A0A077Z124_TRITR Loading...

Collagen protein 48

AlphaFold DB , UniProt , Accession A0A077Z124, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 299 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
1M64.4Low70.4Confident189 Ų189132.1 Ų132.193%0.93161%0.611SS**  0-48.60-63.4-56.2-83.300111.7E3 Y4 Q5M1-E3 PolarHBondContact O-N 3.35Å; M1-Y4 VanDerWaalsContact O-CB 3.31Å; M1-Y4 WeakPolarHBondContact O-CB 3.41Å; M1-Y4 PolarHBondContact O-N 3.12Å; M1-Y4 VanDerWaalsContact O-N 3.15Å; M1-Q5 PolarHBondContact O-N 2.87Å
2E73.4Confident69.9Low155 Ų155127 Ų12772%0.72462%0.621SS**Hα-helixtrans-64.4-39179-67.8179.5137.900114.4Y4 Q5 K6E2-Y4 PolarHBondContact O-N 3.35Å; E2-Q5 PolarHBondContact O-N 3.48Å; E2-K6 PolarHBondContact O-N 2.93Å
3E76.6Confident69.6Low151 Ų151128.7 Ų128.771%0.70664%0.635SS**Hα-helixtrans-59.6-35.1172.7-84.3-100.5125.100112.5M1 K6 L7M1-E3 PolarHBondContact O-N 3.35Å; E3-K6 PolarHBondContact O-N 3.19Å; E3-L7 PolarHBondContact O-N 3.08Å; E3-L7 VanDerWaalsContact O-N 3.14Å
4Y66.3Low69.4Low125 Ų125132.6 Ų132.649%0.4964%0.639SS.*Hα-helixtrans-67.1-45.5179.6-102.1-98.2000111.4M1 E2 K6 L7 E8M1-Y4 VanDerWaalsContact O-CB 3.31Å; M1-Y4 WeakPolarHBondContact O-CB 3.41Å; M1-Y4 PolarHBondContact O-N 3.12Å; M1-Y4 VanDerWaalsContact O-N 3.15Å; E2-Y4 PolarHBondContact O-N 3.35Å; Y4-K6 VanDerWaalsContact C-N 3.34Å; Y4-K6 PolarHBondContact O-N 2.95Å; Y4-L7 WeakPolarHBondContact O-CB 3.33Å; Y4-L7 PolarHBondContact O-N 3.22Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; Y4-E8 PolarHBondContact O-N 2.94Å
5Q73.8Confident69.1Low136 Ų136135.9 Ų135.964%0.63666%0.661SS**Hα-helixtrans-64-39.4177.8-76.3-179-48.300112.2M1 E2 L7 E8 E9M1-Q5 PolarHBondContact O-N 2.87Å; E2-Q5 PolarHBondContact O-N 3.48Å; Q5-L7 PolarHBondContact O-N 3.32Å; Q5-E8 PolarHBondContact O-N 3.43Å; Q5-E9 PolarHBondContact O-N 3.3Å
6K76.5Confident68.8Low129 Ų129131.4 Ų131.456%0.56164%0.641SS**Hα-helixtrans-63.6-30.4174.5-74.7-179.7-178.8173.80112.7E2 E3 Y4 K10E2-K6 PolarHBondContact O-N 2.93Å; E3-K6 PolarHBondContact O-N 3.19Å; Y4-K6 VanDerWaalsContact C-N 3.34Å; Y4-K6 PolarHBondContact O-N 2.95Å; K6-K10 WeakPolarHBondContact O-CG 3.31Å; K6-K10 PolarHBondContact O-N 3.31Å
7L69.2Low69.1Low76 Ų76126.9 Ų126.940%0.39863%0.63SS.*Hα-helixtrans-73.1-44175.6-129.387.5000111.3E3 Y4 Q5 E9 K10 I11 F28E3-L7 PolarHBondContact O-N 3.08Å; E3-L7 VanDerWaalsContact O-N 3.14Å; Y4-L7 WeakPolarHBondContact O-CB 3.33Å; Y4-L7 PolarHBondContact O-N 3.22Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; Q5-L7 PolarHBondContact O-N 3.32Å; L7-E9 VanDerWaalsContact C-N 3.35Å; L7-E9 PolarHBondContact O-N 2.9Å; L7-K10 PolarHBondContact O-N 2.9Å; L7-I11 HydrophobicContact CD2-CD1 4.38Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.43Å; L7-I11 PolarHBondContact O-N 3.48Å; L7-F28 HydrophobicContact CD2-CE1 4.34Å; L7-F28 HydrophobicContact CD2-CE2 4.36Å; L7-F28 HydrophobicContact CD2-CZ 3.75Å
8E70.2Confident69.5Low141 Ų141126.1 Ų126.166%0.65964%0.635SS**Hα-helixtrans-61.3-42.2177.5-72.9-166.4142.500112.1Y4 Q5 K10 I11 G12Y4-E8 PolarHBondContact O-N 2.94Å; Q5-E8 PolarHBondContact O-N 3.43Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 3.36Å; E8-I11 PolarHBondContact O-N 3.05Å; E8-G12 PolarHBondContact O-N 2.77Å
9E71Confident70.1Confident150 Ų150131.1 Ų131.170%0.70165%0.646SS**Hα-helixtrans-62.8-39.2176.4-166.8-176.5174.800112Q5 L7 N13Q5-E9 PolarHBondContact O-N 3.3Å; L7-E9 VanDerWaalsContact C-N 3.35Å; L7-E9 PolarHBondContact O-N 2.9Å; E9-N13 PolarHBondContact O-N 2.75Å
10K67.3Low70.6Confident148 Ų148127.6 Ų127.664%0.64363%0.632SS**Hα-helixtrans-69.5-30.4176-79.5178.6-179.6177.50113.4K6 L7 E8K6-K10 WeakPolarHBondContact O-CG 3.31Å; K6-K10 PolarHBondContact O-N 3.31Å; L7-K10 PolarHBondContact O-N 2.9Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 3.36Å
11I65.3Low71.2Confident53 Ų53124.5 Ų124.527%0.27262%0.62SS.*Hα-helixtrans-80.6-39.7179.1-66162.4000110.3L7 E8 N13 R14L7-I11 HydrophobicContact CD2-CD1 4.38Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.43Å; L7-I11 PolarHBondContact O-N 3.48Å; E8-I11 PolarHBondContact O-N 3.05Å; I11-N13 PolarHBondContact O-N 2.03Å; I11-R14 PolarHBondContact O-N 2.84Å
12G65.1Low72.1Confident71 Ų71118.3 Ų118.373%0.73260%0.599SS**Hα-helixtrans-64.3-24.7177.900000114.2E8E8-G12 PolarHBondContact O-N 2.77Å
13N66.2Low72.8Confident149 Ų149117.8 Ų117.880%0.79760%0.595SS**THydrogen-bonded Turntrans-92.9-1.6-179-149.516.5000114.2E9 I11E9-N13 PolarHBondContact O-N 2.75Å; I11-N13 PolarHBondContact O-N 2.03Å
14R66.6Low73.3Confident183 Ų183112.5 Ų112.569%0.69157%0.574SS**SBendtrans-107.2129.8173-69.1-176.4-179-1710107.9I11 L16I11-R14 PolarHBondContact O-N 2.84Å; R14-L16 HydrophobicContact CB-CD1 4.17Å; R14-L16 PolarHBondContact O-N 3.33Å
15N64.3Low74.3Confident182 Ų182109.9 Ų109.997%0.97357%0.574SS**  trans-64.460.8167.2-84.1-51.8000110.6
16L64.6Low75.2Confident65 Ų65107.7 Ų107.734%0.3457%0.57SS.*  trans-71.7131.5172.8-126.270.3000106.9R14 T20 V21R14-L16 HydrophobicContact CB-CD1 4.17Å; R14-L16 PolarHBondContact O-N 3.33Å; L16-T20 HydrophobicContact CD2-CG2 3.48Å; L16-T20 VanDerWaalsContact CD2-CG2 3.48Å; L16-T20 HydrophobicContact CG-CG2 3.87Å; L16-V21 HydrophobicContact CB-CG2 3.92Å; L16-V21 HydrophobicContact CD2-CG2 4.46Å
17A73.6Confident76Confident55 Ų55104.3 Ų104.346%0.45556%0.56SS.*  trans-51.4139177.400000109.2R19 T20 V21A17-R19 PolarHBondContact O-N 2.98Å; A17-T20 WeakPolarHBondContact O-CA 3.45Å; A17-T20 WeakPolarHBondContact O-CB 3.3Å; A17-T20 PolarHBondContact O-N 3.45Å; A17-V21 PolarHBondContact O-N 2.87Å
18P77.2Confident77Confident112 Ų112104.9 Ų104.973%0.72756%0.559SS**Hα-helixtrans-55.1-26.1-176.618.5-31.3000112.7A22P18-A22 WeakPolarHBondContact O-CB 3.37Å; P18-A22 PolarHBondContact O-N 3.43Å; P18-A22 VanDerWaalsContact O-N 3.1Å
19R81Confident78.1Confident220 Ų220101.2 Ų101.283%0.8355%0.549SS*.Hα-helixtrans-64.7-40172.4-65.8-177.3173.5176.7-2.1113.5A17 F23A17-R19 PolarHBondContact O-N 2.98Å; R19-F23 WeakPolarHBondContact O-CB 3.24Å; R19-F23 PolarHBondContact O-N 3.47Å
20T80.3Confident79.2Confident61 Ų6197.6 Ų97.637%0.37454%0.537SS..Hα-helixtrans-70.1-41.5179.4-48.80000110.8L16 A17 F23 C24L16-T20 HydrophobicContact CD2-CG2 3.48Å; L16-T20 VanDerWaalsContact CD2-CG2 3.48Å; L16-T20 HydrophobicContact CG-CG2 3.87Å; A17-T20 WeakPolarHBondContact O-CA 3.45Å; A17-T20 WeakPolarHBondContact O-CB 3.3Å; A17-T20 PolarHBondContact O-N 3.45Å; T20-F23 PolarHBondContact O-N 3.23Å; T20-C24 WeakPolarHBondContact O-CB 3.2Å; T20-C24 PolarHBondContact O-N 3.03Å; T20-C24 PolarHBondContact O-SG 3.17Å; T20-C24 VanDerWaalsContact O-SG 3.32Å
21V81.4Confident80.4Confident64 Ų6494.5 Ų94.539%0.38853%0.53SS..Hα-helixtrans-61.9-45.5175.7-177.30000110.7L16 A17 F23 C24 S25L16-V21 HydrophobicContact CB-CG2 3.92Å; L16-V21 HydrophobicContact CD2-CG2 4.46Å; A17-V21 PolarHBondContact O-N 2.87Å; V21-F23 PolarHBondContact O-N 3.05Å; V21-C24 PolarHBondContact O-N 2.93Å; V21-S25 WeakPolarHBondContact O-CB 2.96Å; V21-S25 PolarHBondContact O-N 3.05Å
22A85Confident81.8Confident58 Ų5893.8 Ų93.848%0.47953%0.533SS..Hα-helixtrans-60.5-45.2176.300000112.1P18 S25 V26P18-A22 WeakPolarHBondContact O-CB 3.37Å; P18-A22 PolarHBondContact O-N 3.43Å; P18-A22 VanDerWaalsContact O-N 3.1Å; A22-S25 PolarHBondContact O-N 3.33Å; A22-V26 WeakPolarHBondContact O-CG2 3.43Å; A22-V26 PolarHBondContact O-N 3.16Å; A22-V26 VanDerWaalsContact O-N 3.08Å
23F88.3Confident83.2Confident145 Ų14594.5 Ų94.564%0.63652%0.522SS*.Hα-helixtrans-63-46.8177.6-175.5-98.5000112.1R19 T20 V21 S25 V26 V27R19-F23 WeakPolarHBondContact O-CB 3.24Å; R19-F23 PolarHBondContact O-N 3.47Å; T20-F23 PolarHBondContact O-N 3.23Å; V21-F23 PolarHBondContact O-N 3.05Å; F23-S25 VanDerWaalsContact C-N 3.34Å; F23-S25 PolarHBondContact O-N 2.91Å; F23-V26 PolarHBondContact O-N 3.48Å; F23-V27 HydrophobicContact CD1-CG2 4.08Å; F23-V27 HydrophobicContact CE1-CG2 3.7Å; F23-V27 HydrophobicContact CE2-CG2 4.34Å; F23-V27 HydrophobicContact CZ-CG2 3.84Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.21Å
24C86.7Confident84.4Confident39 Ų3991 Ų9126%0.26451%0.507SS..Hα-helixtrans-59.1-44.5176.3-72.50000111.5T20 V21 V26 V27 F28T20-C24 WeakPolarHBondContact O-CB 3.2Å; T20-C24 PolarHBondContact O-N 3.03Å; T20-C24 PolarHBondContact O-SG 3.17Å; T20-C24 VanDerWaalsContact O-SG 3.32Å; V21-C24 PolarHBondContact O-N 2.93Å; C24-V26 VanDerWaalsContact C-N 3.32Å; C24-V26 PolarHBondContact O-N 3.15Å; C24-V27 PolarHBondContact O-N 3.46Å; C24-F28 HydrophobicContact CB-CD2 4.31Å; C24-F28 HydrophobicContact CB-CE2 4.21Å; C24-F28 WeakPolarHBondContact O-CD2 3.4Å; C24-F28 PolarHBondContact O-N 3.38Å
25S87.4Confident85.7Confident70 Ų7084.6 Ų84.649%0.4949%0.493SS..Hα-helixtrans-59.3-42177.6-173.70000112.5V21 A22 F23 S29V21-S25 WeakPolarHBondContact O-CB 2.96Å; V21-S25 PolarHBondContact O-N 3.05Å; A22-S25 PolarHBondContact O-N 3.33Å; F23-S25 VanDerWaalsContact C-N 3.34Å; F23-S25 PolarHBondContact O-N 2.91Å; S25-S29 WeakPolarHBondContact O-CB 3.14Å; S25-S29 PolarHBondContact O-N 3.35Å; S25-S29 PolarHBondContact O-OG 2.77Å
26V92.4Very high87.2Confident91 Ų9178.8 Ų78.855%0.55247%0.466SS*.Hα-helixtrans-66.2-45.5177.5174.10000110.3A22 F23 C24 S29 T30A22-V26 WeakPolarHBondContact O-CG2 3.43Å; A22-V26 PolarHBondContact O-N 3.16Å; A22-V26 VanDerWaalsContact O-N 3.08Å; F23-V26 PolarHBondContact O-N 3.48Å; C24-V26 VanDerWaalsContact C-N 3.32Å; C24-V26 PolarHBondContact O-N 3.15Å; V26-S29 PolarHBondContact O-N 3.03Å; V26-T30 HydrophobicContact CG1-CG2 4.41Å; V26-T30 WeakPolarHBondContact O-CG2 3.36Å; V26-T30 PolarHBondContact O-N 3.32Å; V26-T30 PolarHBondContact O-OG1 3.3Å
27V92.6Very high88.5Confident58 Ų5881.3 Ų81.335%0.35248%0.479SS..Hα-helixtrans-63.5-43.7179.5174.20000111.9F23 C24 S29 T30 V31F23-V27 HydrophobicContact CD1-CG2 4.08Å; F23-V27 HydrophobicContact CE1-CG2 3.7Å; F23-V27 HydrophobicContact CE2-CG2 4.34Å; F23-V27 HydrophobicContact CZ-CG2 3.84Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.21Å; C24-V27 PolarHBondContact O-N 3.46Å; V27-S29 VanDerWaalsContact C-N 3.32Å; V27-S29 PolarHBondContact O-N 3.47Å; V27-T30 WeakPolarHBondContact CA-OG1 3.31Å; V27-T30 PolarHBondContact O-N 3.28Å; V27-T30 PolarHBondContact O-OG1 3.5Å; V27-V31 HydrophobicContact CG1-CG2 4.41Å; V27-V31 WeakPolarHBondContact O-CB 3.28Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.49Å; V27-V31 PolarHBondContact O-N 3.34Å
