A0A024R2P3_HUMAN Loading...

Myelin-associated oligodendrocyte basic protein isoform 2

AlphaFold DB , UniProt , Accession A0A024R2P3, Species HUMAN (Homo sapiens, Human), Gene MOBP, Length 182 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
1M34Very low40.7Very low243 Ų243152.9 Ų152.9100%1.19781%0.807SS**  099.60-71.1-75.4-179.400108.6
2S43.5Very low41.4Very low127 Ų127147.2 Ų147.289%0.88878%0.777SS**  trans-69.1130.5-179.2-70.50000112.5
3Q40.5Very low41.5Very low190 Ų190143.8 Ų143.889%0.88877%0.772SS**  trans-141.397.9156.7-67.4-166.21900111
4K42.7Very low41.9Very low204 Ų204146.4 Ų146.489%0.88777%0.773SS**  trans-87.6136.2141.2-71.5174.1170.8170.60104.6
5P42.4Very low42.1Very low126 Ų126139.8 Ų139.882%0.81874%0.739SS**  -150.5-175.268.733.5-8.9000110.6
6A33.5Very low42.4Very low88 Ų88142.8 Ų142.873%0.72775%0.747SS**  cis-151.1141.321.400000108.3E8A6-E8 VanDerWaalsContact C-N 3.35Å; A6-E8 PolarHBondContact O-N 3.39Å
7K40.4Very low42.5Very low216 Ų216145.4 Ų145.494%0.93975%0.751SS**  trans-65.796.4165.7-82.3-176.8171.6-1780108G9K7-G9 PolarHBondContact O-N 3.17Å
8E36.4Very low42.5Very low156 Ų156144.6 Ų144.673%0.72974%0.738SS**  trans-67.1103.2167.3-167.5156.3115.800107.2A6 R11A6-E8 VanDerWaalsContact C-N 3.35Å; A6-E8 PolarHBondContact O-N 3.39Å; E8-R11 HydrophobicContact CG-CG 4.39Å; E8-R11 WeakPolarHBondContact OE1-CD 3.47Å
9G44.8Very low42.7Very low33 Ų33139.3 Ų139.334%0.3472%0.715SS.*  trans-62162.5175.100000111.1K7 R11K7-G9 PolarHBondContact O-N 3.17Å; G9-R11 PolarHBondContact O-N 3.08Å
10P44.7Very low42.8Very low124 Ų124140.9 Ų140.981%0.80572%0.72SS**  trans-53.2107.2-175.6-23.732.8000111.8L12P10-L12 PolarHBondContact O-N 3.4Å
11R45.2Very low42.6Very low175 Ų175141.4 Ų141.466%0.6672%0.719SS**  trans-69.5111.8176.4-77.6-172.987.5175.26.2109.2E8 G9 S13E8-R11 HydrophobicContact CG-CG 4.39Å; E8-R11 WeakPolarHBondContact OE1-CD 3.47Å; G9-R11 PolarHBondContact O-N 3.08Å; R11-S13 PolarHBondContact O-N 3.43Å
12L48.6Very low42.9Very low84 Ų84135.8 Ų135.844%0.4469%0.688SS.*  trans-72.159172.1-72.6163000111.3P10 K14 N15 C51P10-L12 PolarHBondContact O-N 3.4Å; L12-K14 PolarHBondContact O-N 3.25Å; L12-N15 WeakPolarHBondContact CD2-ND2 3.2Å; L12-C51 HydrophobicContact CD1-CB 4.27Å
13S42.8Very low42.9Very low103 Ų103133.1 Ų133.172%0.7267%0.669SS**THydrogen-bonded Turntrans-77.36.6-177.363.30000115.2R11R11-S13 PolarHBondContact O-N 3.43Å
14K46.6Very low43.4Very low180 Ų180125.7 Ų125.778%0.78364%0.635SS**THydrogen-bonded Turntrans-123.116-176.3-67.6-178.9178.2175.30114.7L12 Q16L12-K14 PolarHBondContact O-N 3.25Å; K14-Q16 PolarHBondContact O-N 3.14Å
15N45.1Very low43.8Very low48 Ų48120.7 Ų120.726%0.25762%0.615SS.*THydrogen-bonded Turntrans-100.433.6-164.2-80.1-98000116.7L12 K17 Y18L12-N15 WeakPolarHBondContact CD2-ND2 3.2Å; N15-K17 VanDerWaalsContact C-N 3.27Å; N15-Y18 HydrophobicContact CB-CD2 4.17Å; N15-Y18 WeakPolarHBondContact OD1-CB 3.46Å; N15-Y18 WeakPolarHBondContact OD1-CD2 3.32Å
16Q47.3Very low44Very low187 Ų187115.9 Ų115.987%0.87458%0.584SS**THydrogen-bonded Turntrans-66.7-34.5167-166.2167.38.500111.1K14K14-Q16 PolarHBondContact O-N 3.14Å
17K44.3Very low44.6Very low188 Ų188113.5 Ų113.582%0.81756%0.561SS**THydrogen-bonded Turntrans-84.4-13-175.4-148.1171.8-173.2176.50115.2N15N15-K17 VanDerWaalsContact C-N 3.27Å
18Y41.6Very low44.9Very low130 Ų130107.3 Ų107.351%0.5154%0.543SS..THydrogen-bonded Turntrans-91.8-11.8179.9-67.5-91.6000113.3N15 E20 H21 F22N15-Y18 HydrophobicContact CB-CD2 4.17Å; N15-Y18 WeakPolarHBondContact OD1-CB 3.46Å; N15-Y18 WeakPolarHBondContact OD1-CD2 3.32Å; Y18-E20 PolarHBondContact O-N 3.01Å; Y18-H21 PolarHBondContact O-N 2.81Å; Y18-F22 HydrophobicContact CD1-CD2 4.19Å; Y18-F22 HydrophobicContact CD1-CE2 4.2Å; Y18-F22 PolarHBondContact O-N 2.78Å
19S47.4Very low45.3Very low44 Ų44102.9 Ų102.931%0.30853%0.528SS..THydrogen-bonded Turntrans-61.4-27.1173.2-73.50000112.7I46S19-I46 VanDerWaalsContact OG-CD1 3.28Å; S19-I46 WeakPolarHBondContact OG-CD1 3.39Å
20E43.6Very low45Very low172 Ų172111.9 Ų111.980%0.80456%0.558SS**THydrogen-bonded Turntrans-77.2-28.5-175.8-158.6176.698.900112.8Y18Y18-E20 PolarHBondContact O-N 3.01Å
21H38.7Very low44.8Very low152 Ų152109.7 Ų109.770%0.70454%0.543SS*.THydrogen-bonded Turntrans-111-17.6-175.9-100.771.4000114.7Y18Y18-H21 PolarHBondContact O-N 2.81Å
22F41.9Very low44.7Very low124 Ų124111.4 Ų111.454%0.54456%0.555SS.*SBendtrans-130.294-179.1-59.5-81.4000108.5Y18 I24Y18-F22 HydrophobicContact CD1-CD2 4.19Å; Y18-F22 HydrophobicContact CD1-CE2 4.2Å; Y18-F22 PolarHBondContact O-N 2.78Å; F22-I24 VanDerWaalsContact C-N 3.33Å; F22-I24 PolarHBondContact O-N 3.07Å
23S43.4Very low44.4Very low71 Ų71114.5 Ų114.550%0.49757%0.571SS.*  trans-62.697173.348.70000109H25S23-H25 VanDerWaalsContact C-N 3.34Å; S23-H25 PolarHBondContact O-CD2 3.24Å; S23-H25 PolarHBondContact O-N 3.28Å; S23-H25 PolarHBondContact OG-NE2 3.21Å
