A0A096N550_PAPAN Loading...

Probable RNA-binding protein EIF1AD

Plays a role into cellular response to oxidative stress. Decreases cell proliferation.

AlphaFold DB (Q8N9N8), UniProt , Accession A0A096N550, Species PAPAN (Papio anubis, Olive baboon), Gene EIF1AD, Length 165 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
1M63.9Low79.5Confident175 Ų17599.9 Ų99.986%0.86251%0.509SS*.  0120.10-73.7-67.8-10000109.8T5 K6M1-T5 HydrophobicContact CE-CG2 3.5Å; M1-T5 HydrophobicContact SD-CG2 3.98Å; M1-K6 HydrophobicContact CB-CG 4.31Å
2S81Confident79.6Confident75 Ų75104.7 Ų104.752%0.52452%0.524SS..  trans-64.2154.1175.7175.10000111.4A4 T5 K6S2-A4 PolarHBondContact O-N 3.2Å; S2-A4 PolarHBondContact OG-N 3.46Å; S2-T5 PolarHBondContact O-N 3.09Å; S2-T5 VanDerWaalsContact O-N 3.15Å; S2-K6 PolarHBondContact O-N 3.14Å; S2-K6 VanDerWaalsContact O-N 3.16Å
3Q79.1Confident79.5Confident124 Ų124101.2 Ų101.258%0.57951%0.505SS*.Hα-helixtrans-55.7-37.4174.9-170.3-1731800111.6K6 R7Q3-K6 PolarHBondContact O-N 2.98Å; Q3-R7 WeakPolarHBondContact O-CG 3.45Å; Q3-R7 PolarHBondContact O-N 3.07Å
4A82.9Confident79.1Confident65 Ų6595.4 Ų95.454%0.53748%0.477SS..Hα-helixtrans-63.2-42.3177.700000112.2S2 R7 K8S2-A4 PolarHBondContact O-N 3.2Å; S2-A4 PolarHBondContact OG-N 3.46Å; A4-R7 PolarHBondContact O-N 3.15Å; A4-K8 PolarHBondContact O-N 3.35Å
5T84.8Confident78.6Confident64 Ų6496.8 Ų96.839%0.39349%0.486SS..Hα-helixtrans-66.1-41.4178.3-41.80000111.5M1 S2 K8 H9M1-T5 HydrophobicContact CE-CG2 3.5Å; M1-T5 HydrophobicContact SD-CG2 3.98Å; S2-T5 PolarHBondContact O-N 3.09Å; S2-T5 VanDerWaalsContact O-N 3.15Å; T5-K8 PolarHBondContact O-N 2.89Å; T5-H9 PolarHBondContact O-N 3.01Å
6K81.2Confident78Confident126 Ų12692.5 Ų92.555%0.54847%0.474SS..Hα-helixtrans-61.4-44.5175.8-68-177.1-179.8-176.50111.4M1 S2 Q3 H9 V10M1-K6 HydrophobicContact CB-CG 4.31Å; S2-K6 PolarHBondContact O-N 3.14Å; S2-K6 VanDerWaalsContact O-N 3.16Å; Q3-K6 PolarHBondContact O-N 2.98Å; K6-H9 PolarHBondContact O-N 3.26Å; K6-V10 WeakPolarHBondContact O-CG2 3.28Å; K6-V10 PolarHBondContact O-N 3.47Å
7R80.5Confident76.8Confident112 Ų11297.3 Ų97.342%0.42349%0.494SS..Hα-helixtrans-59.5-47.5175.6-78.7175.4169.1-178.9-3.4112.1Q3 A4 H9 V10 V11 N60Q3-R7 WeakPolarHBondContact O-CG 3.45Å; Q3-R7 PolarHBondContact O-N 3.07Å; A4-R7 PolarHBondContact O-N 3.15Å; R7-H9 VanDerWaalsContact C-N 3.27Å; R7-H9 PolarHBondContact O-N 2.97Å; R7-V10 PolarHBondContact O-N 3.33Å; R7-V11 VanDerWaalsContact O-CG2 3.31Å; R7-V11 WeakPolarHBondContact O-CG2 3.43Å; R7-V11 PolarHBondContact O-N 2.94Å; R7-N60 VanDerWaalsContact CG-OD1 3.31Å; R7-N60 WeakPolarHBondContact CG-OD1 3.35Å; R7-N60 PolarHBondContact NE-OD1 3.17Å
8K82.8Confident75.9Confident163 Ų16398.8 Ų98.871%0.70950%0.499SS*.Hα-helixtrans-58.7-40.1177.6-175.9174.1-179.7176.40112A4 T5 K12A4-K8 PolarHBondContact O-N 3.35Å; T5-K8 PolarHBondContact O-N 2.89Å; K8-K12 VanDerWaalsContact O-CB 3.29Å; K8-K12 WeakPolarHBondContact O-CB 3.41Å; K8-K12 PolarHBondContact O-N 3.43Å
9H81.8Confident75.4Confident107 Ų10794.8 Ų94.850%0.49548%0.479SS..Hα-helixtrans-65.8-47.3177.1-179.962.7000112T5 K6 R7 V11 K12 E13T5-H9 PolarHBondContact O-N 3.01Å; K6-H9 PolarHBondContact O-N 3.26Å; R7-H9 VanDerWaalsContact C-N 3.27Å; R7-H9 PolarHBondContact O-N 2.97Å; H9-V11 PolarHBondContact O-N 2.84Å; H9-K12 WeakPolarHBondContact O-CB 3.42Å; H9-K12 PolarHBondContact O-N 3.48Å; H9-E13 IonicContact CE1-OE1 2.84Å; H9-E13 IonicContact NE2-OE1 3.14Å; H9-E13 PolarHBondContact NE2-OE1 3.06Å; H9-E13 PolarHBondContact O-N 3.12Å
10V77.8Confident75.1Confident7 Ų793.5 Ų93.54%0.04248%0.475CS..Hα-helixtrans-60.7-45.6177171.70000111.5K6 R7 K12 E13 V14 K56 Y57 N60 I61K6-V10 WeakPolarHBondContact O-CG2 3.28Å; K6-V10 PolarHBondContact O-N 3.47Å; R7-V10 PolarHBondContact O-N 3.33Å; V10-K12 VanDerWaalsContact C-N 3.28Å; V10-K12 PolarHBondContact O-N 2.96Å; V10-E13 PolarHBondContact O-N 3.18Å; V10-V14 HydrophobicContact CG1-CG2 4.38Å; V10-V14 WeakPolarHBondContact O-CG2 3.22Å; V10-V14 PolarHBondContact O-N 3.02Å; V10-K56 HydrophobicContact CG2-CB 4.44Å; V10-K56 WeakPolarHBondContact CG2-O 3.42Å; V10-Y57 HydrophobicContact CG1-CD1 3.67Å; V10-Y57 HydrophobicContact CG1-CE1 3.88Å; V10-N60 HydrophobicContact CG1-CB 4.08Å; V10-I61 HydrophobicContact CG1-CD1 3.96Å; V10-I61 HydrophobicContact CG1-CG1 4.05Å
11V78.8Confident74.9Confident81 Ų8190.1 Ų90.149%0.49146%0.459SS..Hα-helixtrans-62.9-37.8177.4173.50000111.1R7 H9 V14 L15R7-V11 VanDerWaalsContact O-CG2 3.31Å; R7-V11 WeakPolarHBondContact O-CG2 3.43Å; R7-V11 PolarHBondContact O-N 2.94Å; H9-V11 PolarHBondContact O-N 2.84Å; V11-V14 PolarHBondContact O-N 3.4Å; V11-L15 VanDerWaalsContact O-CB 3.23Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 PolarHBondContact O-N 3.07Å
12K80.8Confident75.5Confident157 Ų15785.1 Ų85.168%0.68344%0.442SS*.Hα-helixtrans-66.3-38.9176.1-172.9-178.7179-175.40112.4K8 H9 V10 G16K8-K12 VanDerWaalsContact O-CB 3.29Å; K8-K12 WeakPolarHBondContact O-CB 3.41Å; K8-K12 PolarHBondContact O-N 3.43Å; H9-K12 WeakPolarHBondContact O-CB 3.42Å; H9-K12 PolarHBondContact O-N 3.48Å; V10-K12 VanDerWaalsContact C-N 3.28Å; V10-K12 PolarHBondContact O-N 2.96Å; K12-G16 PolarHBondContact O-N 3.41Å
13E77.7Confident75.2Confident60 Ų6089.4 Ų89.428%0.2846%0.459SS..Hα-helixtrans-64.4-44.7174-72.1-165.5157.800111.2H9 V10 G16 K56 F86H9-E13 IonicContact CE1-OE1 2.84Å; H9-E13 IonicContact NE2-OE1 3.14Å; H9-E13 PolarHBondContact NE2-OE1 3.06Å; H9-E13 PolarHBondContact O-N 3.12Å; V10-E13 PolarHBondContact O-N 3.18Å; E13-G16 PolarHBondContact O-N 2.9Å; E13-K56 IonicContact OE2-NZ 3.4Å; E13-K56 PolarHBondContact OE2-NZ 2.96Å; E13-F86 HydrophobicContact CB-CE1 4.35Å
14V74.5Confident75.3Confident19 Ų1990.6 Ų90.612%0.11546%0.464CS..Hα-helixtrans-68.4-37-178.81760000111.4V10 V11 G16 Y57 I61 H92V10-V14 HydrophobicContact CG1-CG2 4.38Å; V10-V14 WeakPolarHBondContact O-CG2 3.22Å; V10-V14 PolarHBondContact O-N 3.02Å; V11-V14 PolarHBondContact O-N 3.4Å; V14-G16 VanDerWaalsContact C-N 3.32Å; V14-Y57 HydrophobicContact CG2-CE1 4.33Å; V14-I61 HydrophobicContact CG2-CD1 3.31Å; V14-I61 HydrophobicContact CG2-CG1 4.22Å; V14-H92 PolarHBondContact O-CE1 2.9Å
15L71.1Confident75.6Confident117 Ų11789.1 Ų89.161%0.61345%0.446SS*.THydrogen-bonded Turntrans-87.4-0.2178.7-166.661.7000112.9V11 E17V11-L15 VanDerWaalsContact O-CB 3.23Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 PolarHBondContact O-N 3.07Å; L15-E17 PolarHBondContact O-N 3.15Å
16G69.1Low75.7Confident28 Ų2890.5 Ų90.529%0.28945%0.448SS..  trans-59.4124.8-179.900000110.7K12 E13 V14 H18 H92K12-G16 PolarHBondContact O-N 3.41Å; E13-G16 PolarHBondContact O-N 2.9Å; V14-G16 VanDerWaalsContact C-N 3.32Å; G16-H18 PolarHBondContact O-N 3.03Å; G16-H92 PolarHBondContact O-NE2 3.35Å
17E58.1Low76.1Confident174 Ų17485.1 Ų85.181%0.81343%0.425SS*.SBendtrans-67.9-7.1-164.8-65.7-177151.800115.4L15L15-E17 PolarHBondContact O-N 3.15Å
18H60.8Low76.7Confident125 Ų12579.8 Ų79.858%0.57941%0.405SS*.  trans-147.199.9-174-166.574.3000110.8G16 V20 E99G16-H18 PolarHBondContact O-N 3.03Å; H18-V20 VanDerWaalsContact NE2-CG2 3.28Å; H18-V20 WeakPolarHBondContact NE2-CG2 3.38Å; H18-E99 IonicContact CE1-OE1 3.81Å; H18-E99 PolarHBondContact CE1-OE1 3.21Å; H18-E99 IonicContact CE1-OE2 2.98Å; H18-E99 IonicContact ND1-OE1 2.89Å; H18-E99 PolarHBondContact ND1-OE1 3.03Å; H18-E99 VanDerWaalsContact ND1-OE1 3.14Å
19I66.6Low77.2Confident23 Ų2373.8 Ų73.812%0.11838%0.378CS..  trans-114.4103.9174.1-54.1167.3000106.4I70 F86I19-I70 HydrophobicContact CG2-CD1 3.61Å; I19-F86 HydrophobicContact CD1-CB 4.16Å; I19-F86 HydrophobicContact CD1-CD1 3.9Å; I19-F86 HydrophobicContact CD1-CG 4.12Å; I19-F86 HydrophobicContact CG2-CD2 4.14Å; I19-F86 HydrophobicContact CG2-CG 4.24Å
20V68.7Low77.7Confident68 Ų6868.7 Ų68.741%0.41236%0.355SS..PPolyproline II helixtrans-87.7124.4171.6-1780000107.3H18 S22 F101H18-V20 VanDerWaalsContact NE2-CG2 3.28Å; H18-V20 WeakPolarHBondContact NE2-CG2 3.38Å; V20-S22 PolarHBondContact O-N 3.31Å; V20-F101 HydrophobicContact CG1-CE2 4.39Å
21P71.7Confident78.4Confident22 Ų2269.4 Ų69.414%0.14336%0.358CS..PPolyproline II helixtrans-64.3129.7177.427.5-31.9000108.9Q25 L96 F101P21-Q25 HydrophobicContact CB-CB 4.33Å; P21-L96 HydrophobicContact CG-CD2 4.19Å; P21-F101 HydrophobicContact CG-CB 4.07Å; P21-F101 HydrophobicContact CG-CD1 4.42Å; P21-F101 HydrophobicContact CG-CG 4.23Å
