ų65.255%0.55239%0.393SS*.THydrogen-bonded Turntrans-70.3-16.5-17226.4-34.2000114.7A113 R117P108-A113 WeakPolarHBondContact O-CB 3.45Å; P108-R117 PolarHBondContact O-NH1 3.47Å
109D74Confident83.8Confident134 Ų13467.8 Ų67.872%0.71741%0.405SS*.THydrogen-bonded Turntrans-110.620.2-166.8-59-48.3000114.2P107P107-D109 PolarHBondContact O-N 3.33Å
110S84.4Confident83.7Confident17 Ų1763.3 Ų63.312%0.11939%0.392CS..  trans-64.4151.2176.785.60000111.9E88 L112 A113 A114E88-S110 WeakPolarHBondContact OE2-CB 3.25Å; E88-S110 PolarHBondContact OE2-OG 3.24Å; S110-L112 PolarHBondContact O-N 2.88Å; S110-A113 WeakPolarHBondContact O-CA 3.5Å; S110-A113 VanDerWaalsContact O-CB 3.25Å; S110-A113 WeakPolarHBondContact O-CB 3.34Å; S110-A113 PolarHBondContact O-N 3.03Å; S110-A113 PolarHBondContact OG-N 2.83Å; S110-A113 VanDerWaalsContact OG-N 3.11Å; S110-A114 PolarHBondContact O-N 2.97Å
111P87.6Confident83.5Confident111 Ų11165.6 Ų65.672%0.72140%0.402SS*.Hα-helixtrans-63.2-24.6175.425.9-34.8000112.1R115P111-R115 WeakPolarHBondContact O-CG 3.5Å; P111-R115 PolarHBondContact O-N 3.04Å
112L88.7Confident83.1Confident15 Ų1569.8 Ų69.88%0.07942%0.42CS..Hα-helixtrans-65.5-40.8170-177.963.8000111.1L73 A85 E88 S110 A114 R115 I116L73-L112 HydrophobicContact CB-CD1 4.19Å; L73-L112 HydrophobicContact CB-CD2 4.29Å; L73-L112 HydrophobicContact CD2-CD1 3.88Å; L73-L112 HydrophobicContact CD2-CD2 4.26Å; L73-L112 HydrophobicContact CD2-CG 4.46Å; A85-L112 HydrophobicContact CB-CD2 3.89Å; A85-L112 WeakPolarHBondContact O-CD2 3.5Å; E88-L112 HydrophobicContact CB-CD2 4.49Å; S110-L112 PolarHBondContact O-N 2.88Å; L112-A114 PolarHBondContact O-N 3.32Å; L112-R115 WeakPolarHBondContact O-CB 3.21Å; L112-R115 PolarHBondContact O-N 3.32Å; L112-I116 HydrophobicContact CD1-CD1 4.2Å; L112-I116 HydrophobicContact CG-CD1 3.96Å; L112-I116 WeakPolarHBondContact O-CG1 3.47Å; L112-I116 PolarHBondContact O-N 2.82Å
113A89.2Confident82.6Confident1 Ų170.5 Ų70.51%0.00843%0.427CS..Hα-helixtrans-62.4-42.6176.700000112.5L92 P108 S110 R115 I116 R117L92-A113 VanDerWaalsContact CD1-CA 3.45Å; L92-A113 HydrophobicContact CD1-CB 3.46Å; L92-A113 VanDerWaalsContact CD1-CB 3.46Å; L92-A113 HydrophobicContact CD2-CB 4.33Å; P108-A113 WeakPolarHBondContact O-CB 3.45Å; S110-A113 WeakPolarHBondContact O-CA 3.5Å; S110-A113 VanDerWaalsContact O-CB 3.25Å; S110-A113 WeakPolarHBondContact O-CB 3.34Å; S110-A113 PolarHBondContact O-N 3.03Å; S110-A113 PolarHBondContact OG-N 2.83Å; S110-A113 VanDerWaalsContact OG-N 3.11Å; A113-R115 PolarHBondContact O-N 3.24Å; A113-I116 PolarHBondContact O-N 2.98Å; A113-R117 WeakPolarHBondContact O-CB 3.36Å; A113-R117 WeakPolarHBondContact O-CG 3.36Å; A113-R117 PolarHBondContact O-N 3.25Å
114A89.8Confident82.2Confident56 Ų5671.2 Ų71.246%0.46342%0.415SS..Hα-helixtrans-60.3-43.8174.200000112.4S110 L112 I116 G118S110-A114 PolarHBondContact O-N 2.97Å; L112-A114 PolarHBondContact O-N 3.32Å; A114-I116 PolarHBondContact O-N 2.59Å; A114-G118 PolarHBondContact O-N 3.11Å
115R91Very high82Confident118 Ų11872.2 Ų72.245%0.44541%0.409SS..Hα-helixtrans-59.2-45.3175.1-71.6166.958.7-146.4-7.4112.1W72 L73 P111 L112 A113 G118 I119W72-R115 PolarHBondContact O-NH2 3.46Å; L73-R115 PolarHBondContact O-NH1 3.16Å; P111-R115 WeakPolarHBondContact O-CG 3.5Å; P111-R115 PolarHBondContact O-N 3.04Å; L112-R115 WeakPolarHBondContact O-CB 3.21Å; L112-R115 PolarHBondContact O-N 3.32Å; A113-R115 PolarHBondContact O-N 3.24Å; R115-G118 PolarHBondContact O-N 2.59Å; R115-I119 WeakPolarHBondContact O-CG1 3.49Å; R115-I119 PolarHBondContact O-N 3.21Å; R115-I119 VanDerWaalsContact O-N 3.11Å
116I90.6Very high81.7Confident3 Ų374.5 Ų74.52%0.01541%0.409CS..Hα-helixtrans-69.1-43.6-177.8-68.5169.4000111.5V71 L73 A89 L92 L93 L112 A113 A114 G118 I119 L120V71-I116 HydrophobicContact CG1-CG1 4.17Å; L73-I116 HydrophobicContact CD2-CD1 4.1Å; A89-I116 HydrophobicContact CB-CD1 3.38Å; L92-I116 HydrophobicContact CB-CG2 4.07Å; L92-I116 HydrophobicContact CD1-CB 4.4Å; L92-I116 HydrophobicContact CD1-CD1 4.2Å; L92-I116 HydrophobicContact CD1-CG2 4.49Å; L93-I116 HydrophobicContact CD2-CG2 3.82Å; L93-I116 HydrophobicContact CG-CG2 3.99Å; L112-I116 HydrophobicContact CD1-CD1 4.2Å; L112-I116 HydrophobicContact CG-CD1 3.96Å; L112-I116 WeakPolarHBondContact O-CG1 3.47Å; L112-I116 PolarHBondContact O-N 2.82Å; A113-I116 PolarHBondContact O-N 2.98Å; A114-I116 PolarHBondContact O-N 2.59Å; I116-G118 VanDerWaalsContact C-N 3.34Å; I116-G118 PolarHBondContact O-N 3.4Å; I116-I119 PolarHBondContact O-N 3.12Å; I116-L120 PolarHBondContact O-N 3.05Å