28F90.1Very high89.4Confident88 Ų8884.6 Ų84.639%0.38649%0.488SS..Hα-helixtrans-64.8-38.2176.4-76.9-62.7000112.1L7 C24 A32L7-F28 HydrophobicContact CD2-CE1 4.34Å; L7-F28 HydrophobicContact CD2-CE2 4.36Å; L7-F28 HydrophobicContact CD2-CZ 3.75Å; C24-F28 HydrophobicContact CB-CD2 4.31Å; C24-F28 HydrophobicContact CB-CE2 4.21Å; C24-F28 WeakPolarHBondContact O-CD2 3.4Å; C24-F28 PolarHBondContact O-N 3.38Å; F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.25Å; F28-A32 PolarHBondContact O-N 3.37Å
29S92.6Very high90.2Very high64 Ų6482.4 Ų82.445%0.44847%0.473SS..Hα-helixtrans-66.8-42.6177.5-57.10000111.6S25 V26 V27 A32 V33S25-S29 WeakPolarHBondContact O-CB 3.14Å; S25-S29 PolarHBondContact O-N 3.35Å; S25-S29 PolarHBondContact O-OG 2.77Å; V26-S29 PolarHBondContact O-N 3.03Å; V27-S29 VanDerWaalsContact C-N 3.32Å; V27-S29 PolarHBondContact O-N 3.47Å; S29-A32 PolarHBondContact O-N 3.47Å; S29-V33 WeakPolarHBondContact O-CB 3.41Å; S29-V33 VanDerWaalsContact O-CG2 3.24Å; S29-V33 WeakPolarHBondContact O-CG2 3.29Å; S29-V33 PolarHBondContact O-N 3.41Å
30T94.1Very high90.8Very high73 Ų7378.6 Ų78.645%0.44846%0.463SS..Hα-helixtrans-67.7-40.217853.10000112V26 V27 V33 T34V26-T30 HydrophobicContact CG1-CG2 4.41Å; V26-T30 WeakPolarHBondContact O-CG2 3.36Å; V26-T30 PolarHBondContact O-N 3.32Å; V26-T30 PolarHBondContact O-OG1 3.3Å; V27-T30 WeakPolarHBondContact CA-OG1 3.31Å; V27-T30 PolarHBondContact O-N 3.28Å; V27-T30 PolarHBondContact O-OG1 3.5Å; T30-V33 PolarHBondContact O-N 3.13Å; T30-T34 WeakPolarHBondContact O-CB 3.49Å; T30-T34 VanDerWaalsContact O-CG2 3.3Å; T30-T34 WeakPolarHBondContact O-CG2 3.35Å; T30-T34 PolarHBondContact O-N 3.14Å; T30-T34 PolarHBondContact O-OG1 3.45Å
31V94.4Very high91.3Very high83 Ų8379.5 Ų79.550%0.50347%0.469SS..Hα-helixtrans-64.2-43.3174.5173.50000111.2V27 T34 A35V27-V31 HydrophobicContact CG1-CG2 4.41Å; V27-V31 WeakPolarHBondContact O-CB 3.28Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.49Å; V27-V31 PolarHBondContact O-N 3.34Å; V31-T34 WeakPolarHBondContact CA-OG1 3.4Å; V31-T34 PolarHBondContact O-N 3.43Å; V31-T34 PolarHBondContact O-OG1 3.23Å; V31-A35 VanDerWaalsContact O-CB 3.29Å; V31-A35 WeakPolarHBondContact O-CB 3.38Å; V31-A35 PolarHBondContact O-N 2.71Å
32A93Very high91.8Very high39 Ų3982.3 Ų82.332%0.32248%0.482SS..Hα-helixtrans-63.5-45.7177.400000111.9F28 S29 A35 C36F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.25Å; F28-A32 PolarHBondContact O-N 3.37Å; S29-A32 PolarHBondContact O-N 3.47Å; A32-A35 PolarHBondContact O-N 3.08Å; A32-C36 WeakPolarHBondContact O-CB 3.45Å; A32-C36 PolarHBondContact O-N 2.06Å; A32-C36 PolarHBondContact O-SG 3.32Å
33V94.7Very high92.1Very high85 Ų8584.3 Ų84.352%0.51548%0.483SS..Hα-helixtrans-64.2-44.1178.51720000111.1S29 T30 C36 L37S29-V33 WeakPolarHBondContact O-CB 3.41Å; S29-V33 VanDerWaalsContact O-CG2 3.24Å; S29-V33 WeakPolarHBondContact O-CG2 3.29Å; S29-V33 PolarHBondContact O-N 3.41Å; T30-V33 PolarHBondContact O-N 3.13Å; V33-C36 PolarHBondContact O-N 3.4Å; V33-L37 HydrophobicContact CG1-CD1 3.89Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.06Å; V33-L37 PolarHBondContact O-N 3.47Å
34T93.1Very high92.3Very high76 Ų7683.5 Ų83.547%0.46648%0.48SS..Hα-helixtrans-65.6-41.117849.20000112.3T30 V31 C36 L37 L38T30-T34 WeakPolarHBondContact O-CB 3.49Å; T30-T34 VanDerWaalsContact O-CG2 3.3Å; T30-T34 WeakPolarHBondContact O-CG2 3.35Å; T30-T34 PolarHBondContact O-N 3.14Å; T30-T34 PolarHBondContact O-OG1 3.45Å; V31-T34 WeakPolarHBondContact CA-OG1 3.4Å; V31-T34 PolarHBondContact O-N 3.43Å; V31-T34 PolarHBondContact O-OG1 3.23Å; T34-C36 PolarHBondContact O-N 3.42Å; T34-L37 PolarHBondContact O-N 3.28Å; T34-L38 VanDerWaalsContact O-CG 3.31Å; T34-L38 WeakPolarHBondContact O-CG 3.43Å; T34-L38 PolarHBondContact O-N 2.81Å
35A93.7Very high92.5Very high49 Ų4987.3 Ų87.341%0.40549%0.493SS..Hα-helixtrans-61.4-42.7173.900000112V31 A32 L38 T39V31-A35 VanDerWaalsContact O-CB 3.29Å; V31-A35 WeakPolarHBondContact O-CB 3.38Å; V31-A35 PolarHBondContact O-N 2.71Å; A32-A35 PolarHBondContact O-N 3.08Å; A35-L38 PolarHBondContact O-N 2.78Å; A35-T39 WeakPolarHBondContact O-CB 3.24Å; A35-T39 VanDerWaalsContact O-CG2 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.42Å; A35-T39 PolarHBondContact O-N 2.96Å; A35-T39 PolarHBondContact O-OG1 3.12Å
36C94.2Very high92.7Very high59 Ų5991 Ų9140%0.39950%0.497SS..Hα-helixtrans-60.7-49.9173.4-740000111.3A32 V33 T34 L38 T39 F40A32-C36 WeakPolarHBondContact O-CB 3.45Å; A32-C36 PolarHBondContact O-N 2.06Å; A32-C36 PolarHBondContact O-SG 3.32Å; V33-C36 PolarHBondContact O-N 3.4Å; T34-C36 PolarHBondContact O-N 3.42Å; C36-L38 PolarHBondContact O-N 2.83Å; C36-T39 WeakPolarHBondContact CA-OG1 3.31Å; C36-T39 PolarHBondContact O-N 2.72Å; C36-T39 PolarHBondContact O-OG1 3.14Å; C36-F40 HydrophobicContact CB-CD2 4.08Å; C36-F40 HydrophobicContact CB-CE2 4.03Å; C36-F40 WeakPolarHBondContact O-CB 3.18Å; C36-F40 WeakPolarHBondContact O-CD2 3.39Å; C36-F40 PolarHBondContact O-N 2.99Å
37L93.7Very high92.7Very high118 Ų11890 Ų9062%0.61849%0.491SS*.Hα-helixtrans-62.4-28.4-179.1-70.6175.1000113.4V33 T34 P41V33-L37 HydrophobicContact CG1-CD1 3.89Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.06Å; V33-L37 PolarHBondContact O-N 3.47Å; T34-L37 PolarHBondContact O-N 3.28Å; L37-P41 WeakPolarHBondContact O-CD 3.44Å; L37-P41 VanDerWaalsContact O-CG 3.3Å; L37-P41 WeakPolarHBondContact O-CG 3.46Å
38L92.4Very high92.5Very high125 Ų12591.5 Ų91.565%0.65449%0.494SS*.Hα-helixtrans-82.1-38.3174.9-69.1171.1000112.8T34 A35 C36 L42T34-L38 VanDerWaalsContact O-CG 3.31Å; T34-L38 WeakPolarHBondContact O-CG 3.43Å; T34-L38 PolarHBondContact O-N 2.81Å; A35-L38 PolarHBondContact O-N 2.78Å; C36-L38 PolarHBondContact O-N 2.83Å; L38-L42 WeakPolarHBondContact O-CD1 3.22Å; L38-L42 WeakPolarHBondContact O-CG 3.5Å
39T93Very high92.4Very high65 Ų6590.8 Ų90.840%0.39950%0.497SS..Hα-helixtrans-78.7-36.2-176.550.70000113A35 C36 L42 I43A35-T39 WeakPolarHBondContact O-CB 3.24Å; A35-T39 VanDerWaalsContact O-CG2 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.42Å; A35-T39 PolarHBondContact O-N 2.96Å; A35-T39 PolarHBondContact O-OG1 3.12Å; C36-T39 WeakPolarHBondContact CA-OG1 3.31Å; C36-T39 PolarHBondContact O-N 2.72Å; C36-T39 PolarHBondContact O-OG1 3.14Å; T39-L42 PolarHBondContact O-N 3.04Å; T39-I43 WeakPolarHBondContact O-CB 3.16Å; T39-I43 VanDerWaalsContact O-CG1 3.26Å; T39-I43 WeakPolarHBondContact O-CG1 3.43Å; T39-I43 PolarHBondContact O-N 3.21Å
40F92.9Very high92.2Very high141 Ų14191.2 Ų91.262%0.61849%0.494SS*.Hα-helixtrans-57.3-49.2-179.6-88.8-68.9000113.3C36 L42 I43 F44C36-F40 HydrophobicContact CB-CD2 4.08Å; C36-F40 HydrophobicContact CB-CE2 4.03Å; C36-F40 WeakPolarHBondContact O-CB 3.18Å; C36-F40 WeakPolarHBondContact O-CD2 3.39Å; C36-F40 PolarHBondContact O-N 2.99Å; F40-L42 PolarHBondContact O-N 3.29Å; F40-I43 PolarHBondContact O-N 2.67Å; F40-F44 WeakPolarHBondContact O-CB 3.33Å; F40-F44 PolarHBondContact O-N 3.2Å
41P92.6Very high91.8Very high79 Ų7992.7 Ų92.751%0.51350%0.496SS..Hα-helixtrans-64.3-37.4176.8-22.533.7000113.2L37 F44 H45L37-P41 WeakPolarHBondContact O-CD 3.44Å; L37-P41 VanDerWaalsContact O-CG 3.3Å; L37-P41 WeakPolarHBondContact O-CG 3.46Å; P41-F44 PolarHBondContact O-N 3.3Å; P41-H45 VanDerWaalsContact O-CB 3.32Å; P41-H45 WeakPolarHBondContact O-CB 3.38Å; P41-H45 PolarHBondContact O-N 3.18Å
42L90.4Very high91.2Very high124 Ų12494.3 Ų94.365%0.64950%0.501SS*.Hα-helixtrans-65.3-44.4177.5-71.1172.6000111.6L38 T39 F40 H45 Y46L38-L42 WeakPolarHBondContact O-CD1 3.22Å; L38-L42 WeakPolarHBondContact O-CG 3.5Å; T39-L42 PolarHBondContact O-N 3.04Å; F40-L42 PolarHBondContact O-N 3.29Å; L42-H45 PolarHBondContact O-N 2.89Å; L42-Y46 VanDerWaalsContact O-CB 3.27Å; L42-Y46 WeakPolarHBondContact O-CB 3.42Å; L42-Y46 PolarHBondContact O-N 3.29Å
43I92.4Very high90.6Very high99 Ų9995.3 Ų95.351%0.50851%0.506SS..Hα-helixtrans-65.3-43.6176.1-66165.6000109.9T39 F40 Y46 V47T39-I43 WeakPolarHBondContact O-CB 3.16Å; T39-I43 VanDerWaalsContact O-CG1 3.26Å; T39-I43 WeakPolarHBondContact O-CG1 3.43Å; T39-I43 PolarHBondContact O-N 3.21Å; F40-I43 PolarHBondContact O-N 2.67Å; I43-Y46 PolarHBondContact O-N 2.99Å; I43-V47 HydrophobicContact CG2-CG2 4.31Å; I43-V47 VanDerWaalsContact O-CG2 3.3Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.22Å
44F92.5Very high90.1Very high129 Ų12995 Ų9557%0.56650%0.504SS*.Hα-helixtrans-61.4-46.3177.8-174.4-102.1000111.8F40 P41 Y46 V47 Q48F40-F44 WeakPolarHBondContact O-CB 3.33Å; F40-F44 PolarHBondContact O-N 3.2Å; P41-F44 PolarHBondContact O-N 3.3Å; F44-Y46 PolarHBondContact O-N 3.44Å; F44-V47 PolarHBondContact O-N 2.96Å; F44-Q48 HydrophobicContact CD1-CG 4.29Å; F44-Q48 HydrophobicContact CE1-CG 4.04Å; F44-Q48 HydrophobicContact CZ-CG 4.24Å; F44-Q48 WeakPolarHBondContact O-CB 3.39Å; F44-Q48 WeakPolarHBondContact O-CG 3.35Å; F44-Q48 PolarHBondContact O-N 3.42Å
45H90.3Very high89.4Confident119 Ų11995.5 Ų95.555%0.55150%0.501SS*.Hα-helixtrans-62.1-42.5175.2-175.4-89.9000111.7P41 L42 Q48 V49P41-H45 VanDerWaalsContact O-CB 3.32Å; P41-H45 WeakPolarHBondContact O-CB 3.38Å; P41-H45 PolarHBondContact O-N 3.18Å; L42-H45 PolarHBondContact O-N 2.89Å; H45-Q48 PolarHBondContact O-N 3.36Å; H45-V49 WeakPolarHBondContact O-CG2 3.47Å; H45-V49 PolarHBondContact O-N 2.98Å
46Y91.4Very high88.6Confident147 Ų14794.8 Ų94.858%0.57650%0.498SS*.Hα-helixtrans-61.2-45.9176.1-179.8-105.6000112.1L42 I43 F44 V49 L50L42-Y46 VanDerWaalsContact O-CB 3.27Å; L42-Y46 WeakPolarHBondContact O-CB 3.42Å; L42-Y46 PolarHBondContact O-N 3.29Å; I43-Y46 PolarHBondContact O-N 2.99Å; F44-Y46 PolarHBondContact O-N 3.44Å; Y46-V49 PolarHBondContact O-N 2.89Å; Y46-L50 HydrophobicContact CD1-CD1 3.78Å; Y46-L50 HydrophobicContact CD1-CG 4.42Å; Y46-L50 HydrophobicContact CE1-CD1 3.25Å; Y46-L50 HydrophobicContact CE1-CG 4.07Å; Y46-L50 HydrophobicContact CE2-CD1 4.39Å; Y46-L50 HydrophobicContact CE2-CG 4.39Å; Y46-L50 WeakPolarHBondContact O-CB 3.06Å; Y46-L50 WeakPolarHBondContact O-CG 3.49Å; Y46-L50 PolarHBondContact O-N 3.49Å
47V92.6Very high87.7Confident69 Ų6997.7 Ų97.742%0.41851%0.506SS..Hα-helixtrans-64-40.7176.3173.60000110.8I43 F44 L50 Q51I43-V47 HydrophobicContact CG2-CG2 4.31Å; I43-V47 VanDerWaalsContact O-CG2 3.3Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.22Å; F44-V47 PolarHBondContact O-N 2.96Å; V47-L50 PolarHBondContact O-N 3.3Å; V47-Q51 HydrophobicContact CG1-CG 4.29Å; V47-Q51 WeakPolarHBondContact O-CB 3.46Å; V47-Q51 VanDerWaalsContact O-CG 3.25Å; V47-Q51 WeakPolarHBondContact O-CG 3.25Å; V47-Q51 PolarHBondContact O-N 2.91Å