22S75.9Confident79.1Confident70 Ų7074 Ų7449%0.4937%0.367SS..PPolyproline II helixtrans-67.6163.1169.8-164.40000110.9V20 Q24 Q25V20-S22 PolarHBondContact O-N 3.31Å; S22-Q24 PolarHBondContact O-N 3.26Å; S22-Q25 WeakPolarHBondContact O-CB 3.34Å; S22-Q25 PolarHBondContact O-N 3.19Å
23D73.8Confident79.6Confident166 Ų16669.7 Ų69.789%0.88835%0.353SS*.THydrogen-bonded Turntrans-59-31.9-177.4-166.9-105.9000113Q25D23-Q25 VanDerWaalsContact C-N 3.34Å
24Q83.1Confident80.3Confident148 Ų14870.5 Ų70.569%0.69236%0.364SS*.THydrogen-bonded Turntrans-82.3-13.8176.7-59.6-170.2-5900113.3S22 P73S22-Q24 PolarHBondContact O-N 3.26Å; Q24-P73 WeakPolarHBondContact O-CD 3.11Å; Q24-P73 WeakPolarHBondContact O-CG 3.31Å
25Q87.3Confident80.9Confident34 Ų3471 Ų7116%0.15937%0.374CS..  trans-86141.1-174.4-80.3176.5-10.900111.6P21 S22 D23 I70 V71 D72 S85P21-Q25 HydrophobicContact CB-CB 4.33Å; S22-Q25 WeakPolarHBondContact O-CB 3.34Å; S22-Q25 PolarHBondContact O-N 3.19Å; D23-Q25 VanDerWaalsContact C-N 3.34Å; Q25-I70 HydrophobicContact CB-CG2 3.65Å; Q25-I70 HydrophobicContact CG-CG2 3.79Å; Q25-V71 WeakPolarHBondContact CA-O 2.91Å; Q25-D72 WeakPolarHBondContact CG-OD1 3.46Å; Q25-D72 PolarHBondContact NE2-OD1 3.37Å; Q25-S85 PolarHBondContact NE2-OG 2.84Å
26Q87.8Confident81.8Confident93 Ų9372.2 Ų72.244%0.43538%0.38SS..EExtended strand (participates in β ladder)trans-122.4139.7178.7-61.2-173.5-49.300111I70 V71Q26-I70 WeakPolarHBondContact O-CA 3.44Å; Q26-V71 HydrophobicContact CB-CG2 4.17Å; Q26-V71 PolarHBondContact N-O 3.26Å; Q26-V71 WeakPolarHBondContact O-CG2 3.41Å; Q26-V71 PolarHBondContact O-N 2.92Å
27I90.4Very high82.9Confident13 Ų1374.2 Ų74.27%0.06739%0.385CS..EExtended strand (participates in β ladder)trans-85.6126.9172.1-58.7172.9000108.3L69 I70 L88 L96 W102 P103 F106I27-L69 WeakPolarHBondContact CA-O 3.41Å; I27-I70 HydrophobicContact CG1-CG1 4.42Å; I27-L88 HydrophobicContact CG2-CD1 4.2Å; I27-L96 HydrophobicContact CD1-CD1 4.46Å; I27-L96 HydrophobicContact CD1-CD2 4.28Å; I27-W102 HydrophobicContact CD1-CE3 4.24Å; I27-W102 HydrophobicContact CD1-CZ3 4.44Å; I27-W102 HydrophobicContact CG2-CH2 4.36Å; I27-W102 HydrophobicContact CG2-CZ3 4.04Å; I27-P103 HydrophobicContact CB-CG 4.4Å; I27-F106 HydrophobicContact CG2-CD2 4.37Å; I27-F106 HydrophobicContact CG2-CE2 4.21Å; I27-F106 WeakPolarHBondContact O-CE2 3.28Å
28V92.1Very high84.5Confident0 Ų067.7 Ų67.70%036%0.355CS..EExtended strand (participates in β ladder)trans-132.6157.4-179.2-59.70000111.1V41 E42 F49 F68 L69 V71V28-V41 HydrophobicContact CB-CB 3.95Å; V28-V41 HydrophobicContact CB-CG2 4.07Å; V28-V41 HydrophobicContact CG1-CG2 4.34Å; V28-V41 HydrophobicContact CG2-CB 3.76Å; V28-V41 HydrophobicContact CG2-CG1 3.91Å; V28-V41 HydrophobicContact CG2-CG2 3.91Å; V28-E42 WeakPolarHBondContact CA-O 3.32Å; V28-F49 HydrophobicContact CG1-CE1 4.49Å; V28-F49 HydrophobicContact CG1-CZ 4.03Å; V28-F68 WeakPolarHBondContact O-CA 3.42Å; V28-L69 HydrophobicContact CG2-CB 3.99Å; V28-L69 PolarHBondContact N-O 2.83Å; V28-L69 PolarHBondContact O-N 3.07Å; V28-V71 HydrophobicContact CG1-CG2 3.7Å; V28-V71 HydrophobicContact CG2-CB 4.43Å; V28-V71 HydrophobicContact CG2-CG1 3.52Å; V28-V71 HydrophobicContact CG2-CG2 4.02Å
29R92.6Very high86.1Confident38 Ų3862.3 Ų62.314%0.14333%0.33CS..EExtended strand (participates in β ladder)trans-109.2136.6176.8-178.2-178.967.6138.3-8.2111.2V41 E42 F68 F106R29-V41 CarbonylContact O-C 3.51Å; R29-V41 WeakPolarHBondContact O-CA 3.45Å; R29-E42 IonicContact CZ-OE2 3.6Å; R29-E42 PolarHBondContact N-O 3.06Å; R29-E42 IonicContact NE-OE2 3.74Å; R29-E42 IonicContact NH2-OE2 2.66Å; R29-E42 PolarHBondContact NH2-OE2 3.4Å; R29-E42 PolarHBondContact O-N 2.9Å; R29-F68 HydrophobicContact CB-CD1 4.03Å; R29-F68 HydrophobicContact CB-CE1 3.98Å; R29-F68 HydrophobicContact CG-CD1 4.3Å; R29-F68 HydrophobicContact CG-CE1 4.01Å; R29-F106 HydrophobicContact CB-CD1 3.99Å; R29-F106 HydrophobicContact CB-CE1 3.49Å; R29-F106 VanDerWaalsContact CB-CE1 3.49Å; R29-F106 HydrophobicContact CB-CZ 4.23Å
30V93.5Very high87.4Confident0 Ų064.1 Ų64.10%034%0.338CS..EExtended strand (participates in β ladder)trans-79.2123.9179-178.90000111.2V41 I63 G66 D67 L69V30-V41 HydrophobicContact CG2-CG1 4.17Å; V30-I63 HydrophobicContact CB-CG2 4.29Å; V30-I63 HydrophobicContact CG1-CG2 4.13Å; V30-I63 HydrophobicContact CG2-CG2 3.63Å; V30-G66 WeakPolarHBondContact O-CA 3.32Å; V30-G66 PolarHBondContact O-N 3.17Å; V30-D67 WeakPolarHBondContact CG2-O 3.31Å; V30-D67 PolarHBondContact N-O 3.38Å; V30-L69 HydrophobicContact CG2-CD1 3.33Å; V30-L69 HydrophobicContact CG2-CD2 4.43Å; V30-L69 HydrophobicContact CG2-CG 3.65Å
31L92.7Very high88.6Confident22 Ų2260.9 Ų60.912%0.11532%0.318CS..EExtended strand (participates in β ladder)trans-93.1-50175-67.8179.1000112.1E40 E42 R48 R65L31-E40 PolarHBondContact N-O 3.01Å; L31-E42 HydrophobicContact CD1-CB 3.96Å; L31-E42 HydrophobicContact CD2-CB 4.46Å; L31-E42 HydrophobicContact CG-CB 4.09Å; L31-R48 HydrophobicContact CD1-CG 3.92Å; L31-R65 WeakPolarHBondContact O-CD 3.46Å; L31-R65 WeakPolarHBondContact O-CG 3.23Å; L31-R65 PolarHBondContact O-NE 3.07Å
32R92.5Very high89.6Confident177 Ų17761 Ų6167%0.66832%0.317SS*.EExtended strand (participates in β ladder)trans-155.7158.4-176.3-179.9175.8-107.4-160.8-3.1110.4P34 E40R32-P34 WeakPolarHBondContact O-CD 2.97Å; R32-E40 PolarHBondContact N-O 2.92Å; R32-E40 WeakPolarHBondContact O-CB 3.45Å; R32-E40 PolarHBondContact O-N 2.83Å
33T92.2Very high90.4Very high66 Ų6658.3 Ų58.341%0.40530%0.298SS..EExtended strand (participates in β ladder)trans-110.9100172.4-560000108.7G35 L38 H39T33-G35 PolarHBondContact O-N 3.48Å; T33-L38 WeakPolarHBondContact CG2-O 3.04Å; T33-H39 PolarHBondContact OG1-ND1 2.67Å
34P90.8Very high91Very high77 Ų7752 Ų5250%0.527%0.268SS..EExtended strand (participates in β ladder)trans-65-17178.623.6-34.6000114.2R32 L38 L50R32-P34 WeakPolarHBondContact O-CD 2.97Å; P34-L38 VanDerWaalsContact CD-O 3.28Å; P34-L38 WeakPolarHBondContact CD-O 3.24Å; P34-L38 HydrophobicContact CG-CB 3.98Å; P34-L50 HydrophobicContact CG-CD2 3.88Å
35G88.7Confident91.2Very high31 Ų3152.5 Ų52.532%0.3227%0.271SS..EExtended strand (participates in β ladder)trans109-177.1-176.600000112T33 N37 L38T33-G35 PolarHBondContact O-N 3.48Å; G35-N37 VanDerWaalsContact C-N 3.25Å; G35-N37 PolarHBondContact O-N 3.33Å; G35-L38 WeakPolarHBondContact O-CB 3.38Å; G35-L38 PolarHBondContact O-N 3.43Å
36N90Very high91.2Very high141 Ų14153 Ų5375%0.75429%0.285SS*.THydrogen-bonded Turntrans55.832.7-178.1-163.831000115L38N36-L38 PolarHBondContact O-N 3.31Å
37N90.4Very high91.3Very high71 Ų7154.7 Ų54.738%0.3829%0.293SS..THydrogen-bonded Turntrans61.324.1-174.9-45.6-76.1000114.1G35 M53 R58G35-N37 VanDerWaalsContact C-N 3.25Å; G35-N37 PolarHBondContact O-N 3.33Å; N37-M53 HydrophobicContact CB-CB 4.11Å; N37-M53 WeakPolarHBondContact O-CB 3.29Å; N37-M53 PolarHBondContact O-N 3.06Å; N37-R58 HydrophobicContact CB-CG 4.41Å
38L92.7Very high91.4Very high36 Ų3661.5 Ų61.519%0.18832%0.318CS..EExtended strand (participates in β ladder)trans-102.9143.4172.9-59.5175.7000110.3T33 P34 G35 N36 L50 V51 V80T33-L38 WeakPolarHBondContact CG2-O 3.04Å; P34-L38 VanDerWaalsContact CD-O 3.28Å; P34-L38 WeakPolarHBondContact CD-O 3.24Å; P34-L38 HydrophobicContact CG-CB 3.98Å; G35-L38 WeakPolarHBondContact O-CB 3.38Å; G35-L38 PolarHBondContact O-N 3.43Å; N36-L38 PolarHBondContact O-N 3.31Å; L38-L50 HydrophobicContact CD1-CD1 4.48Å; L38-V51 WeakPolarHBondContact CA-O 3.22Å; L38-V80 HydrophobicContact CD1-CG2 4.47Å; L38-V80 HydrophobicContact CD2-CG1 4.36Å; L38-V80 HydrophobicContact CD2-CG2 3.76Å
39H93.4Very high91.4Very high13 Ų1362.6 Ų62.66%0.0632%0.323CS..EExtended strand (participates in β ladder)trans-126.4132.4175.2-60.3-82.7000109.7T33 V41 L50 V51 I84T33-H39 PolarHBondContact OG1-ND1 2.67Å; H39-V41 HydrophobicContact CB-CG1 4.44Å; H39-L50 CarbonylContact O-C 3.58Å; H39-L50 WeakPolarHBondContact O-CA 3.48Å; H39-V51 HydrophobicContact CB-CG2 3.84Å; H39-V51 PolarHBondContact N-O 3.28Å; H39-V51 WeakPolarHBondContact O-CG2 3.49Å; H39-V51 PolarHBondContact O-N 2.9Å; H39-I84 HydrophobicContact CB-CD1 4.41Å; H39-I84 VanDerWaalsContact CD2-CD1 3.48Å; H39-I84 WeakPolarHBondContact CD2-CD1 3.43Å
40E94.2Very high91.5Very high60 Ų6063 Ų6328%0.2833%0.327SS..EExtended strand (participates in β ladder)trans-84.3120.9170.7-172.8-177.9178.700108.4L31 R32 L50L31-E40 PolarHBondContact N-O 3.01Å; R32-E40 PolarHBondContact N-O 2.92Å; R32-E40 WeakPolarHBondContact O-CB 3.45Å; R32-E40 PolarHBondContact O-N 2.83Å; E40-L50 HydrophobicContact CB-CD2 3.99Å; E40-L50 HydrophobicContact CG-CD2 4.45Å