117R90.1Very high81Confident96 Ų9676.2 Ų76.236%0.36243%0.433SS..Hα-helixtrans-56.6-48.8174.2-73.2-175.3-69.3-109.48.8110.9P108 A113 I119 L120 D121P108-R117 PolarHBondContact O-NH1 3.47Å; A113-R117 WeakPolarHBondContact O-CB 3.36Å; A113-R117 WeakPolarHBondContact O-CG 3.36Å; A113-R117 PolarHBondContact O-N 3.25Å; R117-I119 PolarHBondContact O-N 2.95Å; R117-L120 WeakPolarHBondContact O-CB 3.25Å; R117-L120 PolarHBondContact O-N 3.31Å; R117-L120 VanDerWaalsContact O-N 3.09Å; R117-D121 VanDerWaalsContact O-CG 3.28Å; R117-D121 PolarHBondContact O-N 3.49Å
118G90.6Very high80.2Confident23 Ų2382.3 Ų82.324%0.23745%0.446CS..Hα-helixtrans-53-51.7174.400000112.8A114 R115 I116 L120 D121 H122A114-G118 PolarHBondContact O-N 3.11Å; R115-G118 PolarHBondContact O-N 2.59Å; I116-G118 VanDerWaalsContact C-N 3.34Å; I116-G118 PolarHBondContact O-N 3.4Å; G118-L120 VanDerWaalsContact C-N 3.27Å; G118-L120 PolarHBondContact O-N 3.01Å; G118-D121 PolarHBondContact O-N 3.27Å; G118-H122 PolarHBondContact O-N 3.19Å; G118-H122 VanDerWaalsContact O-N 3.1Å; G118-H122 PolarHBondContact O-ND1 3.49Å
119I88Confident79.7Confident69 Ų6984.1 Ų84.135%0.35446%0.455SS..Hα-helixtrans-57.5-40.4178.7-65.9162.8000111.7V69 V71 R115 I116 R117 H122 N123V69-I119 HydrophobicContact CG1-CG2 3.62Å; V69-I119 HydrophobicContact CG2-CG2 4.4Å; V71-I119 HydrophobicContact CG1-CD1 3.98Å; V71-I119 HydrophobicContact CG2-CD1 4.11Å; R115-I119 WeakPolarHBondContact O-CG1 3.49Å; R115-I119 PolarHBondContact O-N 3.21Å; R115-I119 VanDerWaalsContact O-N 3.11Å; I116-I119 PolarHBondContact O-N 3.12Å; R117-I119 PolarHBondContact O-N 2.95Å; I119-H122 PolarHBondContact O-N 3.11Å; I119-N123 PolarHBondContact O-N 2.92Å
120L87.5Confident79.1Confident54 Ų5483 Ų8328%0.28346%0.455SS..Hα-helixtrans-66.6-42.4178.5-173.161.7000112.2Q67 I116 R117 G118 H122 N123 N124Q67-L120 HydrophobicContact CG-CD1 4.43Å; I116-L120 PolarHBondContact O-N 3.05Å; R117-L120 WeakPolarHBondContact O-CB 3.25Å; R117-L120 PolarHBondContact O-N 3.31Å; R117-L120 VanDerWaalsContact O-N 3.09Å; G118-L120 VanDerWaalsContact C-N 3.27Å; G118-L120 PolarHBondContact O-N 3.01Å; L120-H122 VanDerWaalsContact C-N 3.32Å; L120-H122 PolarHBondContact O-N 3.48Å; L120-N123 PolarHBondContact O-N 3.49Å; L120-N124 PolarHBondContact O-N 3.47Å; L120-N124 VanDerWaalsContact O-N 3.14Å
121D87.6Confident77.7Confident93 Ų9387.4 Ų87.450%0.49748%0.484SS..Hα-helixtrans-62.1-38.5177.4-64.2-37.7000112.1R117 G118 N125R117-D121 VanDerWaalsContact O-CG 3.28Å; R117-D121 PolarHBondContact O-N 3.49Å; G118-D121 PolarHBondContact O-N 3.27Å; D121-N125 PolarHBondContact O-N 2.75Å; D121-N125 PolarHBondContact O-ND2 3.14Å
122H83.3Confident76Confident132 Ų13291.4 Ų91.461%0.61149%0.49SS*.Hα-helixtrans-70.3-39.2178.8-6857000111.4G118 I119 L120 N124 N125 N126G118-H122 PolarHBondContact O-N 3.19Å; G118-H122 VanDerWaalsContact O-N 3.1Å; G118-H122 PolarHBondContact O-ND1 3.49Å; I119-H122 PolarHBondContact O-N 3.11Å; L120-H122 VanDerWaalsContact C-N 3.32Å; L120-H122 PolarHBondContact O-N 3.48Å; H122-N124 PolarHBondContact O-N 2.83Å; H122-N125 PolarHBondContact O-N 3.09Å; H122-N126 PolarHBondContact O-N 3.14Å; H122-N126 VanDerWaalsContact O-N 3.09Å
123N79Confident74.2Confident72 Ų72100.3 Ų100.339%0.38553%0.528SS..Hα-helixtrans-63-41.9177.5-166.531.2000112Q67 I119 L120 N125 N126Q67-N123 PolarHBondContact O-ND2 3.19Å; Q67-N123 VanDerWaalsContact O-ND2 3.12Å; I119-N123 PolarHBondContact O-N 2.92Å; L120-N123 PolarHBondContact O-N 3.49Å; N123-N125 VanDerWaalsContact C-N 3.31Å; N123-N125 PolarHBondContact O-N 3.21Å; N123-N126 PolarHBondContact O-N 2.86Å
124N74.3Confident72.6Confident129 Ų129105.8 Ų105.869%0.6956%0.561SS**Hα-helixtrans-64.1-35.6176.8-16930.5000112.5L120 H122L120-N124 PolarHBondContact O-N 3.47Å; L120-N124 VanDerWaalsContact O-N 3.14Å; H122-N124 PolarHBondContact O-N 2.83Å
125N69.1Low71.4Confident102 Ų102110.1 Ų110.155%0.54558%0.576SS.*Hα-helixtrans-75.5-30.9178.9-74.5-50.5000113.4D121 H122 N123 G127 R128D121-N125 PolarHBondContact O-N 2.75Å; D121-N125 PolarHBondContact O-ND2 3.14Å; H122-N125 PolarHBondContact O-N 3.09Å; N123-N125 VanDerWaalsContact C-N 3.31Å; N123-N125 PolarHBondContact O-N 3.21Å; N125-G127 PolarHBondContact O-N 3.49Å; N125-R128 PolarHBondContact O-N 3.4Å