48Q88.8Confident87Confident90 Ų9095.8 Ų95.842%0.42150%0.496SS..Hα-helixtrans-62-45.1175.5-76.4-175.1-38.400112.4F44 H45 L50 Q51 L52F44-Q48 HydrophobicContact CD1-CG 4.29Å; F44-Q48 HydrophobicContact CE1-CG 4.04Å; F44-Q48 HydrophobicContact CZ-CG 4.24Å; F44-Q48 WeakPolarHBondContact O-CB 3.39Å; F44-Q48 WeakPolarHBondContact O-CG 3.35Å; F44-Q48 PolarHBondContact O-N 3.42Å; H45-Q48 PolarHBondContact O-N 3.36Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-L50 PolarHBondContact O-N 2.91Å; Q48-Q51 PolarHBondContact O-N 3.5Å; Q48-L52 WeakPolarHBondContact O-CB 3.44Å; Q48-L52 WeakPolarHBondContact O-CG 3.38Å; Q48-L52 PolarHBondContact O-N 3.15Å
49V87.6Confident86.1Confident73 Ų7393.7 Ų93.744%0.44249%0.485SS..Hα-helixtrans-63.1-41.4176.2171.30000111H45 Y46 L52 S53H45-V49 WeakPolarHBondContact O-CG2 3.47Å; H45-V49 PolarHBondContact O-N 2.98Å; Y46-V49 PolarHBondContact O-N 2.89Å; V49-L52 PolarHBondContact O-N 3.4Å; V49-S53 VanDerWaalsContact O-CB 3.29Å; V49-S53 WeakPolarHBondContact O-CB 3.23Å; V49-S53 PolarHBondContact O-N 2.97Å
50L88.9Confident85.1Confident73 Ų7394.9 Ų94.938%0.38249%0.492SS..Hα-helixtrans-62.8-43.2173.9-76.8178.9000112.1Y46 V47 Q48 S53 V54Y46-L50 HydrophobicContact CD1-CD1 3.78Å; Y46-L50 HydrophobicContact CD1-CG 4.42Å; Y46-L50 HydrophobicContact CE1-CD1 3.25Å; Y46-L50 HydrophobicContact CE1-CG 4.07Å; Y46-L50 HydrophobicContact CE2-CD1 4.39Å; Y46-L50 HydrophobicContact CE2-CG 4.39Å; Y46-L50 WeakPolarHBondContact O-CB 3.06Å; Y46-L50 WeakPolarHBondContact O-CG 3.49Å; Y46-L50 PolarHBondContact O-N 3.49Å; V47-L50 PolarHBondContact O-N 3.3Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-L50 PolarHBondContact O-N 2.91Å; L50-S53 PolarHBondContact O-N 3.27Å; L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 VanDerWaalsContact O-CG2 3.25Å; L50-V54 WeakPolarHBondContact O-CG2 3.15Å; L50-V54 PolarHBondContact O-N 3.42Å
51Q85Confident84.3Confident104 Ų10491.9 Ų91.949%0.48649%0.488SS..Hα-helixtrans-61.4-46.6176.3-72.6-69.4-43.700110.9V47 Q48 S53 V54 Q55V47-Q51 HydrophobicContact CG1-CG 4.29Å; V47-Q51 WeakPolarHBondContact O-CB 3.46Å; V47-Q51 VanDerWaalsContact O-CG 3.25Å; V47-Q51 WeakPolarHBondContact O-CG 3.25Å; V47-Q51 PolarHBondContact O-N 2.91Å; Q48-Q51 PolarHBondContact O-N 3.5Å; Q51-S53 PolarHBondContact O-N 2.93Å; Q51-V54 PolarHBondContact O-N 2.86Å; Q51-Q55 VanDerWaalsContact O-CB 3.23Å; Q51-Q55 WeakPolarHBondContact O-CB 3.47Å; Q51-Q55 VanDerWaalsContact O-CD 3.23Å; Q51-Q55 WeakPolarHBondContact O-CG 3.39Å; Q51-Q55 PolarHBondContact O-N 2.94Å; Q51-Q55 PolarHBondContact O-OE1 3.5Å
52L82.6Confident83.6Confident117 Ų11793.4 Ų93.461%0.61349%0.487SS*.Hα-helixtrans-62.4-42.1177.1-72.8169.8000112.1Q48 V49 Q55 G56Q48-L52 WeakPolarHBondContact O-CB 3.44Å; Q48-L52 WeakPolarHBondContact O-CG 3.38Å; Q48-L52 PolarHBondContact O-N 3.15Å; V49-L52 PolarHBondContact O-N 3.4Å; L52-Q55 PolarHBondContact O-N 2.91Å; L52-G56 PolarHBondContact O-N 3.4Å
53S80.7Confident82.7Confident61 Ų6192.9 Ų92.943%0.42748%0.484SS..Hα-helixtrans-63.8-46.9176.8175.60000111.5V49 L50 Q51 G56 E57V49-S53 VanDerWaalsContact O-CB 3.29Å; V49-S53 WeakPolarHBondContact O-CB 3.23Å; V49-S53 PolarHBondContact O-N 2.97Å; L50-S53 PolarHBondContact O-N 3.27Å; Q51-S53 PolarHBondContact O-N 2.93Å; S53-G56 PolarHBondContact O-N 3.05Å; S53-E57 WeakPolarHBondContact O-CG 3.3Å; S53-E57 PolarHBondContact O-N 3.43Å
54V84.1Confident81.8Confident77 Ų7795.2 Ų95.247%0.46749%0.486SS..Hα-helixtrans-66.9-38.4177.8172.70000111.3L50 Q51 E57 I58L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 VanDerWaalsContact O-CG2 3.25Å; L50-V54 WeakPolarHBondContact O-CG2 3.15Å; L50-V54 PolarHBondContact O-N 3.42Å; Q51-V54 PolarHBondContact O-N 2.86Å; V54-E57 PolarHBondContact O-N 3.39Å; V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.43Å; V54-I58 WeakPolarHBondContact O-CD1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 2.86Å
55Q77.5Confident81.1Confident88 Ų8892.3 Ų92.341%0.41148%0.479SS..Hα-helixtrans-65.3-41.7175.4-75.4157.3-8.500111.6Q51 L52 E57 I58 D59Q51-Q55 VanDerWaalsContact O-CB 3.23Å; Q51-Q55 WeakPolarHBondContact O-CB 3.47Å; Q51-Q55 VanDerWaalsContact O-CD 3.23Å; Q51-Q55 WeakPolarHBondContact O-CG 3.39Å; Q51-Q55 PolarHBondContact O-N 2.94Å; Q51-Q55 PolarHBondContact O-OE1 3.5Å; L52-Q55 PolarHBondContact O-N 2.91Å; Q55-E57 PolarHBondContact O-N 3.17Å; Q55-I58 PolarHBondContact O-N 2.96Å; Q55-D59 WeakPolarHBondContact O-CB 3.45Å; Q55-D59 PolarHBondContact O-N 3.05Å
56G76.4Confident80.4Confident34 Ų3493.9 Ų93.935%0.35149%0.485SS..Hα-helixtrans-60.9-41.3174.400000113.1L52 S53 D59 T60L52-G56 PolarHBondContact O-N 3.4Å; S53-G56 PolarHBondContact O-N 3.05Å; G56-D59 PolarHBondContact O-N 3Å; G56-T60 WeakPolarHBondContact O-CB 3.29Å; G56-T60 PolarHBondContact O-N 3.39Å; G56-T60 PolarHBondContact O-OG1 3.49Å
57E77Confident79.6Confident119 Ų11991.3 Ų91.356%0.55648%0.481SS*.Hα-helixtrans-63.9-44.4172.9-72.9-72.1158.500111.9S53 V54 Q55 D59 T60 C61S53-E57 WeakPolarHBondContact O-CG 3.3Å; S53-E57 PolarHBondContact O-N 3.43Å; V54-E57 PolarHBondContact O-N 3.39Å; Q55-E57 PolarHBondContact O-N 3.17Å; E57-D59 PolarHBondContact O-N 3Å; E57-T60 PolarHBondContact O-N 3.01Å; E57-C61 WeakPolarHBondContact O-CB 3.25Å; E57-C61 PolarHBondContact O-N 2.59Å
58I78.5Confident78.6Confident79 Ų7990.5 Ų90.541%0.40547%0.474SS..Hα-helixtrans-62.2-44.2177-70.5165.4000110.9V54 Q55 C61 K62V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.43Å; V54-I58 WeakPolarHBondContact O-CD1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 2.86Å; Q55-I58 PolarHBondContact O-N 2.96Å; I58-C61 WeakPolarHBondContact O-CB 3.27Å; I58-C61 PolarHBondContact O-N 3.07Å; I58-K62 HydrophobicContact CG2-CD 4.23Å; I58-K62 HydrophobicContact CG2-CG 4.5Å; I58-K62 WeakPolarHBondContact O-CG 3.26Å; I58-K62 PolarHBondContact O-N 3.37Å
59D73Confident78Confident80 Ų8094.9 Ų94.943%0.42849%0.487SS..Hα-helixtrans-69.9-36.9-179-72.7-22.8000111.6Q55 G56 E57 C61 K62 L63Q55-D59 WeakPolarHBondContact O-CB 3.45Å; Q55-D59 PolarHBondContact O-N 3.05Å; G56-D59 PolarHBondContact O-N 3Å; E57-D59 PolarHBondContact O-N 3Å; D59-C61 VanDerWaalsContact C-N 3.33Å; D59-C61 PolarHBondContact O-N 3.47Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 3.52Å; D59-L63 VanDerWaalsContact O-CD1 3.25Å; D59-L63 WeakPolarHBondContact O-CD1 2.92Å; D59-L63 PolarHBondContact O-N 2.88Å
60T73Confident77.5Confident90 Ų9097.8 Ų97.855%0.55249%0.493SS*.Hα-helixtrans-60.3-44.2170.3-58.10000111G56 E57 K62 L63 R64G56-T60 WeakPolarHBondContact O-CB 3.29Å; G56-T60 PolarHBondContact O-N 3.39Å; G56-T60 PolarHBondContact O-OG1 3.49Å; E57-T60 PolarHBondContact O-N 3.01Å; T60-K62 PolarHBondContact O-N 3.5Å; T60-L63 PolarHBondContact O-N 2.92Å; T60-R64 WeakPolarHBondContact O-CB 3.29Å; T60-R64 PolarHBondContact O-N 3.42Å
61C74.4Confident76.7Confident78 Ų78100.2 Ų100.253%0.52750%0.502SS..Hα-helixtrans-63.6-39.8175.3-1710000112.2E57 I58 D59 R64 T65E57-C61 WeakPolarHBondContact O-CB 3.25Å; E57-C61 PolarHBondContact O-N 2.59Å; I58-C61 WeakPolarHBondContact O-CB 3.27Å; I58-C61 PolarHBondContact O-N 3.07Å; D59-C61 VanDerWaalsContact C-N 3.33Å; D59-C61 PolarHBondContact O-N 3.47Å; C61-R64 PolarHBondContact O-N 3.42Å; C61-T65 WeakPolarHBondContact O-CB 3.47Å; C61-T65 WeakPolarHBondContact O-CG2 3.43Å; C61-T65 PolarHBondContact O-N 2.85Å; C61-T65 PolarHBondContact O-OG1 3.27Å
62K78.1Confident76.1Confident112 Ų112100.5 Ų100.549%0.48751%0.505SS..Hα-helixtrans-65-42.1174.8-76173.9-174.8163.90113I58 D59 T60 T65 K66I58-K62 HydrophobicContact CG2-CD 4.23Å; I58-K62 HydrophobicContact CG2-CG 4.5Å; I58-K62 WeakPolarHBondContact O-CG 3.26Å; I58-K62 PolarHBondContact O-N 3.37Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 3.52Å; T60-K62 PolarHBondContact O-N 3.5Å; K62-T65 VanDerWaalsContact CA-OG1 3.31Å; K62-T65 WeakPolarHBondContact CA-OG1 3.36Å; K62-T65 PolarHBondContact O-OG1 2.95Å; K62-K66 WeakPolarHBondContact O-CG 3.29Å; K62-K66 PolarHBondContact O-N 3.49Å
63L72.5Confident75.7Confident112 Ų11299.1 Ų99.159%0.58650%0.498SS*.Hα-helixtrans-63.6-46.2175.3-95.386.3000110.5D59 T60 T65 K66 D67D59-L63 VanDerWaalsContact O-CD1 3.25Å; D59-L63 WeakPolarHBondContact O-CD1 2.92Å; D59-L63 PolarHBondContact O-N 2.88Å; T60-L63 PolarHBondContact O-N 2.92Å; L63-T65 VanDerWaalsContact C-N 3.34Å; L63-T65 PolarHBondContact O-N 3.48Å; L63-K66 WeakPolarHBondContact O-CB 3.39Å; L63-K66 PolarHBondContact O-N 2.83Å; L63-K66 VanDerWaalsContact O-N 3.15Å; L63-D67 PolarHBondContact O-N 3.23Å
64R73.4Confident75.2Confident149 Ų149100.9 Ų100.956%0.56250%0.503SS*.Hα-helixtrans-63.6-39.5-179.2-151.8173.4-159.9-144.52.7112.3T60 C61 D67 L68T60-R64 WeakPolarHBondContact O-CB 3.29Å; T60-R64 PolarHBondContact O-N 3.42Å; C61-R64 PolarHBondContact O-N 3.42Å; R64-D67 PolarHBondContact O-N 3.23Å; R64-L68 WeakPolarHBondContact O-CB 3.49Å; R64-L68 WeakPolarHBondContact O-CD1 3.35Å; R64-L68 WeakPolarHBondContact O-CG 3.48Å; R64-L68 PolarHBondContact O-N 2.94Å
65T76.7Confident74.3Confident68 Ų68101.5 Ų101.542%0.41751%0.507SS..Hα-helixtrans-67.5-36174.847.80000112.6C61 K62 L63 L68 W69C61-T65 WeakPolarHBondContact O-CB 3.47Å; C61-T65 WeakPolarHBondContact O-CG2 3.43Å; C61-T65 PolarHBondContact O-N 2.85Å; C61-T65 PolarHBondContact O-OG1 3.27Å; K62-T65 VanDerWaalsContact CA-OG1 3.31Å; K62-T65 WeakPolarHBondContact CA-OG1 3.36Å; K62-T65 PolarHBondContact O-OG1 2.95Å; L63-T65 VanDerWaalsContact C-N 3.34Å; L63-T65 PolarHBondContact O-N 3.48Å; T65-L68 PolarHBondContact O-N 3.46Å; T65-W69 WeakPolarHBondContact O-CB 3.42Å; T65-W69 PolarHBondContact O-N 3.38Å
66K77.1Confident73.6Confident152 Ų152105.5 Ų105.566%0.66152%0.523SS*.Hα-helixtrans-64.5-44.6171.8-78.4178.3177.6178.20112.1K62 L63 L68 W69 K70K62-K66 WeakPolarHBondContact O-CG 3.29Å; K62-K66 PolarHBondContact O-N 3.49Å; L63-K66 WeakPolarHBondContact O-CB 3.39Å; L63-K66 PolarHBondContact O-N 2.83Å; L63-K66 VanDerWaalsContact O-N 3.15Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.81Å; K66-W69 PolarHBondContact O-N 2.89Å; K66-K70 WeakPolarHBondContact O-CB 3.48Å; K66-K70 PolarHBondContact O-N 3.49Å