41V94.1Very high91.5Very high0 Ų063 Ų630%033%0.327CS..EExtended strand (participates in β ladder)trans-123.9159.3-176.1-59.80000111.3V28 R29 V30 H39 R48 F49 V51 L69V28-V41 HydrophobicContact CB-CB 3.95Å; V28-V41 HydrophobicContact CB-CG2 4.07Å; V28-V41 HydrophobicContact CG1-CG2 4.34Å; V28-V41 HydrophobicContact CG2-CB 3.76Å; V28-V41 HydrophobicContact CG2-CG1 3.91Å; V28-V41 HydrophobicContact CG2-CG2 3.91Å; R29-V41 CarbonylContact O-C 3.51Å; R29-V41 WeakPolarHBondContact O-CA 3.45Å; V30-V41 HydrophobicContact CG2-CG1 4.17Å; H39-V41 HydrophobicContact CB-CG1 4.44Å; V41-R48 VanDerWaalsContact O-CA 3.28Å; V41-R48 WeakPolarHBondContact O-CA 3.37Å; V41-F49 HydrophobicContact CG2-CD1 4.37Å; V41-F49 HydrophobicContact CG2-CD2 3.98Å; V41-F49 HydrophobicContact CG2-CE1 4.07Å; V41-F49 HydrophobicContact CG2-CE2 3.69Å; V41-F49 HydrophobicContact CG2-CG 4.33Å; V41-F49 HydrophobicContact CG2-CZ 3.74Å; V41-F49 PolarHBondContact N-O 2.88Å; V41-F49 PolarHBondContact O-N 2.9Å; V41-V51 HydrophobicContact CG1-CG1 4.46Å; V41-V51 HydrophobicContact CG1-CG2 3.61Å; V41-V51 HydrophobicContact CG2-CG1 3.54Å; V41-V51 HydrophobicContact CG2-CG2 4.23Å; V41-L69 HydrophobicContact CG1-CD1 4.3Å
42E93.2Very high91.5Very high26 Ų2663.4 Ų63.412%0.12133%0.332CS..EExtended strand (participates in β ladder)trans-123.7127.7177-168.9172.8-116.200109.9V28 R29 L31 Q47 R48 F106V28-E42 WeakPolarHBondContact CA-O 3.32Å; R29-E42 IonicContact CZ-OE2 3.6Å; R29-E42 PolarHBondContact N-O 3.06Å; R29-E42 IonicContact NE-OE2 3.74Å; R29-E42 IonicContact NH2-OE2 2.66Å; R29-E42 PolarHBondContact NH2-OE2 3.4Å; R29-E42 PolarHBondContact O-N 2.9Å; L31-E42 HydrophobicContact CD1-CB 3.96Å; L31-E42 HydrophobicContact CD2-CB 4.46Å; L31-E42 HydrophobicContact CG-CB 4.09Å; E42-Q47 VanDerWaalsContact CA-O 3.31Å; E42-Q47 WeakPolarHBondContact CA-O 3.46Å; E42-R48 HydrophobicContact CB-CG 4.38Å; E42-R48 HydrophobicContact CG-CG 4.22Å; E42-R48 IonicContact OE1-CZ 3.68Å; E42-R48 IonicContact OE1-NE 3.69Å; E42-R48 PolarHBondContact OE1-NE 2.81Å; E42-R48 VanDerWaalsContact OE1-NE 3.13Å; E42-R48 IonicContact OE1-NH2 3.29Å; E42-R48 PolarHBondContact OE1-NH2 3.36Å; E42-F106 WeakPolarHBondContact O-CZ 3.37Å
43T91.7Very high91.4Very high13 Ų1355.3 Ų55.38%0.0830%0.302CS..EExtended strand (participates in β ladder)trans-74.1165173.3-40.70000110.9Q45 G46 Q47 F49T43-Q45 PolarHBondContact O-N 2.98Å; T43-G46 PolarHBondContact O-N 2.89Å; T43-Q47 PolarHBondContact N-O 3.26Å; T43-F49 WeakPolarHBondContact OG1-CE1 3.14Å
44A87.2Confident91.3Very high32 Ų3252.6 Ų52.626%0.26429%0.285SS..THydrogen-bonded Turntrans-52.7-25.3167.500000113.8G46 P103 A105 F106A44-G46 VanDerWaalsContact C-N 3.31Å; A44-P103 HydrophobicContact CB-CB 3.6Å; A44-P103 HydrophobicContact CB-CG 4.1Å; A44-A105 HydrophobicContact CB-CB 4.18Å; A44-A105 WeakPolarHBondContact O-CB 3.43Å; A44-F106 HydrophobicContact CB-CE2 3.91Å; A44-F106 HydrophobicContact CB-CZ 4.31Å
45Q87.1Confident91.2Very high159 Ų15953.3 Ų53.374%0.74329%0.292SS*.THydrogen-bonded Turntrans-83.41.5176.7-58.5-62-23.100114T43 Q47T43-Q45 PolarHBondContact O-N 2.98Å; Q45-Q47 VanDerWaalsContact C-N 3.26Å; Q45-Q47 HydrophobicContact CB-CG 4.45Å; Q45-Q47 PolarHBondContact O-N 2.59Å
46G86.8Confident91.1Very high45 Ų4555.4 Ų55.446%0.46429%0.292SS..SBendtrans76.56.2-17700000115.1T43 A44T43-G46 PolarHBondContact O-N 2.89Å; A44-G46 VanDerWaalsContact C-N 3.31Å
47Q90.3Very high90.9Very high129 Ų12948.7 Ų48.760%0.60326%0.257SS*.  trans-75.7136.8174.9-66.3-175.6-8.800110.8E42 T43 Q45E42-Q47 VanDerWaalsContact CA-O 3.31Å; E42-Q47 WeakPolarHBondContact CA-O 3.46Å; T43-Q47 PolarHBondContact N-O 3.26Å; Q45-Q47 VanDerWaalsContact C-N 3.26Å; Q45-Q47 HydrophobicContact CB-CG 4.45Å; Q45-Q47 PolarHBondContact O-N 2.59Å
48R92.6Very high90.8Very high156 Ų15650.2 Ų50.259%0.58926%0.257SS*.EExtended strand (participates in β ladder)trans-111.4136.3179.1-61.2179.9-174.2167.55111.3L31 V41 E42L31-R48 HydrophobicContact CD1-CG 3.92Å; V41-R48 VanDerWaalsContact O-CA 3.28Å; V41-R48 WeakPolarHBondContact O-CA 3.37Å; E42-R48 HydrophobicContact CB-CG 4.38Å; E42-R48 HydrophobicContact CG-CG 4.22Å; E42-R48 IonicContact OE1-CZ 3.68Å; E42-R48 IonicContact OE1-NE 3.69Å; E42-R48 PolarHBondContact OE1-NE 2.81Å; E42-R48 VanDerWaalsContact OE1-NE 3.13Å; E42-R48 IonicContact OE1-NH2 3.29Å; E42-R48 PolarHBondContact OE1-NH2 3.36Å
49F92.8Very high90.4Very high23 Ų2357.6 Ų57.610%0.10129%0.288CS..EExtended strand (participates in β ladder)trans-154.8168.2175.957.7-84000110.6V28 V41 T43 V51 V71 K81 A82V28-F49 HydrophobicContact CG1-CE1 4.49Å; V28-F49 HydrophobicContact CG1-CZ 4.03Å; V41-F49 HydrophobicContact CG2-CD1 4.37Å; V41-F49 HydrophobicContact CG2-CD2 3.98Å; V41-F49 HydrophobicContact CG2-CE1 4.07Å; V41-F49 HydrophobicContact CG2-CE2 3.69Å; V41-F49 HydrophobicContact CG2-CG 4.33Å; V41-F49 HydrophobicContact CG2-CZ 3.74Å; V41-F49 PolarHBondContact N-O 2.88Å; V41-F49 PolarHBondContact O-N 2.9Å; T43-F49 WeakPolarHBondContact OG1-CE1 3.14Å; F49-V51 HydrophobicContact CD2-CG1 3.6Å; F49-V51 HydrophobicContact CE2-CG1 3.26Å; F49-V51 HydrophobicContact CZ-CG1 4.31Å; F49-V71 HydrophobicContact CZ-CG2 4.36Å; F49-K81 HydrophobicContact CB-CB 4.26Å; F49-K81 HydrophobicContact CB-CD 3.95Å; F49-K81 HydrophobicContact CB-CG 4.18Å; F49-K81 HydrophobicContact CD2-CB 3.81Å; F49-K81 HydrophobicContact CE2-CB 4.44Å; F49-K81 HydrophobicContact CG-CB 4.2Å; F49-K81 HydrophobicContact CG-CD 4.41Å; F49-A82 HydrophobicContact CD2-CB 4.49Å; F49-A82 HydrophobicContact CE2-CB 3.7Å
50L93.6Very high90.1Very high46 Ų4659.5 Ų59.524%0.24130%0.298CS..EExtended strand (participates in β ladder)trans-91.2141.4174.7-60.5173.5000110.2P34 L38 H39 E40 K79 V80 K81P34-L50 HydrophobicContact CG-CD2 3.88Å; L38-L50 HydrophobicContact CD1-CD1 4.48Å; H39-L50 CarbonylContact O-C 3.58Å; H39-L50 WeakPolarHBondContact O-CA 3.48Å; E40-L50 HydrophobicContact CB-CD2 3.99Å; E40-L50 HydrophobicContact CG-CD2 4.45Å; L50-K79 WeakPolarHBondContact CB-O 3.44Å; L50-V80 HydrophobicContact CB-CG2 4.12Å; L50-V80 CarbonylContact O-C 3.57Å; L50-V80 VanDerWaalsContact O-CA 3.28Å; L50-V80 WeakPolarHBondContact O-CA 3.18Å; L50-K81 PolarHBondContact O-N 3.29Å
51V93.9Very high89.7Confident0 Ų058.3 Ų58.30%029%0.294CS..EExtended strand (participates in β ladder)trans-120.7143172.5-59.80000111.1L38 H39 V41 F49 V71 A82 I84L38-V51 WeakPolarHBondContact CA-O 3.22Å; H39-V51 HydrophobicContact CB-CG2 3.84Å; H39-V51 PolarHBondContact N-O 3.28Å; H39-V51 WeakPolarHBondContact O-CG2 3.49Å; H39-V51 PolarHBondContact O-N 2.9Å; V41-V51 HydrophobicContact CG1-CG1 4.46Å; V41-V51 HydrophobicContact CG1-CG2 3.61Å; V41-V51 HydrophobicContact CG2-CG1 3.54Å; V41-V51 HydrophobicContact CG2-CG2 4.23Å; F49-V51 HydrophobicContact CD2-CG1 3.6Å; F49-V51 HydrophobicContact CE2-CG1 3.26Å; F49-V51 HydrophobicContact CZ-CG1 4.31Å; V51-V71 HydrophobicContact CB-CG1 4.45Å; V51-V71 HydrophobicContact CG1-CG1 4.06Å; V51-A82 CarbonylContact C-O 3.53Å; V51-A82 WeakPolarHBondContact CA-O 3.46Å; V51-A82 WeakPolarHBondContact CB-O 3.19Å; V51-A82 HydrophobicContact CG1-CB 3.79Å; V51-I84 HydrophobicContact CB-CG1 4.12Å; V51-I84 HydrophobicContact CG2-CD1 3.77Å; V51-I84 HydrophobicContact CG2-CG1 3.58Å
52S92.9Very high89.4Confident30 Ų3069.5 Ų69.521%0.2134%0.336CS..EExtended strand (participates in β ladder)trans-86.6139.6175.4-174.60000110.4A82 E83 I84S52-A82 PolarHBondContact N-O 3.02Å; S52-E83 WeakPolarHBondContact O-CA 3.28Å; S52-I84 PolarHBondContact O-N 3.36Å
53M91.6Very high89.3Confident7 Ų768.7 Ų68.73%0.03433%0.332CS..PPolyproline II helixtrans-84.7125.5169.4-174.774.412200110.3N37 Y57 R58 I61 I63 I84N37-M53 HydrophobicContact CB-CB 4.11Å; N37-M53 WeakPolarHBondContact O-CB 3.29Å; N37-M53 PolarHBondContact O-N 3.06Å; M53-Y57 VanDerWaalsContact SD-CB 3.54Å; M53-Y57 HydrophobicContact SD-CD2 3.89Å; M53-Y57 HydrophobicContact SD-CG 4.24Å; M53-R58 HydrophobicContact CG-CG 4.32Å; M53-R58 PolarHBondContact O-NE 3.34Å; M53-R58 PolarHBondContact O-NH2 2.87Å; M53-I61 HydrophobicContact CE-CB 4.29Å; M53-I63 HydrophobicContact CE-CD1 3.31Å; M53-I63 HydrophobicContact CE-CG1 3.81Å; M53-I63 HydrophobicContact SD-CD1 3.77Å; M53-I84 HydrophobicContact CB-CD1 4.32Å; M53-I84 HydrophobicContact SD-CB 4.35Å; M53-I84 HydrophobicContact SD-CD1 3.81Å; M53-I84 HydrophobicContact SD-CG2 4.4Å