126N61Low70Confident140 Ų140110.1 Ų110.175%0.74959%0.591SS**Hα-helixtrans-65.4-19.2177.6-75.8-7.6000113.7H122 N123H122-N126 PolarHBondContact O-N 3.14Å; H122-N126 VanDerWaalsContact O-N 3.09Å; N123-N126 PolarHBondContact O-N 2.86Å
127G56.4Low68.1Low73 Ų73117.8 Ų117.875%0.75363%0.627SS**THydrogen-bonded Turntrans-78.5-14.6170.900000114.4N125N125-G127 PolarHBondContact O-N 3.49Å
128R55.4Low66.5Low206 Ų206123.6 Ų123.678%0.77765%0.648SS**SBendtrans-96112.5170.8-93.8-176.9167.3-163.4-3.9109.1N125N125-R128 PolarHBondContact O-N 3.4Å
129T57.1Low65Low122 Ų122128 Ų12875%0.74867%0.673SS**PPolyproline II helixtrans-46.2134.1162.849.70000109P131T129-P131 VanDerWaalsContact O-N 3.16Å
130P59.8Low63.4Low111 Ų111130.9 Ų130.972%0.72169%0.694SS**PPolyproline II helixtrans-57.1128.8179.423.6-33000107.5K132P130-K132 PolarHBondContact O-N 3.18Å
131P55.4Low61.9Low110 Ų110132.1 Ų132.171%0.71471%0.712SS**PPolyproline II helixtrans-56.7119.317423.8-32000106.2T129 K133T129-P131 VanDerWaalsContact O-N 3.16Å; P131-K133 PolarHBondContact O-N 3.42Å
132K51.4Low60.1Low195 Ų195131.6 Ų131.685%0.84872%0.72SS**  trans-48.9111.5175.9-79.4-178.6175.9178.20106.1P130 T134P130-K132 PolarHBondContact O-N 3.18Å; K132-T134 PolarHBondContact O-N 3.31Å
133K52.4Low58.7Low202 Ų202136 Ų13688%0.87873%0.732SS**  trans-67.387.1176.7-70.1-177.7-179.8178.50106.5P131 L135P131-K133 PolarHBondContact O-N 3.42Å; K133-L135 PolarHBondContact O-N 3.42Å
134T55.8Low57.5Low115 Ų115141.6 Ų141.671%0.70675%0.753SS**  trans-56.8107.8170.343.60000106.3K132K132-T134 PolarHBondContact O-N 3.31Å
135L62.9Low56.1Low147 Ų147145.2 Ų145.277%0.7776%0.763SS**  trans-47.1128174.8-80.3136.9000108.4K133 H137K133-L135 PolarHBondContact O-N 3.42Å; L135-H137 PolarHBondContact O-CE1 2.95Å; L135-H137 PolarHBondContact O-N 3.1Å; L135-H137 PolarHBondContact O-ND1 3.19Å
136P61.6Low55.4Low119 Ų119146.2 Ų146.277%0.77378%0.775SS**  trans-61.2111.8174.925.3-32.4000107.6R138P136-R138 PolarHBondContact O-N 3.48Å
137H52.2Low54.6Low164 Ų164144.1 Ų144.176%0.75978%0.777SS**  trans-63.6107176.2-14.9-64000106.2L135 P139L135-H137 PolarHBondContact O-CE1 2.95Å; L135-H137 PolarHBondContact O-N 3.1Å; L135-H137 PolarHBondContact O-ND1 3.19Å; H137-P139 WeakPolarHBondContact O-CD 3.44Å; H137-P139 VanDerWaalsContact O-N 3.11Å
138R56.6Low53.9Low217 Ų217145.3 Ų145.382%0.81978%0.78SS**  trans-49.2120174.2173-177.5175.2-166.3-0.5107.5P136 T140P136-R138 PolarHBondContact O-N 3.48Å; R138-T140 PolarHBondContact O-N 3.29Å
139P59.1Low53.4Low116 Ų116140.3 Ų140.375%0.75378%0.783SS**  trans-63.8108.6172.625.3-31.6000107.1H137 A141H137-P139 WeakPolarHBondContact O-CD 3.44Å; H137-P139 VanDerWaalsContact O-N 3.11Å; P139-A141 VanDerWaalsContact C-N 3.29Å; P139-A141 PolarHBondContact O-N 2.69Å
140T53.2Low52.9Low129 Ų129138.6 Ų138.679%0.79178%0.781SS**  trans-64.296.9169.5-59.60000106.5R138 A142R138-T140 PolarHBondContact O-N 3.29Å; T140-A142 PolarHBondContact O-N 3.09Å
141A55.8Low52.5Low80 Ų80138.6 Ų138.666%0.66178%0.783SS**  trans-59.1105.517800000108.6P139 R143P139-A141 VanDerWaalsContact C-N 3.29Å; P139-A141 PolarHBondContact O-N 2.69Å; A141-R143 VanDerWaalsContact C-N 3.29Å; A141-R143 PolarHBondContact O-N 3.38Å
142A50Low52.4Low82 Ų82139.5 Ų139.568%0.67879%0.787SS**  trans-63.393.6171.600000107.9T140 F144T140-A142 PolarHBondContact O-N 3.09Å; A142-F144 WeakPolarHBondContact O-CD2 3.4Å; A142-F144 PolarHBondContact O-N 3.05Å; A142-F144 VanDerWaalsContact O-N 3.08Å
143R53.7Low52.4Low225 Ų225134.5 Ų134.585%0.84978%0.782SS**  trans-73101.4170.9-74.4-173.4175.4-179.4-2107.3A141 F145A141-R143 VanDerWaalsContact C-N 3.29Å; A141-R143 PolarHBondContact O-N 3.38Å; R143-F145 PolarHBondContact O-N 3.15Å
144F53.7Low52.5Low189 Ų189130 Ų13083%0.82978%0.776SS**  trans-51.3129166.9-73.2-96.6000109.5A142 P146A142-F144 WeakPolarHBondContact O-CD2 3.4Å; A142-F144 PolarHBondContact O-N 3.05Å; A142-F144 VanDerWaalsContact O-N 3.08Å; F144-P146 VanDerWaalsContact O-CD 3.28Å; F144-P146 WeakPolarHBondContact O-CD 3.45Å
145F46Very low52Low205 Ų205130.3 Ų130.390%0.89978%0.778SS**  trans-78.5129.5169.9-65.9-94.7000109.4R143R143-F145 PolarHBondContact O-N 3.15Å