67D74Confident72.7Confident92 Ų92110.3 Ų110.349%0.49254%0.54SS..Hα-helixtrans-63-41.5176.6-76.1-28.6000111.5L63 R64 K70 Q71L63-D67 PolarHBondContact O-N 3.23Å; R64-D67 PolarHBondContact O-N 3.23Å; D67-K70 PolarHBondContact O-N 3.23Å; D67-Q71 WeakPolarHBondContact O-CG 3.33Å; D67-Q71 PolarHBondContact O-N 3.25Å
68L72.4Confident71.4Confident53 Ų53107.7 Ų107.728%0.27755%0.545SS..Hα-helixtrans-62.1-43.4174.1-74.1166.1000112R64 T65 K66 K70 Q71 M72 F95R64-L68 WeakPolarHBondContact O-CB 3.49Å; R64-L68 WeakPolarHBondContact O-CD1 3.35Å; R64-L68 WeakPolarHBondContact O-CG 3.48Å; R64-L68 PolarHBondContact O-N 2.94Å; T65-L68 PolarHBondContact O-N 3.46Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.81Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.39Å; L68-Q71 PolarHBondContact O-N 3.17Å; L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.14Å; L68-M72 PolarHBondContact O-N 3.32Å; L68-F95 HydrophobicContact CD2-CE1 4.14Å; L68-F95 HydrophobicContact CD2-CZ 4.31Å
69W76.1Confident70Confident182 Ų182109.8 Ų109.869%0.68955%0.552SS**Hα-helixtrans-63-40175.8-106.188.6000112.2T65 K66 M72 L73T65-W69 WeakPolarHBondContact O-CB 3.42Å; T65-W69 PolarHBondContact O-N 3.38Å; K66-W69 PolarHBondContact O-N 2.89Å; W69-M72 PolarHBondContact O-N 3.38Å; W69-L73 HydrophobicContact CE3-CD1 3.88Å; W69-L73 HydrophobicContact CE3-CG 4.29Å; W69-L73 HydrophobicContact CZ3-CD1 4.41Å; W69-L73 PolarHBondContact O-N 3.18Å
70K76.5Confident68.7Low133 Ų133113.3 Ų113.358%0.57858%0.576SS**Hα-helixtrans-63.9-45.5176.6-172.3170.9-179.8172.60111.6K66 D67 L68 M72 L73 D74K66-K70 WeakPolarHBondContact O-CB 3.48Å; K66-K70 PolarHBondContact O-N 3.49Å; D67-K70 PolarHBondContact O-N 3.23Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.39Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.83Å; K70-L73 PolarHBondContact O-N 3.06Å; K70-D74 PolarHBondContact O-N 2.75Å
71Q72.1Confident67.2Low124 Ų124112.3 Ų112.358%0.57958%0.584SS**Hα-helixtrans-61.8-39175.3-70.8176.519.100112.5D67 L68 T75D67-Q71 WeakPolarHBondContact O-CG 3.33Å; D67-Q71 PolarHBondContact O-N 3.25Å; L68-Q71 PolarHBondContact O-N 3.17Å; Q71-T75 WeakPolarHBondContact O-CB 3.46Å; Q71-T75 PolarHBondContact O-N 2.86Å; Q71-T75 PolarHBondContact O-OG1 3.49Å
72M72.4Confident65.6Low111 Ų111117.7 Ų117.755%0.54759%0.594SS.*Hα-helixtrans-64.1-41.6174.9-74.8-96.3-82.200112L68 W69 K70 K76L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.14Å; L68-M72 PolarHBondContact O-N 3.32Å; W69-M72 PolarHBondContact O-N 3.38Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.83Å; M72-K76 PolarHBondContact O-N 3.34Å; M72-K76 VanDerWaalsContact O-N 3.14Å
73L73.4Confident64Low88 Ų88119.7 Ų119.746%0.46161%0.61SS.*Hα-helixtrans-67-44.8176.5-81.7156.2000112.1W69 K70 T75 K76 N77W69-L73 HydrophobicContact CE3-CD1 3.88Å; W69-L73 HydrophobicContact CE3-CG 4.29Å; W69-L73 HydrophobicContact CZ3-CD1 4.41Å; W69-L73 PolarHBondContact O-N 3.18Å; K70-L73 PolarHBondContact O-N 3.06Å; L73-T75 VanDerWaalsContact C-N 3.32Å; L73-T75 PolarHBondContact O-N 3.41Å; L73-K76 PolarHBondContact O-N 3.37Å; L73-K76 VanDerWaalsContact O-N 3.13Å; L73-N77 PolarHBondContact O-N 3.5Å
74D70.2Confident62.7Low98 Ų98118.8 Ų118.852%0.52462%0.618SS.*Hα-helixtrans-63.4-39177.9-74.5-25.9000111.3K70 K76 N77 G78K70-D74 PolarHBondContact O-N 2.75Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 2.89Å; D74-N77 PolarHBondContact O-N 3.32Å; D74-G78 PolarHBondContact O-N 2.88Å
75T65.3Low61.4Low90 Ų90123.1 Ų123.155%0.55264%0.635SS**Hα-helixtrans-64.6-35.1175.1-53.50000111.7Q71 L73 N77 G78Q71-T75 WeakPolarHBondContact O-CB 3.46Å; Q71-T75 PolarHBondContact O-N 2.86Å; Q71-T75 PolarHBondContact O-OG1 3.49Å; L73-T75 VanDerWaalsContact C-N 3.32Å; L73-T75 PolarHBondContact O-N 3.41Å; T75-N77 VanDerWaalsContact C-N 3.34Å; T75-G78 PolarHBondContact O-N 2.92Å
76K62.6Low59.9Low172 Ų172129.5 Ų129.575%0.74866%0.657SS**Hα-helixtrans-71.1-29179.3-149.1179.7-175.7-176.10112.7M72 L73 D74M72-K76 PolarHBondContact O-N 3.34Å; M72-K76 VanDerWaalsContact O-N 3.14Å; L73-K76 PolarHBondContact O-N 3.37Å; L73-K76 VanDerWaalsContact O-N 3.13Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 2.89Å
77N58Low58.7Low134 Ų134124.9 Ų124.972%0.71764%0.644SS**Hα-helixtrans-84.3-19.1177.4-70-20000113.5L73 D74 T75L73-N77 PolarHBondContact O-N 3.5Å; D74-N77 PolarHBondContact O-N 3.32Å; T75-N77 VanDerWaalsContact C-N 3.34Å
78G50.9Low57.5Low64 Ų64123.2 Ų123.266%0.6665%0.648SS**SBendtrans-88.6-5.1178.100000115.7D74 T75 V80D74-G78 PolarHBondContact O-N 2.88Å; T75-G78 PolarHBondContact O-N 2.92Å; G78-V80 PolarHBondContact O-N 2.89Å
79F47.3Very low56.4Low124 Ų124128.4 Ų128.454%0.54467%0.671SS.*  trans-106.367-167.7-130.4-111.8000112.9Y82F79-Y82 HydrophobicContact CE1-CG 4.44Å; F79-Y82 WeakPolarHBondContact CE1-O 3.47Å; F79-Y82 HydrophobicContact CZ-CG 4.17Å
80V46.2Very low55.1Low154 Ų154124.4 Ų124.493%0.93366%0.663SS**SBendtrans-88.698.3155.2-177.60000106.3G78G78-V80 PolarHBondContact O-N 2.89Å
81G42Very low54.1Low69 Ų69122 Ų12271%0.71166%0.655SS**SBendtrans126.715.7160.400000120.2
82Y40.8Very low53Low191 Ų191121.7 Ų121.775%0.74966%0.657SS**SBendtrans-127.6133.9169.8-104.6-95.9000112.5F79 A84F79-Y82 HydrophobicContact CE1-CG 4.44Å; F79-Y82 WeakPolarHBondContact CE1-O 3.47Å; F79-Y82 HydrophobicContact CZ-CG 4.17Å; Y82-A84 PolarHBondContact O-N 2.91Å
83D43.9Very low51.9Low154 Ų154123.9 Ų123.982%0.82466%0.664SS**  trans-51.3112.5-174-105.7-51.3000113.8R85D83-R85 PolarHBondContact O-N 3.3Å; D83-R85 VanDerWaalsContact O-N 3.08Å
84A45.1Very low51Low92 Ų92128.4 Ų128.476%0.7668%0.675SS**THydrogen-bonded Turntrans-79.724.2-173.200000115.3Y82Y82-A84 PolarHBondContact O-N 2.91Å
85R47.3Very low50Low241 Ų241127.2 Ų127.291%0.90967%0.665SS**THydrogen-bonded Turntrans-116.1-10.2-177-83.3-169.3-172.8-174.94.9117D83D83-R85 PolarHBondContact O-N 3.3Å; D83-R85 VanDerWaalsContact O-N 3.08Å
86K45.2Very low49.2Very low201 Ų201126 Ų12687%0.87466%0.658SS**SBendtrans-109.3-7.7-178.3-84.3-171.2175.7-178.70116.6
87S51.2Low48.5Very low56 Ų56126.7 Ų126.739%0.39266%0.656SS.*SBendtrans-103.2-1.7-172.570.40000116.2Q89 D90 I91S87-Q89 VanDerWaalsContact C-N 3.33Å; S87-Q89 PolarHBondContact O-N 3.34Å; S87-D90 PolarHBondContact O-N 3.28Å; S87-D90 VanDerWaalsContact O-N 3.12Å; S87-I91 VanDerWaalsContact O-CG1 3.31Å; S87-I91 WeakPolarHBondContact O-CG1 3.29Å; S87-I91 PolarHBondContact O-N 2.88Å
88G48.5Very low48.2Very low56 Ų56126 Ų12658%0.57765%0.648SS**Hα-helixtrans-60.9-39.1-178.600000113.6L92G88-L92 PolarHBondContact O-N 3.42Å
89Q49.2Very low48.1Very low162 Ų162126.9 Ų126.976%0.75764%0.641SS**Hα-helixtrans-74-33.2174.1-98.4179.4-26.200112.7S87 L92 F93S87-Q89 VanDerWaalsContact C-N 3.33Å; S87-Q89 PolarHBondContact O-N 3.34Å; Q89-L92 PolarHBondContact O-N 2.85Å; Q89-F93 WeakPolarHBondContact O-CB 3.35Å; Q89-F93 PolarHBondContact O-N 3.48Å
90D49.2Very low48.1Very low98 Ų98126.1 Ų126.152%0.52464%0.641SS.*Hα-helixtrans-71.2-37.5-178.5-136.1-23.6000111.4S87 F93 R94S87-D90 PolarHBondContact O-N 3.28Å; S87-D90 VanDerWaalsContact O-N 3.12Å; D90-F93 PolarHBondContact O-N 3.42Å; D90-R94 WeakPolarHBondContact O-CG 3.36Å; D90-R94 PolarHBondContact O-N 2.73Å
91I54.3Low48.1Very low82 Ų82124 Ų12442%0.42163%0.625SS.*Hα-helixtrans-63.1-50.4171.1-65.3163.9000109S87 F93 R94 F95S87-I91 VanDerWaalsContact O-CG1 3.31Å; S87-I91 WeakPolarHBondContact O-CG1 3.29Å; S87-I91 PolarHBondContact O-N 2.88Å; I91-F93 VanDerWaalsContact C-N 3.3Å; I91-F93 PolarHBondContact O-N 2.88Å; I91-R94 PolarHBondContact O-N 3.21Å; I91-F95 HydrophobicContact CG2-CD2 3.63Å; I91-F95 HydrophobicContact CG2-CE2 3.65Å; I91-F95 WeakPolarHBondContact O-CB 3.36Å; I91-F95 VanDerWaalsContact O-CD2 3.24Å; I91-F95 WeakPolarHBondContact O-CD2 3.24Å; I91-F95 PolarHBondContact O-N 2.87Å
92L50Low48.4Very low119 Ų119122.9 Ų122.962%0.62361%0.609SS**Hα-helixtrans-61.6-36179.9-162.871.3000112.8G88 Q89 F95 T96G88-L92 PolarHBondContact O-N 3.42Å; Q89-L92 PolarHBondContact O-N 2.85Å; L92-F95 WeakPolarHBondContact O-CB 3.44Å; L92-F95 PolarHBondContact O-N 2.89Å; L92-T96 PolarHBondContact O-N 3.3Å; L92-T96 PolarHBondContact O-OG1 2.97Å
93F49Very low48.8Very low157 Ų157118.2 Ų118.269%0.68960%0.604SS**Hα-helixtrans-70.1-39.4175.4-116.3-88.7000112.7Q89 D90 I91 F95 T96 R97Q89-F93 WeakPolarHBondContact O-CB 3.35Å; Q89-F93 PolarHBondContact O-N 3.48Å; D90-F93 PolarHBondContact O-N 3.42Å; I91-F93 VanDerWaalsContact C-N 3.3Å; I91-F93 PolarHBondContact O-N 2.88Å; F93-F95 VanDerWaalsContact C-N 3.29Å; F93-F95 PolarHBondContact O-N 3.47Å; F93-T96 WeakPolarHBondContact CA-OG1 3.41Å; F93-T96 PolarHBondContact O-N 3.24Å; F93-T96 PolarHBondContact O-OG1 2.93Å; F93-R97 WeakPolarHBondContact O-CB 3.44Å; F93-R97 PolarHBondContact O-N 3.21Å
94R53.9Low48.9Very low183 Ų183111.9 Ų111.969%0.69157%0.572SS**Hα-helixtrans-63.6-36.9170.8-73.3-172.9-176.4-154.62.1111.7D90 I91 R97 Q98D90-R94 WeakPolarHBondContact O-CG 3.36Å; D90-R94 PolarHBondContact O-N 2.73Å; I91-R94 PolarHBondContact O-N 3.21Å; R94-R97 PolarHBondContact O-N 3.49Å; R94-Q98 PolarHBondContact O-N 2.92Å
95F49.5Very low49.3Very low72 Ų72112.9 Ų112.932%0.31657%0.572SS.*Hα-helixtrans-66.8-41.5175.7-96.6-91.3000112.8L68 I91 L92 F93 T99L68-F95 HydrophobicContact CD2-CE1 4.14Å; L68-F95 HydrophobicContact CD2-CZ 4.31Å; I91-F95 HydrophobicContact CG2-CD2 3.63Å; I91-F95 HydrophobicContact CG2-CE2 3.65Å; I91-F95 WeakPolarHBondContact O-CB 3.36Å; I91-F95 VanDerWaalsContact O-CD2 3.24Å; I91-F95 WeakPolarHBondContact O-CD2 3.24Å; I91-F95 PolarHBondContact O-N 2.87Å; L92-F95 WeakPolarHBondContact O-CB 3.44Å; L92-F95 PolarHBondContact O-N 2.89Å; F93-F95 VanDerWaalsContact C-N 3.29Å; F93-F95 PolarHBondContact O-N 3.47Å; F95-T99 PolarHBondContact O-N 2.95Å; F95-T99 VanDerWaalsContact O-N 3.16Å; F95-T99 PolarHBondContact O-OG1 3.23Å
96T49.8Very low49.6Very low64 Ų64105.8 Ų105.839%0.39356%0.556SS.*Hα-helixtrans-70.1-36.7174.820.90000111.5L92 F93 T99 I100L92-T96 PolarHBondContact O-N 3.3Å; L92-T96 PolarHBondContact O-OG1 2.97Å; F93-T96 WeakPolarHBondContact CA-OG1 3.41Å; F93-T96 PolarHBondContact O-N 3.24Å; F93-T96 PolarHBondContact O-OG1 2.93Å; T96-T99 VanDerWaalsContact CA-OG1 3.3Å; T96-T99 WeakPolarHBondContact CA-OG1 3.5Å; T96-T99 PolarHBondContact O-N 2.89Å; T96-T99 PolarHBondContact O-OG1 3.32Å; T96-T99 VanDerWaalsContact O-OG1 3.05Å; T96-I100 WeakPolarHBondContact O-CB 3.4Å; T96-I100 WeakPolarHBondContact O-CD1 3.03Å; T96-I100 WeakPolarHBondContact O-CG1 3.46Å; T96-I100 PolarHBondContact O-N 3.49Å