54P90.4Very high89.2Confident9 Ų973 Ų736%0.05835%0.35CS..PPolyproline II helixtrans-57.2149.8175.9-18.622.6000112.2K56 Y57 R58 E83 I84P54-K56 HydrophobicContact CB-CG 3.77Å; P54-K56 PolarHBondContact O-N 3.4Å; P54-K56 VanDerWaalsContact O-N 3.12Å; P54-Y57 HydrophobicContact CG-CD2 4.01Å; P54-Y57 HydrophobicContact CG-CE2 4.36Å; P54-Y57 PolarHBondContact O-N 3.17Å; P54-R58 WeakPolarHBondContact O-CG 3.42Å; P54-R58 PolarHBondContact O-N 3.25Å; P54-E83 VanDerWaalsContact CA-OE1 3.24Å; P54-E83 WeakPolarHBondContact CA-OE1 3.24Å; P54-E83 HydrophobicContact CB-CG 4.45Å; P54-E83 WeakPolarHBondContact CB-OE1 3.43Å; P54-E83 HydrophobicContact CG-CG 3.71Å; P54-I84 WeakPolarHBondContact CD-O 3.21Å; P54-I84 WeakPolarHBondContact CG-O 3.25Å
55S88.7Confident89.4Confident92 Ų9279.7 Ų79.764%0.64337%0.368SS*.THydrogen-bonded Turntrans-56-31.5177.8630000113Y57S55-Y57 VanDerWaalsContact C-N 3.27Å; S55-Y57 PolarHBondContact O-N 2.94Å
56K85.2Confident89.5Confident75 Ų7572.7 Ų72.733%0.32634%0.339SS..THydrogen-bonded Turntrans-61.8-31.2176.556.8167.1-175.5170.30113.7V10 E13 P54 N60V10-K56 HydrophobicContact CG2-CB 4.44Å; V10-K56 WeakPolarHBondContact CG2-O 3.42Å; E13-K56 IonicContact OE2-NZ 3.4Å; E13-K56 PolarHBondContact OE2-NZ 2.96Å; P54-K56 HydrophobicContact CB-CG 3.77Å; P54-K56 PolarHBondContact O-N 3.4Å; P54-K56 VanDerWaalsContact O-N 3.12Å; K56-N60 PolarHBondContact O-ND2 2.89Å
57Y87.3Confident89.7Confident0 Ų071.9 Ų71.90%032%0.324CS..THydrogen-bonded Turntrans-95.3-22.7-175.1-65.4-15.6000113.3V10 V14 M53 P54 S55 K59 N60 I61 I84 S85V10-Y57 HydrophobicContact CG1-CD1 3.67Å; V10-Y57 HydrophobicContact CG1-CE1 3.88Å; V14-Y57 HydrophobicContact CG2-CE1 4.33Å; M53-Y57 VanDerWaalsContact SD-CB 3.54Å; M53-Y57 HydrophobicContact SD-CD2 3.89Å; M53-Y57 HydrophobicContact SD-CG 4.24Å; P54-Y57 HydrophobicContact CG-CD2 4.01Å; P54-Y57 HydrophobicContact CG-CE2 4.36Å; P54-Y57 PolarHBondContact O-N 3.17Å; S55-Y57 VanDerWaalsContact C-N 3.27Å; S55-Y57 PolarHBondContact O-N 2.94Å; Y57-K59 PolarHBondContact O-N 3.46Å; Y57-N60 PolarHBondContact O-N 3.4Å; Y57-I61 HydrophobicContact CD1-CD1 3.28Å; Y57-I61 HydrophobicContact CD1-CG1 4.23Å; Y57-I61 HydrophobicContact CD2-CD1 3.88Å; Y57-I61 HydrophobicContact CE1-CD1 3.65Å; Y57-I61 HydrophobicContact CE2-CD1 4.21Å; Y57-I61 HydrophobicContact CG-CD1 3.41Å; Y57-I61 VanDerWaalsContact CG-CD1 3.41Å; Y57-I61 HydrophobicContact CG-CG1 4.33Å; Y57-I61 PolarHBondContact O-N 2.88Å; Y57-I61 VanDerWaalsContact O-N 3.09Å; Y57-I84 HydrophobicContact CD2-CG2 4.5Å; Y57-S85 WeakPolarHBondContact CE2-O 3.19Å; Y57-S85 VanDerWaalsContact CZ-O 3.23Å; Y57-S85 PolarHBondContact OH-O 3.25Å
58R87.7Confident89.7Confident103 Ų10366.8 Ų66.839%0.38930%0.3SS..THydrogen-bonded Turntrans-54.5125.5175.3-62.7179.7-159.61664.1109.5N37 M53 P54 N60N37-R58 HydrophobicContact CB-CG 4.41Å; M53-R58 HydrophobicContact CG-CG 4.32Å; M53-R58 PolarHBondContact O-NE 3.34Å; M53-R58 PolarHBondContact O-NH2 2.87Å; P54-R58 WeakPolarHBondContact O-CG 3.42Å; P54-R58 PolarHBondContact O-N 3.25Å; R58-N60 PolarHBondContact O-N 2.97Å
59K84.5Confident89.6Confident191 Ų19159.4 Ų59.483%0.8327%0.272SS*.THydrogen-bonded Turntrans72-1.5-178.1-46.2174.1179.5-178.90116.4Y57Y57-K59 PolarHBondContact O-N 3.46Å
60N85.9Confident89.5Confident53 Ų5358.3 Ų58.328%0.28327%0.267SS..THydrogen-bonded Turntrans-112.9-29.7-179-65.4-23.3000112.8R7 V10 K56 Y57 R58R7-N60 VanDerWaalsContact CG-OD1 3.31Å; R7-N60 WeakPolarHBondContact CG-OD1 3.35Å; R7-N60 PolarHBondContact NE-OD1 3.17Å; V10-N60 HydrophobicContact CG1-CB 4.08Å; K56-N60 PolarHBondContact O-ND2 2.89Å; Y57-N60 PolarHBondContact O-N 3.4Å; R58-N60 PolarHBondContact O-N 2.97Å
61I87.3Confident89.5Confident36 Ų3656.1 Ų56.119%0.18526%0.256CS..  trans-123.4135.7-178.5-53176.8000109.8V10 V14 M53 Y57 I63 V87V10-I61 HydrophobicContact CG1-CD1 3.96Å; V10-I61 HydrophobicContact CG1-CG1 4.05Å; V14-I61 HydrophobicContact CG2-CD1 3.31Å; V14-I61 HydrophobicContact CG2-CG1 4.22Å; M53-I61 HydrophobicContact CE-CB 4.29Å; Y57-I61 HydrophobicContact CD1-CD1 3.28Å; Y57-I61 HydrophobicContact CD1-CG1 4.23Å; Y57-I61 HydrophobicContact CD2-CD1 3.88Å; Y57-I61 HydrophobicContact CE1-CD1 3.65Å; Y57-I61 HydrophobicContact CE2-CD1 4.21Å; Y57-I61 HydrophobicContact CG-CD1 3.41Å; Y57-I61 VanDerWaalsContact CG-CD1 3.41Å; Y57-I61 HydrophobicContact CG-CG1 4.33Å; Y57-I61 PolarHBondContact O-N 2.88Å; Y57-I61 VanDerWaalsContact O-N 3.09Å; I61-I63 HydrophobicContact CG2-CG1 4.41Å; I61-V87 HydrophobicContact CD1-CG2 4.25Å; I61-V87 HydrophobicContact CG2-CB 4.42Å; I61-V87 HydrophobicContact CG2-CG2 3.86Å
62W87.9Confident89.3Confident235 Ų23558.5 Ų58.589%0.8927%0.269SS*.PPolyproline II helixtrans-103.9124.8169.4-170.2-51000109.2
63I90.2Very high89.2Confident8 Ų860.3 Ų60.34%0.04128%0.28CS..PPolyproline II helixtrans-103.5125.5174.3-61.6173.1000109V30 M53 I61 D67 L69 I84 V87V30-I63 HydrophobicContact CB-CG2 4.29Å; V30-I63 HydrophobicContact CG1-CG2 4.13Å; V30-I63 HydrophobicContact CG2-CG2 3.63Å; M53-I63 HydrophobicContact CE-CD1 3.31Å; M53-I63 HydrophobicContact CE-CG1 3.81Å; M53-I63 HydrophobicContact SD-CD1 3.77Å; I61-I63 HydrophobicContact CG2-CG1 4.41Å; I63-D67 HydrophobicContact CG2-CB 4.17Å; I63-L69 HydrophobicContact CD1-CD1 4.01Å; I63-L69 HydrophobicContact CD1-CD2 3.87Å; I63-L69 HydrophobicContact CG1-CD2 4.27Å; I63-L69 HydrophobicContact CG2-CD1 4.38Å; I63-L69 HydrophobicContact CG2-CD2 4.27Å; I63-I84 HydrophobicContact CD1-CD1 3.78Å; I63-V87 HydrophobicContact CD1-CG2 4.03Å; I63-V87 HydrophobicContact CG1-CG1 4.42Å; I63-V87 HydrophobicContact CG1-CG2 4.05Å
64K89.8Confident89.1Confident105 Ų10562.9 Ų62.946%0.45729%0.293SS..PPolyproline II helixtrans-98.5166.2175.159.7170.4180-173.30111.3G66 D67K64-G66 PolarHBondContact O-N 3.22Å; K64-D67 WeakPolarHBondContact CE-OD1 2.78Å; K64-D67 WeakPolarHBondContact CG-OD1 3.03Å; K64-D67 WeakPolarHBondContact CG-OD2 3.48Å; K64-D67 PolarHBondContact N-OD2 3.24Å; K64-D67 WeakPolarHBondContact O-CB 3.28Å; K64-D67 PolarHBondContact O-N 3.4Å
65R91Very high88.6Confident171 Ų17172.1 Ų72.165%0.64534%0.335SS*.THydrogen-bonded Turntrans-62.5131.6172.6175.9171.6-176-170.42.9110.3L31 D67L31-R65 WeakPolarHBondContact O-CD 3.46Å; L31-R65 WeakPolarHBondContact O-CG 3.23Å; L31-R65 PolarHBondContact O-NE 3.07Å; R65-D67 VanDerWaalsContact C-N 3.35Å
66G88.6Confident88.2Confident12 Ų1276.8 Ų76.812%0.12435%0.347CS..THydrogen-bonded Turntrans853.4-178.300000114.6V30 K64V30-G66 WeakPolarHBondContact O-CA 3.32Å; V30-G66 PolarHBondContact O-N 3.17Å; K64-G66 PolarHBondContact O-N 3.22Å
67D90.8Very high87.7Confident29 Ų2974.3 Ų74.316%0.15534%0.343CS..  trans-69154.2167.3-77.4-12.8000110.9V30 I63 K64 R65V30-D67 WeakPolarHBondContact CG2-O 3.31Å; V30-D67 PolarHBondContact N-O 3.38Å; I63-D67 HydrophobicContact CG2-CB 4.17Å; K64-D67 WeakPolarHBondContact CE-OD1 2.78Å; K64-D67 WeakPolarHBondContact CG-OD1 3.03Å; K64-D67 WeakPolarHBondContact CG-OD2 3.48Å; K64-D67 PolarHBondContact N-OD2 3.24Å; K64-D67 WeakPolarHBondContact O-CB 3.28Å; K64-D67 PolarHBondContact O-N 3.4Å; R65-D67 VanDerWaalsContact C-N 3.35Å
68F91.1Very high87.3Confident22 Ų2282.6 Ų82.610%0.09638%0.381CS..EExtended strand (participates in β ladder)trans-103137.8175.4-61.1-78.6000109.6V28 R29 L88 V93 W102 F106V28-F68 WeakPolarHBondContact O-CA 3.42Å; R29-F68 HydrophobicContact CB-CD1 4.03Å; R29-F68 HydrophobicContact CB-CE1 3.98Å; R29-F68 HydrophobicContact CG-CD1 4.3Å; R29-F68 HydrophobicContact CG-CE1 4.01Å; F68-L88 HydrophobicContact CB-CB 4.13Å; F68-L88 HydrophobicContact CB-CD1 4.08Å; F68-L88 WeakPolarHBondContact O-CB 3.4Å; F68-L88 PolarHBondContact O-N 3.37Å; F68-V93 HydrophobicContact CD2-CG2 4.08Å; F68-W102 HydrophobicContact CB-CH2 3.92Å; F68-W102 AromaticContact CD1-CH2 3.7Å; F68-W102 HydrophobicContact CD1-CH2 3.7Å; F68-W102 AromaticContact CD1-CZ2 3.98Å; F68-W102 HydrophobicContact CD1-CZ2 3.98Å; F68-W102 AromaticContact CD2-CH2 3.74Å; F68-W102 HydrophobicContact CD2-CH2 3.74Å; F68-W102 HydrophobicContact CD2-CZ2 4.13Å; F68-W102 HydrophobicContact CE1-CH2 4.1Å; F68-W102 AromaticContact CE1-CZ2 3.88Å; F68-W102 HydrophobicContact CE1-CZ2 3.88Å; F68-W102 HydrophobicContact CE2-CH2 4.12Å; F68-W102 HydrophobicContact CE2-CZ2 4.02Å; F68-W102 AromaticContact CG-CH2 3.51Å; F68-W102 HydrophobicContact CG-CH2 3.51Å; F68-W102 HydrophobicContact CG-CZ2 4.1Å; F68-W102 HydrophobicContact CZ-CH2 4.28Å; F68-W102 AromaticContact CZ-CZ2 3.89Å; F68-W102 HydrophobicContact CZ-CZ2 3.89Å; F68-F106 HydrophobicContact CD1-CD1 4.33Å; F68-F106 HydrophobicContact CD1-CG 4.27Å; F68-F106 HydrophobicContact CE1-CB 3.67Å; F68-F106 AromaticContact CE1-CD1 3.65Å; F68-F106 HydrophobicContact CE1-CD1 3.65Å; F68-F106 HydrophobicContact CE1-CD2 4.49Å; F68-F106 HydrophobicContact CE1-CE1 4.41Å; F68-F106 AromaticContact CE1-CG 3.69Å; F68-F106 HydrophobicContact CE1-CG 3.69Å; F68-F106 HydrophobicContact CZ-CB 4.18Å