146P53.8Low50.7Low123 Ų123128 Ų12880%0.79977%0.773SS**  trans-109.9138.6143.534.1-29000109.5F144F144-P146 VanDerWaalsContact O-CD 3.28Å; F144-P146 WeakPolarHBondContact O-CD 3.45Å
147A43.7Very low50Low97 Ų97127 Ų12780%0.80277%0.769SS**  trans-94.7151.1-175.300000113
148A42.6Very low49.6Very low97 Ų97124.2 Ų124.280%0.80277%0.768SS**  trans77.3133.4151.900000120.9
149A44.2Very low48.9Very low102 Ų102120.2 Ų120.284%0.84377%0.768SS**  trans66.7134.9155.900000119
150A47.7Very low48.3Very low85 Ų85119.1 Ų119.170%0.70277%0.769SS**  cis-160.4159.1-15.500000109.3
151S50.6Low47.8Very low111 Ų111118.5 Ų118.578%0.77677%0.769SS**  trans31.9138.7150.1-440000120.3
152T53.2Low47.7Very low130 Ų130120.1 Ų120.180%0.79877%0.773SS**  cis-172.2149.134.9-27.90000110.7
153A51.6Low47.5Very low89 Ų89123.4 Ų123.474%0.73679%0.785SS**  trans59.1155.215300000118.5
154S54.7Low46.9Very low109 Ų109117.8 Ų117.876%0.76278%0.781SS**  cis-172.5163.7-13-93.40000106.1
155T45.9Very low46.6Very low121 Ų121114.5 Ų114.574%0.74278%0.781SS**  cis-155.5-179.42.1-110.60000109
156C36.1Very low46.5Very low99 Ų99110.2 Ų110.267%0.66978%0.776SS**  trans-62.6164.8178.656.30000115.5
157S45.5Very low46.3Very low96 Ų96110.2 Ų110.267%0.67178%0.776SS**  -169.7133.270-62.40000111.1
158S44.7Very low46.3Very low107 Ų107110.4 Ų110.475%0.74877%0.772SS**  68.5137.790.9-46.80000114.5
159T42.3Very low46.1Very low132 Ų132110.9 Ų110.981%0.8177%0.769SS**  cis-171.4142.5-9.4-76.10000106.9
160A45Very low46.3Very low94 Ų94111.5 Ų111.578%0.77777%0.767SS**  trans164.7132.2140.700000112.8
161S42.8Very low46.5Very low115 Ų115113.9 Ų113.980%0.80477%0.767SS**  trans-111.6-158.9175.3-53.50000109.4
162P54.3Low46.5Very low114 Ų114114.1 Ų114.174%0.7477%0.769SS**  -118.9178.2-8236.2-20.8000111.7
163T46.2Very low46.1Very low151 Ų151116.4 Ų116.493%0.92677%0.768SS**  trans-168.7161.6148.68.20000113.4
164S40.7Very low45.7Very low108 Ų108116.9 Ų116.976%0.75577%0.771SS**  trans-88.6148-171.753.60000115.3
165S47.8Very low45Very low120 Ų120117.8 Ų117.884%0.83977%0.773SS**  trans-173.2139.313344.50000113
166S43.4Very low44.9Very low114 Ų114116.7 Ų116.780%0.79777%0.77SS**  trans-79.6165.3157.9-42.10000108.8
167P48.4Very low45.6Very low123 Ų123118.3 Ų118.380%0.79978%0.777SS**  -160.8-179.279.643.7-23.1000117.9
168S43.7Very low45.9Very low102 Ų102122.2 Ų122.271%0.71378%0.784SS**  trans66118.9144-148.80000122.2
169S39.2Very low46.1Very low107 Ų107121.7 Ų121.775%0.74879%0.787SS**  trans-54.5142.9151.649.40000113.9
170S49.3Very low46.3Very low114 Ų114126.1 Ų126.180%0.79779%0.788SS**  trans-14098.3162-70.70000109.8
171I52Low46.7Very low135 Ų135125.4 Ų125.469%0.69278%0.783SS**  trans-76.5126.6170.238.1172.3000109.6F173I171-F173 HydrophobicContact CD1-CE1 3.89Å; I171-F173 HydrophobicContact CD1-CZ 4.3Å; I171-F173 HydrophobicContact CG1-CE1 3.95Å; I171-F173 HydrophobicContact CG1-CZ 4.03Å; I171-F173 PolarHBondContact O-N 2.97Å
172S50.1Low47.1Very low117 Ų117125.8 Ų125.882%0.81878%0.783SS**  trans-82.3112.4-175.8-46.50000111.6A174S172-A174 PolarHBondContact O-N 3.39Å
173F43.8Very low47.2Very low178 Ų178126.6 Ų126.678%0.78178%0.779SS**  trans-83.993.7172.2-33.1-78.3000109.6I171 T175I171-F173 HydrophobicContact CD1-CE1 3.89Å; I171-F173 HydrophobicContact CD1-CZ 4.3Å; I171-F173 HydrophobicContact CG1-CE1 3.95Å; I171-F173 HydrophobicContact CG1-CZ 4.03Å; I171-F173 PolarHBondContact O-N 2.97Å; F173-T175 PolarHBondContact O-N 3.21Å
174A44.5Very low47.8Very low98 Ų98125 Ų12581%0.8177%0.772SS**  trans-78.2104.817400000110.3S172 S176S172-A174 PolarHBondContact O-N 3.39Å; A174-S176 PolarHBondContact O-N 3.09Å; A174-S176 VanDerWaalsContact O-N 3.11Å
175T38.6Very low48.4Very low129 Ų129126.2 Ų126.279%0.79178%0.775SS**  trans-7199.1174.849.70000110.8F173 T177F173-T175 PolarHBondContact O-N 3.21Å; T175-T177 PolarHBondContact O-N 3.27Å
176S43.6Very low48.6Very low98 Ų98127.7 Ų127.769%0.68577%0.772SS**  trans-83.2100.9171.2-171.90000110.3A174 H178A174-S176 PolarHBondContact O-N 3.09Å; A174-S176 VanDerWaalsContact O-N 3.11Å; S176-H178 PolarHBondContact O-N 3.26Å; S176-H178 VanDerWaalsContact O-N 3.15Å
177T51.6Low49.5Very low133 Ų133127.7 Ų127.782%0.81677%0.77SS**  trans-73.896.4171.932.90000110.1T175 A179T175-T177 PolarHBondContact O-N 3.27Å; T177-A179 PolarHBondContact O-N 2.85Å
