A0A087XUF1_POEFO Loading...

CUGBP, Elav-like family member 4

AlphaFold DB , UniProt , Accession A0A087XUF1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 358 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
1E63Low87.1Confident128 Ų12854.1 Ų54.160%0.59825%0.251SS*.  022.80-123.1106.5103.400113.2R3 K85 P263E1-R3 PolarHBondContact O-N 3.38Å; E1-K85 IonicContact OE1-NZ 3.41Å; E1-K85 PolarHBondContact OE1-NZ 3.27Å; E1-P263 WeakPolarHBondContact OE2-CB 3.49Å; E1-P263 WeakPolarHBondContact OE2-CG 3.23Å
2D75.7Confident87.1Confident87 Ų8762 Ų6247%0.46528%0.284SS..  trans-10367.3-131.2-39.4-64.6000113.4H53 F80D2-H53 PolarHBondContact O-ND1 3.09Å; D2-F80 HydrophobicContact CB-CD1 4.15Å; D2-F80 HydrophobicContact CB-CE1 4.25Å; D2-F80 VanDerWaalsContact O-CE1 3.25Å; D2-F80 WeakPolarHBondContact O-CE1 3.33Å
3R90.4Very high87Confident113 Ų11369.9 Ų69.943%0.42632%0.322SS..  trans-113.7-2.5-177.6-78.2-176.2-80.4166.8-3.2115.2E1 K49 Y50 S51 H53E1-R3 PolarHBondContact O-N 3.38Å; R3-K49 WeakPolarHBondContact O-CA 3.44Å; R3-Y50 WeakPolarHBondContact CB-O 3.09Å; R3-Y50 PolarHBondContact O-N 2.98Å; R3-S51 WeakPolarHBondContact CD-O 3.29Å; R3-S51 PolarHBondContact NH1-O 2.92Å; R3-H53 HydrophobicContact CG-CB 4.42Å
4K93.4Very high86.7Confident79 Ų7967.4 Ų67.434%0.34331%0.31SS..EExtended strand (participates in β ladder)trans-105.6126.5178.4-166.4161.5-176.6163.70110.2E31 F47 K49 A81K4-E31 WeakPolarHBondContact CE-OE1 3.38Å; K4-E31 IonicContact NZ-OE1 3.63Å; K4-E31 PolarHBondContact NZ-OE1 2.77Å; K4-F47 HydrophobicContact CG-CB 4.41Å; K4-F47 HydrophobicContact CG-CD1 4.43Å; K4-K49 HydrophobicContact CG-CB 4.45Å; K4-A81 HydrophobicContact CB-CB 4.39Å; K4-A81 HydrophobicContact CG-CB 4.19Å; K4-A81 WeakPolarHBondContact O-CB 3.3Å; K4-A81 PolarHBondContact O-N 2.86Å
5L93.9Very high87Confident0 Ų065.5 Ų65.50%031%0.308CS..EExtended strand (participates in β ladder)trans-101.3145.6175.7-58.1-174.1000110.5F23 F47 V48 Y50 A56 A59 I60 V78 K79 F80L5-F23 HydrophobicContact CD1-CE1 4.2Å; L5-F47 VanDerWaalsContact O-CA 3.26Å; L5-F47 WeakPolarHBondContact O-CA 3.41Å; L5-F47 WeakPolarHBondContact O-CD1 3.48Å; L5-V48 PolarHBondContact N-O 2.93Å; L5-V48 PolarHBondContact O-N 3.03Å; L5-Y50 HydrophobicContact CD1-CD2 4.19Å; L5-Y50 HydrophobicContact CD1-CE2 3.74Å; L5-A56 HydrophobicContact CD1-CB 4.4Å; L5-A56 HydrophobicContact CD2-CB 4Å; L5-A56 HydrophobicContact CG-CB 4.21Å; L5-A59 HydrophobicContact CD1-CB 4Å; L5-I60 HydrophobicContact CD1-CG1 4.19Å; L5-I60 HydrophobicContact CD2-CD1 3.6Å; L5-I60 HydrophobicContact CD2-CG1 3.74Å; L5-V78 HydrophobicContact CD1-CG1 3.81Å; L5-K79 CarbonylContact C-O 3.55Å; L5-K79 WeakPolarHBondContact CA-O 3.4Å; L5-K79 WeakPolarHBondContact CB-O 3.48Å; L5-F80 HydrophobicContact CD2-CD1 3.69Å; L5-F80 HydrophobicContact CD2-CE1 3.89Å; L5-F80 HydrophobicContact CD2-CG 4.35Å
6F94.1Very high87.3Confident51 Ų5164.8 Ų64.822%0.22431%0.305CS..EExtended strand (participates in β ladder)trans-96.3131.8160.4172.6-94.3000108.6C45 F47 V78 K79 A81F6-C45 HydrophobicContact CE2-CB 3.58Å; F6-C45 HydrophobicContact CZ-CB 3.56Å; F6-F47 HydrophobicContact CB-CD1 4.25Å; F6-F47 HydrophobicContact CB-CE1 4Å; F6-F47 HydrophobicContact CD2-CD1 4.37Å; F6-F47 AromaticContact CD2-CE1 3.75Å; F6-F47 HydrophobicContact CD2-CE1 3.75Å; F6-F47 AromaticContact CD2-CZ 3.9Å; F6-F47 HydrophobicContact CD2-CZ 3.9Å; F6-F47 HydrophobicContact CG-CE1 4.38Å; F6-V78 WeakPolarHBondContact O-CA 3.31Å; F6-K79 HydrophobicContact CB-CG 4.09Å; F6-K79 HydrophobicContact CD1-CD 4.23Å; F6-K79 HydrophobicContact CD1-CG 4.03Å; F6-K79 PolarHBondContact N-O 3.45Å; F6-K79 PolarHBondContact O-N 2.79Å; F6-A81 HydrophobicContact CB-CB 4.2Å
7V92.8Very high87.5Confident0 Ų066.9 Ų66.90%032%0.318CS..EExtended strand (participates in β ladder)trans-117.5103.4178.9-174.70000107.5L10 F23 C45 A46 V48 V78V7-L10 HydrophobicContact CB-CD1 4.35Å; V7-L10 HydrophobicContact CG1-CD1 3.97Å; V7-L10 HydrophobicContact CG1-CD2 4.03Å; V7-L10 HydrophobicContact CG1-CG 3.97Å; V7-F23 HydrophobicContact CB-CZ 4.22Å; V7-F23 HydrophobicContact CG1-CE2 4.04Å; V7-F23 HydrophobicContact CG1-CZ 3.76Å; V7-F23 HydrophobicContact CG2-CE1 3.65Å; V7-F23 HydrophobicContact CG2-CE2 4.13Å; V7-F23 HydrophobicContact CG2-CZ 3.35Å; V7-C45 CarbonylContact O-C 3.55Å; V7-C45 WeakPolarHBondContact O-CA 3.35Å; V7-C45 VanDerWaalsContact O-CB 3.3Å; V7-C45 WeakPolarHBondContact O-CB 3.24Å; V7-A46 HydrophobicContact CB-CB 4.42Å; V7-A46 PolarHBondContact N-O 2.79Å; V7-A46 PolarHBondContact O-N 2.97Å; V7-V48 HydrophobicContact CG2-CG2 3.91Å; V7-V78 HydrophobicContact CG1-CG2 4.38Å
8G91.3Very high87.7Confident4 Ų466.7 Ų66.74%0.04132%0.319CS..EExtended strand (participates in β ladder)trans-98.1166.5177.400000113.5L10 V77G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 2.83Å; G8-V77 PolarHBondContact N-O 2.59Å; G8-V77 PolarHBondContact O-N 3.32Å
9M90.7Very high87.8Confident103 Ų10363.2 Ų63.251%0.50730%0.303SS..SBendtrans63.328.8179.7-51-51.7-179.800114.9G44 S75 V77M9-G44 PolarHBondContact N-O 3.37Å; M9-S75 WeakPolarHBondContact CB-O 3.46Å; M9-V77 HydrophobicContact CB-CG2 4.48Å; M9-V77 HydrophobicContact CG-CB 4.49Å; M9-V77 HydrophobicContact CG-CG2 3.72Å
10L87.9Confident88.1Confident9 Ų966.6 Ų66.65%0.04731%0.312CS..  trans-68.6142168-69.2166.7000110.5V7 G8 K12 V19 G44 A46 L76V7-L10 HydrophobicContact CB-CD1 4.35Å; V7-L10 HydrophobicContact CG1-CD1 3.97Å; V7-L10 HydrophobicContact CG1-CD2 4.03Å; V7-L10 HydrophobicContact CG1-CG 3.97Å; G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 2.83Å; L10-K12 PolarHBondContact O-N 3.31Å; L10-V19 HydrophobicContact CD1-CG2 3.77Å; L10-V19 HydrophobicContact CD2-CG2 3.9Å; L10-G44 PolarHBondContact N-O 2.62Å; L10-G44 WeakPolarHBondContact O-CA 3.34Å; L10-A46 HydrophobicContact CD1-CB 3.52Å; L10-L76 HydrophobicContact CD2-CD2 3.68Å; L10-L76 HydrophobicContact CG-CD2 4.24Å
11N85.5Confident88.2Confident21 Ų2172.2 Ų72.211%0.11233%0.33CS..  trans-59.7132.7166.6174.7-9.6000108.9Q13 Q14 P70 A72N11-Q13 PolarHBondContact O-N 2.89Å; N11-Q13 PolarHBondContact OD1-N 3.05Å; N11-Q13 PolarHBondContact OD1-NE2 3.42Å; N11-Q14 HydrophobicContact CB-CG 4.01Å; N11-Q14 WeakPolarHBondContact O-CB 3.47Å; N11-Q14 WeakPolarHBondContact O-CG 3.49Å; N11-Q14 PolarHBondContact O-N 2.81Å; N11-P70 PolarHBondContact ND2-O 3.05Å; N11-A72 HydrophobicContact CB-CB 4.23Å
12K86.9Confident89.5Confident149 Ų14968.2 Ų68.265%0.64831%0.313SS*.THydrogen-bonded Turntrans-62.1-16.2-175.7-62.8-176.5-178.6176.40114.3L10 S42L10-K12 PolarHBondContact O-N 3.31Å; K12-S42 WeakPolarHBondContact O-CB 3.44Å
13Q85.4Confident90.3Very high165 Ų16564 Ų6477%0.77129%0.291SS*.THydrogen-bonded Turntrans-86.2-10.2177.2-65.9166.496.600113.7N11N11-Q13 PolarHBondContact O-N 2.89Å; N11-Q13 PolarHBondContact OD1-N 3.05Å; N11-Q13 PolarHBondContact OD1-NE2 3.42Å
14Q83.4Confident90.4Very high34 Ų3463.5 Ų63.516%0.15929%0.293CS..  trans-67.6142.2-179.9-69.7-84.8-90.500111.8N11 I34N11-Q14 HydrophobicContact CB-CG 4.01Å; N11-Q14 WeakPolarHBondContact O-CB 3.47Å; N11-Q14 WeakPolarHBondContact O-CG 3.49Å; N11-Q14 PolarHBondContact O-N 2.81Å; Q14-I34 WeakPolarHBondContact O-CD1 3.49Å
15S90.4Very high90.4Very high39 Ų3964.5 Ų64.527%0.27331%0.31SS..  trans-92.5166.1173.770.20000112.1D17 D18 V19 I34S15-D17 PolarHBondContact O-N 3.12Å; S15-D17 PolarHBondContact OG-N 2.72Å; S15-D18 WeakPolarHBondContact CB-OD2 3.45Å; S15-D18 PolarHBondContact N-OD2 3.42Å; S15-D18 PolarHBondContact O-N 2.93Å; S15-D18 VanDerWaalsContact OG-CG 3.26Å; S15-D18 PolarHBondContact OG-N 3.45Å; S15-D18 VanDerWaalsContact OG-N 3.09Å; S15-D18 PolarHBondContact OG-OD2 2.96Å; S15-V19 WeakPolarHBondContact O-CG2 3.44Å; S15-V19 PolarHBondContact O-N 3.45Å; S15-I34 VanDerWaalsContact C-CD1 3.43Å
16E91.3Very high90.3Very high55 Ų5567.5 Ų67.526%0.25732%0.323SS..Hα-helixtrans-64.1-27172.8-83.4126.2131.300112.6R20 C32 I34 R36E16-R20 WeakPolarHBondContact O-CB 3.2Å; E16-R20 PolarHBondContact O-N 3.42Å; E16-C32 PolarHBondContact O-SG 3.02Å; E16-C32 VanDerWaalsContact O-SG 3.42Å; E16-I34 HydrophobicContact CG-CB 3.92Å; E16-I34 HydrophobicContact CG-CD1 4.03Å; E16-I34 HydrophobicContact CG-CG1 3.83Å; E16-I34 PolarHBondContact OE1-N 3.1Å; E16-R36 IonicContact OE2-CZ 3.29Å; E16-R36 IonicContact OE2-NE 3.91Å; E16-R36 IonicContact OE2-NH2 3.41Å; E16-R36 PolarHBondContact OE2-NH2 3.26Å
17D91.9Very high90.2Very high100 Ų10065.8 Ų65.854%0.53532%0.32SS..Hα-helixtrans-72.5-37.4172.4-64.9-87.7000113.2S15 R20 R21S15-D17 PolarHBondContact O-N 3.12Å; S15-D17 PolarHBondContact OG-N 2.72Å; D17-R20 PolarHBondContact O-N 3.02Å; D17-R21 WeakPolarHBondContact O-CB 3.44Å; D17-R21 WeakPolarHBondContact O-CD 3.23Å; D17-R21 VanDerWaalsContact O-CG 3.23Å; D17-R21 WeakPolarHBondContact O-CG 3.43Å; D17-R21 PolarHBondContact O-N 3.26Å