69L91.1Very high87.1Confident0 Ų085.3 Ų85.30%040%0.396CS..EExtended strand (participates in β ladder)trans-129.3150.2-176.9-54.7178.4000109.5I27 V28 V30 V41 I63 V71 I84 F86 V87I27-L69 WeakPolarHBondContact CA-O 3.41Å; V28-L69 HydrophobicContact CG2-CB 3.99Å; V28-L69 PolarHBondContact N-O 2.83Å; V28-L69 PolarHBondContact O-N 3.07Å; V30-L69 HydrophobicContact CG2-CD1 3.33Å; V30-L69 HydrophobicContact CG2-CD2 4.43Å; V30-L69 HydrophobicContact CG2-CG 3.65Å; V41-L69 HydrophobicContact CG1-CD1 4.3Å; I63-L69 HydrophobicContact CD1-CD1 4.01Å; I63-L69 HydrophobicContact CD1-CD2 3.87Å; I63-L69 HydrophobicContact CG1-CD2 4.27Å; I63-L69 HydrophobicContact CG2-CD1 4.38Å; I63-L69 HydrophobicContact CG2-CD2 4.27Å; L69-V71 HydrophobicContact CB-CG1 4.4Å; L69-I84 HydrophobicContact CB-CG2 4.4Å; L69-I84 HydrophobicContact CD1-CD1 3.74Å; L69-I84 HydrophobicContact CD1-CG1 3.94Å; L69-I84 HydrophobicContact CD1-CG2 4.21Å; L69-I84 HydrophobicContact CD2-CG2 4.28Å; L69-F86 WeakPolarHBondContact CA-O 3.41Å; L69-V87 HydrophobicContact CD2-CB 3.92Å; L69-V87 HydrophobicContact CD2-CG1 3.72Å; L69-V87 HydrophobicContact CD2-CG2 3.72Å
70I90.8Very high87.4Confident0 Ų078 Ų780%037%0.368CS..EExtended strand (participates in β ladder)trans-97.3127.9163.4-61.3-176.8000107.4I19 Q25 Q26 I27 S85 F86 L88I19-I70 HydrophobicContact CG2-CD1 3.61Å; Q25-I70 HydrophobicContact CB-CG2 3.65Å; Q25-I70 HydrophobicContact CG-CG2 3.79Å; Q26-I70 WeakPolarHBondContact O-CA 3.44Å; I27-I70 HydrophobicContact CG1-CG1 4.42Å; I70-S85 PolarHBondContact O-N 2.91Å; I70-F86 HydrophobicContact CB-CB 4.28Å; I70-F86 PolarHBondContact N-O 2.99Å; I70-F86 PolarHBondContact O-N 2.83Å; I70-L88 HydrophobicContact CD1-CD1 4.49Å; I70-L88 HydrophobicContact CD1-CD2 3.88Å; I70-L88 HydrophobicContact CD1-CG 4.46Å; I70-L88 HydrophobicContact CG1-CD1 3.94Å; I70-L88 HydrophobicContact CG1-CD2 4.02Å; I70-L88 HydrophobicContact CG1-CG 4.04Å
71V92.2Very high87.6Confident0 Ų080.8 Ų80.80%038%0.377CS..EExtended strand (participates in β ladder)trans-120.2142.4-179.5-61.10000111.2Q25 Q26 V28 F49 V51 L69 A82 E83 I84Q25-V71 WeakPolarHBondContact CA-O 2.91Å; Q26-V71 HydrophobicContact CB-CG2 4.17Å; Q26-V71 PolarHBondContact N-O 3.26Å; Q26-V71 WeakPolarHBondContact O-CG2 3.41Å; Q26-V71 PolarHBondContact O-N 2.92Å; V28-V71 HydrophobicContact CG1-CG2 3.7Å; V28-V71 HydrophobicContact CG2-CB 4.43Å; V28-V71 HydrophobicContact CG2-CG1 3.52Å; V28-V71 HydrophobicContact CG2-CG2 4.02Å; F49-V71 HydrophobicContact CZ-CG2 4.36Å; V51-V71 HydrophobicContact CB-CG1 4.45Å; V51-V71 HydrophobicContact CG1-CG1 4.06Å; L69-V71 HydrophobicContact CB-CG1 4.4Å; V71-A82 HydrophobicContact CB-CB 3.84Å; V71-A82 HydrophobicContact CG2-CB 4.02Å; V71-E83 CarbonylContact C-O 3.52Å; V71-E83 VanDerWaalsContact CA-O 3.24Å; V71-E83 WeakPolarHBondContact CA-O 3.2Å; V71-I84 HydrophobicContact CG1-CG1 4.33Å
72D91.5Very high87.9Confident51 Ų5179.1 Ų79.127%0.27337%0.369SS..EExtended strand (participates in β ladder)trans-98.7119.1171.8-69.7-49.1000108.3Q25 A82 E83 S85Q25-D72 WeakPolarHBondContact CG-OD1 3.46Å; Q25-D72 PolarHBondContact NE2-OD1 3.37Å; D72-A82 CarbonylContact O-C 3.48Å; D72-A82 WeakPolarHBondContact O-CA 3.5Å; D72-A82 VanDerWaalsContact O-CB 3.25Å; D72-A82 WeakPolarHBondContact O-CB 3.49Å; D72-E83 PolarHBondContact N-O 2.86Å; D72-E83 PolarHBondContact O-N 3.4Å; D72-S85 WeakPolarHBondContact OD2-CB 3.49Å; D72-S85 PolarHBondContact OD2-OG 2.88Å
73P90.8Very high88.1Confident68 Ų6871.5 Ų71.544%0.44234%0.343SS..EExtended strand (participates in β ladder)trans-66.1140.5-178.827.4-34000111.5Q24Q24-P73 WeakPolarHBondContact O-CD 3.11Å; Q24-P73 WeakPolarHBondContact O-CG 3.31Å
74I88.2Confident88.2Confident61 Ų6171.1 Ų71.131%0.31334%0.341SS..  trans-115.3114.6175.3-62.5166.9000107.7E76 G77 K81 E83I74-E76 VanDerWaalsContact C-N 3.25Å; I74-E76 HydrophobicContact CG2-CB 4.19Å; I74-E76 PolarHBondContact O-N 2.82Å; I74-G77 PolarHBondContact O-N 3.13Å; I74-K81 PolarHBondContact N-O 2.96Å; I74-E83 HydrophobicContact CD1-CB 3.71Å; I74-E83 HydrophobicContact CG1-CB 4.46Å
75E80Confident88.1Confident203 Ų20366.9 Ų66.995%0.94933%0.325SS*.THydrogen-bonded Turntrans-66.7-25.8-177.3-61.8-172.2155.600113.2G77E75-G77 VanDerWaalsContact C-N 3.28Å; E75-G77 PolarHBondContact O-N 2.66Å
76E79.9Confident88Confident189 Ų18960.8 Ų60.888%0.88330%0.303SS*.THydrogen-bonded Turntrans-78.7-6.8-175.1-59.9-178.2161.700114.1I74I74-E76 VanDerWaalsContact C-N 3.25Å; I74-E76 HydrophobicContact CG2-CB 4.19Å; I74-E76 PolarHBondContact O-N 2.82Å
77G74.5Confident88Confident24 Ų2460.7 Ų60.725%0.24730%0.3CS..  trans-92.6116.7-167.300000115.6I74 E75 V80I74-G77 PolarHBondContact O-N 3.13Å; E75-G77 VanDerWaalsContact C-N 3.28Å; E75-G77 PolarHBondContact O-N 2.66Å; G77-V80 WeakPolarHBondContact CA-O 2.81Å
78E79.2Confident87.8Confident173 Ų17359.6 Ų59.681%0.80829%0.294SS*.SBendtrans-73.4-61172.3-172.9-174.8-170.100111.3
79K84.4Confident87.5Confident161 Ų16160.9 Ų60.970%0.731%0.305SS*.SBendtrans-87.8-37-179.4-68.6-178.9-180174.30112.7L50L50-K79 WeakPolarHBondContact CB-O 3.44Å
80V90.6Very high87.1Confident38 Ų3867.7 Ų67.723%0.2334%0.335CS..EExtended strand (participates in β ladder)trans-109.9103.9-176-178.60000108.2L38 L50 G77L38-V80 HydrophobicContact CD1-CG2 4.47Å; L38-V80 HydrophobicContact CD2-CG1 4.36Å; L38-V80 HydrophobicContact CD2-CG2 3.76Å; L50-V80 HydrophobicContact CB-CG2 4.12Å; L50-V80 CarbonylContact O-C 3.57Å; L50-V80 VanDerWaalsContact O-CA 3.28Å; L50-V80 WeakPolarHBondContact O-CA 3.18Å; G77-V80 WeakPolarHBondContact CA-O 2.81Å
81K90.4Very high86.8Confident110 Ų11072.3 Ų72.348%0.47836%0.359SS..EExtended strand (participates in β ladder)trans-97.2-9.2-168.3-62.5-172.5176.5-176.80114.7F49 L50 I74F49-K81 HydrophobicContact CB-CB 4.26Å; F49-K81 HydrophobicContact CB-CD 3.95Å; F49-K81 HydrophobicContact CB-CG 4.18Å; F49-K81 HydrophobicContact CD2-CB 3.81Å; F49-K81 HydrophobicContact CE2-CB 4.44Å; F49-K81 HydrophobicContact CG-CB 4.2Å; F49-K81 HydrophobicContact CG-CD 4.41Å; L50-K81 PolarHBondContact O-N 3.29Å; I74-K81 PolarHBondContact N-O 2.96Å
82A92.7Very high86.4Confident2 Ų272.7 Ų72.72%0.01736%0.361CS..EExtended strand (participates in β ladder)trans-154.1164.6-179.500000111.8F49 V51 S52 V71 D72F49-A82 HydrophobicContact CD2-CB 4.49Å; F49-A82 HydrophobicContact CE2-CB 3.7Å; V51-A82 CarbonylContact C-O 3.53Å; V51-A82 WeakPolarHBondContact CA-O 3.46Å; V51-A82 WeakPolarHBondContact CB-O 3.19Å; V51-A82 HydrophobicContact CG1-CB 3.79Å; S52-A82 PolarHBondContact N-O 3.02Å; V71-A82 HydrophobicContact CB-CB 3.84Å; V71-A82 HydrophobicContact CG2-CB 4.02Å; D72-A82 CarbonylContact O-C 3.48Å; D72-A82 WeakPolarHBondContact O-CA 3.5Å; D72-A82 VanDerWaalsContact O-CB 3.25Å; D72-A82 WeakPolarHBondContact O-CB 3.49Å
83E92.7Very high86Confident75 Ų7571 Ų7135%0.3535%0.353SS..EExtended strand (participates in β ladder)trans-115142.6172.7176.7167-143.300110.6S52 P54 V71 D72 I74 S85S52-E83 WeakPolarHBondContact O-CA 3.28Å; P54-E83 VanDerWaalsContact CA-OE1 3.24Å; P54-E83 WeakPolarHBondContact CA-OE1 3.24Å; P54-E83 HydrophobicContact CB-CG 4.45Å; P54-E83 WeakPolarHBondContact CB-OE1 3.43Å; P54-E83 HydrophobicContact CG-CG 3.71Å; V71-E83 CarbonylContact C-O 3.52Å; V71-E83 VanDerWaalsContact CA-O 3.24Å; V71-E83 WeakPolarHBondContact CA-O 3.2Å; D72-E83 PolarHBondContact N-O 2.86Å; D72-E83 PolarHBondContact O-N 3.4Å; I74-E83 HydrophobicContact CD1-CB 3.71Å; I74-E83 HydrophobicContact CG1-CB 4.46Å; E83-S85 PolarHBondContact O-N 3.16Å