178H51.9Low50.1Low177 Ų177129 Ų12982%0.81977%0.77SS**PPolyproline II helixtrans-62131.1174.3-92.8-94000111.7S176S176-H178 PolarHBondContact O-N 3.26Å; S176-H178 VanDerWaalsContact O-N 3.15Å
179A49.3Very low50.2Low97 Ų97129.9 Ų129.980%0.80277%0.773SS**PPolyproline II helixtrans-62.5135.5-179.900000112.2T177 A181T177-A179 PolarHBondContact O-N 2.85Å; A179-A181 PolarHBondContact O-N 3.11Å
180R46Very low50.2Low224 Ų224136.4 Ų136.485%0.84578%0.781SS**PPolyproline II helixtrans-64.3124172.6173.9178.6172.6-166.3-1.1110.3
181A54.4Low50.2Low80 Ų80137 Ų13766%0.66179%0.785SS**PPolyproline II helixtrans-70.2159175.900000112.5A179A179-A181 PolarHBondContact O-N 3.11Å
182P50.7Low49.8Very low123 Ų123139.4 Ų139.480%0.79979%0.794SS**PPolyproline II helixtrans-73.7153.4-174.3-14.830.8000113.8
183I56.4Low49.6Very low131 Ų131139.8 Ų139.867%0.67280%0.796SS**PPolyproline II helixtrans-75.6129.3173.8-61.2160.3000108.9
184P57.8Low49.9Very low118 Ų118135 Ų13577%0.76679%0.79SS**PPolyproline II helixtrans-79.3126.6169.530.9-31.2000110.7
185T54.4Low50.4Low133 Ų133136.8 Ų136.882%0.81679%0.791SS**PPolyproline II helixtrans-77.3144.2-178.1-37.60000112.3
186L51.2Low51.2Low151 Ų151139 Ų13979%0.79179%0.792SS**PPolyproline II helixtrans-63.3144.2174.9-171.376.3000113.1
187P62.7Low51.5Low114 Ų114142.4 Ų142.474%0.7480%0.797SS**  trans-121152.7151.235.4-25000113.5
188D60.3Low51.6Low151 Ų151140.2 Ų140.281%0.80779%0.793SS**  trans-72.6159.4-165.4-72.5-66.6000117.6
189P45.6Very low51.7Low119 Ų119141.9 Ų141.977%0.77379%0.793SS**  trans-94108.9175.935.3-30.9000113.2
190R39.5Very low51.7Low244 Ų244146.2 Ų146.292%0.92179%0.79SS**  trans-163.9101.6161.2-129.4175.7-178.2148.3-0.9114.4
191S49.3Very low52.1Low127 Ų127139.5 Ų139.589%0.88878%0.782SS**  trans173.7159.1135.4-79.60000111.3
192Q43.9Very low52.2Low186 Ų186141.3 Ų141.387%0.86979%0.788SS**  trans-107.8-178.8-160.2-61.3168.5-7.500113.1
193S45.9Very low52.4Low124 Ų124145.7 Ų145.787%0.86779%0.79SS**  trans76.5143.9173.578.50000116
194A49.5Very low51.8Low79 Ų79145.2 Ų145.265%0.65380%0.798SS**  cis-165.9173.4-19.300000108.5
195T57Low51.3Low134 Ų134144.1 Ų144.182%0.82280%0.799SS**  trans67.2148.5176.771.90000115.4
196E53.5Low51Low175 Ų175145 Ų14582%0.81880%0.804SS**  cis-174.2-176.3-41-123.9-173133.100104.8
197E51.2Low50.6Low171 Ų171141.2 Ų141.280%0.79980%0.802SS**  trans64.388.3178.3-61.6-74.9108.600115.2
198A53Low49.5Very low87 Ų87139.9 Ų139.972%0.71981%0.809SS**  65.7101.161.300000115.9
199Y54.3Low48.7Very low211 Ų211136.6 Ų136.683%0.82781%0.811SS**  -169.4140.6127.6-146.1-125.9000114.5
200Y48.6Very low48.9Very low188 Ų188140.2 Ų140.274%0.73782%0.818SS**  trans67.7108.7161.8-111.1-111.7000122
201A55.1Low49Very low83 Ų83136.3 Ų136.369%0.68681%0.81SS**  trans-106.3156.9161.300000110.6
202P55.8Low48.9Very low119 Ų119139.2 Ų139.277%0.77381%0.807SS**PPolyproline II helixtrans-80.9152.9-176.933.3-35.3000113
203Y55.6Low48.8Very low215 Ų215138.1 Ų138.184%0.84380%0.801SS**PPolyproline II helixtrans-81.2127.4176.551-86.5000111.4
204S43.5Very low48.9Very low120 Ų120140 Ų14084%0.83980%0.801SS**PPolyproline II helixtrans-100.7120.4161.6-62.60000108.1
205A48.5Very low48.7Very low95 Ų95141 Ų14179%0.78581%0.809SS**  trans-120.9109.3175.600000109.8
206T46.3Very low47.9Very low151 Ų151139 Ų13993%0.92681%0.806SS**  trans-93.2133.6173.8-46.20000109.1
207G43.1Very low48Very low73 Ų73137 Ų13775%0.75381%0.807SS**  trans159.2128.516500000115.8
208G40.8Very low47.8Very low85 Ų85134.6 Ų134.688%0.87680%0.803SS**  trans76.8124.6168.100000115
209G41.8Very low47.6Very low83 Ų83138.8 Ų138.886%0.85681%0.808SS**  cis100.962.10.400000113.9
210E51.5Low47.2Very low195 Ų195136 Ų13691%0.91180%0.802SS**  trans-145.3152154.163.2-171.5148.400111.9
211E41.8Very low47Very low161 Ų161136.9 Ų136.975%0.75281%0.806SS**  trans-106.5127.8-164.6170.8-175.3101.100109.4
212F45.5Very low46.6Very low188 Ų188139.8 Ų139.883%0.82581%0.805SS**  trans-142.6102.3164.8-119.5-85000111.6L214F212-L214 HydrophobicContact CD1-CG 4.36Å
213Q41.7Very low46Very low163 Ų163143.2 Ų143.276%0.76281%0.811SS**  trans-74.3122.2164.4-62.5175.318.900108.9
214L48.3Very low45.6Very low163 Ų163141.6 Ų141.685%0.85381%0.811SS**  trans-135.6146.4155.9-81.4-180000110.8F212F212-L214 HydrophobicContact CD1-CG 4.36Å
215A45Very low45.7Very low100 Ų100140.9 Ų140.983%0.82681%0.806SS**  trans-77.5162.8-153.800000115.2