18D90.3Very high90.3Very high64 Ų6469.6 Ų69.634%0.34235%0.347SS..Hα-helixtrans-62.9-48.2173.6-64.1-67.2000110.9S15 R20 R21 L22S15-D18 WeakPolarHBondContact CB-OD2 3.45Å; S15-D18 PolarHBondContact N-OD2 3.42Å; S15-D18 PolarHBondContact O-N 2.93Å; S15-D18 VanDerWaalsContact OG-CG 3.26Å; S15-D18 PolarHBondContact OG-N 3.45Å; S15-D18 VanDerWaalsContact OG-N 3.09Å; S15-D18 PolarHBondContact OG-OD2 2.96Å; D18-R20 VanDerWaalsContact C-N 3.31Å; D18-R20 PolarHBondContact O-N 3.07Å; D18-R21 PolarHBondContact O-N 2.86Å; D18-L22 PolarHBondContact O-N 2.81Å
19V90.5Very high90.5Very high0 Ų071 Ų710%035%0.353CS..Hα-helixtrans-62.6-41.1177.8177.40000110.4L10 S15 L22 F23 I34 A46 V48L10-V19 HydrophobicContact CD1-CG2 3.77Å; L10-V19 HydrophobicContact CD2-CG2 3.9Å; S15-V19 WeakPolarHBondContact O-CG2 3.44Å; S15-V19 PolarHBondContact O-N 3.45Å; V19-L22 PolarHBondContact O-N 3.49Å; V19-F23 HydrophobicContact CG1-CD2 4.23Å; V19-F23 HydrophobicContact CG1-CE2 4.39Å; V19-F23 WeakPolarHBondContact O-CB 3.18Å; V19-F23 VanDerWaalsContact O-CD2 3.23Å; V19-F23 WeakPolarHBondContact O-CD2 3.17Å; V19-F23 PolarHBondContact O-N 3.2Å; V19-I34 HydrophobicContact CG2-CD1 4.17Å; V19-I34 HydrophobicContact CG2-CG1 4.47Å; V19-A46 HydrophobicContact CG1-CB 4.31Å; V19-V48 HydrophobicContact CG1-CG2 3.77Å
20R92.9Very high90.6Very high131 Ų13171.2 Ų71.249%0.49435%0.353SS..Hα-helixtrans-60.9-49.3175.3179.3-176.7167.1155.11.5111.6E16 D17 D18 L22 F23 E24 I29E16-R20 WeakPolarHBondContact O-CB 3.2Å; E16-R20 PolarHBondContact O-N 3.42Å; D17-R20 PolarHBondContact O-N 3.02Å; D18-R20 VanDerWaalsContact C-N 3.31Å; D18-R20 PolarHBondContact O-N 3.07Å; R20-L22 VanDerWaalsContact C-N 3.28Å; R20-L22 PolarHBondContact O-N 3.17Å; R20-F23 PolarHBondContact O-N 3.05Å; R20-E24 IonicContact NE-OE1 2.63Å; R20-E24 WeakPolarHBondContact O-CB 3.49Å; R20-E24 PolarHBondContact O-N 3.42Å; R20-I29 HydrophobicContact CB-CD1 4.45Å; R20-I29 HydrophobicContact CG-CD1 3.97Å; R20-I29 WeakPolarHBondContact O-CD1 3.35Å
21R91.3Very high90.8Very high184 Ų18474.5 Ų74.569%0.69437%0.368SS*.Hα-helixtrans-59.9-35178.7-75.3166.6-179.7-96.62113.3D17 D18D17-R21 WeakPolarHBondContact O-CB 3.44Å; D17-R21 WeakPolarHBondContact O-CD 3.23Å; D17-R21 VanDerWaalsContact O-CG 3.23Å; D17-R21 WeakPolarHBondContact O-CG 3.43Å; D17-R21 PolarHBondContact O-N 3.26Å; D18-R21 PolarHBondContact O-N 2.86Å
22L88.9Confident91.2Very high44 Ų4475 Ų7523%0.2337%0.372CS..Hα-helixtrans-71.6-30.7175.7-179.861.8000112.6D18 V19 R20 F26 L63 M69 L76D18-L22 PolarHBondContact O-N 2.81Å; V19-L22 PolarHBondContact O-N 3.49Å; R20-L22 VanDerWaalsContact C-N 3.28Å; R20-L22 PolarHBondContact O-N 3.17Å; L22-F26 WeakPolarHBondContact O-CE2 3.49Å; L22-L63 HydrophobicContact CD1-CD2 3.99Å; L22-L63 HydrophobicContact CG-CD1 4.24Å; L22-L63 HydrophobicContact CG-CD2 4.23Å; L22-M69 HydrophobicContact CD2-SD 4.25Å; L22-L76 HydrophobicContact CD2-CD1 3.61Å
23F92.1Very high91.5Very high0 Ų070.8 Ų70.80%036%0.359CS..Hα-helixtrans-96.4-28.2-174.7-82.1-113.6000113.3L5 V7 V19 R20 S25 F26 I29 V48 Y50 A59 L63 V78L5-F23 HydrophobicContact CD1-CE1 4.2Å; V7-F23 HydrophobicContact CB-CZ 4.22Å; V7-F23 HydrophobicContact CG1-CE2 4.04Å; V7-F23 HydrophobicContact CG1-CZ 3.76Å; V7-F23 HydrophobicContact CG2-CE1 3.65Å; V7-F23 HydrophobicContact CG2-CE2 4.13Å; V7-F23 HydrophobicContact CG2-CZ 3.35Å; V19-F23 HydrophobicContact CG1-CD2 4.23Å; V19-F23 HydrophobicContact CG1-CE2 4.39Å; V19-F23 WeakPolarHBondContact O-CB 3.18Å; V19-F23 VanDerWaalsContact O-CD2 3.23Å; V19-F23 WeakPolarHBondContact O-CD2 3.17Å; V19-F23 PolarHBondContact O-N 3.2Å; R20-F23 PolarHBondContact O-N 3.05Å; F23-S25 PolarHBondContact O-N 2.66Å; F23-S25 VanDerWaalsContact O-N 3.1Å; F23-F26 PolarHBondContact O-N 3.45Å; F23-I29 HydrophobicContact CB-CD1 3.62Å; F23-V48 HydrophobicContact CB-CG1 4.21Å; F23-V48 HydrophobicContact CD1-CB 4.14Å; F23-V48 HydrophobicContact CD1-CG1 3.93Å; F23-V48 HydrophobicContact CD1-CG2 4.06Å; F23-V48 HydrophobicContact CE1-CG2 4.36Å; F23-V48 HydrophobicContact CG-CG1 4.29Å; F23-V48 HydrophobicContact CG-CG2 4.24Å; F23-Y50 WeakPolarHBondContact CB-OH 3.18Å; F23-Y50 HydrophobicContact CD1-CE2 4.21Å; F23-Y50 WeakPolarHBondContact CD1-OH 3.12Å; F23-Y50 PolarHBondContact O-OH 2.75Å; F23-A59 HydrophobicContact CD1-CB 4.35Å; F23-L63 HydrophobicContact CD1-CD1 4.05Å; F23-L63 HydrophobicContact CD2-CD1 3.72Å; F23-L63 HydrophobicContact CE1-CD1 3.84Å; F23-L63 HydrophobicContact CE2-CD1 3.53Å; F23-L63 HydrophobicContact CG-CD1 3.97Å; F23-L63 HydrophobicContact CZ-CD1 3.57Å; F23-V78 HydrophobicContact CE1-CG1 3.92Å; F23-V78 HydrophobicContact CE1-CG2 4.41Å; F23-V78 HydrophobicContact CZ-CG1 4.14Å; F23-V78 HydrophobicContact CZ-CG2 3.81Å
24E93.5Very high91.8Very high101 Ų10163.2 Ų63.247%0.47232%0.324SS..G310 helixtrans-63.2-23.1-175.866.7-175.26700113.7R20 F26 G27 I29R20-E24 IonicContact NE-OE1 2.63Å; R20-E24 WeakPolarHBondContact O-CB 3.49Å; R20-E24 PolarHBondContact O-N 3.42Å; E24-F26 PolarHBondContact O-N 2.84Å; E24-F26 VanDerWaalsContact O-N 3.12Å; E24-G27 WeakPolarHBondContact CA-O 3.3Å; E24-G27 PolarHBondContact O-N 3.14Å; E24-I29 HydrophobicContact CB-CD1 4.17Å
25S92.5Very high92.2Very high101 Ų10164.7 Ų64.771%0.70633%0.333SS*.G310 helixtrans-63.5-10.9172.2-166.60000114.5F23F23-S25 PolarHBondContact O-N 2.66Å; F23-S25 VanDerWaalsContact O-N 3.1Å
26F92.3Very high92.3Very high62 Ų6268.4 Ų68.427%0.27234%0.341SS..G310 helixtrans-113.1-3.9179.8-56.2-79.3000113.5L22 F23 E24 A59 A62 L63L22-F26 WeakPolarHBondContact O-CE2 3.49Å; F23-F26 PolarHBondContact O-N 3.45Å; E24-F26 PolarHBondContact O-N 2.84Å; E24-F26 VanDerWaalsContact O-N 3.12Å; F26-A59 HydrophobicContact CB-CB 3.94Å; F26-A59 HydrophobicContact CG-CB 4.26Å; F26-A62 HydrophobicContact CD1-CB 4.01Å; F26-A62 HydrophobicContact CE1-CB 3.25Å; F26-A62 HydrophobicContact CZ-CB 3.65Å; F26-L63 HydrophobicContact CD2-CD1 3.97Å; F26-L63 HydrophobicContact CD2-CG 4.37Å; F26-L63 HydrophobicContact CE2-CD1 3.69Å; F26-L63 HydrophobicContact CE2-CD2 3.84Å; F26-L63 HydrophobicContact CE2-CG 3.74Å; F26-L63 HydrophobicContact CZ-CD2 4.1Å; F26-L63 HydrophobicContact CZ-CG 4.12Å
27G92.4Very high92.2Very high15 Ų1566.7 Ų66.716%0.15534%0.338CS..SBendtrans154.7174.7178.800000114.5E24 I29 Y50 E55E24-G27 WeakPolarHBondContact CA-O 3.3Å; E24-G27 PolarHBondContact O-N 3.14Å; G27-I29 PolarHBondContact O-N 3.35Å; G27-Y50 WeakPolarHBondContact O-CE1 3.42Å; G27-E55 WeakPolarHBondContact CA-OE1 3.48Å
28S94.9Very high92Very high81 Ų8168.3 Ų68.357%0.56635%0.354SS*.  trans-79121.7-179-630000111.8Y50 S51 E55S28-Y50 WeakPolarHBondContact O-CA 3.13Å; S28-S51 WeakPolarHBondContact CB-OG 3.15Å; S28-S51 PolarHBondContact O-N 3.06Å; S28-S51 PolarHBondContact O-OG 3.46Å; S28-E55 PolarHBondContact N-OE1 2.92Å
29I95.3Very high92Very high34 Ų3471.3 Ų71.317%0.17437%0.37CS..EExtended strand (participates in β ladder)trans-90.4118.9-178.8-60.8167000109.9R20 F23 E24 G27 E31 C32 V48 K49 Y50R20-I29 HydrophobicContact CB-CD1 4.45Å; R20-I29 HydrophobicContact CG-CD1 3.97Å; R20-I29 WeakPolarHBondContact O-CD1 3.35Å; F23-I29 HydrophobicContact CB-CD1 3.62Å; E24-I29 HydrophobicContact CB-CD1 4.17Å; G27-I29 PolarHBondContact O-N 3.35Å; I29-E31 WeakPolarHBondContact CG2-O 3.19Å; I29-C32 HydrophobicContact CG2-CB 4.29Å; I29-V48 HydrophobicContact CD1-CG1 4.08Å; I29-V48 HydrophobicContact CG1-CG1 3.96Å; I29-V48 HydrophobicContact CG2-CG1 3.97Å; I29-K49 CarbonylContact C-O 3.57Å; I29-K49 WeakPolarHBondContact CA-O 3.38Å; I29-Y50 HydrophobicContact CG1-CD1 4.2Å; I29-Y50 HydrophobicContact CG1-CE1 3.87Å
30E93.8Very high91.7Very high106 Ų10673.4 Ų73.450%0.49539%0.391SS..EExtended strand (participates in β ladder)trans-82-33.7172.9-74.6-172.185.600112.8K49E30-K49 HydrophobicContact CB-CD 4.04Å; E30-K49 HydrophobicContact CB-CG 4.49Å; E30-K49 PolarHBondContact N-O 3.19Å; E30-K49 IonicContact OE1-NZ 3.63Å; E30-K49 PolarHBondContact OE1-NZ 2.7Å; E30-K49 WeakPolarHBondContact OE2-CE 3.27Å; E30-K49 IonicContact OE2-NZ 3.7Å; E30-K49 PolarHBondContact OE2-NZ 2.9Å
31E91.8Very high91.5Very high79 Ų7972.6 Ų72.637%0.36940%0.397SS..EExtended strand (participates in β ladder)trans-148.5127.5-174.5-168.5-174.371.300109.6K4 I29 V48 K49K4-E31 WeakPolarHBondContact CE-OE1 3.38Å; K4-E31 IonicContact NZ-OE1 3.63Å; K4-E31 PolarHBondContact NZ-OE1 2.77Å; I29-E31 WeakPolarHBondContact CG2-O 3.19Å; E31-V48 CarbonylContact O-C 3.55Å; E31-V48 WeakPolarHBondContact O-CA 3.33Å; E31-K49 HydrophobicContact CB-CB 3.75Å; E31-K49 HydrophobicContact CB-CD 4.12Å; E31-K49 PolarHBondContact N-O 3.48Å; E31-K49 PolarHBondContact O-N 2.72Å