97R48.2Very low50Low188 Ų18898.6 Ų98.671%0.70953%0.53SS*.Hα-helixtrans-65.2-40.8175.1-160.6171.8172.5156.7-0.4112.5F93 R94 T99 I100 D101F93-R97 WeakPolarHBondContact O-CB 3.44Å; F93-R97 PolarHBondContact O-N 3.21Å; R94-R97 PolarHBondContact O-N 3.49Å; R97-T99 VanDerWaalsContact C-N 3.35Å; R97-T99 PolarHBondContact O-N 3.33Å; R97-I100 PolarHBondContact O-N 3.42Å; R97-D101 WeakPolarHBondContact O-CB 3.44Å; R97-D101 PolarHBondContact O-N 3.44Å
98Q50.4Low50.2Low118 Ų118101 Ų10155%0.55154%0.535SS*.Hα-helixtrans-69.3-26.8175.3-81.9-178.1-16.200114.5R94 A102R94-Q98 PolarHBondContact O-N 2.92Å; Q98-A102 PolarHBondContact O-N 3.48Å
99T48.4Very low50.9Low83 Ų83106.3 Ų106.351%0.50954%0.537SS..Hα-helixtrans-84.5-28.2176.341.10000112.3F95 T96 R97 S103F95-T99 PolarHBondContact O-N 2.95Å; F95-T99 VanDerWaalsContact O-N 3.16Å; F95-T99 PolarHBondContact O-OG1 3.23Å; T96-T99 VanDerWaalsContact CA-OG1 3.3Å; T96-T99 WeakPolarHBondContact CA-OG1 3.5Å; T96-T99 PolarHBondContact O-N 2.89Å; T96-T99 PolarHBondContact O-OG1 3.32Å; T96-T99 VanDerWaalsContact O-OG1 3.05Å; R97-T99 VanDerWaalsContact C-N 3.35Å; R97-T99 PolarHBondContact O-N 3.33Å; T99-S103 PolarHBondContact O-OG 2.94Å
100I47.7Very low51.6Low108 Ų10898.8 Ų98.855%0.55450%0.504SS*.Hα-helixtrans-76.7-37.3170.8-64.7165.5000111.3T96 R97 A102 S103 C104T96-I100 WeakPolarHBondContact O-CB 3.4Å; T96-I100 WeakPolarHBondContact O-CD1 3.03Å; T96-I100 WeakPolarHBondContact O-CG1 3.46Å; T96-I100 PolarHBondContact O-N 3.49Å; R97-I100 PolarHBondContact O-N 3.42Å; I100-A102 PolarHBondContact O-N 3.42Å; I100-S103 WeakPolarHBondContact CA-OG 3.44Å; I100-S103 PolarHBondContact O-N 2.92Å; I100-S103 PolarHBondContact O-OG 2.99Å; I100-C104 PolarHBondContact O-N 3.41Å
101D45.8Very low52.5Low110 Ų11097.7 Ų97.759%0.58850%0.502SS*.Hα-helixtrans-62.6-25.5172.3-83.5-41.2000112.4R97R97-D101 WeakPolarHBondContact O-CB 3.44Å; R97-D101 PolarHBondContact O-N 3.44Å
102A48.7Very low53.4Low45 Ų4597.7 Ų97.737%0.37251%0.507SS..THydrogen-bonded Turntrans-81.1-15.1175.300000114Q98 I100 C105Q98-A102 PolarHBondContact O-N 3.48Å; I100-A102 PolarHBondContact O-N 3.42Å; A102-C105 PolarHBondContact O-SG 2.98Å
103S50Low54.5Low93 Ų9392.5 Ų92.565%0.6548%0.483SS*.THydrogen-bonded Turntrans-97.3-7.8176.131.80000112.9T99 I100 C105T99-S103 PolarHBondContact O-OG 2.94Å; I100-S103 WeakPolarHBondContact CA-OG 3.44Å; I100-S103 PolarHBondContact O-N 2.92Å; I100-S103 PolarHBondContact O-OG 2.99Å; S103-C105 VanDerWaalsContact C-N 3.31Å; S103-C105 PolarHBondContact O-N 3.27Å
104C46.5Very low55.8Low22 Ų2288.6 Ų88.615%0.14947%0.473CS..  trans-94.543.9170.1-1440000113.4I100 T106 C107 C153I100-C104 PolarHBondContact O-N 3.41Å; C104-T106 PolarHBondContact O-N 2.91Å; C104-C107 PolarHBondContact O-N 3.46Å; C104-C153 HydrophobicContact CB-CB 4.33Å; C104-C153 WeakPolarHBondContact CB-SG 3.49Å; C104-C153 WeakPolarHBondContact SG-CB 3.38Å; C104-C153 CovalentContact SG-SG 2.03Å; C104-C153 PolarHBondContact SG-SG 3.07Å
105C51.8Low56.8Low113 Ų11383 Ų8376%0.76446%0.461SS*.THydrogen-bonded Turntrans-6518.7176.5-80.10000115.2A102 S103A102-C105 PolarHBondContact O-SG 2.98Å; S103-C105 VanDerWaalsContact C-N 3.31Å; S103-C105 PolarHBondContact O-N 3.27Å
106T54Low57.9Low92 Ų9280 Ų8056%0.56445%0.449SS*.THydrogen-bonded Turntrans-89.5-14.9171.6570000112.8C104 Q108C104-T106 PolarHBondContact O-N 2.91Å; T106-Q108 PolarHBondContact O-N 3.05Å
107C53.7Low59.2Low50 Ų5080.7 Ų80.734%0.33846%0.455SS..  trans-75.395177.7-39.20000109.1C104 C155C104-C107 PolarHBondContact O-N 3.46Å; C107-C155 HydrophobicContact CB-CB 3.87Å; C107-C155 WeakPolarHBondContact CB-SG 3.47Å; C107-C155 WeakPolarHBondContact SG-CA 3.18Å; C107-C155 WeakPolarHBondContact SG-CB 3.27Å; C107-C155 CovalentContact SG-SG 2.06Å; C107-C155 PolarHBondContact SG-SG 3.03Å
108Q56.1Low60.4Low107 Ų10774.3 Ų74.350%0.544%0.438SS..PPolyproline II helixtrans-60.1138170.9-70.1171.636.200108.3T106 A140T106-Q108 PolarHBondContact O-N 3.05Å; Q108-A140 HydrophobicContact CB-CB 4.36Å; Q108-A140 WeakPolarHBondContact O-CB 3.45Å
109R62.3Low61.5Low166 Ų16669.1 Ų69.163%0.62642%0.416SS*.PPolyproline II helixtrans-75.7141.9165.6-154.7177.2-172.5166.211.5107.4L158 P159R109-L158 HydrophobicContact CG-CB 4.38Å; R109-P159 WeakPolarHBondContact CG-O 3.31Å; R109-P159 PolarHBondContact NE-O 3.16Å
110G64Low62.7Low5 Ų574 Ų745%0.05243%0.425CS..PPolyproline II helixtrans-62.2167.3178.800000113T138 L158 G160G110-T138 WeakPolarHBondContact CA-O 3.32Å; G110-L158 PolarHBondContact N-O 2.92Å; G110-G160 WeakPolarHBondContact O-CA 3.04Å
111P69.5Low64.1Low74 Ų7470.8 Ų70.848%0.48141%0.409SS..PPolyproline II helixtrans-59.4148.1178.326.8-34.6000110.8G137 T138 G160P111-G137 WeakPolarHBondContact O-CA 3.08Å; P111-T138 WeakPolarHBondContact CG-OG1 2.98Å; P111-G160 WeakPolarHBondContact O-CA 3.19Å
112P72.5Confident65Low83 Ų8366 Ų6654%0.53939%0.385SS..PPolyproline II helixtrans-52.7143.8174.1-23.432.1000111.8P161P112-P161 VanDerWaalsContact CA-O 3.32Å; P112-P161 WeakPolarHBondContact CA-O 3.33Å; P112-P161 HydrophobicContact CB-CG 4.08Å; P112-P161 HydrophobicContact CG-CG 3.97Å
113G73.3Confident65.6Low10 Ų1069.5 Ų69.510%0.10339%0.393CS..PPolyproline II helixtrans-64.8167.8176.400000113.1S135 G137 P161 G163G113-S135 WeakPolarHBondContact CA-O 3.41Å; G113-G137 VanDerWaalsContact CA-CA 3.47Å; G113-G137 VanDerWaalsContact N-CA 3.28Å; G113-P161 PolarHBondContact N-O 2.87Å; G113-G163 WeakPolarHBondContact O-CA 3.2Å
114P75.3Confident66.1Low75 Ų7568.4 Ų68.449%0.48738%0.379SS..PPolyproline II helixtrans-58.6148.8175.827-35000110.9G134 S135P114-G134 WeakPolarHBondContact O-CA 3.46Å; P114-S135 WeakPolarHBondContact CD-OG 3.29Å; P114-S135 WeakPolarHBondContact CG-OG 3.42Å
115P76.2Confident66.5Low66 Ų6669.5 Ų69.543%0.42939%0.394SS..PPolyproline II helixtrans-51.6147172.1-25.834.4000112.2V164P115-V164 HydrophobicContact CB-CG2 3.85Å; P115-V164 HydrophobicContact CG-CG2 3.97Å
116G72.2Confident66.9Low7 Ų766.4 Ų66.47%0.07238%0.377CS..PPolyproline II helixtrans-66.7162.6175.100000113P132 G134 V164 G166G116-P132 WeakPolarHBondContact CA-O 3.32Å; G116-G134 VanDerWaalsContact CA-CA 3.48Å; G116-G134 VanDerWaalsContact N-CA 3.32Å; G116-V164 PolarHBondContact N-O 2.94Å; G116-G166 WeakPolarHBondContact O-CA 3.44Å
117P76.5Confident67.4Low80 Ų8066.9 Ų66.952%0.51938%0.381SS..PPolyproline II helixtrans-62.7156.4173.528.5-34.9000111G131 P132 G166P117-G131 WeakPolarHBondContact O-CA 3.4Å; P117-P132 HydrophobicContact CG-CG 3.67Å; P117-G166 WeakPolarHBondContact O-CA 3.31Å
118P74.4Confident67.9Low54 Ų5465 Ų6535%0.35137%0.371SS..PPolyproline II helixtrans-52.2150.1171.9-24.934.2000112.2P167P118-P167 WeakPolarHBondContact CA-O 3.25Å; P118-P167 HydrophobicContact CB-CG 4.2Å; P118-P167 HydrophobicContact CG-CG 4.18Å
119G72.6Confident68.7Low9 Ų965.1 Ų65.19%0.09337%0.37CS..PPolyproline II helixtrans-66.7173.817400000113.1K129 G131 P167G119-K129 VanDerWaalsContact CA-O 3.27Å; G119-K129 WeakPolarHBondContact CA-O 3.35Å; G119-G131 VanDerWaalsContact CA-CA 3.43Å; G119-G131 VanDerWaalsContact N-CA 3.28Å; G119-P167 PolarHBondContact N-O 3.15Å
120R74.8Confident69.3Low185 Ų18562.8 Ų62.870%0.69837%0.37SS*.PPolyproline II helixtrans-76.2136.4174.6-67.5-179.5-168.1172.7-5.5108.8K129R120-K129 HydrophobicContact CB-CD 3.92Å; R120-K129 VanDerWaalsContact CB-CE 3.43Å; R120-K129 HydrophobicContact CB-CG 4.01Å; R120-K129 VanDerWaalsContact CD-NZ 3.26Å; R120-K129 HydrophobicContact CG-CD 4.36Å; R120-K129 PolarHBondContact O-N 2.72Å
121D76.7Confident69.6Low40 Ų4062.9 Ų62.921%0.21437%0.37CS..PPolyproline II helixtrans-58.7148172.7-53.3-39.3000110.8Q170D121-Q170 CarbonylContact C-O 3.57Å; D121-Q170 VanDerWaalsContact CA-O 3.31Å; D121-Q170 WeakPolarHBondContact CA-O 3.32Å; D121-Q170 PolarHBondContact OD1-N 3.32Å
122G63.2Low69.8Low9 Ų962.9 Ų62.99%0.09337%0.37CS..PPolyproline II helixtrans-67.4167.1175.500000112.2A126 Q170 G172G122-A126 WeakPolarHBondContact CA-O 3.28Å; G122-Q170 PolarHBondContact N-O 3.24Å; G122-G172 VanDerWaalsContact C-CA 3.41Å; G122-G172 VanDerWaalsContact O-CA 3.24Å; G122-G172 WeakPolarHBondContact O-CA 3Å
123K61.5Low70Confident120 Ų12066.5 Ų66.552%0.52237%0.373SS..SBendtrans-129.5145175.2-58.5-176.7-173.8-170.30109G125 A126 P269K123-G125 PolarHBondContact O-N 2.98Å; K123-A126 WeakPolarHBondContact O-CB 3.3Å; K123-A126 PolarHBondContact O-N 3.39Å; K123-P269 HydrophobicContact CD-CB 4.29Å; K123-P269 HydrophobicContact CD-CG 3.89Å; K123-P269 HydrophobicContact CG-CB 4.36Å; K123-P269 HydrophobicContact CG-CG 4.46Å; K123-P269 VanDerWaalsContact NZ-CG 3.34Å
124D61Low70Confident70 Ų7066.3 Ų66.337%0.37437%0.371SS..THydrogen-bonded Turntrans53.843.5173.6-51.2-39.7000114.5A126 S266 G267D124-A126 VanDerWaalsContact C-N 3.27Å; D124-A126 PolarHBondContact O-N 3.38Å; D124-S266 WeakPolarHBondContact OD2-CB 3.47Å; D124-S266 PolarHBondContact OD2-OG 3.25Å; D124-G267 PolarHBondContact OD1-N 3.27Å
125G54.8Low70Confident45 Ų4565.9 Ų65.946%0.46437%0.37SS..THydrogen-bonded Turntrans79.4-2.5-17700000115.6K123 G172 S173K123-G125 PolarHBondContact O-N 2.98Å; G125-G172 VanDerWaalsContact CA-O 3.22Å; G125-G172 WeakPolarHBondContact CA-O 3.32Å; G125-G172 PolarHBondContact N-O 3.08Å; G125-S173 PolarHBondContact N-O 3.43Å; G125-S173 VanDerWaalsContact N-O 3.1Å
126A59.7Low69.8Low47 Ų4766.8 Ų66.839%0.38838%0.376SS..PPolyproline II helixtrans-71.6146.6174.100000111.2G122 K123 D124 G172G122-A126 WeakPolarHBondContact CA-O 3.28Å; K123-A126 WeakPolarHBondContact O-CB 3.3Å; K123-A126 PolarHBondContact O-N 3.39Å; D124-A126 VanDerWaalsContact C-N 3.27Å; D124-A126 PolarHBondContact O-N 3.38Å; A126-G172 PolarHBondContact O-N 3.23Å
127P65.6Low69.6Low102 Ų10266.8 Ų66.866%0.66238%0.376SS*.PPolyproline II helixtrans-61148.6174-23.833.9000113D171P127-D171 VanDerWaalsContact CA-OD1 3.28Å; P127-D171 WeakPolarHBondContact CA-OD1 3.3Å
128G63.7Low69.3Low12 Ų1267.6 Ų67.612%0.12438%0.38CS..PPolyproline II helixtrans-63.3147.3170.500000111.6G169 D171G128-G169 WeakPolarHBondContact CA-O 3.4Å; G128-D171 PolarHBondContact N-OD1 3.36Å
129K73Confident68.9Low109 Ų10969.5 Ų69.547%0.47439%0.386SS..PPolyproline II helixtrans-82.3158177.272.1-175.6-164.4-179.20110.6G119 R120 G169G119-K129 VanDerWaalsContact CA-O 3.27Å; G119-K129 WeakPolarHBondContact CA-O 3.35Å; R120-K129 HydrophobicContact CB-CD 3.92Å; R120-K129 VanDerWaalsContact CB-CE 3.43Å; R120-K129 HydrophobicContact CB-CG 4.01Å; R120-K129 VanDerWaalsContact CD-NZ 3.26Å; R120-K129 HydrophobicContact CG-CD 4.36Å; R120-K129 PolarHBondContact O-N 2.72Å; K129-G169 PolarHBondContact O-N 3.33Å