84I92.5Very high85.7Confident0 Ų075.1 Ų75.10%036%0.359CS..EExtended strand (participates in β ladder)trans-75.9109.9-177.7-60.6166.6000110H39 V51 S52 M53 P54 Y57 I63 L69 V71 V87H39-I84 HydrophobicContact CB-CD1 4.41Å; H39-I84 VanDerWaalsContact CD2-CD1 3.48Å; H39-I84 WeakPolarHBondContact CD2-CD1 3.43Å; V51-I84 HydrophobicContact CB-CG1 4.12Å; V51-I84 HydrophobicContact CG2-CD1 3.77Å; V51-I84 HydrophobicContact CG2-CG1 3.58Å; S52-I84 PolarHBondContact O-N 3.36Å; M53-I84 HydrophobicContact CB-CD1 4.32Å; M53-I84 HydrophobicContact SD-CB 4.35Å; M53-I84 HydrophobicContact SD-CD1 3.81Å; M53-I84 HydrophobicContact SD-CG2 4.4Å; P54-I84 WeakPolarHBondContact CD-O 3.21Å; P54-I84 WeakPolarHBondContact CG-O 3.25Å; Y57-I84 HydrophobicContact CD2-CG2 4.5Å; I63-I84 HydrophobicContact CD1-CD1 3.78Å; L69-I84 HydrophobicContact CB-CG2 4.4Å; L69-I84 HydrophobicContact CD1-CD1 3.74Å; L69-I84 HydrophobicContact CD1-CG1 3.94Å; L69-I84 HydrophobicContact CD1-CG2 4.21Å; L69-I84 HydrophobicContact CD2-CG2 4.28Å; V71-I84 HydrophobicContact CG1-CG1 4.33Å; I84-V87 HydrophobicContact CG2-CG2 4.4Å
85S88Confident85.4Confident16 Ų1674 Ų7411%0.11236%0.357CS..EExtended strand (participates in β ladder)trans-79.9-46178-147.20000112.3Q25 Y57 I70 D72 E83Q25-S85 PolarHBondContact NE2-OG 2.84Å; Y57-S85 WeakPolarHBondContact CE2-O 3.19Å; Y57-S85 VanDerWaalsContact CZ-O 3.23Å; Y57-S85 PolarHBondContact OH-O 3.25Å; I70-S85 PolarHBondContact O-N 2.91Å; D72-S85 WeakPolarHBondContact OD2-CB 3.49Å; D72-S85 PolarHBondContact OD2-OG 2.88Å; E83-S85 PolarHBondContact O-N 3.16Å
86F87.2Confident85.5Confident43 Ų4364.5 Ų64.519%0.18931%0.313CS..EExtended strand (participates in β ladder)trans-146.2148.9-177.3-67.5-85.3000112.2E13 I19 L69 I70E13-F86 HydrophobicContact CB-CE1 4.35Å; I19-F86 HydrophobicContact CD1-CB 4.16Å; I19-F86 HydrophobicContact CD1-CD1 3.9Å; I19-F86 HydrophobicContact CD1-CG 4.12Å; I19-F86 HydrophobicContact CG2-CD2 4.14Å; I19-F86 HydrophobicContact CG2-CG 4.24Å; L69-F86 WeakPolarHBondContact CA-O 3.41Å; I70-F86 HydrophobicContact CB-CB 4.28Å; I70-F86 PolarHBondContact N-O 2.99Å; I70-F86 PolarHBondContact O-N 2.83Å
87V88.7Confident85.7Confident9 Ų959.7 Ų59.76%0.05529%0.29CS..EExtended strand (participates in β ladder)trans-101.2122173.3-1760000108.6I61 I63 L69 I84I61-V87 HydrophobicContact CD1-CG2 4.25Å; I61-V87 HydrophobicContact CG2-CB 4.42Å; I61-V87 HydrophobicContact CG2-CG2 3.86Å; I63-V87 HydrophobicContact CD1-CG2 4.03Å; I63-V87 HydrophobicContact CG1-CG1 4.42Å; I63-V87 HydrophobicContact CG1-CG2 4.05Å; L69-V87 HydrophobicContact CD2-CB 3.92Å; L69-V87 HydrophobicContact CD2-CG1 3.72Å; L69-V87 HydrophobicContact CD2-CG2 3.72Å; I84-V87 HydrophobicContact CG2-CG2 4.4Å
88L87.5Confident86.1Confident7 Ų767.2 Ų67.24%0.03732%0.316CS..EExtended strand (participates in β ladder)trans-86.3120.6-176.6-62.2174.3000110.9I27 F68 I70 H92 V93 L96 W102I27-L88 HydrophobicContact CG2-CD1 4.2Å; F68-L88 HydrophobicContact CB-CB 4.13Å; F68-L88 HydrophobicContact CB-CD1 4.08Å; F68-L88 WeakPolarHBondContact O-CB 3.4Å; F68-L88 PolarHBondContact O-N 3.37Å; I70-L88 HydrophobicContact CD1-CD1 4.49Å; I70-L88 HydrophobicContact CD1-CD2 3.88Å; I70-L88 HydrophobicContact CD1-CG 4.46Å; I70-L88 HydrophobicContact CG1-CD1 3.94Å; I70-L88 HydrophobicContact CG1-CD2 4.02Å; I70-L88 HydrophobicContact CG1-CG 4.04Å; L88-H92 HydrophobicContact CB-CB 4.4Å; L88-H92 HydrophobicContact CD2-CB 3.72Å; L88-V93 HydrophobicContact CB-CG2 4.23Å; L88-L96 HydrophobicContact CD1-CD1 3.73Å; L88-L96 HydrophobicContact CD2-CD1 3.78Å; L88-L96 HydrophobicContact CG-CD1 4.38Å; L88-W102 HydrophobicContact CD1-CZ3 4.11Å
89C84Confident86.1Confident48 Ų4862.4 Ų62.432%0.32429%0.294SS..PPolyproline II helixtrans-82.6168.7168.3-62.20000110.7D91 H92 V93C89-D91 PolarHBondContact O-N 2.94Å; C89-D91 VanDerWaalsContact O-N 3.17Å; C89-H92 PolarHBondContact N-ND1 3.34Å; C89-H92 PolarHBondContact O-N 3.3Å; C89-H92 VanDerWaalsContact O-N 3.07Å; C89-V93 WeakPolarHBondContact O-CG2 3.49Å; C89-V93 PolarHBondContact O-N 3.03Å
90K83.7Confident85.9Confident143 Ų14357.7 Ų57.762%0.62229%0.291SS*.Hα-helixtrans-54.8-36179.6-65.6180177.4-177.80112.5V93 R94K90-V93 PolarHBondContact O-N 3.48Å; K90-R94 WeakPolarHBondContact O-CG 3.47Å; K90-R94 PolarHBondContact O-N 2.95Å; K90-R94 VanDerWaalsContact O-N 3.12Å
91D84.3Confident85.2Confident97 Ų9761.2 Ų61.252%0.51930%0.303SS..Hα-helixtrans-70.5-37179.4-58.2-68.5000112.6C89 R94 S95C89-D91 PolarHBondContact O-N 2.94Å; C89-D91 VanDerWaalsContact O-N 3.17Å; D91-R94 PolarHBondContact O-N 3.25Å; D91-S95 PolarHBondContact O-N 3.43Å; D91-S95 PolarHBondContact O-OG 3Å
92H83.5Confident84.7Confident8 Ų857.1 Ų57.14%0.03729%0.285CS..Hα-helixtrans-67.6-42.7173.4-52.4137.6000111.1V14 G16 L88 C89 R94 S95 L96V14-H92 PolarHBondContact O-CE1 2.9Å; G16-H92 PolarHBondContact O-NE2 3.35Å; L88-H92 HydrophobicContact CB-CB 4.4Å; L88-H92 HydrophobicContact CD2-CB 3.72Å; C89-H92 PolarHBondContact N-ND1 3.34Å; C89-H92 PolarHBondContact O-N 3.3Å; C89-H92 VanDerWaalsContact O-N 3.07Å; H92-R94 VanDerWaalsContact C-N 3.26Å; H92-R94 PolarHBondContact O-N 3.24Å; H92-S95 PolarHBondContact O-N 3.32Å; H92-L96 HydrophobicContact CB-CD1 4.48Å; H92-L96 WeakPolarHBondContact O-CB 3.2Å; H92-L96 WeakPolarHBondContact O-CD1 3.37Å; H92-L96 WeakPolarHBondContact O-CG 3.17Å; H92-L96 PolarHBondContact O-N 3.19Å
93V83.8Confident83.9Confident16 Ų1658.5 Ų58.510%0.09729%0.294CS..Hα-helixtrans-57.3-43.1176.9175.50000110.7F68 L88 C89 K90 S95 Q97 W102F68-V93 HydrophobicContact CD2-CG2 4.08Å; L88-V93 HydrophobicContact CB-CG2 4.23Å; C89-V93 WeakPolarHBondContact O-CG2 3.49Å; C89-V93 PolarHBondContact O-N 3.03Å; K90-V93 PolarHBondContact O-N 3.48Å; V93-S95 PolarHBondContact O-N 2.99Å; V93-Q97 WeakPolarHBondContact O-CB 3.4Å; V93-Q97 WeakPolarHBondContact O-CG 3.34Å; V93-Q97 PolarHBondContact O-N 3.12Å; V93-W102 HydrophobicContact CB-CH2 4.15Å; V93-W102 HydrophobicContact CB-CZ3 4.17Å; V93-W102 HydrophobicContact CG1-CD2 4.27Å; V93-W102 HydrophobicContact CG1-CE3 4.17Å; V93-W102 HydrophobicContact CG1-CH2 3.58Å; V93-W102 HydrophobicContact CG1-CZ2 3.68Å; V93-W102 HydrophobicContact CG1-CZ3 3.84Å; V93-W102 HydrophobicContact CG2-CH2 3.63Å; V93-W102 HydrophobicContact CG2-CZ2 4.48Å; V93-W102 HydrophobicContact CG2-CZ3 3.83Å
94R83.1Confident82.9Confident154 Ų15463.1 Ų63.158%0.58132%0.315SS*.Hα-helixtrans-63.5-38.8175.5-72.8171.9175.3-178.7-4.4112.7K90 D91 H92 K98K90-R94 WeakPolarHBondContact O-CG 3.47Å; K90-R94 PolarHBondContact O-N 2.95Å; K90-R94 VanDerWaalsContact O-N 3.12Å; D91-R94 PolarHBondContact O-N 3.25Å; H92-R94 VanDerWaalsContact C-N 3.26Å; H92-R94 PolarHBondContact O-N 3.24Å; R94-K98 WeakPolarHBondContact O-CG 3.31Å; R94-K98 PolarHBondContact O-N 3.35Å; R94-K98 VanDerWaalsContact O-N 3.15Å
95S82.3Confident82.1Confident38 Ų3865.6 Ų65.627%0.26634%0.336SS..Hα-helixtrans-70.1-44.7179.4-55.50000111.4D91 H92 V93 Q97 K98 E99D91-S95 PolarHBondContact O-N 3.43Å; D91-S95 PolarHBondContact O-OG 3Å; H92-S95 PolarHBondContact O-N 3.32Å; V93-S95 PolarHBondContact O-N 2.99Å; S95-Q97 VanDerWaalsContact C-N 3.3Å; S95-Q97 PolarHBondContact O-N 2.83Å; S95-K98 WeakPolarHBondContact O-CB 3.44Å; S95-K98 PolarHBondContact O-N 2.99Å; S95-E99 PolarHBondContact O-N 3.29Å
96L83.1Confident81.4Confident3 Ų365.1 Ų65.12%0.01633%0.332CS..Hα-helixtrans-60.2-37.3173.9-75.8155.6000112.7P21 I27 L88 H92 E99 G100 F101 W102P21-L96 HydrophobicContact CG-CD2 4.19Å; I27-L96 HydrophobicContact CD1-CD1 4.46Å; I27-L96 HydrophobicContact CD1-CD2 4.28Å; L88-L96 HydrophobicContact CD1-CD1 3.73Å; L88-L96 HydrophobicContact CD2-CD1 3.78Å; L88-L96 HydrophobicContact CG-CD1 4.38Å; H92-L96 HydrophobicContact CB-CD1 4.48Å; H92-L96 WeakPolarHBondContact O-CB 3.2Å; H92-L96 WeakPolarHBondContact O-CD1 3.37Å; H92-L96 WeakPolarHBondContact O-CG 3.17Å; H92-L96 PolarHBondContact O-N 3.19Å; L96-E99 PolarHBondContact O-N 3.05Å; L96-G100 PolarHBondContact O-N 2.96Å; L96-G100 VanDerWaalsContact O-N 3.09Å; L96-F101 HydrophobicContact CD2-CB 4.16Å; L96-F101 PolarHBondContact O-N 3.42Å; L96-W102 HydrophobicContact CB-CE3 3.97Å; L96-W102 HydrophobicContact CD1-CE3 4.3Å; L96-W102 HydrophobicContact CD1-CZ3 4.24Å
97Q83.4Confident80.4Confident89 Ų8965.4 Ų65.442%0.41634%0.339SS..Hα-helixtrans-65.9-38.5173.9-77173.88.500112.2V93 S95 G100 W102V93-Q97 WeakPolarHBondContact O-CB 3.4Å; V93-Q97 WeakPolarHBondContact O-CG 3.34Å; V93-Q97 PolarHBondContact O-N 3.12Å; S95-Q97 VanDerWaalsContact C-N 3.3Å; S95-Q97 PolarHBondContact O-N 2.83Å; Q97-G100 PolarHBondContact O-N 2.94Å; Q97-W102 HydrophobicContact CB-CB 4.4Å; Q97-W102 HydrophobicContact CG-CB 3.69Å; Q97-W102 HydrophobicContact CG-CD2 4.09Å; Q97-W102 HydrophobicContact CG-CG 3.54Å