32C93.4Very high91.4Very high30 Ų3064.3 Ų64.320%0.20337%0.367CS..EExtended strand (participates in β ladder)trans-124.7136.7168-173.70000107.7E16 I29 F47E16-C32 PolarHBondContact O-SG 3.02Å; E16-C32 VanDerWaalsContact O-SG 3.42Å; I29-C32 HydrophobicContact CG2-CB 4.29Å; C32-F47 WeakPolarHBondContact CA-O 3.37Å
33T92.5Very high91.5Very high62 Ų6268.5 Ų68.538%0.3838%0.384SS..EExtended strand (participates in β ladder)trans-154.3123.9178.2-49.40000110.6A46 F47T33-A46 CarbonylContact O-C 3.54Å; T33-A46 VanDerWaalsContact O-CA 3.27Å; T33-A46 WeakPolarHBondContact O-CA 3.39Å; T33-A46 WeakPolarHBondContact O-CB 3.26Å; T33-F47 PolarHBondContact N-O 2.85Å; T33-F47 PolarHBondContact O-N 2.85Å
34I93.3Very high91.4Very high6 Ų668.9 Ų68.93%0.03139%0.388CS..EExtended strand (participates in β ladder)trans-82.3133.6172.7-81168.5000109.4Q14 S15 E16 V19 R36 S42 A46Q14-I34 WeakPolarHBondContact O-CD1 3.49Å; S15-I34 VanDerWaalsContact C-CD1 3.43Å; E16-I34 HydrophobicContact CG-CB 3.92Å; E16-I34 HydrophobicContact CG-CD1 4.03Å; E16-I34 HydrophobicContact CG-CG1 3.83Å; E16-I34 PolarHBondContact OE1-N 3.1Å; V19-I34 HydrophobicContact CG2-CD1 4.17Å; V19-I34 HydrophobicContact CG2-CG1 4.47Å; I34-R36 HydrophobicContact CG2-CG 4.05Å; I34-R36 PolarHBondContact O-N 2.9Å; I34-S42 WeakPolarHBondContact CG2-OG 3.45Å; I34-A46 HydrophobicContact CG1-CB 3.81Å
35L91.7Very high91.4Very high65 Ų6564.8 Ų64.834%0.3437%0.37SS..EExtended strand (participates in β ladder)trans-80.3108177.8-165.270.6000109.3K43 C45 F47L35-K43 HydrophobicContact CD2-CD 4.23Å; L35-K43 HydrophobicContact CG-CD 4.18Å; L35-K43 VanDerWaalsContact O-CB 3.24Å; L35-K43 WeakPolarHBondContact O-CB 3.45Å; L35-K43 WeakPolarHBondContact O-CG 3.06Å; L35-K43 PolarHBondContact O-N 3.21Å; L35-C45 PolarHBondContact N-O 2.97Å; L35-F47 HydrophobicContact CD1-CE2 4.42Å
36R92.5Very high91.4Very high117 Ų11760 Ų6044%0.44234%0.336SS..EExtended strand (participates in β ladder)trans-96.9155.1179.9-62.1173.4-171.8-87.1-1.5111.1E16 I34 N41E16-R36 IonicContact OE2-CZ 3.29Å; E16-R36 IonicContact OE2-NE 3.91Å; E16-R36 IonicContact OE2-NH2 3.41Å; E16-R36 PolarHBondContact OE2-NH2 3.26Å; I34-R36 HydrophobicContact CG2-CG 4.05Å; I34-R36 PolarHBondContact O-N 2.9Å; R36-N41 CarbonylContact C-O 3.41Å; R36-N41 WeakPolarHBondContact CA-O 3.45Å
37G89Confident91.5Very high19 Ų1958.3 Ų58.320%0.19633%0.329CS..  trans-78.8175.2170.600000112.1D39 G40 N41G37-D39 PolarHBondContact O-N 2.9Å; G37-G40 PolarHBondContact O-N 2.86Å; G37-G40 VanDerWaalsContact O-N 3.12Å; G37-N41 PolarHBondContact N-O 3Å
38P87.9Confident91.7Very high134 Ų13457.6 Ų57.687%0.8732%0.322SS*.THydrogen-bonded Turntrans-59.9-28.1171.627.8-33.8000111.6G40P38-G40 PolarHBondContact O-N 2.98Å
39D88.4Confident91.6Very high126 Ų12656.7 Ų56.767%0.67431%0.308SS*.THydrogen-bonded Turntrans-79.911.6178.4-23.8-91.8000113.1G37 N41G37-D39 PolarHBondContact O-N 2.9Å; D39-N41 PolarHBondContact O-N 3.12Å
40G85Confident91.6Very high44 Ų4455 Ų5545%0.45430%0.299SS..SBendtrans70.9-20.5-175.900000115.7G37 P38G37-G40 PolarHBondContact O-N 2.86Å; G37-G40 VanDerWaalsContact O-N 3.12Å; P38-G40 PolarHBondContact O-N 2.98Å
41N88.8Confident91.6Very high115 Ų11552.1 Ų52.162%0.61529%0.291SS*.  trans-58.3138.4179.1-79.1-52.4000113R36 G37 D39R36-N41 CarbonylContact C-O 3.41Å; R36-N41 WeakPolarHBondContact CA-O 3.45Å; G37-N41 PolarHBondContact N-O 3Å; D39-N41 PolarHBondContact O-N 3.12Å
42S90Very high91.6Very high10 Ų1051 Ų517%0.0729%0.291CS..EExtended strand (participates in β ladder)trans-64.1135.4173.9177.20000111.5K12 I34 G44K12-S42 WeakPolarHBondContact O-CB 3.44Å; I34-S42 WeakPolarHBondContact CG2-OG 3.45Å; S42-G44 PolarHBondContact O-N 3.25Å; S42-G44 PolarHBondContact OG-N 2.91Å
43K90.6Very high91.6Very high131 Ų13152.7 Ų52.757%0.5730%0.296SS*.EExtended strand (participates in β ladder)trans-82.36.4174.9-59.7-175.967.2171.80113.2L35 C45L35-K43 HydrophobicContact CD2-CD 4.23Å; L35-K43 HydrophobicContact CG-CD 4.18Å; L35-K43 VanDerWaalsContact O-CB 3.24Å; L35-K43 WeakPolarHBondContact O-CB 3.45Å; L35-K43 WeakPolarHBondContact O-CG 3.06Å; L35-K43 PolarHBondContact O-N 3.21Å; K43-C45 VanDerWaalsContact C-N 3.31Å
44G89.9Confident91.6Very high9 Ų952.7 Ų52.79%0.09330%0.302CS..EExtended strand (participates in β ladder)trans71.425.8-176.400000113.3M9 L10 S42M9-G44 PolarHBondContact N-O 3.37Å; L10-G44 PolarHBondContact N-O 2.62Å; L10-G44 WeakPolarHBondContact O-CA 3.34Å; S42-G44 PolarHBondContact O-N 3.25Å; S42-G44 PolarHBondContact OG-N 2.91Å
45C92.4Very high91.7Very high14 Ų1454.2 Ų54.210%0.09531%0.309CS..EExtended strand (participates in β ladder)trans-149.6155.7174.759.40000112.8F6 V7 L35 K43F6-C45 HydrophobicContact CE2-CB 3.58Å; F6-C45 HydrophobicContact CZ-CB 3.56Å; V7-C45 CarbonylContact O-C 3.55Å; V7-C45 WeakPolarHBondContact O-CA 3.35Å; V7-C45 VanDerWaalsContact O-CB 3.3Å; V7-C45 WeakPolarHBondContact O-CB 3.24Å; L35-C45 PolarHBondContact N-O 2.97Å; K43-C45 VanDerWaalsContact C-N 3.31Å
46A94Very high91.8Very high0 Ų051.1 Ų51.10%029%0.293CS..EExtended strand (participates in β ladder)trans-138.3168.6-179.200000111.2V7 L10 V19 T33 I34V7-A46 HydrophobicContact CB-CB 4.42Å; V7-A46 PolarHBondContact N-O 2.79Å; V7-A46 PolarHBondContact O-N 2.97Å; L10-A46 HydrophobicContact CD1-CB 3.52Å; V19-A46 HydrophobicContact CG1-CB 4.31Å; T33-A46 CarbonylContact O-C 3.54Å; T33-A46 VanDerWaalsContact O-CA 3.27Å; T33-A46 WeakPolarHBondContact O-CA 3.39Å; T33-A46 WeakPolarHBondContact O-CB 3.26Å; I34-A46 HydrophobicContact CG1-CB 3.81Å
47F94.6Very high91.8Very high27 Ų2750.5 Ų50.512%0.11830%0.295CS..EExtended strand (participates in β ladder)trans-116.1139.5161.9-64.3-82.2000110.4K4 L5 F6 C32 T33 L35 A81K4-F47 HydrophobicContact CG-CB 4.41Å; K4-F47 HydrophobicContact CG-CD1 4.43Å; L5-F47 VanDerWaalsContact O-CA 3.26Å; L5-F47 WeakPolarHBondContact O-CA 3.41Å; L5-F47 WeakPolarHBondContact O-CD1 3.48Å; F6-F47 HydrophobicContact CB-CD1 4.25Å; F6-F47 HydrophobicContact CB-CE1 4Å; F6-F47 HydrophobicContact CD2-CD1 4.37Å; F6-F47 AromaticContact CD2-CE1 3.75Å; F6-F47 HydrophobicContact CD2-CE1 3.75Å; F6-F47 AromaticContact CD2-CZ 3.9Å; F6-F47 HydrophobicContact CD2-CZ 3.9Å; F6-F47 HydrophobicContact CG-CE1 4.38Å; C32-F47 WeakPolarHBondContact CA-O 3.37Å; T33-F47 PolarHBondContact N-O 2.85Å; T33-F47 PolarHBondContact O-N 2.85Å; L35-F47 HydrophobicContact CD1-CE2 4.42Å; F47-A81 HydrophobicContact CD1-CB 3.78Å; F47-A81 HydrophobicContact CE1-CB 3.71Å
48V94.9Very high92Very high0 Ų052 Ų520%031%0.305CS..EExtended strand (participates in β ladder)trans-127.2130.1175.1-179.20000108.1L5 V7 V19 F23 I29 E31 Y50L5-V48 PolarHBondContact N-O 2.93Å; L5-V48 PolarHBondContact O-N 3.03Å; V7-V48 HydrophobicContact CG2-CG2 3.91Å; V19-V48 HydrophobicContact CG1-CG2 3.77Å; F23-V48 HydrophobicContact CB-CG1 4.21Å; F23-V48 HydrophobicContact CD1-CB 4.14Å; F23-V48 HydrophobicContact CD1-CG1 3.93Å; F23-V48 HydrophobicContact CD1-CG2 4.06Å; F23-V48 HydrophobicContact CE1-CG2 4.36Å; F23-V48 HydrophobicContact CG-CG1 4.29Å; F23-V48 HydrophobicContact CG-CG2 4.24Å; I29-V48 HydrophobicContact CD1-CG1 4.08Å; I29-V48 HydrophobicContact CG1-CG1 3.96Å; I29-V48 HydrophobicContact CG2-CG1 3.97Å; E31-V48 CarbonylContact O-C 3.55Å; E31-V48 WeakPolarHBondContact O-CA 3.33Å; V48-Y50 HydrophobicContact CG1-CE2 4.22Å
49K93.9Very high92.3Very high62 Ų6245.6 Ų45.627%0.2726%0.264SS..EExtended strand (participates in β ladder)trans-115.9123.8178.5-172.8-161.1175.2-141.30109.4R3 K4 I29 E30 E31R3-K49 WeakPolarHBondContact O-CA 3.44Å; K4-K49 HydrophobicContact CG-CB 4.45Å; I29-K49 CarbonylContact C-O 3.57Å; I29-K49 WeakPolarHBondContact CA-O 3.38Å; E30-K49 HydrophobicContact CB-CD 4.04Å; E30-K49 HydrophobicContact CB-CG 4.49Å; E30-K49 PolarHBondContact N-O 3.19Å; E30-K49 IonicContact OE1-NZ 3.63Å; E30-K49 PolarHBondContact OE1-NZ 2.7Å; E30-K49 WeakPolarHBondContact OE2-CE 3.27Å; E30-K49 IonicContact OE2-NZ 3.7Å; E30-K49 PolarHBondContact OE2-NZ 2.9Å; E31-K49 HydrophobicContact CB-CB 3.75Å; E31-K49 HydrophobicContact CB-CD 4.12Å; E31-K49 PolarHBondContact N-O 3.48Å; E31-K49 PolarHBondContact O-N 2.72Å
50Y95.3Very high92.5Very high0 Ų041.2 Ų41.20%024%0.24CC..EExtended strand (participates in β ladder)trans-94.1157.7174.2-73.1-79.5000112.2R3 L5 F23 G27 S28 I29 V48 S52 E55 A56 A59R3-Y50 WeakPolarHBondContact CB-O 3.09Å; R3-Y50 PolarHBondContact O-N 2.98Å; L5-Y50 HydrophobicContact CD1-CD2 4.19Å; L5-Y50 HydrophobicContact CD1-CE2 3.74Å; F23-Y50 WeakPolarHBondContact CB-OH 3.18Å; F23-Y50 HydrophobicContact CD1-CE2 4.21Å; F23-Y50 WeakPolarHBondContact CD1-OH 3.12Å; F23-Y50 PolarHBondContact O-OH 2.75Å; G27-Y50 WeakPolarHBondContact O-CE1 3.42Å; S28-Y50 WeakPolarHBondContact O-CA 3.13Å; I29-Y50 HydrophobicContact CG1-CD1 4.2Å; I29-Y50 HydrophobicContact CG1-CE1 3.87Å; V48-Y50 HydrophobicContact CG1-CE2 4.22Å; Y50-S52 VanDerWaalsContact C-N 3.29Å; Y50-S52 WeakPolarHBondContact CB-O 3.05Å; Y50-S52 PolarHBondContact O-N 3.47Å; Y50-E55 HydrophobicContact CD1-CB 3.73Å; Y50-E55 HydrophobicContact CE1-CB 4.35Å; Y50-E55 HydrophobicContact CG-CB 3.83Å; Y50-A56 HydrophobicContact CD2-CB 3.78Å; Y50-A56 HydrophobicContact CG-CB 4.46Å; Y50-A59 HydrophobicContact CE2-CB 3.6Å; Y50-A59 WeakPolarHBondContact OH-CB 3.36Å