130D74.8Confident68.2Low117 Ų11769.7 Ų69.763%0.62639%0.388SS*.PPolyproline II helixtrans-62.3146.4174.6-64.9-26000112.5
131G70.3Confident67.4Low6 Ų669.1 Ų69.16%0.06239%0.393CS..PPolyproline II helixtrans-65.2143.7172.900000111.9P117 G119 G166P117-G131 WeakPolarHBondContact O-CA 3.4Å; G119-G131 VanDerWaalsContact CA-CA 3.43Å; G119-G131 VanDerWaalsContact N-CA 3.28Å; G131-G166 PolarHBondContact N-O 2.93Å
132P74.7Confident66.3Low74 Ų7472.1 Ų72.148%0.48141%0.414SS..PPolyproline II helixtrans-59.7159.6172.128-34.4000110.5G116 P117 G166G116-P132 WeakPolarHBondContact CA-O 3.32Å; P117-P132 HydrophobicContact CG-CG 3.67Å; P132-G166 PolarHBondContact O-N 3.4Å
133R76.7Confident65.8Low159 Ų15978.4 Ų78.460%0.644%0.439SS*.BIsolated β-bridgetrans-62.8144.7176.4-163.2173.3-174.7170.82110.9P162 G163R133-P162 HydrophobicContact CG-CB 4.01Å; R133-P162 PolarHBondContact NE-O 2.9Å; R133-P162 VanDerWaalsContact NE-O 3.1Å; R133-P162 PolarHBondContact NH2-O 3.39Å; R133-G163 WeakPolarHBondContact CG-O 3.28Å; R133-G163 PolarHBondContact NE-O 3.1Å
134G71.6Confident65Low6 Ų680.5 Ų80.56%0.06246%0.456CS..PPolyproline II helixtrans-57.2160.3171.700000113.6P114 G116 P162 G163 V164P114-G134 WeakPolarHBondContact O-CA 3.46Å; G116-G134 VanDerWaalsContact CA-CA 3.48Å; G116-G134 VanDerWaalsContact N-CA 3.32Å; G134-P162 VanDerWaalsContact O-CB 3.29Å; G134-P162 WeakPolarHBondContact O-CB 3.34Å; G134-G163 PolarHBondContact N-O 2.99Å; G134-V164 PolarHBondContact N-O 2.97Å
135S75.5Confident64.3Low66 Ų6681.3 Ų81.346%0.46246%0.464SS..PPolyproline II helixtrans-59.5158.7174.858.60000111.1G113 P114 P162 G163G113-S135 WeakPolarHBondContact CA-O 3.41Å; P114-S135 WeakPolarHBondContact CD-OG 3.29Å; P114-S135 WeakPolarHBondContact CG-OG 3.42Å; S135-P162 WeakPolarHBondContact O-CA 3.41Å; S135-G163 PolarHBondContact O-N 3.48Å; S135-G163 VanDerWaalsContact O-N 3.16Å
136P73.1Confident64Low86 Ų8687.4 Ų87.456%0.55849%0.485SS*.PPolyproline II helixtrans-51148.3170.4-26.636000111.9
137G66.6Low63.5Low6 Ų691.2 Ų91.26%0.06250%0.498CS..PPolyproline II helixtrans-66.1161.1172.300000111.9P111 G113 G160 P161P111-G137 WeakPolarHBondContact O-CA 3.08Å; G113-G137 VanDerWaalsContact CA-CA 3.47Å; G113-G137 VanDerWaalsContact N-CA 3.28Å; G137-G160 PolarHBondContact N-O 3.44Å; G137-G160 PolarHBondContact O-N 3.01Å; G137-P161 PolarHBondContact N-O 3.33Å
138T70.6Confident62.9Low98 Ų9892.4 Ų92.460%0.60151%0.505SS*.PPolyproline II helixtrans-64.1159172.457.50000109.9G110 P111 G160G110-T138 WeakPolarHBondContact CA-O 3.32Å; P111-T138 WeakPolarHBondContact CG-OG1 2.98Å; T138-G160 PolarHBondContact O-N 3.33Å
139D66.8Low62Low93 Ų9397.1 Ų97.150%0.49753%0.526SS..BIsolated β-bridgetrans-61148.4172.2-60.7-31.8000110.3Q141 A157 P159D139-Q141 PolarHBondContact O-N 3Å; D139-Q141 VanDerWaalsContact O-N 3.17Å; D139-A157 HydrophobicContact CB-CB 3.82Å; D139-P159 WeakPolarHBondContact OD1-CD 3.4Å; D139-P159 VanDerWaalsContact OD1-CG 3.31Å; D139-P159 WeakPolarHBondContact OD1-CG 3.19Å
140A58.6Low61Low14 Ų1496.4 Ų96.412%0.11653%0.532CS..PPolyproline II helixtrans-62.8119171.400000109.6Q108 A157Q108-A140 HydrophobicContact CB-CB 4.36Å; Q108-A140 WeakPolarHBondContact O-CB 3.45Å; A140-A157 HydrophobicContact CB-CB 4.38Å; A140-A157 WeakPolarHBondContact O-CB 3.24Å
141Q57.1Low60Low172 Ų17297.1 Ų97.180%0.80454%0.543SS*.PPolyproline II helixtrans-61.2132.9168.4-70-115.7-83.200108.2D139 K143D139-Q141 PolarHBondContact O-N 3Å; D139-Q141 VanDerWaalsContact O-N 3.17Å; Q141-K143 PolarHBondContact O-N 3.1Å
142P53.7Low59Low103 Ų103105 Ų10567%0.66958%0.579SS**  trans-55.4115.7163.5-14.326.7000105.7D144P142-D144 PolarHBondContact O-N 3.33Å; P142-D144 VanDerWaalsContact O-N 3.17Å
143K52.1Low57.8Low142 Ų142104.1 Ų104.162%0.61757%0.573SS**  trans-55.6129.1166.5-76.7-173.6179.7-179.40105.3Q141 T145Q141-K143 PolarHBondContact O-N 3.1Å; K143-T145 PolarHBondContact O-N 2.94Å; K143-T145 PolarHBondContact O-OG1 3.06Å
144D45.6Very low56.5Low163 Ų163102.2 Ų102.287%0.87258%0.582SS**  trans-57.173.9171.9-66.8-46.8000109.1P142 L146P142-D144 PolarHBondContact O-N 3.33Å; P142-D144 VanDerWaalsContact O-N 3.17Å; D144-L146 PolarHBondContact O-N 2.78Å
145T46.3Very low55.4Low88 Ų88103.9 Ų103.954%0.5459%0.592SS.*  trans-86.4107169.4-390000101K143 L147K143-T145 PolarHBondContact O-N 2.94Å; K143-T145 PolarHBondContact O-OG1 3.06Å; T145-L147 HydrophobicContact CG2-CB 4.28Å; T145-L147 HydrophobicContact CG2-CD1 4.45Å; T145-L147 HydrophobicContact CG2-CG 4.46Å; T145-L147 PolarHBondContact O-N 3Å
146L49Very low54.4Low173 Ų173106 Ų10691%0.90660%0.602SS**SBendtrans-61.324.8176.1-70.3165.3000112.9D144D144-L146 PolarHBondContact O-N 2.78Å
147L48.7Very low53.6Low126 Ų126103.5 Ų103.566%0.6659%0.589SS**SBendtrans-124.1126.4179.6-60.8177.3000108.4T145 M149T145-L147 HydrophobicContact CG2-CB 4.28Å; T145-L147 HydrophobicContact CG2-CD1 4.45Å; T145-L147 HydrophobicContact CG2-CG 4.46Å; T145-L147 PolarHBondContact O-N 3Å; L147-M149 PolarHBondContact O-N 3.45Å
148P51.8Low53.1Low127 Ų127108.2 Ų108.283%0.82561%0.612SS**  trans-60.1115173.924-30.7000108.9
149M46.4Very low52.8Low111 Ų111106.4 Ų106.455%0.54760%0.602SS.*  trans-58140170.3-66.8179.682.100108.6L147L147-M149 PolarHBondContact O-N 3.45Å
150P51.6Low52.6Low95 Ų95102.1 Ų102.162%0.61758%0.579SS**  trans-57.8136.3174.722.6-31.2000109.6Q152P150-Q152 PolarHBondContact O-N 3.49Å
151P53.8Low53.1Low132 Ų132103.1 Ų103.186%0.85759%0.585SS**THydrogen-bonded Turntrans-67.714.1-171.126.4-35.4000115.2
152Q49.7Very low53.8Low171 Ų17196.9 Ų96.980%0.79956%0.559SS**THydrogen-bonded Turntrans-104.4-5.4-168.1-51.1-168.342.800113.6P150P150-Q152 PolarHBondContact O-N 3.49Å
153C48Very low54.6Low55 Ų5592 Ų9237%0.37253%0.528SS..  trans-115.3106.6168.3-76.90000110.2C104 C155C104-C153 HydrophobicContact CB-CB 4.33Å; C104-C153 WeakPolarHBondContact CB-SG 3.49Å; C104-C153 WeakPolarHBondContact SG-CB 3.38Å; C104-C153 CovalentContact SG-SG 2.03Å; C104-C153 PolarHBondContact SG-SG 3.07Å; C153-C155 PolarHBondContact O-N 3.49Å
154P49.3Very low55.7Low119 Ų11990.3 Ų90.377%0.77353%0.529SS*.  trans-71.276.2161.130.8-31000107.6V156P154-V156 PolarHBondContact O-N 3.05Å
155C50.2Low57Low41 Ų4185.5 Ų85.528%0.27751%0.512SS..  trans-65.480.9162.7-75.60000107.2C107 C153 A157C107-C155 HydrophobicContact CB-CB 3.87Å; C107-C155 WeakPolarHBondContact CB-SG 3.47Å; C107-C155 WeakPolarHBondContact SG-CA 3.18Å; C107-C155 WeakPolarHBondContact SG-CB 3.27Å; C107-C155 CovalentContact SG-SG 2.06Å; C107-C155 PolarHBondContact SG-SG 3.03Å; C153-C155 PolarHBondContact O-N 3.49Å; C155-A157 PolarHBondContact O-N 3.4Å; C155-A157 VanDerWaalsContact O-N 3.08Å
156V54.3Low57.9Low112 Ų11281.5 Ų81.568%0.67949%0.488SS*.  trans-62.8111.7160.9-176.90000104.3P154 L158P154-V156 PolarHBondContact O-N 3.05Å; V156-L158 PolarHBondContact O-N 2.99Å
157A54.8Low58.9Low33 Ų3377 Ų7727%0.27347%0.469SS..  trans-51.4106.7178.300000108.3D139 A140 C155D139-A157 HydrophobicContact CB-CB 3.82Å; A140-A157 HydrophobicContact CB-CB 4.38Å; A140-A157 WeakPolarHBondContact O-CB 3.24Å; C155-A157 PolarHBondContact O-N 3.4Å; C155-A157 VanDerWaalsContact O-N 3.08Å
158L57.5Low60Low105 Ų10574.8 Ų74.855%0.5546%0.462SS..PPolyproline II helixtrans-73.6131.3-177.1-75.1170.7000107.9R109 G110 V156 G160R109-L158 HydrophobicContact CG-CB 4.38Å; G110-L158 PolarHBondContact N-O 2.92Å; V156-L158 PolarHBondContact O-N 2.99Å; L158-G160 PolarHBondContact O-N 2.77Å
159P63.2Low60.5Low60 Ų6069 Ų6939%0.3943%0.426SS..BIsolated β-bridgetrans-49.9137.9171.4-25.229.5000110.6R109 D139R109-P159 WeakPolarHBondContact CG-O 3.31Å; R109-P159 PolarHBondContact NE-O 3.16Å; D139-P159 WeakPolarHBondContact OD1-CD 3.4Å; D139-P159 VanDerWaalsContact OD1-CG 3.31Å; D139-P159 WeakPolarHBondContact OD1-CG 3.19Å
160G63.5Low61.6Low2 Ų270.3 Ų70.32%0.02143%0.431CS..PPolyproline II helixtrans-52.5155171.100000112.4G110 P111 G137 T138 L158G110-G160 WeakPolarHBondContact O-CA 3.04Å; P111-G160 WeakPolarHBondContact O-CA 3.19Å; G137-G160 PolarHBondContact N-O 3.44Å; G137-G160 PolarHBondContact O-N 3.01Å; T138-G160 PolarHBondContact O-N 3.33Å; L158-G160 PolarHBondContact O-N 2.77Å
161P68.1Low62.5Low36 Ų3671.4 Ų71.423%0.23443%0.432CS..PPolyproline II helixtrans-56.7147.4176.228-33.2000109.6P112 G113 G137 G163P112-P161 VanDerWaalsContact CA-O 3.32Å; P112-P161 WeakPolarHBondContact CA-O 3.33Å; P112-P161 HydrophobicContact CB-CG 4.08Å; P112-P161 HydrophobicContact CG-CG 3.97Å; G113-P161 PolarHBondContact N-O 2.87Å; G137-P161 PolarHBondContact N-O 3.33Å; P161-G163 PolarHBondContact O-N 3.34Å
162P73Confident62.3Low41 Ų4165.7 Ų65.727%0.26640%0.397SS..PPolyproline II helixtrans-61.6144.8177.1-6.415.8000110.3R133 G134 S135R133-P162 HydrophobicContact CG-CB 4.01Å; R133-P162 PolarHBondContact NE-O 2.9Å; R133-P162 VanDerWaalsContact NE-O 3.1Å; R133-P162 PolarHBondContact NH2-O 3.39Å; G134-P162 VanDerWaalsContact O-CB 3.29Å; G134-P162 WeakPolarHBondContact O-CB 3.34Å; S135-P162 WeakPolarHBondContact O-CA 3.41Å
163G68.9Low62.5Low1 Ų162 Ų621%0.0139%0.39CS..PPolyproline II helixtrans-55.2165.5-176.300000113.4G113 R133 G134 S135 P161G113-G163 WeakPolarHBondContact O-CA 3.2Å; R133-G163 WeakPolarHBondContact CG-O 3.28Å; R133-G163 PolarHBondContact NE-O 3.1Å; G134-G163 PolarHBondContact N-O 2.99Å; S135-G163 PolarHBondContact O-N 3.48Å; S135-G163 VanDerWaalsContact O-N 3.16Å; P161-G163 PolarHBondContact O-N 3.34Å
164V75.7Confident62.8Low105 Ų10564.9 Ų64.964%0.63641%0.408SS*.PPolyproline II helixtrans-58.3154.8176.3-63.50000111P115 G116 G134P115-V164 HydrophobicContact CB-CG2 3.85Å; P115-V164 HydrophobicContact CG-CG2 3.97Å; G116-V164 PolarHBondContact N-O 2.94Å; G134-V164 PolarHBondContact N-O 2.97Å
165A74Confident62.8Low62 Ų6261.2 Ų61.251%0.51239%0.392SS..BIsolated β-bridgetrans-57.2141.2170.500000109.6
166G64.8Low62.8Low5 Ų566.2 Ų66.25%0.05242%0.416CS..PPolyproline II helixtrans-63.2160.5171.700000111.3G116 P117 G131 P132G116-G166 WeakPolarHBondContact O-CA 3.44Å; P117-G166 WeakPolarHBondContact O-CA 3.31Å; G131-G166 PolarHBondContact N-O 2.93Å; P132-G166 PolarHBondContact O-N 3.4Å