24I50.9Low44.3Very low35 Ų35111.7 Ų111.718%0.17955%0.548CS..  trans-62.2102.5167.7-64.9163.1000105.5F22 C26 I46F22-I24 VanDerWaalsContact C-N 3.33Å; F22-I24 PolarHBondContact O-N 3.07Å; I24-C26 PolarHBondContact O-N 3.11Å; I24-I46 HydrophobicContact CD1-CD1 3.72Å; I24-I46 HydrophobicContact CD1-CG1 3.94Å; I24-I46 HydrophobicContact CD1-CG2 4.17Å
25H50.4Low44Very low98 Ų98107.7 Ų107.745%0.45454%0.543SS..  trans-72.579.9177.3-78.7-93.7000108.8S23 C27S23-H25 VanDerWaalsContact C-N 3.34Å; S23-H25 PolarHBondContact O-CD2 3.24Å; S23-H25 PolarHBondContact O-N 3.28Å; S23-H25 PolarHBondContact OG-NE2 3.21Å; H25-C27 PolarHBondContact O-N 3.38Å
26C46.8Very low44.1Very low25 Ų25114.5 Ų114.517%0.16957%0.57CS.*  trans-59.7109.2155.3-93.60000106.3I24 P28 C65I24-C26 PolarHBondContact O-N 3.11Å; C26-P28 WeakPolarHBondContact O-CD 3.4Å; C26-P28 VanDerWaalsContact O-N 3.14Å; C26-C65 VanDerWaalsContact SG-SG 3.61Å
27C45.1Very low44Very low38 Ų38114.4 Ų114.426%0.25757%0.567SS.*  trans-43.6121.8-176-81.60000111.5H25 R69H25-C27 PolarHBondContact O-N 3.38Å; C27-R69 VanDerWaalsContact SG-CZ 3.6Å; C27-R69 PolarHBondContact SG-NE 3.31Å; C27-R69 PolarHBondContact SG-NH2 2.85Å
28P47.2Very low44.1Very low86 Ų86110.1 Ų110.156%0.55855%0.55SS*.  trans-67.1129.6157.328.2-28.1000106.8C26C26-P28 WeakPolarHBondContact O-CD 3.4Å; C26-P28 VanDerWaalsContact O-N 3.14Å
29P44.8Very low44.3Very low63 Ų63107.3 Ų107.341%0.40954%0.543SS..  trans-70.5141.216531.2-28.8000107.6T31P29-T31 HydrophobicContact CB-CG2 4.36Å; P29-T31 PolarHBondContact O-N 3.33Å
30F38.6Very low44Very low222 Ų222108.7 Ų108.797%0.97455%0.55SS*.  trans-58.891.2160.1-113.6-96000107.4
31T41.4Very low43.9Very low78 Ų78106.1 Ų106.148%0.47954%0.541SS..  trans-137.4117.4166.251.70000107.3P29 L33P29-T31 HydrophobicContact CB-CG2 4.36Å; P29-T31 PolarHBondContact O-N 3.33Å; T31-L33 PolarHBondContact O-N 2.98Å
32F41.6Very low44.1Very low212 Ų212103.7 Ų103.793%0.9353%0.526SS*.SBendtrans-54.40.1176.3-165.4-101.6000114.7
33L43.5Very low44.3Very low148 Ų148103 Ų10378%0.77552%0.523SS*.  trans-133.296.2171.1-75.497.2000109.4T31T31-L33 PolarHBondContact O-N 2.98Å
34N39.8Very low44.4Very low44 Ų44107.5 Ų107.524%0.23553%0.53CS..  trans-149.3104158.9-143.9-97.9000108.7K36 I39N34-K36 PolarHBondContact O-N 2.86Å; N34-I39 HydrophobicContact CB-CD1 4.13Å; N34-I39 HydrophobicContact CB-CG1 4.09Å; N34-I39 VanDerWaalsContact OD1-CG1 3.26Å; N34-I39 WeakPolarHBondContact OD1-CG1 3.46Å
35S40.1Very low44.2Very low96 Ų96108.9 Ų108.967%0.67154%0.543SS*.  trans-54.4128177.9-55.70000109.1K37 E38S35-K37 PolarHBondContact O-N 2.83Å; S35-E38 PolarHBondContact O-N 3.49Å
36K47.5Very low44.4Very low191 Ų191106.9 Ų106.983%0.8354%0.535SS*.Hα-helixtrans-42.4-19.1-173.9-161.8175.5-177.9-179.90116N34 V40N34-K36 PolarHBondContact O-N 2.86Å; K36-V40 VanDerWaalsContact O-CG2 3.24Å; K36-V40 WeakPolarHBondContact O-CG2 3.29Å
37K46.5Very low44.5Very low186 Ų186106.8 Ų106.881%0.80953%0.534SS*.Hα-helixtrans-76-35.3177.4-145.382.8173.4178.70113.6S35 D41S35-K37 PolarHBondContact O-N 2.83Å; K37-D41 PolarHBondContact O-N 3.01Å
38E45.2Very low44.5Very low97 Ų97114.7 Ų114.745%0.45356%0.564SS.*Hα-helixtrans-84.9-29.1-171.3-154.2-169.8120.500112.5S35 V40 D41 R42S35-E38 PolarHBondContact O-N 3.49Å; E38-V40 VanDerWaalsContact C-N 3.31Å; E38-D41 PolarHBondContact O-N 3.31Å; E38-R42 PolarHBondContact O-N 2.99Å; E38-R42 VanDerWaalsContact O-N 3.1Å; E38-R42 IonicContact OE1-CZ 3.55Å; E38-R42 IonicContact OE1-NE 3.28Å; E38-R42 IonicContact OE1-NH2 2.65Å; E38-R42 PolarHBondContact OE1-NH2 3.33Å
39I47.1Very low44.4Very low71 Ų71114.9 Ų114.936%0.36457%0.568SS.*Hα-helixtrans-66.1-36.3171-57.6179.9000111N34 K43N34-I39 HydrophobicContact CB-CD1 4.13Å; N34-I39 HydrophobicContact CB-CG1 4.09Å; N34-I39 VanDerWaalsContact OD1-CG1 3.26Å; N34-I39 WeakPolarHBondContact OD1-CG1 3.46Å; I39-K43 WeakPolarHBondContact O-CB 3.44Å; I39-K43 PolarHBondContact O-N 3.31Å
40V40.7Very low44.9Very low74 Ų74112.7 Ų112.745%0.44856%0.556SS.*Hα-helixtrans-65.9-47.4178.5174.20000109.2K36 E38 R42 K43 Y44K36-V40 VanDerWaalsContact O-CG2 3.24Å; K36-V40 WeakPolarHBondContact O-CG2 3.29Å; E38-V40 VanDerWaalsContact C-N 3.31Å; V40-R42 PolarHBondContact O-N 2.68Å; V40-K43 WeakPolarHBondContact O-CB 3.26Å; V40-K43 PolarHBondContact O-N 3.06Å; V40-K43 VanDerWaalsContact O-N 3.08Å; V40-Y44 HydrophobicContact CG1-CD2 3.95Å; V40-Y44 HydrophobicContact CG1-CE2 3.58Å; V40-Y44 WeakPolarHBondContact O-CD2 3.48Å; V40-Y44 PolarHBondContact O-N 3.05Å
41D41Very low46.1Very low117 Ų117102.7 Ų102.763%0.62651%0.514SS*.Hα-helixtrans-61.1-42.2178.1-155.7-98.9000112.5K37 E38 K43 Y44 S45K37-D41 PolarHBondContact O-N 3.01Å; E38-D41 PolarHBondContact O-N 3.31Å; D41-K43 VanDerWaalsContact C-N 3.34Å; D41-K43 PolarHBondContact O-N 3.14Å; D41-Y44 PolarHBondContact O-N 2.88Å; D41-Y44 VanDerWaalsContact O-N 3.16Å; D41-S45 PolarHBondContact O-N 2.65Å
42R42.7Very low47.1Very low102 Ų102103.5 Ų103.539%0.38551%0.511SS..Hα-helixtrans-69.2-24.3173.7-72.7-169.6-147.3152.52114.9E38 V40 Y44 S45E38-R42 PolarHBondContact O-N 2.99Å; E38-R42 VanDerWaalsContact O-N 3.1Å; E38-R42 IonicContact OE1-CZ 3.55Å; E38-R42 IonicContact OE1-NE 3.28Å; E38-R42 IonicContact OE1-NH2 2.65Å; E38-R42 PolarHBondContact OE1-NH2 3.33Å; V40-R42 PolarHBondContact O-N 2.68Å; R42-Y44 VanDerWaalsContact C-N 3.26Å; R42-S45 PolarHBondContact O-OG 3.18Å