51S93.6Very high92.8Very high45 Ų4542.5 Ų42.532%0.31525%0.253SS..SBendtrans-58.7-37.8168.830.10000113.3R3 S28 E55R3-S51 WeakPolarHBondContact CD-O 3.29Å; R3-S51 PolarHBondContact NH1-O 2.92Å; S28-S51 WeakPolarHBondContact CB-OG 3.15Å; S28-S51 PolarHBondContact O-N 3.06Å; S28-S51 PolarHBondContact O-OG 3.46Å; S51-E55 PolarHBondContact N-OE2 3.26Å; S51-E55 PolarHBondContact OG-OE1 3.45Å; S51-E55 PolarHBondContact OG-OE2 2.78Å
52S92.8Very high92.9Very high54 Ų5438.9 Ų38.938%0.37824%0.239SC..SBendtrans-125.3156.5-174.4-171.60000113Y50 E55 A56Y50-S52 VanDerWaalsContact C-N 3.29Å; Y50-S52 WeakPolarHBondContact CB-O 3.05Å; Y50-S52 PolarHBondContact O-N 3.47Å; S52-E55 WeakPolarHBondContact CA-OE2 3.5Å; S52-E55 WeakPolarHBondContact CB-OE2 3.49Å; S52-E55 PolarHBondContact N-OE2 2.9Å; S52-A56 PolarHBondContact O-N 2.87Å
53H92.2Very high92.9Very high67 Ų6738.9 Ų38.931%0.3124%0.238SC..Hα-helixtrans-71.1-34.8175.3-179.170.8000112.1D2 R3 A56 Q57 F80D2-H53 PolarHBondContact O-ND1 3.09Å; R3-H53 HydrophobicContact CG-CB 4.42Å; H53-A56 WeakPolarHBondContact O-CB 3.42Å; H53-A56 PolarHBondContact O-N 3.46Å; H53-Q57 PolarHBondContact CD2-OE1 3.12Å; H53-Q57 VanDerWaalsContact NE2-CD 3.29Å; H53-Q57 PolarHBondContact NE2-NE2 3.24Å; H53-Q57 PolarHBondContact O-N 3.49Å; H53-F80 AromaticContact CE1-CE1 3.71Å; H53-F80 AromaticContact CE1-CZ 3.31Å; H53-F80 WeakPolarHBondContact CE1-CZ 3.44Å; H53-F80 AromaticContact ND1-CE1 3.78Å; H53-F80 AromaticContact ND1-CZ 3.81Å
54A93.7Very high92.8Very high61 Ų6137.3 Ų37.350%0.50423%0.233SC..Hα-helixtrans-65.5-40.9-179.500000112.1A56 Q57 A58A54-A56 VanDerWaalsContact C-N 3.32Å; A54-A56 PolarHBondContact O-N 2.97Å; A54-Q57 PolarHBondContact O-N 3.47Å; A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 3.21Å
55E94.6Very high92.6Very high38 Ų3838.8 Ų38.818%0.17825%0.248CC..Hα-helixtrans-57.6-45.9171.9-63172.8121.200110.8G27 S28 Y50 S51 S52 Q57 A58 A59G27-E55 WeakPolarHBondContact CA-OE1 3.48Å; S28-E55 PolarHBondContact N-OE1 2.92Å; Y50-E55 HydrophobicContact CD1-CB 3.73Å; Y50-E55 HydrophobicContact CE1-CB 4.35Å; Y50-E55 HydrophobicContact CG-CB 3.83Å; S51-E55 PolarHBondContact N-OE2 3.26Å; S51-E55 PolarHBondContact OG-OE1 3.45Å; S51-E55 PolarHBondContact OG-OE2 2.78Å; S52-E55 WeakPolarHBondContact CA-OE2 3.5Å; S52-E55 WeakPolarHBondContact CB-OE2 3.49Å; S52-E55 PolarHBondContact N-OE2 2.9Å; E55-Q57 PolarHBondContact O-N 2.97Å; E55-A58 PolarHBondContact O-N 3.11Å; E55-A59 WeakPolarHBondContact O-CB 3.28Å; E55-A59 PolarHBondContact O-N 3.05Å
56A93.7Very high91.6Very high0 Ų041.6 Ų41.60%027%0.268CS..Hα-helixtrans-64.2-38.2177.300000113L5 Y50 S52 H53 A54 I60 F80L5-A56 HydrophobicContact CD1-CB 4.4Å; L5-A56 HydrophobicContact CD2-CB 4Å; L5-A56 HydrophobicContact CG-CB 4.21Å; Y50-A56 HydrophobicContact CD2-CB 3.78Å; Y50-A56 HydrophobicContact CG-CB 4.46Å; S52-A56 PolarHBondContact O-N 2.87Å; H53-A56 WeakPolarHBondContact O-CB 3.42Å; H53-A56 PolarHBondContact O-N 3.46Å; A54-A56 VanDerWaalsContact C-N 3.32Å; A54-A56 PolarHBondContact O-N 2.97Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.35Å; A56-I60 VanDerWaalsContact O-N 3.11Å; A56-F80 HydrophobicContact CB-CE1 4.04Å
57Q93.4Very high90.1Very high105 Ų10547.2 Ų47.249%0.49129%0.294SS..Hα-helixtrans-67.4-44174-73.8-174.3-56.900112.3H53 A54 E55 A59 I60 G61 F80H53-Q57 PolarHBondContact CD2-OE1 3.12Å; H53-Q57 VanDerWaalsContact NE2-CD 3.29Å; H53-Q57 PolarHBondContact NE2-NE2 3.24Å; H53-Q57 PolarHBondContact O-N 3.49Å; A54-Q57 PolarHBondContact O-N 3.47Å; E55-Q57 PolarHBondContact O-N 2.97Å; Q57-A59 VanDerWaalsContact C-N 3.33Å; Q57-A59 PolarHBondContact O-N 3.23Å; Q57-I60 PolarHBondContact O-N 3.25Å; Q57-G61 PolarHBondContact O-N 3.47Å; Q57-F80 HydrophobicContact CG-CE2 4.42Å; Q57-F80 HydrophobicContact CG-CZ 3.78Å
58A93.3Very high88.5Confident50 Ų5049.3 Ų49.341%0.41331%0.309SS..Hα-helixtrans-60.2-44.1176.900000111.4A54 E55 I60 G61 A62A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 3.21Å; E55-A58 PolarHBondContact O-N 3.11Å; A58-I60 PolarHBondContact O-N 3.28Å; A58-G61 PolarHBondContact O-N 2.99Å; A58-A62 WeakPolarHBondContact O-CB 3.25Å; A58-A62 PolarHBondContact O-N 3.48Å
59A93.5Very high87.1Confident0 Ų050.9 Ų50.90%032%0.317CS..Hα-helixtrans-63.2-38.8175.800000113.2L5 F23 F26 Y50 E55 Q57 L63L5-A59 HydrophobicContact CD1-CB 4Å; F23-A59 HydrophobicContact CD1-CB 4.35Å; F26-A59 HydrophobicContact CB-CB 3.94Å; F26-A59 HydrophobicContact CG-CB 4.26Å; Y50-A59 HydrophobicContact CE2-CB 3.6Å; Y50-A59 WeakPolarHBondContact OH-CB 3.36Å; E55-A59 WeakPolarHBondContact O-CB 3.28Å; E55-A59 PolarHBondContact O-N 3.05Å; Q57-A59 VanDerWaalsContact C-N 3.33Å; Q57-A59 PolarHBondContact O-N 3.23Å; A59-L63 VanDerWaalsContact O-CB 3.28Å; A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 2.94Å
60I93.5Very high85.4Confident34 Ų3453.4 Ų53.417%0.17434%0.34CS..Hα-helixtrans-60.7-52.4171.1-68162.4000109.7L5 A56 Q57 A58 A62 L63 H64 V78 F80L5-I60 HydrophobicContact CD1-CG1 4.19Å; L5-I60 HydrophobicContact CD2-CD1 3.6Å; L5-I60 HydrophobicContact CD2-CG1 3.74Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.35Å; A56-I60 VanDerWaalsContact O-N 3.11Å; Q57-I60 PolarHBondContact O-N 3.25Å; A58-I60 PolarHBondContact O-N 3.28Å; I60-A62 VanDerWaalsContact C-N 3.28Å; I60-A62 PolarHBondContact O-N 2.94Å; I60-L63 PolarHBondContact O-N 3.33Å; I60-H64 HydrophobicContact CG2-CB 4.31Å; I60-H64 WeakPolarHBondContact O-CB 3.09Å; I60-H64 PolarHBondContact O-N 3.49Å; I60-V78 HydrophobicContact CG1-CG1 4.01Å; I60-F80 HydrophobicContact CD1-CD1 4.19Å; I60-F80 HydrophobicContact CD1-CD2 3.67Å; I60-F80 HydrophobicContact CD1-CE1 3.97Å; I60-F80 HydrophobicContact CD1-CE2 3.43Å; I60-F80 VanDerWaalsContact CD1-CE2 3.43Å; I60-F80 HydrophobicContact CD1-CG 4.04Å; I60-F80 HydrophobicContact CD1-CZ 3.58Å
61G91.2Very high83.8Confident70 Ų7056.5 Ų56.572%0.72237%0.371SS*.Hα-helixtrans-61.9-31.2-174.800000114.5Q57 A58Q57-G61 PolarHBondContact O-N 3.47Å; A58-G61 PolarHBondContact O-N 2.99Å
62A89.8Confident82.3Confident39 Ų3955.1 Ų55.132%0.32236%0.363SS..Hα-helixtrans-94.2-26.5-178.500000115F26 A58 I60 S66F26-A62 HydrophobicContact CD1-CB 4.01Å; F26-A62 HydrophobicContact CE1-CB 3.25Å; F26-A62 HydrophobicContact CZ-CB 3.65Å; A58-A62 WeakPolarHBondContact O-CB 3.25Å; A58-A62 PolarHBondContact O-N 3.48Å; I60-A62 VanDerWaalsContact C-N 3.28Å; I60-A62 PolarHBondContact O-N 2.94Å; A62-S66 WeakPolarHBondContact O-CB 3.3Å; A62-S66 PolarHBondContact O-OG 2.89Å
63L89.8Confident80.9Confident10 Ų1058.5 Ų58.55%0.05239%0.386CS..Hα-helixtrans-111.6-18.3-174.2-61.3176.6000114.4L22 F23 F26 A59 I60 G65 V78L22-L63 HydrophobicContact CD1-CD2 3.99Å; L22-L63 HydrophobicContact CG-CD1 4.24Å; L22-L63 HydrophobicContact CG-CD2 4.23Å; F23-L63 HydrophobicContact CD1-CD1 4.05Å; F23-L63 HydrophobicContact CD2-CD1 3.72Å; F23-L63 HydrophobicContact CE1-CD1 3.84Å; F23-L63 HydrophobicContact CE2-CD1 3.53Å; F23-L63 HydrophobicContact CG-CD1 3.97Å; F23-L63 HydrophobicContact CZ-CD1 3.57Å; F26-L63 HydrophobicContact CD2-CD1 3.97Å; F26-L63 HydrophobicContact CD2-CG 4.37Å; F26-L63 HydrophobicContact CE2-CD1 3.69Å; F26-L63 HydrophobicContact CE2-CD2 3.84Å; F26-L63 HydrophobicContact CE2-CG 3.74Å; F26-L63 HydrophobicContact CZ-CD2 4.1Å; F26-L63 HydrophobicContact CZ-CG 4.12Å; A59-L63 VanDerWaalsContact O-CB 3.28Å; A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 2.94Å; I60-L63 PolarHBondContact O-N 3.33Å; L63-G65 PolarHBondContact O-N 3.09Å; L63-V78 HydrophobicContact CB-CG2 3.75Å
64H90Very high80.2Confident99 Ų9958 Ų5846%0.45839%0.39SS..THydrogen-bonded Turntrans-68.2121.6175.1-174.799.5000111I60 S66 V78I60-H64 HydrophobicContact CG2-CB 4.31Å; I60-H64 WeakPolarHBondContact O-CB 3.09Å; I60-H64 PolarHBondContact O-N 3.49Å; H64-S66 PolarHBondContact O-N 3.14Å; H64-V78 HydrophobicContact CB-CB 4.28Å; H64-V78 PolarHBondContact ND1-O 2.88Å
65G84Confident79.8Confident39 Ų3957.1 Ų57.140%0.40238%0.381SS..THydrogen-bonded Turntrans71.5-16.8179.500000115.3L63 S75 L76L63-G65 PolarHBondContact O-N 3.09Å; G65-S75 VanDerWaalsContact O-CB 3.25Å; G65-S75 WeakPolarHBondContact O-CB 3.47Å; G65-S75 PolarHBondContact O-OG 2.9Å; G65-S75 VanDerWaalsContact O-OG 3.09Å; G65-L76 PolarHBondContact N-O 3.47Å
66S72.8Confident79.6Confident74 Ų7455.4 Ų55.452%0.51737%0.373SS..THydrogen-bonded Turntrans-58.4-57.6-171174.40000114.5A62 H64A62-S66 WeakPolarHBondContact O-CB 3.3Å; A62-S66 PolarHBondContact O-OG 2.89Å; H64-S66 PolarHBondContact O-N 3.14Å