167P70.9Confident62.7Low77 Ų7765.6 Ų65.650%0.542%0.423SS..PPolyproline II helixtrans-57.7152.7177.526.5-34.5000111P118 G119P118-P167 WeakPolarHBondContact CA-O 3.25Å; P118-P167 HydrophobicContact CB-CG 4.2Å; P118-P167 HydrophobicContact CG-CG 4.18Å; G119-P167 PolarHBondContact N-O 3.15Å
168P70.4Confident62.2Low80 Ų8066 Ų6652%0.51943%0.43SS..PPolyproline II helixtrans-53.3146.8169.6-2232.1000111
169G62.7Low61.6Low7 Ų765.8 Ų65.87%0.07244%0.435CS..PPolyproline II helixtrans-59.4163.6167.900000111.1G128 K129G128-G169 WeakPolarHBondContact CA-O 3.4Å; K129-G169 PolarHBondContact O-N 3.33Å
170Q69.4Low61.1Low138 Ų13869 Ų6965%0.64546%0.455SS*.PPolyproline II helixtrans-68150.7174.1-63.6-174.113.500110.5D121 G122D121-Q170 CarbonylContact C-O 3.57Å; D121-Q170 VanDerWaalsContact CA-O 3.31Å; D121-Q170 WeakPolarHBondContact CA-O 3.32Å; D121-Q170 PolarHBondContact OD1-N 3.32Å; G122-Q170 PolarHBondContact N-O 3.24Å
171D71Confident60Low117 Ų11771 Ų7163%0.62648%0.476SS*.PPolyproline II helixtrans-62.9140.2173.3-66.4-17.2000110.2P127 G128 S173P127-D171 VanDerWaalsContact CA-OD1 3.28Å; P127-D171 WeakPolarHBondContact CA-OD1 3.3Å; G128-D171 PolarHBondContact N-OD1 3.36Å; D171-S173 PolarHBondContact O-N 3.35Å
172G49.3Very low59.1Low12 Ų1280.6 Ų80.612%0.12451%0.507CS..PPolyproline II helixtrans-62.8136.717700000110.4G122 G125 A126G122-G172 VanDerWaalsContact C-CA 3.41Å; G122-G172 VanDerWaalsContact O-CA 3.24Å; G122-G172 WeakPolarHBondContact O-CA 3Å; G125-G172 VanDerWaalsContact CA-O 3.22Å; G125-G172 WeakPolarHBondContact CA-O 3.32Å; G125-G172 PolarHBondContact N-O 3.08Å; A126-G172 PolarHBondContact O-N 3.23Å
173S53.1Low58.2Low95 Ų9586.3 Ų86.366%0.66454%0.536SS*.PPolyproline II helixtrans-57.3147.2171-44.50000110.1G125 D171 G175G125-S173 PolarHBondContact N-O 3.43Å; G125-S173 VanDerWaalsContact N-O 3.1Å; D171-S173 PolarHBondContact O-N 3.35Å; S173-G175 PolarHBondContact O-N 2.93Å
174P55.4Low56.8Low115 Ų11588.3 Ų88.375%0.74756%0.556SS**PPolyproline II helixtrans-52.3135.7170.8-24.734.1000110.1
175G48.3Very low55.6Low42 Ų4292.6 Ų92.643%0.43357%0.566SS.*PPolyproline II helixtrans-61.4150.3177.100000111.5S173S173-G175 PolarHBondContact O-N 2.93Å
176D50.7Low54.6Low145 Ų14595.7 Ų95.778%0.77558%0.581SS**PPolyproline II helixtrans-58.2144.5176-69.1-44.1000110.9G178D176-G178 PolarHBondContact O-N 3.19Å
177A52.7Low53.5Low100 Ų10097.8 Ų97.883%0.82660%0.603SS**PPolyproline II helixtrans-59.3134.9174.600000110.3
178G43.7Very low52.4Low41 Ų41100.4 Ų100.442%0.42362%0.618SS.*PPolyproline II helixtrans-58.8152.8175.900000111.9D176D176-G178 PolarHBondContact O-N 3.19Å
179P44.4Very low51.5Low100 Ų100105.9 Ų105.965%0.64964%0.637SS**PPolyproline II helixtrans-60.9151177.826.7-34000111
180P52.4Low50.5Low127 Ų127107.7 Ų107.783%0.82566%0.656SS**PPolyproline II helixtrans-52.9142.7172.9-25.134000111.9
181G41.7Very low49.6Very low44 Ų44104.3 Ų104.345%0.45466%0.657SS.*PPolyproline II helixtrans-57.6151.117500000111.8
182R48.4Very low48.8Very low238 Ų238105.1 Ų105.190%0.89867%0.669SS**PPolyproline II helixtrans-69143.3176.5-71.3-177.6170.7179.8-2.4110.5
183D54.7Low48.5Very low161 Ų161107.3 Ų107.386%0.86169%0.692SS**PPolyproline II helixtrans-57.3139.3172.6-66-39.1000111.1
184G39.3Very low48.4Very low43 Ų43110.6 Ų110.644%0.44370%0.702SS.*PPolyproline II helixtrans-63.2146.5174.600000111.5
185K50.2Low48.4Very low195 Ų195111.9 Ų111.985%0.84871%0.708SS**PPolyproline II helixtrans-62.3141.8176.5-68.8-173177.5-176.80110.6
186P53.6Low48.2Very low127 Ų127112.4 Ų112.483%0.82571%0.713SS**PPolyproline II helixtrans-54141.5171.4-24.833.8000111.7
187G41.1Very low48.2Very low50 Ų50111.3 Ų111.352%0.51571%0.714SS.*PPolyproline II helixtrans-63.1152.2175.100000111.8
188T48.2Very low48.5Very low132 Ų132112.6 Ų112.681%0.8171%0.714SS**PPolyproline II helixtrans-69.5139174.849.10000110.8
189Q52.1Low48.6Very low194 Ų194114 Ų11491%0.90773%0.728SS**PPolyproline II helixtrans-60.1134.3173.1-176175.5-23.500110.3
190G41.2Very low49Very low46 Ų46118.6 Ų118.647%0.47474%0.741SS.*PPolyproline II helixtrans-62.5146.517500000111.7
191G49.7Very low49Very low66 Ų66120.3 Ų120.368%0.6874%0.743SS**PPolyproline II helixtrans-66161.5177.400000113
192P54.7Low49.1Very low135 Ų135123 Ų12388%0.87776%0.76SS**PPolyproline II helixtrans-57.6142.6174-21.332.7000112
193G43.5Very low49.1Very low57 Ų57120 Ų12059%0.58876%0.759SS**PPolyproline II helixtrans-67.2157.4175.600000113.1
194D50.2Low49.2Very low164 Ų164118.1 Ų118.188%0.87776%0.755SS**PPolyproline II helixtrans-62.8147.3179.2-68.8-40.3000112.4G196D194-G196 PolarHBondContact O-N 3Å
195T55.5Low49.5Very low143 Ų143119.7 Ų119.788%0.87777%0.772SS**PPolyproline II helixtrans-69.4128176-55.60000110.1
196G44.5Very low49.5Very low52 Ų52120.5 Ų120.554%0.53678%0.775SS.*PPolyproline II helixtrans-61.3157178.300000113.6D194D194-G196 PolarHBondContact O-N 3Å
197P50.8Low49.6Very low123 Ų123124.3 Ų124.380%0.79978%0.779SS**PPolyproline II helixtrans-65.3150.4-177.826.7-34.2000112.4
198P58Low49.8Very low127 Ų127124.5 Ų124.583%0.82578%0.781SS**PPolyproline II helixtrans-57.4139173.8-23.233000112.5
199G47.4Very low50.1Low69 Ų69124.1 Ų124.171%0.71178%0.781SS**PPolyproline II helixtrans-61141.8177.800000112.8
200Q51.3Low50.4Low198 Ų198121 Ų12193%0.92578%0.777SS**PPolyproline II helixtrans-67.7131.9176.7-72.4179.6-7.100111.2A202Q200-A202 PolarHBondContact O-N 2.96Å
201N52.3Low50.8Low163 Ų163121.9 Ų121.987%0.87279%0.786SS**PPolyproline II helixtrans-63.4130.4174.4-67.5-23.8000110.7
202A44.7Very low50.9Low99 Ų99124.7 Ų124.782%0.81879%0.792SS**PPolyproline II helixtrans-71.6138.8174.100000111.5Q200Q200-A202 PolarHBondContact O-N 2.96Å
203M49Very low50.9Low177 Ų177124.2 Ų124.287%0.87279%0.789SS**PPolyproline II helixtrans-63.6149.6175-81.6-171.783.500112.2G205M203-G205 PolarHBondContact O-N 3.5Å
204P55.7Low51Low121 Ų121125.2 Ų125.279%0.78680%0.799SS**PPolyproline II helixtrans-55.7136.4173.5-23.933.4000112.8
205G45.8Very low50.8Low76 Ų76127.2 Ų127.278%0.78480%0.8SS**PPolyproline II helixtrans-61.4144.1176.300000112.7M203M203-G205 PolarHBondContact O-N 3.5Å
206K50.8Low50.2Low212 Ų212128.6 Ų128.692%0.92280%0.802SS**PPolyproline II helixtrans-67.6142178-67.6-176.4177.2-179.10111.3
207K54.9Low50.3Low206 Ų206133 Ų13390%0.89681%0.813SS**PPolyproline II helixtrans-58131.8174.2-174.8179.9178.8-1780110.6
208G45.9Very low49.8Very low55 Ų55133.8 Ų133.857%0.56782%0.815SS**PPolyproline II helixtrans-66.4155.3176.100000113.3
209P53.6Low49Very low124 Ų124131.3 Ų131.381%0.80581%0.813SS**PPolyproline II helixtrans-68156.1179.528-33.8000112.6
210P60Low48.8Very low129 Ų129137.3 Ų137.384%0.83882%0.822SS**PPolyproline II helixtrans-58.1144173.5-22.133.2000112.6
211G47.9Very low48.2Very low64 Ų64135.1 Ų135.166%0.6682%0.823SS**PPolyproline II helixtrans-66.6157.417600000113.1
212P51.7Low48Very low124 Ų124130 Ų13081%0.80581%0.808SS**PPolyproline II helixtrans-65.9146.2-177.526.6-33.6000112.2
213P54.9Low48.1Very low126 Ų126131.5 Ų131.582%0.81881%0.81SS**PPolyproline II helixtrans-60.3134.7173.3-21.732.5000112.1
214G46.5Very low48Very low77 Ų77133 Ų13379%0.79481%0.811SS**PPolyproline II helixtrans-66.8129.9174.700000111.8
215K46.3Very low47.6Very low207 Ų207129.8 Ų129.890%0.980%0.801SS**PPolyproline II helixtrans-69.3126.4173-74.6177.9174.2-1800109.9
216L42.6Very low47.9Very low172 Ų172132 Ų13290%0.90180%0.801SS**  trans-107.1118.1170.4-145.389.7000109.5
217N45.9Very low48.2Very low144 Ų144127.9 Ų127.977%0.7780%0.796SS**  trans-97.4126.8166.1-73.5-28.1000108.3
218T41.9Very low47.9Very low139 Ų139121.1 Ų121.185%0.85379%0.785SS**  trans28.6129.7149.842.70000122
219G40.2Very low48.1Very low75 Ų75124.7 Ų124.777%0.77380%0.798SS**  trans98.6117.6141.500000117.1
220E43.8Very low48.1Very low195 Ų195130 Ų13091%0.91180%0.802SS**  trans50.693162.8-62.6-169.1124.700119.3G222E220-G222 PolarHBondContact O-N 3.37Å
221T38.1Very low47.4Very low152 Ų152127 Ų12793%0.93379%0.794SS**  trans-0.189.1151.3-35.10000118.7
222G47.3Very low47.4Very low55 Ų55129.4 Ų129.457%0.56780%0.802SS**PPolyproline II helixtrans-97.4158149.300000111.3E220 K224E220-G222 PolarHBondContact O-N 3.37Å; G222-K224 PolarHBondContact O-N 2.84Å
223P47.3Very low47.3Very low131 Ų131129.7 Ų129.785%0.85180%0.801SS**PPolyproline II helixtrans-59.4139-176.724.4-32.9000111.7G225P223-G225 PolarHBondContact O-N 2.83Å; P223-G225 VanDerWaalsContact O-N 3.1Å
224K45.9Very low47Very low209 Ų209126.7 Ų126.791%0.90979%0.793SS**PPolyproline II helixtrans-47.5116.1176.2-176.7178.1-179.3177.90109.8G222G222-K224 PolarHBondContact O-N 2.84Å
225G49.4Very low47Very low54 Ų54134.8 Ų134.856%0.55780%0.8SS**PPolyproline II helixtrans-55.6149.817500000111.3P223P223-G225 PolarHBondContact O-N 2.83Å; P223-G225 VanDerWaalsContact O-N 3.1Å
226P51.1Low47.3Very low121 Ų121129.5 Ų129.579%0.78680%0.795SS**PPolyproline II helixtrans-58.3153.7179.324.6-33.1000111.2G228P226-G228 PolarHBondContact O-N 2.67Å
227P57Low47.5Very low126 Ų126124.9 Ų124.982%0.81879%0.788SS**PPolyproline II helixtrans-48.9136.6173-25.633.8000111.1
228G48.5Very low47.8Very low65 Ų65127.2 Ų127.267%0.6780%0.795SS**PPolyproline II helixtrans-54.6149.3173.200000110.9P226P226-G228 PolarHBondContact O-N 2.67Å
229P50.2Low48.3Very low130 Ų130132 Ų13284%0.84480%0.797SS**PPolyproline II helixtrans-57.4142.5-177.923.3-32.7000111.2G231P229-G231 PolarHBondContact O-N 2.99Å
230R53.9Low48.8Very low234 Ų234131 Ų13188%0.88379%0.786SS**PPolyproline II helixtrans-52.3126.3171.5-179.5177.5-179.8168.51.1108.4S232R230-S232 PolarHBondContact O-N 3.33Å
231G45.8Very low49.3Very low66 Ų66127.6 Ų127.668%0.6878%0.781SS**PPolyproline II helixtrans-51.8137.1174.800000110.5P229 T233P229-G231 PolarHBondContact O-N 2.99Å; G231-T233 PolarHBondContact O-N 2.98Å
232S47.1Very low50.2Low116 Ų116126.3 Ų126.381%0.81178%0.775SS**PPolyproline II helixtrans-58.4136.7178.841.40000110.4R230 G234R230-S232 PolarHBondContact O-N 3.33Å; S232-G234 PolarHBondContact O-N 3.37Å
233T50.6Low50.2Low129 Ų129127.1 Ų127.179%0.79178%0.784SS**PPolyproline II helixtrans-53.8124.9165.5-52.70000107.5G231 R235G231-T233 PolarHBondContact O-N 2.98Å; T233-R235 PolarHBondContact O-N 3.35Å
234G46.9Very low50.7Low63 Ų63129.9 Ų129.965%0.64979%0.785SS**PPolyproline II helixtrans-53138.5174.600000109.7S232 A236S232-G234 PolarHBondContact O-N 3.37Å; G234-A236 PolarHBondContact O-N 3.01Å
235R48.5Very low51.3Low248 Ų248125.9 Ų125.994%0.93678%0.781SS**PPolyproline II helixtrans-54.3139.6174.7-80.1-175.8170.6-173-2.2109T233 G237T233-R235 PolarHBondContact O-N 3.35Å; R235-G237 PolarHBondContact O-N 3.47Å