43K46.5Very low48Very low109 Ų10998.6 Ų98.647%0.47449%0.487SS..Hα-helixtrans-69.3-29172.6-121.2-174.5177.9-1660111.2I39 V40 D41I39-K43 WeakPolarHBondContact O-CB 3.44Å; I39-K43 PolarHBondContact O-N 3.31Å; V40-K43 WeakPolarHBondContact O-CB 3.26Å; V40-K43 PolarHBondContact O-N 3.06Å; V40-K43 VanDerWaalsContact O-N 3.08Å; D41-K43 VanDerWaalsContact C-N 3.34Å; D41-K43 PolarHBondContact O-N 3.14Å
44Y44.3Very low48.9Very low165 Ų16594.3 Ų94.365%0.64746%0.463SS*.Hα-helixtrans-97.9-16.7-179.3-65.7-67.5000114V40 D41 R42 I46V40-Y44 HydrophobicContact CG1-CD2 3.95Å; V40-Y44 HydrophobicContact CG1-CE2 3.58Å; V40-Y44 WeakPolarHBondContact O-CD2 3.48Å; V40-Y44 PolarHBondContact O-N 3.05Å; D41-Y44 PolarHBondContact O-N 2.88Å; D41-Y44 VanDerWaalsContact O-N 3.16Å; R42-Y44 VanDerWaalsContact C-N 3.26Å; Y44-I46 PolarHBondContact O-N 3.29Å
45S48.1Very low49.9Very low64 Ų64100.9 Ų100.945%0.44849%0.489SS..  trans-76.565.7170.2780000110.7D41 R42 C47D41-S45 PolarHBondContact O-N 2.65Å; R42-S45 PolarHBondContact O-OG 3.18Å; S45-C47 PolarHBondContact O-N 3.05Å
46I53.1Low51Low57 Ų57104.7 Ų104.729%0.29249%0.494SS..  trans-54.9117.4169.4-63.5170.8000106.5S19 I24 Y44 K48S19-I46 VanDerWaalsContact OG-CD1 3.28Å; S19-I46 WeakPolarHBondContact OG-CD1 3.39Å; I24-I46 HydrophobicContact CD1-CD1 3.72Å; I24-I46 HydrophobicContact CD1-CG1 3.94Å; I24-I46 HydrophobicContact CD1-CG2 4.17Å; Y44-I46 PolarHBondContact O-N 3.29Å; I46-K48 PolarHBondContact O-N 3.17Å
47C50.5Low51.7Low23 Ų2398.7 Ų98.716%0.15547%0.469CS..  trans-49.9115.2-178-53.30000108.4S45 S49 G50 C62S45-C47 PolarHBondContact O-N 3.05Å; C47-S49 PolarHBondContact O-N 3.08Å; C47-G50 PolarHBondContact O-N 3.22Å; C47-C62 HydrophobicContact CB-CB 3.59Å; C47-C62 WeakPolarHBondContact CB-SG 3.5Å; C47-C62 WeakPolarHBondContact SG-CB 3.48Å; C47-C62 CovalentContact SG-SG 2.05Å; C47-C62 PolarHBondContact SG-SG 3.04Å
48K44.7Very low52.4Low204 Ų20497 Ų9789%0.88746%0.464SS*.THydrogen-bonded Turntrans-53.5-17.2-175.1-164.4171.7-176.8176.30113.5I46I46-K48 PolarHBondContact O-N 3.17Å
49S45.6Very low53.1Low90 Ų9095.4 Ų95.463%0.62946%0.458SS*.THydrogen-bonded Turntrans-89.14.7178.730.50000115.3C47 C63C47-S49 PolarHBondContact O-N 3.08Å; S49-C63 PolarHBondContact O-SG 3.1Å; S49-C63 VanDerWaalsContact O-SG 3.37Å
50G53.8Low53.8Low16 Ų1698.2 Ų98.217%0.16546%0.464CS..  trans96.9166.4170.300000115.7C47 C63C47-G50 PolarHBondContact O-N 3.22Å; G50-C63 PolarHBondContact O-N 2.72Å; G50-C63 PolarHBondContact O-SG 3.33Å; G50-C63 VanDerWaalsContact O-SG 3.41Å
51C64.7Low55Low13 Ų1395 Ų959%0.08844%0.444CS..EExtended strand (participates in β ladder)trans-119.3142.3179.9-64.20000110.3L12 W60 I61L12-C51 HydrophobicContact CD1-CB 4.27Å; C51-W60 HydrophobicContact CB-CE3 4.41Å; C51-I61 CarbonylContact C-O 3.6Å; C51-I61 WeakPolarHBondContact CA-O 3.45Å
52F61.6Low56.3Low95 Ų9589.4 Ų89.442%0.41742%0.415SS..EExtended strand (participates in β ladder)trans-118.7143.1177.2-63.6-77.7000110.4I61 C63F52-I61 PolarHBondContact N-O 2.9Å; F52-I61 PolarHBondContact O-N 3.02Å; F52-C63 WeakPolarHBondContact CE2-SG 3.4Å
53Y62Low57.3Low108 Ų10885.6 Ų85.642%0.42440%0.404SS..EExtended strand (participates in β ladder)trans-81.4128.2173.7-177.9-105.6000110.8K55 E58 W60Y53-K55 HydrophobicContact CE1-CB 4.21Å; Y53-E58 WeakPolarHBondContact CE2-O 3.24Å; Y53-E58 WeakPolarHBondContact OH-CA 3.3Å; Y53-W60 AromaticContact CD2-CD1 3.89Å; Y53-W60 HydrophobicContact CD2-CD2 4.1Å; Y53-W60 AromaticContact CD2-CE2 3.73Å; Y53-W60 HydrophobicContact CD2-CG 4.21Å; Y53-W60 HydrophobicContact CD2-CZ2 4.22Å; Y53-W60 AromaticContact CD2-NE1 3.58Å; Y53-W60 HydrophobicContact CG-CZ2 4.42Å
54Q62.5Low58Low58 Ų5883 Ų8327%0.27140%0.402SS..EExtended strand (participates in β ladder)trans-105.396.9178.5-178145.873.800110.1K56 E57 E58 D59 I61Q54-K56 PolarHBondContact O-N 3.49Å; Q54-E57 PolarHBondContact O-N 2.88Å; Q54-E57 VanDerWaalsContact O-N 3.08Å; Q54-E57 PolarHBondContact OE1-OE2 3.28Å; Q54-E58 PolarHBondContact O-N 3.09Å; Q54-D59 PolarHBondContact N-O 3.08Å; Q54-D59 PolarHBondContact O-N 2.96Å; Q54-I61 HydrophobicContact CB-CD1 3.97Å; Q54-I61 HydrophobicContact CG-CD1 4.39Å
55K60.1Low59Low183 Ų18375.9 Ų75.980%0.79638%0.377SS*.THydrogen-bonded Turntrans-54.8-26.2-177.3-168.7176.6-177.7-177.80115Y53 E57Y53-K55 HydrophobicContact CE1-CB 4.21Å; K55-E57 VanDerWaalsContact C-N 3.33Å
56K63.5Low59.9Low175 Ų17576.7 Ų76.776%0.76137%0.373SS*.THydrogen-bonded Turntrans-72.6-26.6-178.7-171.8171.4-177.9172.90113.4Q54Q54-K56 PolarHBondContact O-N 3.49Å
57E61.5Low60.4Low65 Ų6581.4 Ų81.430%0.30439%0.392SS..THydrogen-bonded Turntrans-120.72.7-177.9-69.4174.174.700111.1Q54 K55 D59 R69 R73Q54-E57 PolarHBondContact O-N 2.88Å; Q54-E57 VanDerWaalsContact O-N 3.08Å; Q54-E57 PolarHBondContact OE1-OE2 3.28Å; K55-E57 VanDerWaalsContact C-N 3.33Å; E57-D59 HydrophobicContact CB-CB 4.3Å; E57-D59 PolarHBondContact O-N 2.77Å; E57-D59 VanDerWaalsContact O-N 3.09Å; E57-R69 VanDerWaalsContact CD-NH1 3.28Å; E57-R69 IonicContact OE1-CZ 3.82Å; E57-R69 IonicContact OE1-NH1 3.82Å; E57-R69 PolarHBondContact OE1-NH1 2.8Å; E57-R69 IonicContact OE2-NH1 2.77Å; E57-R69 PolarHBondContact OE2-NH1 3.43Å; E57-R73 IonicContact OE1-NH2 3.92Å; E57-R73 IonicContact OE2-CZ 3.84Å; E57-R73 IonicContact OE2-NH2 2.68Å; E57-R73 PolarHBondContact OE2-NH2 3.01Å