67Q61.3Low79.5Confident118 Ų11857.4 Ų57.455%0.55139%0.385SS*.  trans-126.2137.6-175.7-70-13067.500112.6S75 L76Q67-S75 WeakPolarHBondContact O-CA 3.46Å; Q67-L76 PolarHBondContact O-N 3.1Å
68T61.8Low79.5Confident70 Ų7052.4 Ų52.443%0.42936%0.361SS..  trans-90.7109.7159.8-63.10000107.3A72 S75T68-A72 HydrophobicContact CG2-CB 4.34Å; T68-A72 VanDerWaalsContact CG2-O 3.29Å; T68-A72 WeakPolarHBondContact CG2-O 3.43Å; T68-S75 WeakPolarHBondContact OG1-CA 3.25Å; T68-S75 PolarHBondContact OG1-N 3.01Å; T68-S75 VanDerWaalsContact OG1-N 3.12Å; T68-S75 PolarHBondContact OG1-OG 3.5Å
69M64.4Low79.5Confident34 Ų3454.8 Ų54.817%0.16736%0.362CS..  trans-61.9151.2-179.4-71.3-67.9-81.200111.3L22 G71 A72 L76L22-M69 HydrophobicContact CD2-SD 4.25Å; M69-G71 PolarHBondContact O-N 3.25Å; M69-G71 VanDerWaalsContact O-N 3.14Å; M69-A72 HydrophobicContact CB-CB 4.05Å; M69-A72 VanDerWaalsContact O-CB 3.3Å; M69-A72 WeakPolarHBondContact O-CB 3.18Å; M69-A72 PolarHBondContact O-N 3.24Å; M69-L76 HydrophobicContact CG-CD1 4.11Å; M69-L76 HydrophobicContact CG-CD2 4.15Å; M69-L76 HydrophobicContact CG-CG 4.28Å
70P59Low79.5Confident115 Ų11558.1 Ų58.175%0.74738%0.377SS*.THydrogen-bonded Turntrans-52.2121.6173.9-27.635.9000111.9N11 A72N11-P70 PolarHBondContact ND2-O 3.05Å; P70-A72 VanDerWaalsContact C-N 3.31Å; P70-A72 PolarHBondContact O-N 2.8Å
71G61.6Low79.3Confident64 Ų6457.3 Ų57.366%0.6638%0.375SS*.THydrogen-bonded Turntrans75.77.1-175.900000116M69M69-G71 PolarHBondContact O-N 3.25Å; M69-G71 VanDerWaalsContact O-N 3.14Å
72A61.2Low78.9Confident17 Ų1756.7 Ų56.714%0.1436%0.355CS..  trans-86.5146.2164.600000110.5N11 T68 M69 P70N11-A72 HydrophobicContact CB-CB 4.23Å; T68-A72 HydrophobicContact CG2-CB 4.34Å; T68-A72 VanDerWaalsContact CG2-O 3.29Å; T68-A72 WeakPolarHBondContact CG2-O 3.43Å; M69-A72 HydrophobicContact CB-CB 4.05Å; M69-A72 VanDerWaalsContact O-CB 3.3Å; M69-A72 WeakPolarHBondContact O-CB 3.18Å; M69-A72 PolarHBondContact O-N 3.24Å; P70-A72 VanDerWaalsContact C-N 3.31Å; P70-A72 PolarHBondContact O-N 2.8Å
73S63.4Low78.3Confident124 Ų12457 Ų5787%0.86735%0.354SS*.SBendtrans-88.70.2-178.2-47.30000114.1
74S78.4Confident77.2Confident56 Ų5662.5 Ų62.539%0.39238%0.383SS..SBendtrans-163.4160.6-175.5-63.20000110.8
75S85.8Confident76Confident44 Ų4462.6 Ų62.631%0.30838%0.382SS..  trans-61.5150.1172-59.80000112.6M9 G65 Q67 T68 V77M9-S75 WeakPolarHBondContact CB-O 3.46Å; G65-S75 VanDerWaalsContact O-CB 3.25Å; G65-S75 WeakPolarHBondContact O-CB 3.47Å; G65-S75 PolarHBondContact O-OG 2.9Å; G65-S75 VanDerWaalsContact O-OG 3.09Å; Q67-S75 WeakPolarHBondContact O-CA 3.46Å; T68-S75 WeakPolarHBondContact OG1-CA 3.25Å; T68-S75 PolarHBondContact OG1-N 3.01Å; T68-S75 VanDerWaalsContact OG1-N 3.12Å; T68-S75 PolarHBondContact OG1-OG 3.5Å; S75-V77 PolarHBondContact O-N 3.36Å
76L89.7Confident75.3Confident2 Ų264.5 Ų64.51%0.0138%0.38CS..  trans-60.5134178.2-64.2177.4000112.5L10 L22 G65 Q67 M69 V78L10-L76 HydrophobicContact CD2-CD2 3.68Å; L10-L76 HydrophobicContact CG-CD2 4.24Å; L22-L76 HydrophobicContact CD2-CD1 3.61Å; G65-L76 PolarHBondContact N-O 3.47Å; Q67-L76 PolarHBondContact O-N 3.1Å; M69-L76 HydrophobicContact CG-CD1 4.11Å; M69-L76 HydrophobicContact CG-CD2 4.15Å; M69-L76 HydrophobicContact CG-CG 4.28Å; L76-V78 HydrophobicContact CB-CG2 4.38Å
77V91.4Very high75.2Confident42 Ų4267 Ų6726%0.25538%0.378SS..EExtended strand (participates in β ladder)trans-105.986.5179.5-179.60000109.1G8 M9 S75G8-V77 PolarHBondContact N-O 2.59Å; G8-V77 PolarHBondContact O-N 3.32Å; M9-V77 HydrophobicContact CB-CG2 4.48Å; M9-V77 HydrophobicContact CG-CB 4.49Å; M9-V77 HydrophobicContact CG-CG2 3.72Å; S75-V77 PolarHBondContact O-N 3.36Å
78V93.3Very high75.5Confident0 Ų065.5 Ų65.50%038%0.378CS..EExtended strand (participates in β ladder)trans-92.9125.4179.4-169.70000110.1L5 F6 V7 F23 I60 L63 H64 L76L5-V78 HydrophobicContact CD1-CG1 3.81Å; F6-V78 WeakPolarHBondContact O-CA 3.31Å; V7-V78 HydrophobicContact CG1-CG2 4.38Å; F23-V78 HydrophobicContact CE1-CG1 3.92Å; F23-V78 HydrophobicContact CE1-CG2 4.41Å; F23-V78 HydrophobicContact CZ-CG1 4.14Å; F23-V78 HydrophobicContact CZ-CG2 3.81Å; I60-V78 HydrophobicContact CG1-CG1 4.01Å; L63-V78 HydrophobicContact CB-CG2 3.75Å; H64-V78 HydrophobicContact CB-CB 4.28Å; H64-V78 PolarHBondContact ND1-O 2.88Å; L76-V78 HydrophobicContact CB-CG2 4.38Å
79K93.3Very high76Confident99 Ų9967.2 Ų67.243%0.4338%0.383SS..EExtended strand (participates in β ladder)trans-150.7166.2178.759.8172.769.6-178.30110.4L5 F6 A81L5-K79 CarbonylContact C-O 3.55Å; L5-K79 WeakPolarHBondContact CA-O 3.4Å; L5-K79 WeakPolarHBondContact CB-O 3.48Å; F6-K79 HydrophobicContact CB-CG 4.09Å; F6-K79 HydrophobicContact CD1-CD 4.23Å; F6-K79 HydrophobicContact CD1-CG 4.03Å; F6-K79 PolarHBondContact N-O 3.45Å; F6-K79 PolarHBondContact O-N 2.79Å; K79-A81 PolarHBondContact O-N 3.07Å
80F93.4Very high76.6Confident71 Ų7171.8 Ų71.831%0.31140%0.398SS..EExtended strand (participates in β ladder)trans-58.6138.3163.8-68.6-67.2000110.4D2 L5 H53 A56 Q57 I60D2-F80 HydrophobicContact CB-CD1 4.15Å; D2-F80 HydrophobicContact CB-CE1 4.25Å; D2-F80 VanDerWaalsContact O-CE1 3.25Å; D2-F80 WeakPolarHBondContact O-CE1 3.33Å; L5-F80 HydrophobicContact CD2-CD1 3.69Å; L5-F80 HydrophobicContact CD2-CE1 3.89Å; L5-F80 HydrophobicContact CD2-CG 4.35Å; H53-F80 AromaticContact CE1-CE1 3.71Å; H53-F80 AromaticContact CE1-CZ 3.31Å; H53-F80 WeakPolarHBondContact CE1-CZ 3.44Å; H53-F80 AromaticContact ND1-CE1 3.78Å; H53-F80 AromaticContact ND1-CZ 3.81Å; A56-F80 HydrophobicContact CB-CE1 4.04Å; Q57-F80 HydrophobicContact CG-CE2 4.42Å; Q57-F80 HydrophobicContact CG-CZ 3.78Å; I60-F80 HydrophobicContact CD1-CD1 4.19Å; I60-F80 HydrophobicContact CD1-CD2 3.67Å; I60-F80 HydrophobicContact CD1-CE1 3.97Å; I60-F80 HydrophobicContact CD1-CE2 3.43Å; I60-F80 VanDerWaalsContact CD1-CE2 3.43Å; I60-F80 HydrophobicContact CD1-CG 4.04Å; I60-F80 HydrophobicContact CD1-CZ 3.58Å
81A90.3Very high77.3Confident16 Ų1675.8 Ų75.813%0.13240%0.398CS..PPolyproline II helixtrans-77.4131.7175.800000110.3K4 F6 F47 K79 T83K4-A81 HydrophobicContact CB-CB 4.39Å; K4-A81 HydrophobicContact CG-CB 4.19Å; K4-A81 WeakPolarHBondContact O-CB 3.3Å; K4-A81 PolarHBondContact O-N 2.86Å; F6-A81 HydrophobicContact CB-CB 4.2Å; F47-A81 HydrophobicContact CD1-CB 3.78Å; F47-A81 HydrophobicContact CE1-CB 3.71Å; K79-A81 PolarHBondContact O-N 3.07Å; A81-T83 PolarHBondContact O-N 2.97Å
82D82.7Confident77.8Confident58 Ų5879.6 Ų79.631%0.3140%0.401SS..PPolyproline II helixtrans-50.4125166.6-54.2-116.1000109.3R90D82-R90 IonicContact OD1-CZ 2.7Å; D82-R90 VanDerWaalsContact OD1-CZ 3.29Å; D82-R90 IonicContact OD1-NE 3.58Å; D82-R90 PolarHBondContact OD1-NE 2.79Å; D82-R90 IonicContact OD1-NH1 2.69Å; D82-R90 IonicContact OD1-NH2 2.69Å
83T75.9Confident78.3Confident46 Ų4685.6 Ų85.628%0.28243%0.426SS..PPolyproline II helixtrans-63.9153.9175.665.50000110.3A81 K85 E86 R87A81-T83 PolarHBondContact O-N 2.97Å; T83-K85 PolarHBondContact O-N 3.48Å; T83-K85 VanDerWaalsContact O-N 3.13Å; T83-E86 PolarHBondContact O-N 2.74Å; T83-E86 WeakPolarHBondContact OG1-CB 3.41Å; T83-E86 PolarHBondContact OG1-N 2.78Å; T83-R87 PolarHBondContact O-N 3.15Å
84D67.9Low78.7Confident125 Ų12587 Ų8767%0.66842%0.419SS*.Hα-helixtrans-55.3-33.1175.7-99.1-78.9000112.6T88D84-T88 VanDerWaalsContact O-CB 3.29Å; D84-T88 WeakPolarHBondContact O-CB 3.11Å; D84-T88 PolarHBondContact O-N 3.47Å; D84-T88 PolarHBondContact O-OG1 2.69Å
85K63.6Low78Confident101 Ų10191.4 Ų91.444%0.43944%0.435SS..Hα-helixtrans-57.6-54.2171.7-59.7168.7180170.70110.7E1 T83 T88 I89E1-K85 IonicContact OE1-NZ 3.41Å; E1-K85 PolarHBondContact OE1-NZ 3.27Å; T83-K85 PolarHBondContact O-N 3.48Å; T83-K85 VanDerWaalsContact O-N 3.13Å; K85-T88 PolarHBondContact O-N 3.39Å; K85-I89 WeakPolarHBondContact O-CG1 3.43Å; K85-I89 PolarHBondContact O-N 3.22Å
86E69.4Low76.8Confident78 Ų7892.7 Ų92.736%0.36445%0.448SS..Hα-helixtrans-70.1-39.2-176.4-161.9179.8150.500112.6T83 T88 I89 R90T83-E86 PolarHBondContact O-N 2.74Å; T83-E86 WeakPolarHBondContact OG1-CB 3.41Å; T83-E86 PolarHBondContact OG1-N 2.78Å; E86-T88 VanDerWaalsContact C-N 3.29Å; E86-T88 PolarHBondContact O-N 2.8Å; E86-I89 PolarHBondContact O-N 3.2Å; E86-R90 WeakPolarHBondContact O-CB 3.29Å; E86-R90 WeakPolarHBondContact O-CG 3.41Å; E86-R90 PolarHBondContact O-N 2.88Å; E86-R90 IonicContact OE1-CZ 2.9Å; E86-R90 IonicContact OE1-NE 2.97Å; E86-R90 PolarHBondContact OE1-NE 2.85Å; E86-R90 IonicContact OE1-NH2 2.91Å; E86-R90 PolarHBondContact OE1-NH2 3.45Å
87R72.1Confident75.2Confident126 Ų12695.8 Ų95.848%0.47548%0.481SS..Hα-helixtrans-58.6-41.3171.1180179.4-68.1-162.3-1.7111.7T83 R91T83-R87 PolarHBondContact O-N 3.15Å; R87-R91 WeakPolarHBondContact O-CB 3.47Å; R87-R91 PolarHBondContact O-N 2.83Å