216A40.6Very low45.8Very low92 Ų92147.9 Ų147.976%0.7681%0.812SS**  trans-59.915017500000113.3
217T55.7Low45.8Very low135 Ų135144 Ų14483%0.82880%0.796SS**  trans-145.1111.4147.4-74.20000108.6
218T47.3Very low45.8Very low119 Ų119148.4 Ų148.473%0.7380%0.801SS**  trans-69131.7168.5-88.40000109
219H49.5Very low46.2Very low175 Ų175152.4 Ų152.481%0.8180%0.802SS**  trans-138.3127151.8-143.2-85.6000111.2
220Q45.9Very low46.2Very low153 Ų153153.3 Ų153.372%0.71580%0.802SS**  trans-70.8144.5178.5-67.3-87.1-5.200110.6
221Y44.3Very low45.9Very low207 Ų207148.9 Ų148.981%0.81280%0.798SS**  trans-158.5101.9133.7-128.9-81.5000112.9
222E46.9Very low46.1Very low144 Ų144146.6 Ų146.667%0.67380%0.8SS**  trans38.9110.6141.8-137.5158.8116.400121.2
223Q43.1Very low46.5Very low190 Ų190142.9 Ų142.989%0.88880%0.798SS**  trans-81.9132161-67.7175.8-900110.6
224Q47.4Very low46.7Very low182 Ų182141.3 Ų141.385%0.8580%0.801SS**  trans-90.9113.2163-74.6-174-1.100110.8
225S45.5Very low47Very low105 Ų105141.7 Ų141.773%0.73480%0.803SS**  trans-77.4134.9175.2176.10000111.3A227S225-A227 PolarHBondContact OG-N 3.26Å
226W49.2Very low47.5Very low242 Ų242143 Ų14392%0.91780%0.802SS**  trans-112.28315655.4-84.7000108.7L228W226-L228 PolarHBondContact O-N 3.35Å
227A47.4Very low48.7Very low70 Ų70144 Ų14458%0.57980%0.8SS**  trans-69.1129.2-178.600000112.1S225S225-A227 PolarHBondContact OG-N 3.26Å
228L41.6Very low49.1Very low165 Ų165143.1 Ų143.186%0.86480%0.797SS**  trans16.4114.5137.2-56.2174.2000117.1W226W226-L228 PolarHBondContact O-N 3.35Å
229N50.7Low49.9Very low169 Ų169143 Ų14390%0.90480%0.797SS**  trans-117113.3146.2-87.3-50.9000108.5
230A40.3Very low50.8Low102 Ų102140.4 Ų140.484%0.84380%0.797SS**  trans-86.3129.1178.400000110.4
231A46Very low51.8Low101 Ų101139.2 Ų139.284%0.83580%0.802SS**  trans-137.892.9167.800000109.7
232S45.4Very low52.1Low114 Ų114137.6 Ų137.680%0.79781%0.807SS**  trans-24.9128168.1-45.50000117.1
233S53.8Low51.8Low110 Ų110135.1 Ų135.177%0.76981%0.811SS**  177.7118.5129.1-79.80000111.7
234P47.4Very low52.4Low129 Ų129138 Ų13884%0.83881%0.814SS**  trans-94.1124.8171.634-27.9000111
235L54.7Low52.4Low171 Ų171136.2 Ų136.290%0.89581%0.811SS**  trans-131.3122.4170.9-94.1163.2000111.3
236T55.1Low52.8Low129 Ų129137.3 Ų137.379%0.79181%0.813SS**PPolyproline II helixtrans-74.8139.9-170.1-35.40000112.5
237P65.8Low52.6Low111 Ų111128.9 Ų128.972%0.72180%0.801SS**PPolyproline II helixtrans-80.1138.5169.531.8-32.9000111.7
238P63.3Low52.8Low118 Ų118131.1 Ų131.177%0.76681%0.812SS**PPolyproline II helixtrans-84.3156.7178.133.7-35.2000113.4
239P65.4Low53.2Low115 Ų115128.9 Ų128.975%0.74781%0.805SS**PPolyproline II helixtrans-84.5159.6178.835.2-35.8000113.5
240P67.5Low53.2Low122 Ų122128.6 Ų128.679%0.79280%0.804SS**PPolyproline II helixtrans-82.9144.4178.233.6-34.3000113
241P67.5Low53.2Low128 Ų128127.7 Ų127.783%0.83180%0.796SS**PPolyproline II helixtrans-89.4159.4178.334.9-35.1000114.7
242D50.5Low53.5Low172 Ų172134.7 Ų134.792%0.9280%0.801SS**PPolyproline II helixtrans-70.2164-170.6-79.6-65.5000117.9
243A40.4Very low53.5Low92 Ų92140 Ų14076%0.7680%0.804SS**PPolyproline II helixtrans-80.8139.3-177.100000115.2
244R55.1Low53.4Low250 Ų250142 Ų14294%0.94381%0.805SS**  trans-156.2152.4149.9-59.9-170.1176.2157.61.1107.1
245D48.6Very low52.9Low145 Ų145140.2 Ų140.278%0.77580%0.801SS**  cis171.1163.1-20.9179.724.5000104.8
246V53.6Low52.5Low129 Ų129139 Ų13978%0.78280%0.8SS**  trans75.7125.2164.7-154.30000121
247G44.8Very low52.2Low65 Ų65137.3 Ų137.367%0.6780%0.799SS**  trans100.7108.5152.900000115.9
248S50.7Low51.5Low117 Ų117136.5 Ų136.582%0.81880%0.802SS**  cis56.6122.140.1-135.40000111.5
249V51Low50.7Low117 Ų117140.3 Ų140.371%0.70981%0.809SS**  cis-151.2138.923.2176.90000109.5
250N51.3Low50.2Low164 Ų164141.6 Ų141.688%0.87782%0.816SS**  trans-173.5101.2135.2-107.2-23.1000113.2
251A40Very low49.5Very low83 Ų83139.1 Ų139.169%0.68681%0.812SS**  trans-94.5129.5161.500000109.2
252R52.9Low48.9Very low247 Ų247144.6 Ų144.693%0.93282%0.816SS**  trans175.9137.8131-96.2155.3-175-152.90.3113.6
253R43.6Very low49Very low226 Ų226144 Ų14485%0.85381%0.813SS**  trans97.2131.6139.5-115.9-174.5178.4160.9-0.6120.4
254L51.9Low50.1Low153 Ų153151.8 Ų151.880%0.80182%0.823SS**  trans85.188.8155.1-56176.4000118.5
255A37.7Very low50.1Low90 Ų90148.5 Ų148.574%0.74482%0.82SS**  trans-75.9179.9140.900000111