58E60.9Low61.1Low151 Ų15183.4 Ų83.471%0.70640%0.403SS*.THydrogen-bonded Turntrans52.526.3-174.7-61-178.384.100114.2Y53 Q54Y53-E58 WeakPolarHBondContact CE2-O 3.24Å; Y53-E58 WeakPolarHBondContact OH-CA 3.3Å; Q54-E58 PolarHBondContact O-N 3.09Å
59D60Low62Low63 Ų6375.6 Ų75.634%0.33737%0.368SS..EExtended strand (participates in β ladder)trans-114.8148-170.5-86.2-37000113.1Q54 E57Q54-D59 PolarHBondContact N-O 3.08Å; Q54-D59 PolarHBondContact O-N 2.96Å; E57-D59 HydrophobicContact CB-CB 4.3Å; E57-D59 PolarHBondContact O-N 2.77Å; E57-D59 VanDerWaalsContact O-N 3.09Å
60W61.5Low62.9Low130 Ų13075.2 Ų75.249%0.49236%0.362SS..EExtended strand (participates in β ladder)trans-90.5123.2170.4-71.288.1000110.9C51 Y53C51-W60 HydrophobicContact CB-CE3 4.41Å; Y53-W60 AromaticContact CD2-CD1 3.89Å; Y53-W60 HydrophobicContact CD2-CD2 4.1Å; Y53-W60 AromaticContact CD2-CE2 3.73Å; Y53-W60 HydrophobicContact CD2-CG 4.21Å; Y53-W60 HydrophobicContact CD2-CZ2 4.22Å; Y53-W60 AromaticContact CD2-NE1 3.58Å; Y53-W60 HydrophobicContact CG-CZ2 4.42Å
61I67Low63Low6 Ų677.7 Ų77.73%0.03138%0.377CS..EExtended strand (participates in β ladder)trans-125135-174.1-67.3167.6000109.9C51 F52 Q54 C65 Q66 R69C51-I61 CarbonylContact C-O 3.6Å; C51-I61 WeakPolarHBondContact CA-O 3.45Å; F52-I61 PolarHBondContact N-O 2.9Å; F52-I61 PolarHBondContact O-N 3.02Å; Q54-I61 HydrophobicContact CB-CD1 3.97Å; Q54-I61 HydrophobicContact CG-CD1 4.39Å; I61-C65 HydrophobicContact CG2-CB 3.67Å; I61-Q66 HydrophobicContact CG2-CB 4.1Å; I61-R69 VanDerWaalsContact CD1-NH1 3.33Å
62C67.4Low62.8Low0 Ų083.1 Ų83.10%040%0.396CS..EExtended strand (participates in β ladder)trans-76.3156.2174.7108.70000112.2C47 A64 C65 Q66C47-C62 HydrophobicContact CB-CB 3.59Å; C47-C62 WeakPolarHBondContact CB-SG 3.5Å; C47-C62 WeakPolarHBondContact SG-CB 3.48Å; C47-C62 CovalentContact SG-SG 2.05Å; C47-C62 PolarHBondContact SG-SG 3.04Å; C62-A64 VanDerWaalsContact C-N 3.29Å; C62-A64 PolarHBondContact O-N 3.48Å; C62-A64 PolarHBondContact SG-N 2.97Å; C62-C65 CarbonylContact O-C 3.59Å; C62-C65 WeakPolarHBondContact O-CB 3.17Å; C62-C65 PolarHBondContact O-N 2.83Å; C62-C65 PolarHBondContact SG-N 3.1Å; C62-Q66 PolarHBondContact O-N 2.89Å
63C64.3Low62.7Low23 Ų2385.3 Ų85.316%0.15540%0.401CS..Hα-helixtrans-48.9-41.4176.9-71.70000115S49 G50 F52 Q66 K67S49-C63 PolarHBondContact O-SG 3.1Å; S49-C63 VanDerWaalsContact O-SG 3.37Å; G50-C63 PolarHBondContact O-N 2.72Å; G50-C63 PolarHBondContact O-SG 3.33Å; G50-C63 VanDerWaalsContact O-SG 3.41Å; F52-C63 WeakPolarHBondContact CE2-SG 3.4Å; C63-Q66 PolarHBondContact O-N 3.28Å; C63-K67 PolarHBondContact O-N 3.48Å
64A60.5Low62.4Low54 Ų5484.3 Ų84.345%0.44642%0.415SS..Hα-helixtrans-69.5-39.7178.400000112C62 T68C62-A64 VanDerWaalsContact C-N 3.29Å; C62-A64 PolarHBondContact O-N 3.48Å; C62-A64 PolarHBondContact SG-N 2.97Å; A64-T68 PolarHBondContact O-N 3.17Å; A64-T68 PolarHBondContact O-OG1 3.25Å; A64-T68 VanDerWaalsContact O-OG1 3.08Å
65C65.3Low61.8Low16 Ų1690.1 Ų90.111%0.10844%0.44CS..Hα-helixtrans-69.3-32.4176.2-660000112.3C26 I61 C62 T68 R69C26-C65 VanDerWaalsContact SG-SG 3.61Å; I61-C65 HydrophobicContact CG2-CB 3.67Å; C62-C65 CarbonylContact O-C 3.59Å; C62-C65 WeakPolarHBondContact O-CB 3.17Å; C62-C65 PolarHBondContact O-N 2.83Å; C62-C65 PolarHBondContact SG-N 3.1Å; C65-T68 WeakPolarHBondContact CA-OG1 2.99Å; C65-T68 PolarHBondContact O-OG1 2.84Å; C65-T68 VanDerWaalsContact O-OG1 3.04Å; C65-R69 VanDerWaalsContact O-CB 3.29Å; C65-R69 WeakPolarHBondContact O-CB 3.34Å; C65-R69 VanDerWaalsContact O-CG 3.3Å; C65-R69 WeakPolarHBondContact O-CG 3.41Å; C65-R69 PolarHBondContact O-N 2.89Å
66Q67.3Low60.8Low81 Ų8184.8 Ų84.838%0.37943%0.425SS..Hα-helixtrans-63.9-47.7175.4-170-175.834.600111.3I61 C62 C63 R69 T70I61-Q66 HydrophobicContact CG2-CB 4.1Å; C62-Q66 PolarHBondContact O-N 2.89Å; C63-Q66 PolarHBondContact O-N 3.28Å; Q66-R69 PolarHBondContact O-N 3.43Å; Q66-T70 WeakPolarHBondContact O-CG2 3.44Å; Q66-T70 PolarHBondContact O-N 3.37Å; Q66-T70 PolarHBondContact O-OG1 3.41Å
67K63.8Low60Low156 Ų15681.9 Ų81.968%0.67842%0.424SS*.Hα-helixtrans-64.6-41-179.5-69.6-179.3-179.3-175.50112.9C63 T70 S71C63-K67 PolarHBondContact O-N 3.48Å; K67-T70 WeakPolarHBondContact CA-OG1 3.4Å; K67-T70 PolarHBondContact O-OG1 3.01Å; K67-T70 VanDerWaalsContact O-OG1 3.05Å; K67-S71 WeakPolarHBondContact O-CB 3.28Å; K67-S71 PolarHBondContact O-N 3.28Å
68T64.4Low59Low64 Ų6487.4 Ų87.439%0.39345%0.45SS..Hα-helixtrans-68.4-39176.150.10000111.5A64 C65 R72A64-T68 PolarHBondContact O-N 3.17Å; A64-T68 PolarHBondContact O-OG1 3.25Å; A64-T68 VanDerWaalsContact O-OG1 3.08Å; C65-T68 WeakPolarHBondContact CA-OG1 2.99Å; C65-T68 PolarHBondContact O-OG1 2.84Å; C65-T68 VanDerWaalsContact O-OG1 3.04Å; T68-R72 WeakPolarHBondContact O-CG 3.23Å; T68-R72 PolarHBondContact O-N 3.08Å