88T68.1Low73.2Confident88 Ų88101.9 Ų101.954%0.5451%0.506SS..Hα-helixtrans-66.5-44.8177.6-59.10000111.1D84 K85 E86 R91 M92D84-T88 VanDerWaalsContact O-CB 3.29Å; D84-T88 WeakPolarHBondContact O-CB 3.11Å; D84-T88 PolarHBondContact O-N 3.47Å; D84-T88 PolarHBondContact O-OG1 2.69Å; K85-T88 PolarHBondContact O-N 3.39Å; E86-T88 VanDerWaalsContact C-N 3.29Å; E86-T88 PolarHBondContact O-N 2.8Å; T88-R91 PolarHBondContact O-N 2.85Å; T88-M92 WeakPolarHBondContact O-CB 3.13Å; T88-M92 PolarHBondContact O-N 3.28Å
89I72.4Confident71.1Confident106 Ų106109.8 Ų109.854%0.54455%0.545SS..Hα-helixtrans-60.4-48.4175.6-67.2163000110.8K85 E86 R91 M92 Q93K85-I89 WeakPolarHBondContact O-CG1 3.43Å; K85-I89 PolarHBondContact O-N 3.22Å; E86-I89 PolarHBondContact O-N 3.2Å; I89-R91 VanDerWaalsContact C-N 3.33Å; I89-R91 PolarHBondContact O-N 3Å; I89-M92 PolarHBondContact O-N 3.47Å; I89-Q93 WeakPolarHBondContact O-CB 3.49Å; I89-Q93 PolarHBondContact O-N 3.15Å
90R75.3Confident69.3Low130 Ų130108.6 Ų108.649%0.49156%0.561SS.*Hα-helixtrans-60.1-40.5177.3-70.3177.2-173.3-137.59112.1D82 E86 Q93 Q94D82-R90 IonicContact OD1-CZ 2.7Å; D82-R90 VanDerWaalsContact OD1-CZ 3.29Å; D82-R90 IonicContact OD1-NE 3.58Å; D82-R90 PolarHBondContact OD1-NE 2.79Å; D82-R90 IonicContact OD1-NH1 2.69Å; D82-R90 IonicContact OD1-NH2 2.69Å; E86-R90 WeakPolarHBondContact O-CB 3.29Å; E86-R90 WeakPolarHBondContact O-CG 3.41Å; E86-R90 PolarHBondContact O-N 2.88Å; E86-R90 IonicContact OE1-CZ 2.9Å; E86-R90 IonicContact OE1-NE 2.97Å; E86-R90 PolarHBondContact OE1-NE 2.85Å; E86-R90 IonicContact OE1-NH2 2.91Å; E86-R90 PolarHBondContact OE1-NH2 3.45Å; R90-Q93 PolarHBondContact O-N 3.15Å; R90-Q94 WeakPolarHBondContact O-CB 3.46Å; R90-Q94 WeakPolarHBondContact O-CG 3.34Å; R90-Q94 PolarHBondContact O-N 2.77Å
91R75.2Confident67.1Low198 Ų198112.7 Ų112.775%0.74759%0.585SS**Hα-helixtrans-64.8-43.7175.4-172.4-179.8-176.1-174.20.9112.1R87 T88 I89 M95R87-R91 WeakPolarHBondContact O-CB 3.47Å; R87-R91 PolarHBondContact O-N 2.83Å; T88-R91 PolarHBondContact O-N 2.85Å; I89-R91 VanDerWaalsContact C-N 3.33Å; I89-R91 PolarHBondContact O-N 3Å; R91-M95 PolarHBondContact O-N 2.94Å; R91-M95 VanDerWaalsContact O-N 3.11Å
92M71.7Confident64.7Low145 Ų145121 Ų12171%0.71462%0.618SS**Hα-helixtrans-63.8-41.9176.5-173.7177.7-177.800111.4T88 I89 M95 A96T88-M92 WeakPolarHBondContact O-CB 3.13Å; T88-M92 PolarHBondContact O-N 3.28Å; I89-M92 PolarHBondContact O-N 3.47Å; M92-M95 PolarHBondContact O-N 3.44Å; M92-A96 PolarHBondContact O-N 3.02Å
93Q71Confident62.7Low142 Ų142124.2 Ų124.266%0.66464%0.635SS**Hα-helixtrans-71.7-34.4-179.6-164.5161.533.500112.8I89 R90 M95 A96 G97I89-Q93 WeakPolarHBondContact O-CB 3.49Å; I89-Q93 PolarHBondContact O-N 3.15Å; R90-Q93 PolarHBondContact O-N 3.15Å; Q93-M95 VanDerWaalsContact C-N 3.33Å; Q93-A96 PolarHBondContact O-N 2.9Å; Q93-G97 PolarHBondContact O-N 2.83Å
94Q71.6Confident61.8Low153 Ų153126.9 Ų126.972%0.71565%0.654SS**Hα-helixtrans-64.3-36.7169.3-77.5179.3-24.900112.4R90 G97R90-Q94 WeakPolarHBondContact O-CB 3.46Å; R90-Q94 WeakPolarHBondContact O-CG 3.34Å; R90-Q94 PolarHBondContact O-N 2.77Å; Q94-G97 PolarHBondContact O-N 3.05Å
95M64.9Low60.4Low150 Ų150130 Ų13074%0.73967%0.667SS**Hα-helixtrans-71.5-39.3176.1-165.4169.2-176.200112.1R91 M92 Q93 G97 Q98R91-M95 PolarHBondContact O-N 2.94Å; R91-M95 VanDerWaalsContact O-N 3.11Å; M92-M95 PolarHBondContact O-N 3.44Å; Q93-M95 VanDerWaalsContact C-N 3.33Å; M95-G97 VanDerWaalsContact C-N 3.32Å; M95-G97 PolarHBondContact O-N 3.02Å; M95-Q98 PolarHBondContact O-N 2.8Å
96A59.3Low59.6Low70 Ų70129.4 Ų129.458%0.57968%0.68SS**Hα-helixtrans-63-37.2173.400000112.4M92 Q93 Q98 M99M92-A96 PolarHBondContact O-N 3.02Å; Q93-A96 PolarHBondContact O-N 2.9Å; A96-Q98 PolarHBondContact O-N 2.8Å; A96-Q98 VanDerWaalsContact O-N 3.15Å; A96-M99 PolarHBondContact O-N 2.97Å
97G55.6Low58.1Low67 Ų67133.6 Ų133.669%0.69170%0.704SS**THydrogen-bonded Turntrans-65.6-10.6178.300000115.6Q93 Q94 M95Q93-G97 PolarHBondContact O-N 2.83Å; Q94-G97 PolarHBondContact O-N 3.05Å; M95-G97 VanDerWaalsContact C-N 3.32Å; M95-G97 PolarHBondContact O-N 3.02Å
98Q50.2Low56.7Low170 Ų170136 Ų13679%0.79472%0.721SS**THydrogen-bonded Turntrans-88.8-15.9179.1-160.6168.329.600113.5M95 A96 G100M95-Q98 PolarHBondContact O-N 2.8Å; A96-Q98 PolarHBondContact O-N 2.8Å; A96-Q98 VanDerWaalsContact O-N 3.15Å; Q98-G100 PolarHBondContact O-N 2.87Å
99M49.9Very low55.1Low166 Ų166142.1 Ų142.182%0.81874%0.74SS**  trans-95.455.7179.8-79.3-89.6-77.200112.1A96 I101A96-M99 PolarHBondContact O-N 2.97Å; M99-I101 PolarHBondContact O-N 2.63Å
100G55.8Low53.6Low74 Ų74141 Ų14176%0.76376%0.755SS**  trans-80.670.918000000114.1Q98Q98-G100 PolarHBondContact O-N 2.87Å
101I47Very low52.1Low158 Ų158139.5 Ų139.581%0.8177%0.77SS**  trans-129.8136.9172.9-60-176.3000111.8M99M99-I101 PolarHBondContact O-N 2.63Å
102F39.2Very low50.6Low190 Ų190140.6 Ų140.683%0.83378%0.776SS**  trans-54.5165.1177.4-91-133.3000115.4
103N41.4Very low49.6Very low125 Ų125136.8 Ų136.867%0.66877%0.774SS**  cis-164.3-137.2-23.8-169.614.6000108.1
104P55.6Low48.3Very low103 Ų103133.7 Ų133.767%0.66977%0.772SS**  trans-114.1131.7-132.536.2-18.4000116.2
105M39Very low47.2Very low191 Ų191135 Ų13594%0.94177%0.772SS**  trans-158.1144.3140.9-129.3-179.6-178.600113.2
106A46.3Very low46.5Very low88 Ų88131.1 Ų131.173%0.72776%0.764SS**  trans19.2106.3162.200000119.8
107L37.5Very low46.1Very low166 Ų166135.2 Ų135.287%0.86977%0.771SS**  -168.4103.3118.9-102.3166.4000113.2F109L107-F109 PolarHBondContact O-N 2.77Å
108Q43.5Very low45.7Very low177 Ų177139 Ų13983%0.82777%0.77SS**  trans54.258.2134.4-14578.8-26.700121
109F35.4Very low45.9Very low215 Ų215134.7 Ų134.794%0.94376%0.756SS**  trans-140.667.3155.8-153.9-95.3000113.7L107L107-F109 PolarHBondContact O-N 2.77Å
110G40.1Very low46.2Very low82 Ų82134.1 Ų134.185%0.84575%0.751SS**  trans-129.495.7177.800000112.3
111A42.8Very low46.2Very low99 Ų99137.7 Ų137.782%0.81875%0.748SS**SBendtrans-145.57-178.600000115.7
112Y44.4Very low46.5Very low222 Ų222137.1 Ų137.187%0.87174%0.742SS**SBendtrans-136.7-9.2-176.8-137-96.5000116.2
113G50.8Low47.2Very low64 Ų64131.5 Ų131.566%0.6673%0.73SS**SBendtrans-82.1-34.3179.500000114.7Y115G113-Y115 PolarHBondContact O-N 2.7Å
114A43.4Very low47.8Very low77 Ų77129.1 Ų129.164%0.63673%0.728SS**Hα-helixtrans-69-34.3-167.900000114.3A116 Q118A114-A116 PolarHBondContact O-N 3.41Å; A114-Q118 PolarHBondContact O-N 3.33Å
115Y48.7Very low47.7Very low182 Ų182130 Ų13071%0.71473%0.727SS**Hα-helixtrans-67.9-34.9-174.3-163.5-100.7000112.8G113 Q117 Q118 V119G113-Y115 PolarHBondContact O-N 2.7Å; Y115-Q117 PolarHBondContact O-N 3.13Å; Y115-Q118 PolarHBondContact O-N 2.98Å; Y115-V119 HydrophobicContact CD1-CG2 4.18Å; Y115-V119 HydrophobicContact CE1-CG2 3.84Å; Y115-V119 PolarHBondContact O-N 2.66Å
116A50.7Low48.3Very low68 Ų68128.7 Ų128.756%0.56272%0.72SS**Hα-helixtrans-64.4-41-17900000112.6A114 Q120A114-A116 PolarHBondContact O-N 3.41Å; A116-Q120 PolarHBondContact O-N 3.28Å
117Q51Low48.5Very low156 Ų156129 Ų12973%0.72972%0.723SS**Hα-helixtrans-69.3-36.3-179.6-165.6172.525.200112Y115 Q120 Q121Y115-Q117 PolarHBondContact O-N 3.13Å; Q117-Q120 PolarHBondContact O-N 2.85Å; Q117-Q121 PolarHBondContact O-N 2.97Å
118Q47.7Very low49Very low145 Ų145125.7 Ų125.768%0.67871%0.714SS**Hα-helixtrans-70-36.2-177.9-167.3172.7-23.500112.7A114 Y115A114-Q118 PolarHBondContact O-N 3.33Å; Y115-Q118 PolarHBondContact O-N 2.98Å
119V52.8Low48.8Very low80 Ų80123.1 Ų123.149%0.48571%0.71SS.*Hα-helixtrans-68.3-41.6175.5175.70000111.4Y115 Q121 Q122 A123Y115-V119 HydrophobicContact CD1-CG2 4.18Å; Y115-V119 HydrophobicContact CE1-CG2 3.84Å; Y115-V119 PolarHBondContact O-N 2.66Å; V119-Q121 VanDerWaalsContact C-N 3.33Å; V119-Q121 PolarHBondContact O-N 3.37Å; V119-Q122 PolarHBondContact O-N 3.24Å; V119-A123 PolarHBondContact O-N 3.41Å
120Q56.1Low49.2Very low155 Ų155115.9 Ų115.972%0.72470%0.695SS**Hα-helixtrans-69.2-29.6-177.2-169.8161.5-14.400113.1A116 Q117A116-Q120 PolarHBondContact O-N 3.28Å; Q117-Q120 PolarHBondContact O-N 2.85Å
121Q56Low49Very low148 Ų148121 Ų12169%0.69270%0.697SS**Hα-helixtrans-72.2-28.1175.1-163.5167.224.900112.9Q117 V119Q117-Q121 PolarHBondContact O-N 2.97Å; V119-Q121 VanDerWaalsContact C-N 3.33Å; V119-Q121 PolarHBondContact O-N 3.37Å
122Q53.8Low49Very low146 Ų146120.3 Ų120.368%0.68270%0.7SS**Hα-helixtrans-72.3-29.6176.6-171.1154.956.800112.7V119 A124 L125V119-Q122 PolarHBondContact O-N 3.24Å; Q122-A124 VanDerWaalsContact C-N 3.32Å; Q122-A124 PolarHBondContact O-N 2.69Å; Q122-L125 HydrophobicContact CG-CD1 4.46Å; Q122-L125 PolarHBondContact O-N 3.34Å
123A54.6Low48.6Very low72 Ų72113.6 Ų113.660%0.59570%0.698SS**Hα-helixtrans-66.1-29.7176.800000113.7V119 L125V119-A123 PolarHBondContact O-N 3.41Å; A123-L125 PolarHBondContact O-N 2.85Å