256V47Very low50.4Low145 Ų145150 Ų15088%0.87983%0.826SS**  trans103.6104.4173.5-177.40000115.3
257A47.7Very low50.5Low94 Ų94153.2 Ų153.278%0.77783%0.83SS**  trans159.376.9147.600000108
258A51.5Low51.2Low94 Ų94157.5 Ų157.578%0.77784%0.837SS**  66.7108.178.200000113.5
259E47.2Very low51.3Low198 Ų198160 Ų16093%0.92584%0.836SS**  trans-47.7145.3171.7-91.116991.400113.9
260T55Low51.3Low143 Ų143164.1 Ų164.188%0.87784%0.844SS**  trans-152.7130.3160.5-59.30000111.6
261G51.9Low51.7Low70 Ų70165 Ų16572%0.72284%0.84SS**  trans103.664.5142.100000119
262R55.2Low52.3Low242 Ų242166.7 Ų166.791%0.91385%0.847SS**  trans-138.546.6158-69.1-161.5-17188.41.8114.6
263D52.9Low52.5Low161 Ų161159.9 Ų159.986%0.86184%0.837SS**  trans-135.692.8172.2-89.3-66.5000112.3
264R62.9Low52.8Low255 Ų255155.3 Ų155.396%0.96284%0.84SS**  trans-149.6143.8158-71.2-162177.6-173.9-0.2111.5
265M53.9Low52.8Low180 Ų180152.5 Ų152.589%0.88784%0.839SS**  trans87.467.6151.8-155.4163.566.400119.1
266I56.6Low53.4Low176 Ų176153.6 Ų153.690%0.90384%0.841SS**  trans-135.3102.5141.5-41.7175.2000109.4
267K54.7Low53.8Low198 Ų198154.7 Ų154.786%0.86184%0.841SS**  trans-156.7156.6166.7-161.4159-175.21700108.2
268L59.3Low53.8Low154 Ų154154.4 Ų154.481%0.80683%0.833SS**  trans75.1132.6-153.8-46.6174.8000110.2
269E52.6Low53.7Low170 Ų170157.3 Ų157.379%0.79484%0.835SS**  cis-145.5141.99.7-160.3161.1106.100111.4
270K52.5Low53.9Low204 Ų204153 Ų15389%0.88783%0.827SS**  trans-132.1101.5175176.8175.7178.1171.90108.7
271K57.9Low54.1Low183 Ų183151.6 Ų151.680%0.79682%0.82SS**  trans-165139.7171.4-106.8152.3-179.6179.60110.2
272S54.5Low54.2Low118 Ų118158.1 Ų158.183%0.82583%0.831SS**  trans61.2138.4167.4-71.20000117.5
273S55.2Low53.7Low103 Ų103150.1 Ų150.172%0.7282%0.824SS**  cis-149.3138.3-7.5-78.60000109.2
274S50.7Low53.7Low131 Ų131149.2 Ų149.292%0.91682%0.824SS**  trans-82.5114.8156.155.70000108.6
275A52.1Low53.5Low94 Ų94144.3 Ų144.378%0.77782%0.815SS**  trans-138.7107.6166.700000108.6
276S50.4Low53.3Low113 Ų113142.6 Ų142.679%0.7981%0.809SS**  trans-70.4154.8162.742.60000110.3
277L55.6Low53.2Low167 Ų167145 Ų14587%0.87481%0.807SS**  trans161.8110.6152.3-87.6163.9000105.1
278S47.4Very low52.9Low89 Ų89138.5 Ų138.562%0.62280%0.796SS**  93.8109.760.6177.90000112.7
279L49Very low52.6Low155 Ų155136.8 Ų136.881%0.81279%0.794SS**  trans55.3113.5148.9-83.777.5000120.2
280S51Low52.7Low108 Ų108135.8 Ų135.876%0.75579%0.794SS**  148.3131.8102.9-84.30000113.3
281P60Low52.9Low113 Ų113134.2 Ų134.273%0.73479%0.787SS**  trans-96.3141.1166.236.2-29.5000111.3
282H53.3Low52.6Low207 Ų207133.1 Ų133.196%0.95879%0.79SS**  trans176.3137.2147.7-101.2-71.8000109
283G45.5Very low52.7Low74 Ų74135.5 Ų135.576%0.76379%0.793SS**  trans15878.2177.700000112.9
284V53.6Low52.6Low142 Ų142135.2 Ų135.286%0.86180%0.797SS**  trans-77.7135.2171.983.20000109.1
285I57.5Low52.7Low152 Ų152138.1 Ų138.178%0.77979%0.793SS**  trans-141.2106.8161.1-35.5174.7000107.7
286D50.4Low52.7Low143 Ų143140.5 Ų140.577%0.76579%0.793SS**  trans-95.4122.4171.5-175.8-14.9000108.4
287R54.2Low53Low228 Ų228140.6 Ų140.686%0.8679%0.788SS**  trans-151.2106.1157.4-66.4-165.2-157.8-1454.2110.5
288G47.9Very low52.5Low60 Ų60135.6 Ų135.662%0.61978%0.777SS**  55.2115.6125.700000119
289P52.9Low52.9Low119 Ų119138.3 Ų138.377%0.77378%0.784SS**  trans-74.4162.4170.136.1-36000111.3
290D54.4Low52.8Low148 Ų148136.5 Ų136.579%0.79178%0.776SS**  trans176.2161.7151.5-88.6-25000109.4
291K57.9Low53.2Low171 Ų171135.8 Ų135.874%0.74378%0.776SS**  trans78.580167-60.1161.5-115.6-173.30117.4L293K291-L293 PolarHBondContact O-N 3.27Å
292D51.2Low53.1Low161 Ų161134.6 Ų134.686%0.86177%0.771SS**  19.598.1121.5-46.9-65.7000116.8
293L56.2Low52.9Low168 Ų168132 Ų13288%0.8876%0.764SS**  trans-121115.7154.9-73.3178.1000108.2K291 F295K291-L293 PolarHBondContact O-N 3.27Å; L293-F295 PolarHBondContact O-N 3.44Å
294A53.2Low53.5Low96 Ų96133.4 Ų133.479%0.79376%0.762SS**  trans-56.6132.8-176.200000111.1D296A294-D296 VanDerWaalsContact C-N 3.28Å; A294-D296 PolarHBondContact O-N 2.96Å
295F52.2Low53.6Low193 Ų193133.6 Ų133.685%0.84676%0.757SS**  trans-73.990.3165.6-142.8-85.8000107L293 V297L293-F295 PolarHBondContact O-N 3.44Å; F295-V297 HydrophobicContact CD1-CG2 4.43Å; F295-V297 PolarHBondContact O-N 2.85Å
296D52.9Low54Low144 Ų144137.3 Ų137.377%0.7776%0.762SS**  trans-66.1101.1172.9-151.1-59.4000107.5A294 G298A294-D296 VanDerWaalsContact C-N 3.28Å; A294-D296 PolarHBondContact O-N 2.96Å; D296-G298 PolarHBondContact O-N 2.96Å