69R64.5Low58.2Low40 Ų4089.7 Ų89.715%0.15145%0.452CS..Hα-helixtrans-65.9-44.5174.5-80-178.4174.4-142.73.1112.7C27 E57 I61 C65 Q66 S71 R72 R73C27-R69 VanDerWaalsContact SG-CZ 3.6Å; C27-R69 PolarHBondContact SG-NE 3.31Å; C27-R69 PolarHBondContact SG-NH2 2.85Å; E57-R69 VanDerWaalsContact CD-NH1 3.28Å; E57-R69 IonicContact OE1-CZ 3.82Å; E57-R69 IonicContact OE1-NH1 3.82Å; E57-R69 PolarHBondContact OE1-NH1 2.8Å; E57-R69 IonicContact OE2-NH1 2.77Å; E57-R69 PolarHBondContact OE2-NH1 3.43Å; I61-R69 VanDerWaalsContact CD1-NH1 3.33Å; C65-R69 VanDerWaalsContact O-CB 3.29Å; C65-R69 WeakPolarHBondContact O-CB 3.34Å; C65-R69 VanDerWaalsContact O-CG 3.3Å; C65-R69 WeakPolarHBondContact O-CG 3.41Å; C65-R69 PolarHBondContact O-N 2.89Å; Q66-R69 PolarHBondContact O-N 3.43Å; R69-S71 VanDerWaalsContact C-N 3.35Å; R69-R72 PolarHBondContact O-N 3.43Å; R69-R73 WeakPolarHBondContact O-CG 3.09Å; R69-R73 PolarHBondContact O-N 3.4Å
70T63.6Low57.3Low83 Ų8392 Ų9251%0.50947%0.47SS..Hα-helixtrans-64.9-40.4178.351.70000111.6Q66 K67 R72 R73 A74Q66-T70 WeakPolarHBondContact O-CG2 3.44Å; Q66-T70 PolarHBondContact O-N 3.37Å; Q66-T70 PolarHBondContact O-OG1 3.41Å; K67-T70 WeakPolarHBondContact CA-OG1 3.4Å; K67-T70 PolarHBondContact O-OG1 3.01Å; K67-T70 VanDerWaalsContact O-OG1 3.05Å; T70-R72 PolarHBondContact O-N 2.95Å; T70-R73 PolarHBondContact O-N 2.05Å; T70-A74 WeakPolarHBondContact O-CB 2.87Å; T70-A74 PolarHBondContact O-N 2.83Å
71S57.2Low56.3Low68 Ų6895.1 Ų95.148%0.47649%0.487SS..Hα-helixtrans-61.6-42.6173.8-175.20000112.2K67 R69 A74 K75K67-S71 WeakPolarHBondContact O-CB 3.28Å; K67-S71 PolarHBondContact O-N 3.28Å; R69-S71 VanDerWaalsContact C-N 3.35Å; S71-A74 PolarHBondContact O-N 3.28Å; S71-K75 PolarHBondContact O-N 2.84Å; S71-K75 VanDerWaalsContact O-N 3.11Å
72R60.5Low55.3Low126 Ų126102.5 Ų102.548%0.47552%0.522SS..Hα-helixtrans-68.4-38.8175-74.2-167.4-63.6-96.81.4113.3T68 R69 T70 A74 K75 S76T68-R72 WeakPolarHBondContact O-CG 3.23Å; T68-R72 PolarHBondContact O-N 3.08Å; R69-R72 PolarHBondContact O-N 3.43Å; T70-R72 PolarHBondContact O-N 2.95Å; R72-A74 PolarHBondContact O-N 3.16Å; R72-K75 PolarHBondContact O-N 3.41Å; R72-S76 WeakPolarHBondContact O-CB 3.19Å; R72-S76 PolarHBondContact O-N 2.89Å
73R58.6Low54.3Low142 Ų142110.9 Ų110.954%0.53656%0.561SS.*Hα-helixtrans-64.2-30.5174.1-75.6-178.3-175.9-86.23.7111.9E57 R69 T70E57-R73 IonicContact OE1-NH2 3.92Å; E57-R73 IonicContact OE2-CZ 3.84Å; E57-R73 IonicContact OE2-NH2 2.68Å; E57-R73 PolarHBondContact OE2-NH2 3.01Å; R69-R73 WeakPolarHBondContact O-CG 3.09Å; R69-R73 PolarHBondContact O-N 3.4Å; T70-R73 PolarHBondContact O-N 2.05Å
74A56.8Low53.5Low86 Ų86115.8 Ų115.871%0.71159%0.593SS**Hα-helixtrans-75.6-27.3175.200000113.3T70 S71 R72T70-A74 WeakPolarHBondContact O-CB 2.87Å; T70-A74 PolarHBondContact O-N 2.83Å; S71-A74 PolarHBondContact O-N 3.28Å; R72-A74 PolarHBondContact O-N 3.16Å
75K49Very low52.9Low181 Ų181117.8 Ų117.879%0.78761%0.609SS**Hα-helixtrans-96.5-19178-113.388.9174.7-169.70114.5S71 R72S71-K75 PolarHBondContact O-N 2.84Å; S71-K75 VanDerWaalsContact O-N 3.11Å; R72-K75 PolarHBondContact O-N 3.41Å
76S40.1Very low52.3Low71 Ų71121.1 Ų121.150%0.49764%0.638SS.*SBendtrans-84.1125178.5-171.10000108.4R72 Q78R72-S76 WeakPolarHBondContact O-CB 3.19Å; R72-S76 PolarHBondContact O-N 2.89Å; S76-Q78 PolarHBondContact O-N 2.98Å
77P44.8Very low51.9Low113 Ų113122.9 Ų122.973%0.73466%0.656SS**PPolyproline II helixtrans-55.2135159.725.1-29.6000106.5R79P77-R79 PolarHBondContact O-N 3.37Å
78Q42.2Very low51.3Low182 Ų182121.4 Ų121.485%0.8566%0.663SS**PPolyproline II helixtrans-54119.8176.5-66.9-159.1-9.500107.7S76 P80S76-Q78 PolarHBondContact O-N 2.98Å; Q78-P80 WeakPolarHBondContact O-CD 3.44Å; Q78-P80 VanDerWaalsContact O-N 3.12Å
79R43.1Very low50.5Low198 Ų198122.7 Ų122.775%0.74768%0.68SS**PPolyproline II helixtrans-49.6122.8167.8-173178.1179.4-144.20.2106.3P77 K81P77-R79 PolarHBondContact O-N 3.37Å; R79-K81 PolarHBondContact O-N 3.04Å
80P40.5Very low50Low111 Ų111127.3 Ų127.372%0.72171%0.712SS**PPolyproline II helixtrans-52.7132.8-179.8-23.631.6000108.3Q78 Q82Q78-P80 WeakPolarHBondContact O-CD 3.44Å; Q78-P80 VanDerWaalsContact O-N 3.12Å; P80-Q82 PolarHBondContact O-N 3.34Å; P80-Q82 VanDerWaalsContact O-N 3.07Å
81K41.8Very low49.2Very low196 Ų196130 Ų13085%0.85273%0.728SS**  trans-45.8121.9166.7-74.6173.4175.3174.60106.2R79 Q83R79-K81 PolarHBondContact O-N 3.04Å; K81-Q83 VanDerWaalsContact C-N 3.3Å; K81-Q83 PolarHBondContact O-N 2.85Å
82Q45Very low48.8Very low161 Ų161137.9 Ų137.975%0.75275%0.747SS**  trans-56103.5168.3-79.1-176.1-23.400106.5P80P80-Q82 PolarHBondContact O-N 3.34Å; P80-Q82 VanDerWaalsContact O-N 3.07Å
83Q46.5Very low47.9Very low177 Ų177136 Ų13683%0.82776%0.759SS**PPolyproline II helixtrans-62.6135.3161.7-79.8175.4-63.700106.3K81 A85K81-Q83 VanDerWaalsContact C-N 3.3Å; K81-Q83 PolarHBondContact O-N 2.85Å; Q83-A85 PolarHBondContact O-N 3.28Å; Q83-A85 VanDerWaalsContact O-N 3.14Å