98K82.9Confident79Confident181 Ų18171.3 Ų71.379%0.78737%0.366SS*.Hα-helixtrans-69-35.5176.2-71.6175.5-176.4-178.40112.5R94 S95 G100R94-K98 WeakPolarHBondContact O-CG 3.31Å; R94-K98 PolarHBondContact O-N 3.35Å; R94-K98 VanDerWaalsContact O-N 3.15Å; S95-K98 WeakPolarHBondContact O-CB 3.44Å; S95-K98 PolarHBondContact O-N 2.99Å; K98-G100 VanDerWaalsContact C-N 3.32Å
99E80.6Confident77.6Confident73 Ų7372.4 Ų72.434%0.34137%0.373SS..Hα-helixtrans-79.5-14.5178.8-71.1170.6-15300113.3H18 S95 L96 F101H18-E99 IonicContact CE1-OE1 3.81Å; H18-E99 PolarHBondContact CE1-OE1 3.21Å; H18-E99 IonicContact CE1-OE2 2.98Å; H18-E99 IonicContact ND1-OE1 2.89Å; H18-E99 PolarHBondContact ND1-OE1 3.03Å; H18-E99 VanDerWaalsContact ND1-OE1 3.14Å; S95-E99 PolarHBondContact O-N 3.29Å; L96-E99 PolarHBondContact O-N 3.05Å; E99-F101 HydrophobicContact CB-CD2 3.76Å; E99-F101 HydrophobicContact CB-CE2 4.17Å
100G78.3Confident76.3Confident62 Ų6272 Ų7264%0.63937%0.373SS*.THydrogen-bonded Turntrans85.97.3176.800000115L96 Q97 K98 W102L96-G100 PolarHBondContact O-N 2.96Å; L96-G100 VanDerWaalsContact O-N 3.09Å; Q97-G100 PolarHBondContact O-N 2.94Å; K98-G100 VanDerWaalsContact C-N 3.32Å; G100-W102 VanDerWaalsContact C-N 3.29Å
101F76.3Confident74.9Confident111 Ų11172.7 Ų72.749%0.48738%0.379SS..  trans-84.4-0.2175.9-67-73.2000113.6V20 P21 L96 E99V20-F101 HydrophobicContact CG1-CE2 4.39Å; P21-F101 HydrophobicContact CG-CB 4.07Å; P21-F101 HydrophobicContact CG-CD1 4.42Å; P21-F101 HydrophobicContact CG-CG 4.23Å; L96-F101 HydrophobicContact CD2-CB 4.16Å; L96-F101 PolarHBondContact O-N 3.42Å; E99-F101 HydrophobicContact CB-CD2 3.76Å; E99-F101 HydrophobicContact CB-CE2 4.17Å
102W80.5Confident73.5Confident24 Ų2474.4 Ų74.49%0.09138%0.382CS..SBendtrans-81.3124.1-177.5-167.8-100.8000112.3I27 F68 L88 V93 L96 Q97 G100 E104 F106I27-W102 HydrophobicContact CD1-CE3 4.24Å; I27-W102 HydrophobicContact CD1-CZ3 4.44Å; I27-W102 HydrophobicContact CG2-CH2 4.36Å; I27-W102 HydrophobicContact CG2-CZ3 4.04Å; F68-W102 HydrophobicContact CB-CH2 3.92Å; F68-W102 AromaticContact CD1-CH2 3.7Å; F68-W102 HydrophobicContact CD1-CH2 3.7Å; F68-W102 AromaticContact CD1-CZ2 3.98Å; F68-W102 HydrophobicContact CD1-CZ2 3.98Å; F68-W102 AromaticContact CD2-CH2 3.74Å; F68-W102 HydrophobicContact CD2-CH2 3.74Å; F68-W102 HydrophobicContact CD2-CZ2 4.13Å; F68-W102 HydrophobicContact CE1-CH2 4.1Å; F68-W102 AromaticContact CE1-CZ2 3.88Å; F68-W102 HydrophobicContact CE1-CZ2 3.88Å; F68-W102 HydrophobicContact CE2-CH2 4.12Å; F68-W102 HydrophobicContact CE2-CZ2 4.02Å; F68-W102 AromaticContact CG-CH2 3.51Å; F68-W102 HydrophobicContact CG-CH2 3.51Å; F68-W102 HydrophobicContact CG-CZ2 4.1Å; F68-W102 HydrophobicContact CZ-CH2 4.28Å; F68-W102 AromaticContact CZ-CZ2 3.89Å; F68-W102 HydrophobicContact CZ-CZ2 3.89Å; L88-W102 HydrophobicContact CD1-CZ3 4.11Å; V93-W102 HydrophobicContact CB-CH2 4.15Å; V93-W102 HydrophobicContact CB-CZ3 4.17Å; V93-W102 HydrophobicContact CG1-CD2 4.27Å; V93-W102 HydrophobicContact CG1-CE3 4.17Å; V93-W102 HydrophobicContact CG1-CH2 3.58Å; V93-W102 HydrophobicContact CG1-CZ2 3.68Å; V93-W102 HydrophobicContact CG1-CZ3 3.84Å; V93-W102 HydrophobicContact CG2-CH2 3.63Å; V93-W102 HydrophobicContact CG2-CZ2 4.48Å; V93-W102 HydrophobicContact CG2-CZ3 3.83Å; L96-W102 HydrophobicContact CB-CE3 3.97Å; L96-W102 HydrophobicContact CD1-CE3 4.3Å; L96-W102 HydrophobicContact CD1-CZ3 4.24Å; Q97-W102 HydrophobicContact CB-CB 4.4Å; Q97-W102 HydrophobicContact CG-CB 3.69Å; Q97-W102 HydrophobicContact CG-CD2 4.09Å; Q97-W102 HydrophobicContact CG-CG 3.54Å; G100-W102 VanDerWaalsContact C-N 3.29Å; W102-E104 PolarHBondContact O-N 2.84Å; W102-F106 HydrophobicContact CZ2-CB 3.72Å
103P76Confident72.1Confident32 Ų3277.6 Ų77.621%0.20840%0.396CS..  trans-69.1129.7177.5-12.825.9000111.3I27 A44 A105 F106I27-P103 HydrophobicContact CB-CG 4.4Å; A44-P103 HydrophobicContact CB-CB 3.6Å; A44-P103 HydrophobicContact CB-CG 4.1Å; P103-A105 PolarHBondContact O-N 3.01Å; P103-A105 VanDerWaalsContact O-N 3.15Å; P103-F106 HydrophobicContact CB-CD2 3.81Å; P103-F106 HydrophobicContact CB-CE2 4.2Å; P103-F106 HydrophobicContact CG-CD2 3.67Å; P103-F106 HydrophobicContact CG-CE2 3.88Å; P103-F106 PolarHBondContact O-N 2.79Å
104E72Confident70.6Confident171 Ų17181.9 Ų81.980%0.79942%0.419SS*.Hα-helixtrans-56.5-33179.9-171.1174.1-173.700112.9W102 F106 S107W102-E104 PolarHBondContact O-N 2.84Å; E104-F106 PolarHBondContact O-N 3.29Å; E104-S107 WeakPolarHBondContact O-CB 3.48Å; E104-S107 PolarHBondContact O-N 3.15Å
105A74.2Confident69Low53 Ų5380.5 Ų80.544%0.43842%0.423SS..Hα-helixtrans-54.3-26.1176.500000113.8A44 P103A44-A105 HydrophobicContact CB-CB 4.18Å; A44-A105 WeakPolarHBondContact O-CB 3.43Å; P103-A105 PolarHBondContact O-N 3.01Å; P103-A105 VanDerWaalsContact O-N 3.15Å
106F74.2Confident67.6Low5 Ų588 Ų882%0.02245%0.445CS..Hα-helixtrans-93.9-16.3178.9-64.5-53.8000114I27 R29 E42 A44 F68 W102 P103 E104 V109 A110I27-F106 HydrophobicContact CG2-CD2 4.37Å; I27-F106 HydrophobicContact CG2-CE2 4.21Å; I27-F106 WeakPolarHBondContact O-CE2 3.28Å; R29-F106 HydrophobicContact CB-CD1 3.99Å; R29-F106 HydrophobicContact CB-CE1 3.49Å; R29-F106 VanDerWaalsContact CB-CE1 3.49Å; R29-F106 HydrophobicContact CB-CZ 4.23Å; E42-F106 WeakPolarHBondContact O-CZ 3.37Å; A44-F106 HydrophobicContact CB-CE2 3.91Å; A44-F106 HydrophobicContact CB-CZ 4.31Å; F68-F106 HydrophobicContact CD1-CD1 4.33Å; F68-F106 HydrophobicContact CD1-CG 4.27Å; F68-F106 HydrophobicContact CE1-CB 3.67Å; F68-F106 AromaticContact CE1-CD1 3.65Å; F68-F106 HydrophobicContact CE1-CD1 3.65Å; F68-F106 HydrophobicContact CE1-CD2 4.49Å; F68-F106 HydrophobicContact CE1-CE1 4.41Å; F68-F106 AromaticContact CE1-CG 3.69Å; F68-F106 HydrophobicContact CE1-CG 3.69Å; F68-F106 HydrophobicContact CZ-CB 4.18Å; W102-F106 HydrophobicContact CZ2-CB 3.72Å; P103-F106 HydrophobicContact CB-CD2 3.81Å; P103-F106 HydrophobicContact CB-CE2 4.2Å; P103-F106 HydrophobicContact CG-CD2 3.67Å; P103-F106 HydrophobicContact CG-CE2 3.88Å; P103-F106 PolarHBondContact O-N 2.79Å; E104-F106 PolarHBondContact O-N 3.29Å; F106-V109 PolarHBondContact O-N 3.32Å; F106-A110 PolarHBondContact O-N 3.21Å
107S65.4Low66.1Low49 Ų4994 Ų9434%0.34348%0.477SS..Hα-helixtrans-64.6-42.8179.2-62.50000111.7E104 V109 A110E104-S107 WeakPolarHBondContact O-CB 3.48Å; E104-S107 PolarHBondContact O-N 3.15Å; S107-V109 VanDerWaalsContact C-N 3.25Å; S107-V109 PolarHBondContact O-N 2.98Å; S107-A110 PolarHBondContact O-N 3.23Å
108E60.6Low64.6Low133 Ų13399.9 Ų99.962%0.62150%0.496SS*.Hα-helixtrans-67.5-27.9-180-158.4-166.8114.500112.9K112E108-K112 IonicContact OE1-NZ 3.13Å; E108-K112 PolarHBondContact OE1-NZ 3.09Å
109V58.7Low62.9Low30 Ų3099.2 Ų99.218%0.18250%0.496CS..Hα-helixtrans-81.7-33.4-177.21770000111.8F106 S107 E111 K112 H113F106-V109 PolarHBondContact O-N 3.32Å; S107-V109 VanDerWaalsContact C-N 3.25Å; S107-V109 PolarHBondContact O-N 2.98Å; V109-E111 PolarHBondContact O-N 3.46Å; V109-K112 PolarHBondContact O-N 3.45Å; V109-H113 PolarHBondContact O-N 3.01Å
110A56.6Low61.1Low40 Ų40101.4 Ų101.433%0.33151%0.514SS..Hα-helixtrans-59.6-37-179.700000111.9F106 S107F106-A110 PolarHBondContact O-N 3.21Å; S107-A110 PolarHBondContact O-N 3.23Å
111E53.9Low59.6Low157 Ų157106.6 Ų106.673%0.73452%0.522SS*.Hα-helixtrans-61.6-45176.1-66.4-96.5102.200111.7V109V109-E111 PolarHBondContact O-N 3.46Å
112K54.3Low58Low134 Ų134106.8 Ų106.858%0.58353%0.534SS*.Hα-helixtrans-73.1-30.9-175.2-67.1173.5-177.1160.60113E108 V109E108-K112 IonicContact OE1-NZ 3.13Å; E108-K112 PolarHBondContact OE1-NZ 3.09Å; V109-K112 PolarHBondContact O-N 3.45Å
113H53.1Low56.2Low74 Ų74114.8 Ų114.834%0.34357%0.573SS.*Hα-helixtrans-77.9-21.9-177.1-101.5-114.5000114.1V109 N115V109-H113 PolarHBondContact O-N 3.01Å; H113-N115 VanDerWaalsContact C-N 3.34Å
114N52.6Low55Low107 Ų107120.8 Ų120.857%0.57260%0.602SS**Hα-helixtrans-71.5-30.8179.4-152.711.4000112.1
115N49.8Very low53.9Low124 Ų124118.4 Ų118.466%0.66360%0.601SS**Hα-helixtrans-76.4-30.4-179.4-91.69.9000114.1H113 N117H113-N115 VanDerWaalsContact C-N 3.34Å; N115-N117 VanDerWaalsContact C-N 3.32Å; N115-N117 PolarHBondContact O-N 3.1Å
116R53.7Low52.6Low196 Ų196120.6 Ų120.674%0.7462%0.619SS**Hα-helixtrans-75.8-20.6-173.5-135.9174.3-167.2169.63.8113.8
117N52.1Low51.7Low128 Ų128129 Ų12968%0.68466%0.658SS**THydrogen-bonded Turntrans-91.90.4-176.6-145.444.3000113.9N115N115-N117 VanDerWaalsContact C-N 3.32Å; N115-N117 PolarHBondContact O-N 3.1Å
118R50.3Low50.8Low214 Ų214131.7 Ų131.781%0.80868%0.675SS**SBendtrans-90.1-14.7171.1-83.1-172.3171.5-177.9-3113.6