297V57.3Low54.5Low114 Ų114137.6 Ų137.669%0.69176%0.763SS**  trans-71.886.9176.1176.20000106.4F295 N299F295-V297 HydrophobicContact CD1-CG2 4.43Å; F295-V297 PolarHBondContact O-N 2.85Å; V297-N299 VanDerWaalsContact C-N 3.31Å; V297-N299 PolarHBondContact O-N 2.73Å
298G45.8Very low54.9Low62 Ų62133.2 Ų133.264%0.63976%0.756SS**  trans-54.297.8169.200000109.2D296 D300D296-G298 PolarHBondContact O-N 2.96Å; G298-D300 PolarHBondContact O-N 3.36Å
299N54.8Low55.8Low146 Ų146135.2 Ų135.278%0.78176%0.758SS**  trans-67.683.5178.4179.686.2000108.7V297 A301V297-N299 VanDerWaalsContact C-N 3.31Å; V297-N299 PolarHBondContact O-N 2.73Å; N299-A301 PolarHBondContact O-N 2.95Å; N299-A301 VanDerWaalsContact O-N 3.16Å
300D47.4Very low56.3Low118 Ų118135.1 Ų135.163%0.63176%0.758SS**  trans-62.4113.8-179.1-162.5-58.3000109.1G298 S302G298-D300 PolarHBondContact O-N 3.36Å; D300-S302 PolarHBondContact O-N 3.06Å; D300-S302 WeakPolarHBondContact OD1-CB 3.28Å; D300-S302 PolarHBondContact OD1-OG 2.95Å
301A59.5Low56.7Low92 Ų92136 Ų13676%0.7676%0.76SS**THydrogen-bonded Turntrans-74.228.5-170.200000113.8N299N299-A301 PolarHBondContact O-N 2.95Å; N299-A301 VanDerWaalsContact O-N 3.16Å
302S56.3Low56.7Low89 Ų89132.6 Ų132.662%0.62276%0.757SS**THydrogen-bonded Turntrans-105-11.1-172.3-55.60000114.5D300D300-S302 PolarHBondContact O-N 3.06Å; D300-S302 WeakPolarHBondContact OD1-CB 3.28Å; D300-S302 PolarHBondContact OD1-OG 2.95Å
303D49Very low57.1Low153 Ų153130.3 Ų130.382%0.81875%0.751SS**SBendtrans-88.2-12.1-175.9-109.8-83.7000114.5L305D303-L305 PolarHBondContact O-N 2.91Å
304S58Low57Low103 Ų103131.3 Ų131.372%0.7276%0.757SS**THydrogen-bonded Turntrans-86.88.5-175.3-52.80000115.8
305L55.7Low57.1Low145 Ų145131.6 Ų131.676%0.75975%0.753SS**THydrogen-bonded Turntrans-88-3.6-172.2-162.558.4000115D303D303-L305 PolarHBondContact O-N 2.91Å
306W67.9Low57.2Low230 Ų230127.9 Ų127.987%0.87175%0.751SS**SBendtrans-112.3-2.2176.9-64.5103.9000114.4L308W306-L308 PolarHBondContact O-N 2.9Å
307D60.2Low57.3Low150 Ų150127.8 Ų127.880%0.80276%0.76SS**  trans-83.861.6175.3-141.2-5.3000109.9
308L62.5Low57.4Low136 Ų136133.5 Ų133.571%0.71277%0.769SS**PPolyproline II helixtrans-72.7126.5171.3-76.1169.4000108.3W306W306-L308 PolarHBondContact O-N 2.9Å
309P66.6Low57.8Low101 Ų101136 Ų13666%0.65678%0.777SS**PPolyproline II helixtrans-59.4147.5176.426.2-34.3000109.8I311P309-I311 PolarHBondContact O-N 2.88Å; P309-I311 VanDerWaalsContact O-N 3.14Å
310P64.4Low58Low117 Ų117137.1 Ų137.176%0.7678%0.779SS**PPolyproline II helixtrans-55.7125.3177.924.1-33.7000109C312P310-C312 PolarHBondContact O-N 2.85Å
311I62.4Low58.5Low166 Ų166138.4 Ų138.485%0.85178%0.783SS**  trans-62.4100.5-179.3-60.5172.1000107.5P309P309-I311 PolarHBondContact O-N 2.88Å; P309-I311 VanDerWaalsContact O-N 3.14Å
312C57.3Low58.2Low100 Ų100147.3 Ų147.368%0.67681%0.805SS**  trans-56.2124178-69.10000109P310 L314P310-C312 PolarHBondContact O-N 2.85Å; C312-L314 PolarHBondContact O-N 3.08Å; C312-L314 VanDerWaalsContact O-N 3.09Å
313P58.7Low58.3Low114 Ų114150.2 Ų150.274%0.7481%0.814SS**  trans-64.5117.2179.125.2-32.6000109.2S315P313-S315 PolarHBondContact O-N 3.37Å
314L55.8Low58.8Low189 Ų189150.1 Ų150.199%0.9981%0.814SS**  trans-66.178.4169.6-111.978.8000109C312C312-L314 PolarHBondContact O-N 3.08Å; C312-L314 VanDerWaalsContact O-N 3.09Å
315S54Low58.8Low102 Ų102152.7 Ų152.771%0.71382%0.819SS**  trans-152.542.6-169.2-175.60000112.5P313P313-S315 PolarHBondContact O-N 3.37Å
316S55.1Low59Low115 Ų115153.1 Ų153.180%0.80482%0.823SS**  trans-164.363.3157.3-154.80000113.4
317C53.9Low58.5Low142 Ų142148.3 Ų148.396%0.95982%0.82SS**  trans-121.963.4165.4-70.60000109.6
318R61.1Low58.3Low234 Ų234148.2 Ų148.288%0.88382%0.821SS**SBendtrans-144.5109.4176.6-169.7153.7173.8157.6-7.1111.8
319S54.2Low58Low115 Ų115149.1 Ų149.180%0.80483%0.829SS**  trans59.881.1148.8-171.50000118
320M58.1Low57.4Low168 Ų168152.8 Ų152.883%0.82884%0.842SS**  trans-144.9143.2147.5-86.8-162.2-88.300107.8
321M58.6Low56.8Low146 Ų146155.8 Ų155.872%0.71985%0.849SS**  cis-171.3139.7-15.4-125.7171.3-167.700106.8
322F52.4Low56.3Low278 Ų278154.8 Ų154.8100%1.21985%0.849SS**  trans66.80178.5-67.5-85.3000117.6

Retrieved 322 of 322 residues in 55.2 ms (Link to these results)