84P49Very low47.3Very low126 Ų126135.6 Ų135.682%0.81877%0.774SS**PPolyproline II helixtrans-54.5123.4167.9-18.730.1000107.7A86P84-A86 PolarHBondContact O-N 2.97Å
85A46.1Very low46.5Very low95 Ų95136.3 Ų136.379%0.78578%0.78SS**PPolyproline II helixtrans-55.3127177.700000109Q83Q83-A85 PolarHBondContact O-N 3.28Å; Q83-A85 VanDerWaalsContact O-N 3.14Å
86A53.9Low46.4Very low86 Ų86136.3 Ų136.371%0.71178%0.78SS**PPolyproline II helixtrans-56.1143.3169.300000109.3P84P84-A86 PolarHBondContact O-N 2.97Å
87P57.8Low46.6Very low118 Ų118138.3 Ų138.377%0.76679%0.792SS**PPolyproline II helixtrans-61.514217726.2-33000109.7A89P87-A89 PolarHBondContact O-N 3.4Å
88P52.6Low46.3Very low126 Ų126144.3 Ų144.382%0.81880%0.8SS**PPolyproline II helixtrans-61.9136179.524.9-32000110.3V90P88-V90 PolarHBondContact O-N 3.06Å
89A46.6Very low46.1Very low91 Ų91140.3 Ų140.375%0.75279%0.792SS**PPolyproline II helixtrans-5613117900000111P87 V91P87-A89 PolarHBondContact O-N 3.4Å; A89-V91 PolarHBondContact O-N 2.91Å; A89-V91 VanDerWaalsContact O-N 3.08Å
90V53.3Low46.7Very low137 Ų137136.4 Ų136.483%0.8379%0.792SS**  trans-66.2104.5176-154.60000108.1P88 R92P88-V90 PolarHBondContact O-N 3.06Å; V90-R92 PolarHBondContact O-N 2.94Å; V90-R92 VanDerWaalsContact O-N 3.17Å
91V48.1Very low46.8Very low138 Ų138137.1 Ų137.184%0.83680%0.797SS**  trans-74.5104.4168.3-177.40000107.1A89 A93A89-V91 PolarHBondContact O-N 2.91Å; A89-V91 VanDerWaalsContact O-N 3.08Å; V91-A93 PolarHBondContact O-N 3.18Å
92R49.3Very low47Very low235 Ų235139.2 Ų139.289%0.88780%0.799SS**  trans-71.9114.3169.9-78.6175.5128.6-179.3-2.7108.9V90V90-R92 PolarHBondContact O-N 2.94Å; V90-R92 VanDerWaalsContact O-N 3.17Å
93A40.8Very low46.8Very low87 Ų87137 Ų13772%0.71980%0.802SS**PPolyproline II helixtrans-84145.3166.100000110.6V91V91-A93 PolarHBondContact O-N 3.18Å
94P46.9Very low46.7Very low132 Ų132136.9 Ų136.986%0.85780%0.801SS**PPolyproline II helixtrans-81.3169-176.533.5-33.1000113.2
95A40.1Very low46.5Very low102 Ų102141.3 Ų141.384%0.84380%0.801SS**PPolyproline II helixtrans-65.5155.5-161.500000117.4
96K46.4Very low46.5Very low180 Ų180144.8 Ų144.878%0.78380%0.801SS**PPolyproline II helixtrans-54.7163.4176.5-138.3159.4-177.8172.90114.2
97P43.2Very low46.3Very low113 Ų113145.6 Ų145.673%0.73480%0.799SS**  -141.2149.3113.533.1-17.3000116.8
98R39.1Very low45.8Very low240 Ų240150.8 Ų150.891%0.90680%0.804SS**  trans65.2114.6150.6-72.9177.7170.4-123.90121.2
99S37.9Very low45.4Very low97 Ų97150.2 Ų150.268%0.67880%0.803SS**  trans-91.3-174.8158-320000110.7
100P55Low45.7Very low116 Ų116151.4 Ų151.475%0.75380%0.803SS**  cis-136.3-166-14.939.6-17.5000113
101P44.5Very low45.6Very low126 Ų126150.9 Ų150.982%0.81880%0.802SS**  -141.1138.280.634-14.7000116.6
102R45.6Very low45.6Very low240 Ų240154.5 Ų154.591%0.90680%0.801SS**  trans16.7115.9136-159.6177.1-167.1-129.56.7120
103S39.9Very low45.5Very low115 Ų115148.8 Ų148.880%0.80480%0.797SS**  trans-163.4140.6145.4-137.50000106.7
104E45.8Very low46Very low175 Ų175150.5 Ų150.582%0.81879%0.79SS**  cis-153.8169.6-19.8-153.2-157.611300103.6
105R44.3Very low46.1Very low219 Ų219154 Ų15483%0.82679%0.786SS**  trans-60.3143.9-176-77.9164.8153.9-134.1-1112.5
106Q45.1Very low46.5Very low167 Ų167156.7 Ų156.778%0.7878%0.781SS**  -153.7130.7121.3-91.8-129.8-33.500111.8
107P49.4Very low46.7Very low103 Ų103153.5 Ų153.567%0.66978%0.779SS**  trans-99.7128.3170.634.6-24.3000110.1
108R47.8Very low47Very low227 Ų227158.5 Ų158.586%0.85778%0.783SS**  trans-142.1122.2155.4-71.4-166.7179.1-100.6-0.5110.8
109S45Very low47.6Very low114 Ų114152 Ų15280%0.79778%0.775SS**PPolyproline II helixtrans-67.6171.9-175.5-44.80000113.6
110P52.6Low48.5Very low116 Ų116152.8 Ų152.875%0.75378%0.778SS**PPolyproline II helixtrans-90.8160.5-169.137.2-31.7000112.4
111P51.8Low48.5Very low127 Ų127153.6 Ų153.683%0.82578%0.783SS**PPolyproline II helixtrans-97.2116154.431.6-24.1000110.5
112R48Very low48.7Very low213 Ų213157.7 Ų157.780%0.80478%0.782SS**PPolyproline II helixtrans-75.4126157.5177.6-179.1-175-1121.7107.9
113S47.1Very low48.7Very low115 Ų115151.7 Ų151.780%0.80478%0.777SS**  trans-155.988.5159.6-133.90000107.4
114E51.5Low49Very low123 Ų123154 Ų15458%0.57578%0.775SS**  46.4108.194.9-89.1-101.190.200114.3
115R48.3Very low49.2Very low207 Ų207157.2 Ų157.278%0.78178%0.779SS**  trans56.8113.6145.9-76.8173.6172.1-106.9-1.9120.2
116Q48.4Very low49.4Very low158 Ų158153.8 Ų153.874%0.73877%0.773SS**  -150130.4113.6-92.3-142.1-44.900111.7
117P50.7Low49.5Very low113 Ų113152 Ų15273%0.73478%0.775SS**  trans-81.6114163.631.2-25.9000108.9S119P117-S119 PolarHBondContact O-N 2.95Å
118R49.8Very low49.4Very low217 Ų217157.3 Ų157.382%0.81978%0.782SS**  trans-88.8103.1170.8-77.6-176177.3-105-0.9109.7
119S51.6Low49.5Very low105 Ų105151.6 Ų151.673%0.73478%0.777SS**  trans49.6134.5148.7-49.60000120.7P117P117-S119 PolarHBondContact O-N 2.95Å
120P57.3Low49.9Very low113 Ų113151.5 Ų151.573%0.73477%0.774SS**  trans-71.7146170.731.2-33.3000110.9R122P120-R122 PolarHBondContact O-N 3.49Å