124A53.3Low48.4Very low76 Ų76121.5 Ų121.563%0.62871%0.71SS**THydrogen-bonded Turntrans-69.7-17.5-179.400000113.9Q122Q122-A124 VanDerWaalsContact C-N 3.32Å; Q122-A124 PolarHBondContact O-N 2.69Å
125L52.9Low48Very low121 Ų121126.1 Ų126.163%0.63472%0.723SS**THydrogen-bonded Turntrans-79.1-23.5-175.9-54.1175000113.3Q122 A123Q122-L125 HydrophobicContact CG-CD1 4.46Å; Q122-L125 PolarHBondContact O-N 3.34Å; A123-L125 PolarHBondContact O-N 2.85Å
126M53Low47.4Very low163 Ų163122.5 Ų122.580%0.80372%0.724SS**THydrogen-bonded Turntrans-90.4-4.2-167.2-155.5169.1-172.500113.9
127A49.6Very low47.2Very low96 Ų96125.3 Ų125.379%0.79374%0.737SS**THydrogen-bonded Turntrans-87.4-1.9-172.300000115.3
128S47.5Very low47.1Very low96 Ų96126.7 Ų126.767%0.67175%0.746SS**SBendtrans-118.1-4.3-168.756.50000116.1G130S128-G130 PolarHBondContact O-N 3.06Å
129V40.9Very low47.2Very low123 Ų123124.5 Ų124.575%0.74575%0.752SS**  trans-102.555.8-175.5-690000113.6
130G42.4Very low46.9Very low62 Ų62125.4 Ų125.464%0.63977%0.768SS**  trans-76.8145.9151.700000110S128S128-G130 PolarHBondContact O-N 3.06Å
131Q36.2Very low46.5Very low189 Ų189128 Ų12888%0.88378%0.777SS**SBendtrans79.392.4-178.9-50-57.1-25.100117.4
132G42.4Very low45.9Very low85 Ų85125.8 Ų125.888%0.87679%0.785SS**  58.9107.5124.500000120.8
133G37.1Very low45.4Very low81 Ų81123.7 Ų123.784%0.83579%0.792SS**  trans168.5128.8160.300000113.3
134Y45.8Very low45Very low231 Ų231125.1 Ų125.191%0.90680%0.804SS**  trans-76.4139.6166.5-89.3-110.1000109.9
135L34.5Very low44.6Very low174 Ų174130.2 Ų130.291%0.91182%0.815SS**  trans176.3163.6130.4-94.8161.2000112.2
136S37.7Very low44.6Very low105 Ų105133.1 Ų133.173%0.73483%0.827SS**  trans-83.1147.6-165.4-51.40000115.2M138S136-M138 PolarHBondContact O-N 3.32Å
137P46.1Very low44.4Very low128 Ų128133.4 Ų133.483%0.83183%0.826SS**SBendtrans-89.994.6-176.634.6-34.4000113.5
138M49.2Very low44.1Very low185 Ų185137.4 Ų137.491%0.91183%0.829SS**SBendtrans-150.416.9167.6-157.853.9-171.600115.3S136S136-M138 PolarHBondContact O-N 3.32Å
139A49.9Very low43.7Very low99 Ų99141.7 Ų141.782%0.81884%0.84SS**SBendtrans-126.13.7-169.500000116.2
140A45.3Very low43.2Very low99 Ų99140.6 Ų140.682%0.81884%0.844SS**SBendtrans-110.4-1.4-168.400000116
141F47.9Very low42.8Very low208 Ų208143.9 Ų143.991%0.91285%0.852SS**SBendtrans-90.3-2.2-172.8-154-99.8000114.7
142A43.9Very low42.9Very low103 Ų103142.1 Ų142.185%0.85185%0.847SS**SBendtrans-99.70.6-166.300000115.8
143A42.6Very low42.5Very low102 Ų102146.1 Ų146.184%0.84385%0.848SS**SBendtrans-121.814.4-165.100000115.6
144A46.8Very low42.1Very low101 Ų101145.8 Ų145.884%0.83585%0.845SS**SBendtrans-135.423.2-174.500000114.6
145Q45.9Very low41.5Very low184 Ų184143 Ų14386%0.8684%0.844SS**SBendtrans-127.148-179.9-160.9-173.57300112.8
146M52.4Low42.1Very low181 Ų181140.6 Ų140.689%0.89284%0.84SS**  trans-158.9170.7162.8-117.2-176.7-173.400110.8
147Q49.1Very low41.8Very low169 Ų169139.3 Ų139.379%0.7984%0.842SS**  trans80.1143.7-164.5-49.3-80.1-76.600113.4
148H41.6Very low41.4Very low181 Ų181137.9 Ų137.984%0.83884%0.841SS**  trans84.232.4178.3-48.9-45.7000119.6
149M39.2Very low41.3Very low186 Ų186134.7 Ų134.792%0.91684%0.835SS**SBendtrans-127.8146.4139.1-93.1-166.1169.800109.6
150A31.1Very low40.6Very low100 Ų100137.7 Ų137.783%0.82684%0.836SS**  trans64.9147.1-163.100000113.9
151T33.7Very low40Very low130 Ų130138.3 Ų138.380%0.79883%0.83SS**  cis-141.7172.4-0.9-155.70000113.3
152I38.9Very low39.9Very low152 Ų152134 Ų13478%0.77982%0.823SS**  trans-77.5168.9-17751169.1000114.8
153N34.1Very low39.4Very low169 Ų169135 Ų13590%0.90482%0.819SS**  trans88.7119.6150-155.446.1000118.7
154G28.5Very low39Very low74 Ų74135.2 Ų135.276%0.76381%0.814SS**  trans16298.2171.400000116.4
155L33.7Very low38.2Very low172 Ų172134.5 Ų134.590%0.90182%0.816SS**  trans-113.8174162.3-87167.3000107.9
156P47.3Very low37.4Very low125 Ų125129.2 Ų129.281%0.81281%0.811SS**  cis-136.2-176.213.243.2-26000115.9
157G30.1Very low36.4Very low77 Ų77125.9 Ų125.979%0.79481%0.806SS**  trans170.9101.4162.600000115.2
158A37.7Very low35.9Very low98 Ų98124.2 Ų124.281%0.8181%0.807SS**  trans-149.6144.7172.900000111.3
159P48.1Very low36.7Very low119 Ų119121.1 Ų121.177%0.77380%0.803SS**  -145.7162.4126.730.8-12.8000113.5
160L34.4Very low36.9Very low161 Ų161118.4 Ų118.484%0.84380%0.8SS**  cis-155.9170.2-15.2-107.7-155.6000111.6
161T33.3Very low36.8Very low113 Ų113116.7 Ų116.769%0.69379%0.792SS**  trans-57.7171.817143.10000115.9
162P45.7Very low36.8Very low116 Ų116118.6 Ų118.675%0.75380%0.795SS**  cis-133.1157.936.716.511.7000117.6
163T33.7Very low36.4Very low126 Ų126116.6 Ų116.677%0.77380%0.795SS**  92.1143.554-120.70000113.1
164S33.6Very low36.1Very low106 Ų106112.8 Ų112.874%0.74179%0.786SS**  cis-159.6155.66.3-99.90000113.8
165G30.5Very low37.3Very low85 Ų85114.6 Ų114.688%0.87679%0.785SS**  trans75.6161.1140.800000120.5
166G29.3Very low37.1Very low74 Ų74111.6 Ų111.676%0.76377%0.774SS**  cis168.2138.1-11.400000115.3
167S31.8Very low36.4Very low111 Ų111111.9 Ų111.978%0.77677%0.773SS**  trans63.2117.2154.3-54.80000123.7
168T37.3Very low36.3Very low133 Ų133113.9 Ų113.982%0.81677%0.77SS**  trans65.4143.7137.252.30000123.5
169P58.4Low35.9Very low117 Ų117114 Ų11476%0.7676%0.764SS**  trans-93.1165.917340.2-36.7000113.2
170P44.8Very low35.5Very low129 Ų129115.8 Ų115.884%0.83877%0.766SS**  -156.6158.2102.339.5-21.6000118.3
171G28.9Very low36.2Very low64 Ų64113.6 Ų113.666%0.6676%0.762SS**  trans84.3131.1132.500000122.4
172I33.4Very low36.6Very low170 Ų170113.3 Ų113.387%0.87276%0.764SS**  trans57.5144.3151.672.9171.9000118.7
173S29.4Very low36.8Very low110 Ų110114.1 Ų114.177%0.76977%0.77SS**  cis-143.7171.215.5-66.10000112.4
174A29.3Very low37.3Very low88 Ų88115.3 Ų115.373%0.72777%0.77SS**  trans-90.1-174.6167.200000111.2
175P53.3Low37.1Very low113 Ų113116 Ų11673%0.73478%0.775SS**  cis-122.3-140.5-4.126.80000111.4
176T28.5Very low37.2Very low109 Ų109117.4 Ų117.467%0.66977%0.766SS**  cis-165.716212.2-17.80000112.5
177V33.1Very low37.7Very low131 Ų131121.7 Ų121.779%0.79477%0.771SS**  trans58.1176.2160.2-56.90000121.2
178T28.4Very low37.6Very low118 Ų118120.2 Ų120.272%0.72477%0.773SS**  -164.4155.7-70.2-50.40000107.5
179S29Very low37.4Very low100 Ų100123 Ų12370%0.69977%0.774SS**  trans80.5104.8157-61.80000122.8
180I39.2Very low36.1Very low157 Ų157123.4 Ų123.481%0.80578%0.775SS**  -6.5164122.543.3162.8000120.5
181P49.9Very low35.4Very low116 Ų116120.8 Ų120.875%0.75377%0.772SS**  cis-141.7-159.4-2138-15.9000115.2
182S41.3Very low35.7Very low107 Ų107126.4 Ų126.475%0.74878%0.783SS**  trans-60.6174.1-179.6-32.40000118
183P49.2Very low36.7Very low133 Ų133123.4 Ų123.486%0.86478%0.775SS**  -143.5-175.2108.740.7-27.3000116.8
184I45Very low38.2Very low151 Ų151123.4 Ų123.477%0.77477%0.772SS**  trans-107.2160.3-170.9-66155.6000111.1V186I184-V186 HydrophobicContact CG2-CG2 4.03Å
185S29.9Very low39.4Very low121 Ų121124 Ų12485%0.84677%0.769SS**  trans-145.9153.9163.6-83.10000113.5
186V32.3Very low38.5Very low113 Ų113127.6 Ų127.669%0.68578%0.776SS**  trans-153.2145.4-161.6166.90000113.4I184I184-V186 HydrophobicContact CG2-CG2 4.03Å
187N38.9Very low38.6Very low164 Ų164126.8 Ų126.888%0.87778%0.78SS**  trans79.7135.2160.2-74.8-6.1000125
188G30Very low38.5Very low80 Ų80128.3 Ų128.383%0.82578%0.783SS**  trans99.5154.8146.700000119.3
189F32.2Very low38.6Very low191 Ų191125.8 Ų125.884%0.83878%0.781SS**  cis-170.2158.9-22.3-174.4-122.7000112
190T31.6Very low38.6Very low126 Ų126129.9 Ų129.977%0.77379%0.789SS**  trans72.8141162.916.70000124.4
191G31.1Very low39.4Very low75 Ų75127.4 Ų127.477%0.77378%0.783SS**  trans164.1126.1159.500000116.4
192M33.8Very low39.6Very low181 Ų181127.1 Ų127.189%0.89278%0.781SS**  trans-170.7171.3176.3-99.1-146.2-63.500110.2
193P54.2Low39Very low108 Ų108125.9 Ų125.970%0.70178%0.778SS**  cis-125.7-119.8-15.125.7-0.2000114.8
194P62.7Low37.9Very low110 Ų110128.2 Ų128.271%0.71478%0.777SS**  -113.8-158-105.941.4-23.1000113.8
195P54.1Low37.1Very low101 Ų101125.2 Ų125.266%0.65678%0.775SS**  cis-145179.94.745.8-26.2000120.3
196Q34.1Very low37Very low188 Ų188126.1 Ų126.188%0.87978%0.775SS**  trans67.8147.9152.5-80167.4-32.900120.1
197A30.4Very low36.9Very low91 Ų91129.9 Ų129.975%0.75278%0.782SS**  cis-153161.3-12.200000108.6
198N31.5Very low36.3Very low163 Ų163128 Ų12887%0.87278%0.777SS**  176.4148.476.5171.753000112.3
199G31.1Very low36.3Very low65 Ų65131.3 Ų131.367%0.6778%0.776SS**  trans86.2105.5145.700000120.6
200Q27.8Very low36.1Very low187 Ų187125.4 Ų125.487%0.87477%0.769SS**  trans-134.4-178.3168.6-97.5-171.2-9600108.4
201P56.9Low36.2Very low104 Ų104126.4 Ų126.468%0.67577%0.768SS**  -131.1-128.5-53.741.3-21.7000108.2