119Q48.2Very low49.7Very low167 Ų167134.5 Ų134.578%0.7869%0.688SS**THydrogen-bonded Turntrans-9413.6-171.8-89.6173.2-21.800115.1
120T42.9Very low49Very low119 Ų119140.6 Ų140.673%0.7372%0.719SS**THydrogen-bonded Turntrans-131.913.8-177.7-200000114.7
121Q45.6Very low48.2Very low170 Ų170144.2 Ų144.279%0.79474%0.742SS**SBendtrans-89.4126157.5-96.8-176.728.100107.6E123Q121-E123 PolarHBondContact O-N 2.89Å; Q121-E123 VanDerWaalsContact O-N 3.1Å
122P42.8Very low47.6Very low116 Ų116139.8 Ų139.875%0.75374%0.738SS**  trans-60115.3162-2.517000106.1L124P122-L124 VanDerWaalsContact C-N 3.34Å; P122-L124 PolarHBondContact O-N 3.25Å
123E43.5Very low46.9Very low192 Ų192141.7 Ų141.790%0.89775%0.749SS**  trans-55.3102.3166.7-89.1177.877.300107.4Q121Q121-E123 PolarHBondContact O-N 2.89Å; Q121-E123 VanDerWaalsContact O-N 3.1Å
124L50.9Low46.4Very low158 Ų158146.4 Ų146.483%0.82777%0.771SS**PPolyproline II helixtrans-62.8129162.2-75.2163000106.6P122 A126P122-L124 VanDerWaalsContact C-N 3.34Å; P122-L124 PolarHBondContact O-N 3.25Å; L124-A126 PolarHBondContact O-N 3.01Å
125P47.6Very low46.2Very low121 Ų121146.8 Ų146.879%0.78678%0.782SS**PPolyproline II helixtrans-56.3130.8179.2-20.730.9000110.1E127P125-E127 PolarHBondContact O-N 3.29Å
126A46.8Very low46.1Very low98 Ų98145.9 Ų145.981%0.8179%0.786SS**PPolyproline II helixtrans-55.8121.5176.600000110.3L124L124-A126 PolarHBondContact O-N 3.01Å
127E56.5Low46.2Very low181 Ų181141.8 Ų141.885%0.84679%0.787SS**PPolyproline II helixtrans-60.6129173-65.1-173.498.900109.5P125 Q129P125-E127 PolarHBondContact O-N 3.29Å; E127-Q129 PolarHBondContact O-N 3.23Å
128P47.2Very low46.4Very low106 Ų106145.5 Ų145.569%0.68880%0.801SS**PPolyproline II helixtrans-69.5127.4176.128-30.3000109.4L130P128-L130 PolarHBondContact O-N 3.26Å
129Q36.6Very low46.9Very low192 Ų192141 Ų14190%0.89779%0.792SS**  trans-62.6114.7168.4-58.8-169.9-48.800108.7E127E127-Q129 PolarHBondContact O-N 3.23Å
130L44.5Very low47.9Very low159 Ų159139 Ų13983%0.83279%0.787SS**  trans-123.688.9168.8-80165000109.4P128P128-L130 PolarHBondContact O-N 3.26Å
131S39Very low49.1Very low116 Ų116137.4 Ų137.481%0.81178%0.781SS**  trans-53.8133.4146.2500000110.2
132G41.9Very low50.4Low64 Ų64137 Ų13766%0.6678%0.784SS**  trans143.185.7170.600000111.8
133E39.7Very low51.9Low173 Ų173136.6 Ų136.681%0.80878%0.775SS**  25.9141124.7-43.4-177.712400117.8
134E41.9Very low53.5Low174 Ų174136.6 Ų136.681%0.81377%0.772SS**  trans82.1109161.6-25.6-69.47100119.4
135S48.8Very low54.6Low114 Ų114134.2 Ų134.280%0.79776%0.764SS**  trans84.5101.8131.6-162.90000121.2
136S48Very low56.1Low106 Ų106132.9 Ų132.974%0.74175%0.751SS**  51.3104.3122.1-178.40000119.6
137S55.6Low57.7Low110 Ų110135 Ų13577%0.76975%0.754SS**  168.3141.9109.752.10000110.2D139S137-D139 PolarHBondContact O-N 3.32Å; S137-D139 VanDerWaalsContact O-N 3.11Å
138E56Low59Low206 Ų206133.6 Ų133.696%0.96375%0.752SS**  trans-72.591.7-172.9-62.5168.699.800111.5
139D61.7Low60.6Low118 Ų118137.7 Ų137.763%0.63175%0.753SS**  trans-12880.3172-164.117.6000110.8S137 S141S137-D139 PolarHBondContact O-N 3.32Å; S137-D139 VanDerWaalsContact O-N 3.11Å; D139-S141 PolarHBondContact O-N 3.11Å; D139-S141 VanDerWaalsContact O-N 3.15Å; D139-S141 WeakPolarHBondContact OD1-CB 3.18Å; D139-S141 PolarHBondContact OD1-OG 3.3Å; D139-S141 PolarHBondContact OD2-OG 3.17Å; D139-S141 VanDerWaalsContact OD2-OG 3.11Å
140D68.9Low62.6Low127 Ų127138.3 Ų138.368%0.67975%0.748SS**G310 helixtrans-74.617.5172.8-95.4-40.2000112.6D142 L143D140-D142 PolarHBondContact O-N 3.15Å; D140-L143 HydrophobicContact CB-CD1 4.25Å; D140-L143 PolarHBondContact O-N 3.31Å; D140-L143 WeakPolarHBondContact OD1-CD1 3.49Å; D140-L143 WeakPolarHBondContact OD1-CG 3.1Å
141S68.2Low64.1Low85 Ų85139 Ų13959%0.59475%0.747SS**G310 helixtrans-71.2-13.9-179.862.30000114.1D139D139-S141 PolarHBondContact O-N 3.11Å; D139-S141 VanDerWaalsContact O-N 3.15Å; D139-S141 WeakPolarHBondContact OD1-CB 3.18Å; D139-S141 PolarHBondContact OD1-OG 3.3Å; D139-S141 PolarHBondContact OD2-OG 3.17Å; D139-S141 VanDerWaalsContact OD2-OG 3.11Å
142D71.6Confident65.8Low161 Ų161142.9 Ų142.986%0.86175%0.745SS**G310 helixtrans-92.10.4175.5-99.2-12.1000114.2D140D140-D142 PolarHBondContact O-N 3.15Å
143L76Confident67Low107 Ų107148.3 Ų148.356%0.5675%0.753SS**SBendtrans-76.2127.8172.9-67.8-174000110.9D140 V145D140-L143 HydrophobicContact CB-CD1 4.25Å; D140-L143 PolarHBondContact O-N 3.31Å; D140-L143 WeakPolarHBondContact OD1-CD1 3.49Å; D140-L143 WeakPolarHBondContact OD1-CG 3.1Å; L143-V145 PolarHBondContact O-N 3.11Å; L143-V145 VanDerWaalsContact O-N 3.17Å
144F75.8Confident68Low193 Ų193148.6 Ų148.685%0.84675%0.754SS**PPolyproline II helixtrans-56123.5173.144.8-93.7000110.7N146F144-N146 PolarHBondContact O-N 2.64Å
145V74.8Confident68.7Low108 Ų108144.4 Ų144.466%0.65574%0.744SS**PPolyproline II helixtrans-70.9121.5177.9-175.30000109L143 T147L143-V145 PolarHBondContact O-N 3.11Å; L143-V145 VanDerWaalsContact O-N 3.17Å; V145-T147 PolarHBondContact O-N 3Å
146N78.3Confident68.8Low93 Ų93148.1 Ų148.150%0.49775%0.749SS.*  trans-65.2100.7173.3-179.2-2.7000110.2F144 N148 R149F144-N146 PolarHBondContact O-N 2.64Å; N146-N148 PolarHBondContact O-N 3.01Å; N146-N148 VanDerWaalsContact O-N 3.11Å; N146-N148 WeakPolarHBondContact OD1-CB 3.39Å; N146-N148 PolarHBondContact OD1-N 3.11Å; N146-R149 HydrophobicContact CB-CB 4.34Å; N146-R149 WeakPolarHBondContact O-CB 3.39Å; N146-R149 PolarHBondContact O-N 2.94Å
147T80.3Confident69.2Low143 Ų143151.4 Ų151.488%0.87775%0.752SS**THydrogen-bonded Turntrans-65.3-11.8-179.5560000114.2V145V145-T147 PolarHBondContact O-N 3Å
148N84.2Confident69.1Low151 Ų151155.2 Ų155.281%0.80776%0.758SS**THydrogen-bonded Turntrans-90.30.9173.9-155.544.9000112.9N146N146-N148 PolarHBondContact O-N 3.01Å; N146-N148 VanDerWaalsContact O-N 3.11Å; N146-N148 WeakPolarHBondContact OD1-CB 3.39Å; N146-N148 PolarHBondContact OD1-N 3.11Å
149R80.4Confident69.4Low191 Ų191151 Ų15172%0.72175%0.752SS**SBendtrans-97.1124.9175.1-179.6174.7-74.7-148.4-0.5109.9N146 Q151N146-R149 HydrophobicContact CB-CB 4.34Å; N146-R149 WeakPolarHBondContact O-CB 3.39Å; N146-R149 PolarHBondContact O-N 2.94Å; R149-Q151 PolarHBondContact O-N 3.32Å
150R80Confident69.3Low205 Ų205154.1 Ų154.177%0.77476%0.762SS**PPolyproline II helixtrans-66.2120.6170.6-65.3-177.8177.6-176.4-2.2109Y152R150-Y152 HydrophobicContact CB-CE2 4.33Å
151Q74.4Confident68.7Low174 Ų174157.3 Ų157.381%0.81377%0.773SS**PPolyproline II helixtrans-78.8123.8166.5-83-174.2-33.200108.7R149R149-Q151 PolarHBondContact O-N 3.32Å
152Y75.3Confident68.4Low198 Ų198162.7 Ų162.778%0.77679%0.789SS**PPolyproline II helixtrans-93.2123.6166.7-70.3-89.8000107.1R150R150-Y152 HydrophobicContact CB-CE2 4.33Å
153H67.3Low67.9Low177 Ų177164.5 Ų164.582%0.81979%0.792SS**  trans-92.2107.9168.3-157.2-62.3000106.2S155H153-S155 PolarHBondContact O-N 3.21Å
154E60.1Low67.5Low180 Ų180164 Ų16484%0.84180%0.804SS**  trans-76100.7166.7-78.4-179.812900106.8
155S56.4Low66.5Low86 Ų86163.3 Ų163.360%0.60183%0.833SS**  trans-83.5110.5159.143.80000107H153 E157H153-S155 PolarHBondContact O-N 3.21Å; S155-E157 PolarHBondContact O-N 3.06Å
156E52.1Low66.1Low192 Ų192166.1 Ų166.190%0.89784%0.842SS**  trans-67.297.1168.8-61.5178.811500107.6E158E156-E158 PolarHBondContact O-N 3.26Å
157E56.7Low65.5Low175 Ų175169.9 Ų169.982%0.81886%0.86SS**  trans-8395.5167.6-68-165.3143.700108.2S155 S159S155-E157 PolarHBondContact O-N 3.06Å; E157-S159 PolarHBondContact O-N 3.31Å
158E53.1Low64.7Low190 Ų190171.4 Ų171.489%0.88886%0.859SS**  trans-58.9111.3160.7-126.5-179.812800107.8E156E156-E158 PolarHBondContact O-N 3.26Å
159S61.1Low63.5Low118 Ų118172.6 Ų172.683%0.82586%0.862SS**  trans-134.9110.7171-148.20000110E157E157-S159 PolarHBondContact O-N 3.31Å
160E60.6Low62.4Low182 Ų182171.4 Ų171.485%0.8587%0.871SS**  trans-67.1146.5-173.5-64.1169.1127.900112.7
161E56Low61.3Low195 Ų195169.2 Ų169.291%0.91188%0.877SS**  trans-61.3137.5178.9-65.5169.7129.500113.5
162E62.5Low60.3Low198 Ų198168.9 Ų168.993%0.92588%0.882SS**  trans-138.1106.4145-93.8-154.1133.700110.2
163E60.5Low59.2Low199 Ų199166.6 Ų166.693%0.9389%0.89SS**  trans-76.1121.3161.3-94.4-104.7137.900109
164A66.9Low58.5Low97 Ų97165.8 Ų165.880%0.80290%0.896SS**  trans-106.5122.3170.500000110.3
165A56.2Low58.4Low177 Ų177164.5 Ų164.5100%1.46390%0.901SS**  trans-87.30160.700000111.3

Retrieved 165 of 165 residues in 269.8 ms (Link to these results)

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