121P53.5Low49.5Very low133 Ų133152 Ų15286%0.86478%0.777SS**  trans-71.496.7164.229.1-30.7000108.8S123P121-S123 PolarHBondContact O-N 3.07Å
122R49.5Very low49.2Very low212 Ų212155.5 Ų155.580%0.877%0.774SS**  trans-81.599.9161.3-162.7175.6-170.8-114.7-1.4108.1P120P120-R122 PolarHBondContact O-N 3.49Å
123S44.8Very low49Very low114 Ų114150.2 Ų150.280%0.79777%0.769SS**  trans-146.381.9152.8-85.70000107.3P121 R125P121-S123 PolarHBondContact O-N 3.07Å; S123-R125 PolarHBondContact O-N 2.86Å
124E48Very low49.2Very low162 Ų162153.8 Ų153.876%0.75777%0.773SS**  trans-48.5113.6156.6-77.7-152.310000108.4Q126E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 3.2Å
125R48.3Very low49.1Very low244 Ų244156.4 Ų156.492%0.92178%0.778SS**  trans-62.6100.6161-79.2177.9174-117.80.3106.6S123S123-R125 PolarHBondContact O-N 2.86Å
126Q48.6Very low49.3Very low146 Ų146154.5 Ų154.568%0.68278%0.778SS**  trans-56.6130.7159.5-83.3-154-4000109E124 R128E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 3.2Å; Q126-R128 PolarHBondContact O-N 3.14Å; Q126-R128 VanDerWaalsContact O-N 3.14Å
127P47.6Very low49.4Very low129 Ų129152.7 Ų152.784%0.83878%0.78SS**  trans-73.4104.2169.728.7-29.3000108.1S129P127-S129 PolarHBondContact O-N 3.38Å
128R48.5Very low49.8Very low215 Ų215157.6 Ų157.681%0.81178%0.784SS**  trans-84.2110.5172.9-80.2-172.7177.1-109.3-1110.8Q126Q126-R128 PolarHBondContact O-N 3.14Å; Q126-R128 VanDerWaalsContact O-N 3.14Å
129S48.7Very low50.1Low107 Ų107153.2 Ų153.275%0.74878%0.783SS**  trans99.1127.6148.2-55.40000117.9P127P127-S129 PolarHBondContact O-N 3.38Å
130P52.8Low50.5Low113 Ų113158.3 Ų158.373%0.73479%0.787SS**  trans-67.4158.5171.629.7-33.5000110.7R132P130-R132 PolarHBondContact O-N 3.09Å; P130-R132 VanDerWaalsContact O-N 3.09Å
131P45.6Very low50.6Low125 Ų125158.2 Ų158.281%0.81279%0.786SS**  trans-58.4120.2174.525-32.2000108.6S133P131-S133 PolarHBondContact O-N 2.78Å
132R44.8Very low51Low201 Ų201160.7 Ų160.776%0.75879%0.786SS**  trans-57.6115176.2-166.9178-168.8-136.38.3107.3P130 E134P130-R132 PolarHBondContact O-N 3.09Å; P130-R132 VanDerWaalsContact O-N 3.09Å; R132-E134 PolarHBondContact O-N 3.48Å
133S44.1Very low51.5Low102 Ų102155.8 Ų155.871%0.71378%0.779SS**  trans-31.9133.9176.9-59.10000112P131 R135P131-S133 PolarHBondContact O-N 2.78Å; S133-R135 VanDerWaalsContact C-N 3.34Å; S133-R135 PolarHBondContact O-N 3.04Å
134E51Low52.3Low191 Ų191160.8 Ų160.889%0.89378%0.781SS**  trans-39101.2161.4-87.5-151.595.200109.3R132 Q136R132-E134 PolarHBondContact O-N 3.48Å; E134-Q136 PolarHBondContact O-N 3.38Å; E134-Q136 VanDerWaalsContact O-N 3.1Å
135R50.1Low53.2Low177 Ų177158.4 Ų158.467%0.66878%0.779SS**  trans-72.4107.6166.1-88-173.2173.7-139.6-4.6104.9S133S133-R135 VanDerWaalsContact C-N 3.34Å; S133-R135 PolarHBondContact O-N 3.04Å
136Q51.7Low53.7Low167 Ų167152.2 Ų152.278%0.7877%0.771SS**  trans-43.6140169-74.4-150.3-9.300110.7E134 R138E134-Q136 PolarHBondContact O-N 3.38Å; E134-Q136 VanDerWaalsContact O-N 3.1Å; Q136-R138 PolarHBondContact O-N 3.17Å; Q136-R138 VanDerWaalsContact O-N 3.17Å
137P50.5Low54.3Low121 Ų121151 Ų15179%0.78678%0.775SS**PPolyproline II helixtrans-58.2124.6176.722.9-30.4000108.7
138R59.6Low55.2Low216 Ų216149.3 Ų149.382%0.81577%0.772SS**PPolyproline II helixtrans-58.4138.5171.1-76.8-175.3173.6-135.3-3.4108.5Q136 R140Q136-R138 PolarHBondContact O-N 3.17Å; Q136-R138 VanDerWaalsContact O-N 3.17Å; R138-R140 PolarHBondContact O-N 3.1Å
139P55.9Low55.7Low124 Ų124148.8 Ų148.881%0.80578%0.776SS**PPolyproline II helixtrans-56.8137.317422.6-30.6000109.4
140R60Low56.3Low213 Ų213152.8 Ų152.880%0.80478%0.783SS**PPolyproline II helixtrans-56.5135.8-177.5-173.6176.9-179-129.42109.3R138 E142R138-R140 PolarHBondContact O-N 3.1Å; R140-E142 PolarHBondContact O-N 3.33Å
141P58.3Low56.9Low110 Ų110157 Ų15771%0.71478%0.784SS**PPolyproline II helixtrans-57.2125.1170-18.629.4000108.9V143P141-V143 PolarHBondContact O-N 3.08Å
142E62.1Low57.6Low185 Ų185156.1 Ų156.186%0.86478%0.778SS**  trans-64.9107.8174.9-165.4168.99400108.1R140 R144R140-E142 PolarHBondContact O-N 3.33Å; E142-R144 PolarHBondContact O-N 3.02Å; E142-R144 VanDerWaalsContact O-N 3.08Å
143V59.6Low58.4Low109 Ų109152.5 Ų152.566%0.66178%0.781SS**  trans-72.3103.7176.3178.70000106.2P141P141-V143 PolarHBondContact O-N 3.08Å
144R62.5Low59.2Low219 Ų219155 Ų15583%0.82678%0.781SS**PPolyproline II helixtrans-56.2130.4170.7-77.6-173.6177.4-158.2-0.9108.8E142E142-R144 PolarHBondContact O-N 3.02Å; E142-R144 VanDerWaalsContact O-N 3.08Å
145P66.1Low59.4Low112 Ų112155.6 Ų155.673%0.72778%0.781SS**PPolyproline II helixtrans-61146.9174.524.6-31.3000109.7
146P58.7Low59.8Low115 Ų115152.3 Ų152.375%0.74779%0.785SS**PPolyproline II helixtrans-60.1147.3176.526-33.3000110A148P146-A148 PolarHBondContact O-N 3.19Å
147P62.6Low60Low120 Ų120154.1 Ų154.178%0.77979%0.79SS**PPolyproline II helixtrans-58.5133.7176.924.4-32.3000109.6K149P147-K149 PolarHBondContact O-N 3.25Å
148A64.9Low60.3Low93 Ų93157.1 Ų157.177%0.76979%0.794SS**PPolyproline II helixtrans-53.8127.9175.700000109.1P146 Q150P146-A148 PolarHBondContact O-N 3.19Å; A148-Q150 PolarHBondContact O-N 3.17Å