236A51Low51.2Low96 Ų96126.4 Ų126.479%0.79379%0.786SS**PPolyproline II helixtrans-51.8136.1166.300000108.3G234G234-A236 PolarHBondContact O-N 3.01Å
237G47.9Very low51.4Low74 Ų74129.7 Ų129.776%0.76379%0.791SS**PPolyproline II helixtrans-55.6142.7174.100000109.7R235R235-G237 PolarHBondContact O-N 3.47Å
238E50.9Low51.4Low194 Ų194131.5 Ų131.591%0.90779%0.793SS**PPolyproline II helixtrans-58141.8174.8-67.8-173.4148.800109.7G240E238-G240 PolarHBondContact O-N 3.1Å
239R52.7Low51.3Low240 Ų240131 Ų13191%0.90679%0.788SS**PPolyproline II helixtrans-55.7126.6170.4-177.3-175.1-69.8-176.9-2.1107
240G50.9Low51.4Low53 Ų53129.1 Ų129.155%0.54678%0.783SS.*PPolyproline II helixtrans-53.7151.9173.800000111E238E238-G240 PolarHBondContact O-N 3.1Å
241P53.7Low51.4Low123 Ų123124 Ų12480%0.79978%0.781SS**PPolyproline II helixtrans-56.9152.617825.2-34000110.8
242P57Low51.4Low126 Ų126123 Ų12382%0.81877%0.77SS**PPolyproline II helixtrans-50.1143.4168.8-23.733.3000110.5
243G48.4Very low51.5Low72 Ų72122 Ų12274%0.74277%0.769SS**PPolyproline II helixtrans-54.5148.7171.900000110.7
244Q56.6Low51.7Low189 Ų189127.8 Ų127.888%0.88378%0.776SS**PPolyproline II helixtrans-58.9145.2174.2-75.3-178.5-13.100110.1
245P59.2Low51.6Low125 Ų125126 Ų12681%0.81276%0.759SS**PPolyproline II helixtrans-50.8143.2168.2-24.133.7000110.5
246G48.2Very low51.7Low64 Ų64120.1 Ų120.166%0.6675%0.752SS**PPolyproline II helixtrans-56.7152.417100000110.8
247Q54.1Low51.6Low191 Ų191124 Ų12489%0.89376%0.756SS**PPolyproline II helixtrans-63.2146.3173.1-68-177-3.600110.2G249Q247-G249 PolarHBondContact O-N 3.33Å
248D57.4Low51.3Low163 Ų163122 Ų12287%0.87274%0.736SS**PPolyproline II helixtrans-55135.2171.8-68.4-28.8000109.7
249G45.8Very low51.1Low54 Ų54121.4 Ų121.456%0.55773%0.733SS**PPolyproline II helixtrans-58.5145.5174.700000110.9Q247Q247-G249 PolarHBondContact O-N 3.33Å
250A52.2Low50.9Low91 Ų91115.8 Ų115.875%0.75273%0.727SS**PPolyproline II helixtrans-56.6145.5176.400000111G252A250-G252 PolarHBondContact O-N 3.38Å
251P55.4Low50.4Low127 Ų127115.3 Ų115.383%0.82572%0.723SS**PPolyproline II helixtrans-52.1136.9174.2-25.733.8000111.4
252G45.3Very low49.9Very low45 Ų45117.8 Ų117.846%0.46472%0.723SS.*PPolyproline II helixtrans-56.7149175.800000111.6A250A250-G252 PolarHBondContact O-N 3.38Å
253A50Low49.4Very low95 Ų95117.8 Ų117.879%0.78572%0.723SS**PPolyproline II helixtrans-57.1142.4177.100000111G255A253-G255 PolarHBondContact O-N 3.41Å
254R53.4Low48.9Very low250 Ų250116.1 Ų116.194%0.94371%0.706SS**PPolyproline II helixtrans-56.4128.2172.7-175.5178.3177.4178.3-0.1108.5
255G45.5Very low48.3Very low27 Ų27116.5 Ų116.528%0.27871%0.708SS.*PPolyproline II helixtrans-57.5158.3175.200000112A253A253-G255 PolarHBondContact O-N 3.41Å
256P49.1Very low47.6Very low124 Ų124114.8 Ų114.881%0.80570%0.699SS**PPolyproline II helixtrans-57.9149.3178.125.3-33.7000111.2G258P256-G258 PolarHBondContact O-N 3.5Å
257M49.4Very low47.1Very low177 Ų177112.9 Ų112.987%0.87268%0.68SS**PPolyproline II helixtrans-56.3135.1170.7-172.917274.200109
258G41.5Very low46.5Very low33 Ų33113.6 Ų113.634%0.3468%0.68SS.*PPolyproline II helixtrans-57.9150.9176.300000111.4P256P256-G258 PolarHBondContact O-N 3.5Å
259E47.5Very low45.9Very low181 Ų181109.3 Ų109.385%0.84666%0.661SS**PPolyproline II helixtrans-60.7145.1175.3-66.4-164.6132.600110.9G261E259-G261 PolarHBondContact O-N 3.44Å
260P49.4Very low45.6Very low121 Ų121109.1 Ų109.179%0.78666%0.659SS**PPolyproline II helixtrans-52.2140.9172-24.934000111.5
261G39.2Very low45Very low43 Ų43109.9 Ų109.944%0.44366%0.659SS.*PPolyproline II helixtrans-57.8149.9174.200000111.6E259E259-G261 PolarHBondContact O-N 3.44Å
262Q44.4Very low44.5Very low175 Ų175109.3 Ų109.382%0.81866%0.655SS**PPolyproline II helixtrans-61146.7172.3-71.8-172.2-9.400110.4
263P45.7Very low44.2Very low126 Ų126109 Ų10982%0.81865%0.652SS**PPolyproline II helixtrans-51.6141.7172.1-25.434.2000111.7
264G38.5Very low43.7Very low37 Ų37109.1 Ų109.138%0.38165%0.653SS.*PPolyproline II helixtrans-58.6152.9175.100000111.9
265Q42.8Very low43.3Very low197 Ų197103.6 Ų103.692%0.92165%0.647SS**PPolyproline II helixtrans-67.8142.5171.7-67.6-175.118.100110
266S43.8Very low43Very low89 Ų89104.3 Ų104.362%0.62265%0.654SS**PPolyproline II helixtrans-47.5140.6172.4-72.60000112.6D124D124-S266 WeakPolarHBondContact OD2-CB 3.47Å; D124-S266 PolarHBondContact OD2-OG 3.25Å
267G38.7Very low42.8Very low25 Ų25104.5 Ų104.526%0.25866%0.655SS.*PPolyproline II helixtrans-64.6156.8178.100000111.9D124D124-G267 PolarHBondContact OD1-N 3.27Å
268K42Very low42.5Very low205 Ų205105.8 Ų105.889%0.89166%0.656SS**PPolyproline II helixtrans-63.9141.4170.9-73.5-175.5179.3178.80109.3G270K268-G270 PolarHBondContact O-N 3.39Å
269P45.2Very low42.3Very low74 Ų74105.6 Ų105.648%0.48165%0.654SS.*PPolyproline II helixtrans-57.1140.8176.5-21.633.6000111K123K123-P269 HydrophobicContact CD-CB 4.29Å; K123-P269 HydrophobicContact CD-CG 3.89Å; K123-P269 HydrophobicContact CG-CB 4.36Å; K123-P269 HydrophobicContact CG-CG 4.46Å; K123-P269 VanDerWaalsContact NZ-CG 3.34Å
270G39.6Very low42Very low50 Ų50102.6 Ų102.652%0.51565%0.65SS.*PPolyproline II helixtrans-57.3153.3172.500000112.1K268K268-G270 PolarHBondContact O-N 3.39Å
271S39.2Very low41.8Very low106 Ų106102.8 Ų102.874%0.74165%0.651SS**PPolyproline II helixtrans-63.9138.2171.949.80000110.1G273S271-G273 PolarHBondContact O-N 3.46Å
272P45Very low41.7Very low116 Ų116103.6 Ų103.675%0.75366%0.66SS**PPolyproline II helixtrans-51.1133.6178.3-26.233.6000112.3
273G39Very low41.5Very low38 Ų38105 Ų10539%0.39266%0.664SS.*PPolyproline II helixtrans-56.9152.2172.700000112.8S271S271-G273 PolarHBondContact O-N 3.46Å
274A39.6Very low41.3Very low98 Ų98104.4 Ų104.481%0.8166%0.663SS**PPolyproline II helixtrans-57.9141.6175.200000110.9G276A274-G276 PolarHBondContact O-N 3.41Å
275V45Very low41.4Very low134 Ų134106 Ų10681%0.81268%0.678SS**PPolyproline II helixtrans-57.6122.4176.1179.10000108.8
276G39.3Very low41.2Very low41 Ų41101 Ų10142%0.42367%0.665SS.*PPolyproline II helixtrans-59.2153.7177.800000111.9A274A274-G276 PolarHBondContact O-N 3.41Å
277P43.6Very low41Very low129 Ų129101.9 Ų101.984%0.83867%0.67SS**PPolyproline II helixtrans-58.4145.7177.725.8-33.9000110.6G279P277-G279 PolarHBondContact O-N 3.47Å
278K43.9Very low41.2Very low203 Ų203107.3 Ų107.388%0.88369%0.694SS**PPolyproline II helixtrans-53.7125.7173.9-174.5179.2178.9179.50109
279G37.3Very low41.4Very low29 Ų29106.2 Ų106.230%0.29969%0.691SS.*PPolyproline II helixtrans-57.1152.2176.400000111.7P277P277-G279 PolarHBondContact O-N 3.47Å
280P41.1Very low41.2Very low119 Ų119107.5 Ų107.577%0.77370%0.701SS**PPolyproline II helixtrans-57.9151.6175.525.5-33.4000110.6G282P280-G282 PolarHBondContact O-N 3.21Å
281P45.1Very low41.6Very low124 Ų124109 Ų10981%0.80570%0.702SS**PPolyproline II helixtrans-50.5132.8172.1-2533.9000110.8F283P281-F283 PolarHBondContact O-N 3.38Å
282G36.8Very low41.9Very low61 Ų61109.7 Ų109.763%0.62970%0.704SS**PPolyproline II helixtrans-59135.6178.100000110.9P280 S284P280-G282 PolarHBondContact O-N 3.21Å; G282-S284 PolarHBondContact O-N 3.5Å
283F40.1Very low42Very low204 Ų204108.6 Ų108.690%0.89570%0.704SS**PPolyproline II helixtrans-57129.8173.1-80.2-89.1000109.6P281 G285P281-F283 PolarHBondContact O-N 3.38Å; F283-G285 PolarHBondContact O-N 3.43Å
284S42.3Very low42.3Very low114 Ų114118.2 Ų118.280%0.79773%0.729SS**  trans-55.8113.8168.350.30000108.3G282 S286G282-S284 PolarHBondContact O-N 3.5Å; S284-S286 PolarHBondContact O-N 3.41Å
285G40.2Very low42.6Very low69 Ų69121.5 Ų121.571%0.71173%0.732SS**  trans-59.4111.1-179.800000110.7F283 C287F283-G285 PolarHBondContact O-N 3.43Å; G285-C287 PolarHBondContact O-N 3.48Å
286S38.1Very low42.3Very low92 Ų92119.4 Ų119.464%0.64373%0.728SS**  trans-70.3114.1157.549.20000107S284 D288S284-S286 PolarHBondContact O-N 3.41Å; S286-D288 PolarHBondContact O-N 3.21Å
287C39.6Very low42.2Very low108 Ų108123.8 Ų123.873%0.7375%0.749SS**  trans-75.193.6173.9-54.80000108.5G285 H289G285-C287 PolarHBondContact O-N 3.48Å; C287-H289 PolarHBondContact O-N 3.25Å
288D43.5Very low42Very low140 Ų140120.5 Ų120.575%0.74974%0.739SS**THydrogen-bonded Turntrans-71.613.5169.3-65.1-55.5000113S286S286-D288 PolarHBondContact O-N 3.21Å
289H46.6Very low41.6Very low181 Ų181126 Ų12684%0.83876%0.756SS**THydrogen-bonded Turntrans-125.927.7-176.2-77.771.4000113C287C287-H289 PolarHBondContact O-N 3.25Å
290C40.6Very low41.8Very low102 Ų102130.8 Ų130.869%0.68978%0.779SS**PPolyproline II helixtrans-103.4120.7167.9-147.20000109
291P47.1Very low41.8Very low82 Ų82131.4 Ų131.453%0.53278%0.779SS.*PPolyproline II helixtrans-58.3142.3164.725.1-31.1000107.9A293P291-A293 PolarHBondContact O-N 3.41Å
292P46.9Very low41.6Very low120 Ų120131.8 Ų131.878%0.77978%0.778SS**PPolyproline II helixtrans-55.2123.2178.222.4-31.3000107.8R294P292-R294 PolarHBondContact O-N 3.38Å
293A47.3Very low41.9Very low92 Ų92136 Ų13676%0.7679%0.787SS**PPolyproline II helixtrans-48116.8169.300000106.7P291 L295P291-A293 PolarHBondContact O-N 3.41Å; A293-L295 VanDerWaalsContact C-N 3.27Å; A293-L295 PolarHBondContact O-N 3.1Å
294R43.6Very low42Very low241 Ų241131.8 Ų131.891%0.90978%0.78SS**  trans-58.9101.7168.4-74.6-173.2-170-1773.8105.6P292 A296P292-R294 PolarHBondContact O-N 3.38Å; R294-A296 PolarHBondContact O-N 3.49Å
295L45.9Very low42Very low167 Ų167132.9 Ų132.987%0.87478%0.779SS**  trans-53.2102151.9-77.6158.1000104.8A293 P297A293-L295 VanDerWaalsContact C-N 3.27Å; A293-L295 PolarHBondContact O-N 3.1Å; L295-P297 VanDerWaalsContact O-CD 3.29Å; L295-P297 WeakPolarHBondContact O-CD 3.22Å
296A40Very low42.2Very low89 Ų89137.5 Ų137.574%0.73678%0.784SS**  trans-59.8121.5168.500000106.8R294 G298R294-A296 PolarHBondContact O-N 3.49Å; A296-G298 PolarHBondContact O-N 3.26Å
297P35.7Very low42.5Very low133 Ų133141 Ų14186%0.86479%0.794SS**  trans-79.8107.6165.126.6-17.2000106.3L295L295-P297 VanDerWaalsContact O-CD 3.29Å; L295-P297 WeakPolarHBondContact O-CD 3.22Å
298G40.1Very low42.7Very low60 Ų60143.8 Ų143.862%0.61980%0.8SS**  trans-156.387.1179.900000110.8A296A296-G298 PolarHBondContact O-N 3.26Å
299Y35.3Very low42.6Very low318 Ų318144.1 Ų144.1100%1.24780%0.804SS**  trans59.90159.6-73-88.3000119.4

Retrieved 299 of 299 residues in 162.5 ms (Link to these results)