149K61.1Low60.3Low205 Ų205155.2 Ų155.289%0.89179%0.794SS**  trans-52.7114.9174-68.1-179.5177.7-178.60107.9P147 R151P147-K149 PolarHBondContact O-N 3.25Å; K149-R151 PolarHBondContact O-N 3.01Å
150Q59.8Low60.1Low191 Ų191155.2 Ų155.289%0.89379%0.794SS**PPolyproline II helixtrans-55.2123.2172.4-74-1764.300108A148A148-Q150 PolarHBondContact O-N 3.17Å
151R65.5Low59.8Low200 Ų200156.6 Ų156.676%0.75580%0.799SS**PPolyproline II helixtrans-58.9135168.5-93.9171.787.8-14511107.5K149K149-R151 PolarHBondContact O-N 3.01Å
152P61.1Low59.5Low107 Ų107157 Ų15770%0.69581%0.805SS**PPolyproline II helixtrans-57.5145.3171.923.2-30.8000109.4Q154P152-Q154 PolarHBondContact O-N 3.25Å
153P61.1Low59.4Low125 Ų125153.2 Ų153.281%0.81280%0.799SS**PPolyproline II helixtrans-57.6128.9-178.223.1-32.1000109.2K155P153-K155 PolarHBondContact O-N 3.12Å
154Q61.7Low59.3Low154 Ų154154.1 Ų154.172%0.7281%0.807SS**  trans-62.1113.5171.6-75.1-148.3-37.900108P152 S156P152-Q154 PolarHBondContact O-N 3.25Å; Q154-S156 PolarHBondContact O-N 2.95Å
155K54.5Low58.9Low205 Ų205152 Ų15289%0.89181%0.812SS**  trans-56.8106.8170.6-162.1173-173.2179.50107.2P153 K157P153-K155 PolarHBondContact O-N 3.12Å; K155-K157 PolarHBondContact O-N 3.03Å; K155-K157 VanDerWaalsContact O-N 3.12Å
156S58.2Low58.1Low107 Ų107158.4 Ų158.475%0.74882%0.821SS**  trans-51.3118.9175.8-49.10000108.7Q154 Q158Q154-S156 PolarHBondContact O-N 2.95Å; S156-Q158 PolarHBondContact O-N 2.98Å
157K57.4Low57.5Low205 Ų205155.9 Ų155.989%0.89182%0.815SS**  trans-57.7105.8166.8-96.4176.1169.7177.90106.8K155 Q159K155-K157 PolarHBondContact O-N 3.03Å; K155-K157 VanDerWaalsContact O-N 3.12Å; K157-Q159 PolarHBondContact O-N 3.32Å
158Q55.9Low57Low185 Ų185156.6 Ų156.686%0.86482%0.82SS**PPolyproline II helixtrans-58.4120.1163.2-79.2-179.7-12.100107S156S156-Q158 PolarHBondContact O-N 2.98Å
159Q58.7Low56.2Low175 Ų175156 Ų15682%0.81882%0.823SS**PPolyproline II helixtrans-59.6139170.2-72.9177.6-34.600108.7K157 R161K157-Q159 PolarHBondContact O-N 3.32Å; Q159-R161 PolarHBondContact O-N 3.14Å
160P52.8Low55.4Low125 Ų125151.2 Ų151.281%0.81282%0.822SS**PPolyproline II helixtrans-62.6121.817225.8-30.5000108.1S162P160-S162 PolarHBondContact O-N 3.18Å; P160-S162 VanDerWaalsContact O-N 3.14Å
161R52.9Low55.1Low241 Ų241147.9 Ų147.991%0.90982%0.82SS**PPolyproline II helixtrans-57.8118.3170.7-78.5-177.6166.2-149.9-3.1107.9Q159 S163Q159-R161 PolarHBondContact O-N 3.14Å; R161-S163 PolarHBondContact O-N 3.19Å
162S52.6Low54.5Low119 Ų119150.2 Ų150.283%0.83283%0.829SS**PPolyproline II helixtrans-57.2122.9169.821.50000109.6P160P160-S162 PolarHBondContact O-N 3.18Å; P160-S162 VanDerWaalsContact O-N 3.14Å
163S59.5Low53.8Low106 Ų106149.3 Ų149.374%0.74184%0.839SS**PPolyproline II helixtrans-57.1139.5172.3-53.50000110.7R161 L165R161-S163 PolarHBondContact O-N 3.19Å; S163-L165 PolarHBondContact O-N 3.33Å
164P58.5Low52.9Low128 Ų128147.1 Ų147.183%0.83184%0.839SS**PPolyproline II helixtrans-66.6125.5171.8-16.530.1000110.1R166P164-R166 PolarHBondContact O-N 3.3Å
165L52.8Low52.5Low175 Ų175145.4 Ų145.492%0.91684%0.844SS**PPolyproline II helixtrans-56.1124.2170.8-80.3155.5000109.9S163 G167S163-L165 PolarHBondContact O-N 3.33Å; L165-G167 PolarHBondContact O-N 3.18Å
166R50Low52.8Low246 Ų246141.3 Ų141.393%0.92884%0.838SS**  trans-65.2105.9171-170.2-179-75.8-127.80.9107.9P164P164-R166 PolarHBondContact O-N 3.3Å
167G46Very low52.6Low61 Ų61143.3 Ų143.363%0.62985%0.846SS**PPolyproline II helixtrans-72.1149.3173.500000111.9L165L165-G167 PolarHBondContact O-N 3.18Å
168P51.1Low52.4Low135 Ų135143.4 Ų143.488%0.87785%0.846SS**PPolyproline II helixtrans-77.7156.6178.532.5-31.4000111.6
169G48.4Very low52.1Low81 Ų81139.7 Ų139.784%0.83585%0.847SS**PPolyproline II helixtrans-66.8164.1-159.800000117.5
170A45.3Very low51.6Low105 Ų105136.4 Ų136.487%0.86884%0.843SS**  trans-141.5104.2150.700000108.5
171S53.8Low51.6Low121 Ų121141.6 Ų141.685%0.84685%0.847SS**  trans-66.4121.7172.5-46.30000110.9
172R52.5Low51.5Low248 Ų248143.2 Ų143.294%0.93686%0.861SS**  trans-152.6103.7150.7-68-165.1171.8-167.6-4.3105.7
173G46.2Very low51.5Low88 Ų88144.4 Ų144.491%0.90786%0.862SS**  87.977.868.300000108.4
174G42.6Very low51Low79 Ų79146.4 Ų146.481%0.81487%0.868SS**  trans-143.497.1176.500000109.6
175S53.4Low50.6Low118 Ų118147.4 Ų147.483%0.82587%0.87SS**  trans-70.6157.3175.2-91.10000112.1
176P59.7Low50.5Low119 Ų119145.8 Ų145.877%0.77387%0.868SS**  trans-87.1139.5-169.234.8-31.5000111.2
177V55Low50.5Low149 Ų149139.6 Ų139.690%0.90386%0.864SS**  trans-118.9110.9160.1-850000109.5
178K52.9Low50.8Low208 Ų208144.8 Ų144.890%0.90488%0.88SS**  trans-53139.7162.2-70.5170.1168178.40110
179A48.6Very low50.8Low106 Ų106145.5 Ų145.588%0.87688%0.88SS**  -165.3109.7128.200000109.6
180S49.1Very low51Low106 Ų106150.5 Ų150.574%0.74188%0.883SS**  trans-100.6134.7162.21790000106.8
181R52.1Low51.4Low235 Ų235154.3 Ų154.389%0.88789%0.885SS**  trans177115.7152-96.2162.3-168.4-1244.7105.7
182F51.5Low51.2Low274 Ų274157.3 Ų157.3100%1.20289%0.888SS**  51.6085-88.3-77.3000112.2

Retrieved 182 of 182 residues in 308 ms (Link to these results)