202P53.3Low36.4Very low110 Ų110129.4 Ų129.471%0.71476%0.761SS**  cis-125.3-170.3-45.840-23.9000113.8
203A28.9Very low36.1Very low82 Ų82128.4 Ų128.468%0.67876%0.755SS**  trans69.1165.3151.500000119
204E25.6Very low34.9Very low181 Ų181131.3 Ų131.385%0.84675%0.753SS**  cis-161147.2-31.4-107.2-178.197.900110.2
205A28.9Very low34.4Very low88 Ų88131.6 Ų131.673%0.72776%0.755SS**  trans52.2171.8147.500000124.4
206V26.8Very low33.2Very low140 Ų140130.9 Ų130.985%0.84876%0.757SS**  trans90.6145.9158.9-172.10000120.1
207F30.6Very low33Very low193 Ų193130.8 Ų130.885%0.84676%0.757SS**  trans-81166.1-179-73.2-124000113.5
208T27.5Very low32.9Very low124 Ų124131.2 Ų131.276%0.76176%0.76SS**  162.6176.5104.5-159.90000115.4
209N29.1Very low32.9Very low149 Ų149128 Ų12880%0.79776%0.756SS**  trans-53.2169.1171.3-58.4-94000113.5
210G29.3Very low32.8Very low68 Ų68133.5 Ų133.570%0.70176%0.764SS**  cis151.9-1486.800000110.4
211I32.6Very low32.9Very low147 Ų147130 Ų13075%0.75476%0.761SS**  trans92.5101.8162.4-58.1-178.3000119.6
212H35.5Very low32.5Very low137 Ų137130.2 Ų130.263%0.63476%0.762SS**  trans71.2177.1144.8-62.7-179.9000118.8
213H26.5Very low31.5Very low161 Ų161131.5 Ų131.575%0.74577%0.768SS**  cis-149.3167.915.7-139.1-81.1000115.8
214Y30.3Very low31.6Very low168 Ų168131.8 Ų131.866%0.65977%0.771SS**  trans-120.4173.8176.135.924.1000111.8
215P52Low32Very low117 Ų117127.9 Ų127.976%0.7677%0.769SS**  cis-139.4-174.84.343.8-25.2000117.7
216A29.6Very low32.2Very low86 Ų86130.1 Ų130.171%0.71177%0.769SS**  trans66.9160.6152.700000119.9
217E28Very low32.8Very low186 Ų186129.2 Ų129.287%0.86977%0.766SS**  cis-158.7173.5-2.3-143.2169.792.600112.9
218A29.8Very low33.1Very low99 Ų99126.7 Ų126.782%0.81876%0.761SS**  trans80.2152.7157.400000123.3
219A31.6Very low33.7Very low95 Ų95128.3 Ų128.379%0.78576%0.759SS**  trans-81.3179.8-166.600000115
220Q28.7Very low34.3Very low181 Ų181130.1 Ų130.185%0.84676%0.763SS**  cis-157.1-178.738.5-63.2178-40.100114.2
221S29.3Very low34.3Very low114 Ų114131.2 Ų131.280%0.79777%0.766SS**  trans98.6147.3156.9-64.40000119.4
222P49.1Very low34.3Very low108 Ų108134.5 Ų134.570%0.70177%0.77SS**  trans-140.6-177.8-132.345-27.9000118.2
223T32.1Very low34Very low137 Ų137134.6 Ų134.684%0.8478%0.78SS**  trans72.5136.2152.4-56.20000116.8
224A31.5Very low34.3Very low89 Ų89130.4 Ų130.474%0.73678%0.781SS**  cis-175.4166.9-14.500000106.8
225A32.4Very low34.6Very low99 Ų99128.9 Ų128.982%0.81879%0.789SS**  cis-161.1158-23.300000108.1
226D34.9Very low33.7Very low135 Ų135130.4 Ų130.472%0.72279%0.786SS**  trans-130.5136.5173.7177.3-81.9000109.6L228D226-L228 PolarHBondContact OD1-N 2.96Å; D226-L228 VanDerWaalsContact OD1-N 3.14Å
227P37.5Very low33.7Very low121 Ų121133.7 Ų133.779%0.78679%0.787SS**  trans-11992.9167.935.8-22.4000112.8
228L38.1Very low33.9Very low140 Ų140135 Ų13573%0.73379%0.785SS**  trans-54.1164.7155.1-91.7169.4000113.4D226D226-L228 PolarHBondContact OD1-N 2.96Å; D226-L228 VanDerWaalsContact OD1-N 3.14Å
229Q40.1Very low33.9Very low157 Ų157135 Ų13573%0.73479%0.785SS**  trans70.6153.4166.7-114.75635.700113.3
230Q42.3Very low34Very low187 Ų187137.1 Ų137.187%0.87479%0.788SS**  cis-140.5137.725.2-60.7164.4-38.600112.3
231A29.3Very low34.1Very low92 Ų92134.5 Ų134.576%0.7679%0.789SS**  trans-116.3107.8166.900000109.3
232Y31.6Very low34.4Very low215 Ų215133.9 Ų133.984%0.84379%0.791SS**  trans-157.7135.7172.4-142.1-108.3000111.6
233T29.8Very low33.4Very low139 Ų139133.4 Ų133.485%0.85380%0.796SS**  trans63.8155.8-17578.20000114.9
234G32.7Very low33.5Very low73 Ų73137.8 Ų137.875%0.75380%0.799SS**  cis-157.4171.71.600000112.6
235V35.9Very low34.2Very low137 Ų137139.6 Ų139.683%0.8380%0.804SS**  trans-84.7154.6-161.8-139.50000115.4
236Q33.7Very low34.5Very low148 Ų148139.7 Ų139.769%0.69280%0.804SS**  trans99.8131.6147.7-73.5-178.2111.100122.7
237Q29.7Very low34.4Very low156 Ų156137.2 Ų137.273%0.72980%0.803SS**  trans70.5156.4147.2-69.8162.7-35.600116.8
238Y31.5Very low34.4Very low213 Ų213142.6 Ų142.684%0.83581%0.809SS**  cis-154.71631623.3-103.1000113.2
239A29.7Very low34.4Very low100 Ų100139.3 Ų139.383%0.82681%0.809SS**  trans74.2154.815100000121.6
240V33.3Very low34.2Very low139 Ų139140.6 Ų140.684%0.84282%0.815SS**  trans-111.6144.2-176.7168.90000110
241S31.6Very low33.8Very low125 Ų125138.8 Ų138.887%0.87481%0.809SS**  trans-165167.1151.4-85.30000111.2
242A35.3Very low34.4Very low101 Ų101140 Ų14084%0.83581%0.812SS**  trans-125.5162.1-167.500000113.2
243A27.5Very low34.9Very low98 Ų98138.2 Ų138.281%0.8181%0.812SS**  trans158161148.500000112.3
244Y34.8Very low35.4Very low230 Ų230135.7 Ų135.790%0.90281%0.805SS**  trans-81.1-179.6176.7-59.3-88.3000112.1
245P46.2Very low35.9Very low127 Ų127140.8 Ų140.883%0.82581%0.807SS**  cis-131.6-167.3337.5-16.1000115.1
246A38.5Very low36.3Very low101 Ų101140.2 Ų140.284%0.83581%0.806SS**  trans-90.3155.4-173.700000115.2
247A33.7Very low36.9Very low83 Ų83140.8 Ų140.869%0.68681%0.808SS**  trans-161.4157147.100000111.4
248Y36.8Very low37.9Very low233 Ų233138.6 Ų138.691%0.91481%0.807SS**  trans57.6113172.3-71.6-83000118.9
249G38Very low38.6Very low71 Ų71133.8 Ų133.873%0.73280%0.802SS**  trans-92.1160164.900000112.7
250Q35.7Very low39.3Very low184 Ų184134.2 Ų134.286%0.8680%0.797SS**  trans-119.2136.8164.6-104.2-65.5-24.600109.1
251I35.3Very low40Very low149 Ų149135.6 Ų135.676%0.76480%0.798SS**  trans-103.987.5-166.3-50.6165.5000108.4Q253I251-Q253 PolarHBondContact O-N 3.08Å
252S41.2Very low40.7Very low117 Ų117135.2 Ų135.282%0.81879%0.785SS**  trans-62.7109.6169.2-58.80000109.2A254S252-A254 PolarHBondContact O-N 2.86Å
253Q42.6Very low41Very low179 Ų179132.8 Ų132.884%0.83676%0.76SS**  trans-68.298177.5-71.8-170.8-1600110.1I251 F255I251-Q253 PolarHBondContact O-N 3.08Å; Q253-F255 PolarHBondContact O-N 3.46Å
254A39.7Very low41.7Very low86 Ų86136.1 Ų136.171%0.71176%0.759SS**  trans-63.7127.7164.200000108.8S252S252-A254 PolarHBondContact O-N 2.86Å
255F43.9Very low42.4Very low180 Ų180132.4 Ų132.479%0.78975%0.75SS**  trans-58.5135.6171.1-78.6-101.9000109.1Q253 H257Q253-F255 PolarHBondContact O-N 3.46Å; F255-H257 VanDerWaalsContact C-N 3.33Å; F255-H257 PolarHBondContact O-CD2 3.39Å; F255-H257 PolarHBondContact O-N 3.36Å
256P43.8Very low43Very low125 Ų125129.8 Ų129.881%0.81273%0.727SS**  trans-68.594.617428.1-33.2000108.9
257H46.6Very low44.3Very low160 Ų160133.4 Ų133.474%0.74172%0.719SS**PPolyproline II helixtrans-54132.7169.7-61.5-90.1000108.6F255F255-H257 VanDerWaalsContact C-N 3.33Å; F255-H257 PolarHBondContact O-CD2 3.39Å; F255-H257 PolarHBondContact O-N 3.36Å
258P50.5Low46.1Very low109 Ų109134.4 Ų134.471%0.70871%0.709SS**PPolyproline II helixtrans-57.1135.6166.326.3-33000107.5
259P46.6Very low47.9Very low112 Ų112123.8 Ų123.873%0.72767%0.671SS**PPolyproline II helixtrans-57133-178.924.2-33.5000108.3I261P259-I261 PolarHBondContact O-N 3.04Å; P259-I261 VanDerWaalsContact O-N 3.1Å
260P43.7Very low49.8Very low109 Ų109123.9 Ų123.971%0.70866%0.658SS**PPolyproline II helixtrans-56.8126179.623.6-32.9000107.8I262P260-I262 WeakPolarHBondContact O-CG1 3.35Å; P260-I262 PolarHBondContact O-N 3.25Å
261I48Very low51.9Low169 Ų169123.7 Ų123.787%0.86766%0.657SS**  trans-71.481.1170.5-55.1177.9000105.9P259P259-I261 PolarHBondContact O-N 3.04Å; P259-I261 VanDerWaalsContact O-N 3.1Å
262I45.8Very low54.1Low117 Ų117118.3 Ų118.360%0.664%0.638SS**  trans-49.6129.1167.3-44.6179.1000104.7P260 Q264P260-I262 WeakPolarHBondContact O-CG1 3.35Å; P260-I262 PolarHBondContact O-N 3.25Å; I262-Q264 PolarHBondContact O-N 3.16Å
263P41.6Very low56.5Low49 Ų49112.7 Ų112.732%0.31860%0.599SS.*  trans-50.8145.1169.324.5-35.2000107.6E1 Q265E1-P263 WeakPolarHBondContact OE2-CB 3.49Å; E1-P263 WeakPolarHBondContact OE2-CG 3.23Å; P263-Q265 PolarHBondContact O-N 2.74Å
264Q43.5Very low58.8Low168 Ų168104.9 Ų104.979%0.78556%0.563SS**  trans-66.178.7161.2-69.9-177.3-1.600107.8I262 Q266I262-Q264 PolarHBondContact O-N 3.16Å; Q264-Q266 PolarHBondContact O-N 2.86Å
265Q49.8Very low61.4Low153 Ų153100.8 Ų100.872%0.71553%0.529SS*.  trans-44.8123.6134.7-70.5-1761200104.9P263 R267P263-Q265 PolarHBondContact O-N 2.74Å; Q265-R267 PolarHBondContact O-N 2.91Å
266Q57.8Low63.8Low72 Ų7294.1 Ų94.134%0.33650%0.5SS..  trans-43.6106.7176.1-174.1-176.4-28.400107.3Q264 E268 S301Q264-Q266 PolarHBondContact O-N 2.86Å; Q266-E268 VanDerWaalsContact C-N 3.28Å; Q266-E268 PolarHBondContact O-N 2.67Å; Q266-S301 WeakPolarHBondContact CG-OG 3.36Å
267R65.3Low66.2Low177 Ų17788.2 Ų88.267%0.66846%0.462SS*.  trans-70.393.2-168.4-85.8-173.5173.9175.7-2.3107.6Q265 G269 I300Q265-R267 PolarHBondContact O-N 2.91Å; R267-G269 PolarHBondContact O-N 3.23Å; R267-I300 HydrophobicContact CB-CG2 3.39Å; R267-I300 WeakPolarHBondContact O-CG2 3.14Å
268E72.5Confident68.4Low104 Ų10484.8 Ų84.849%0.48644%0.443SS..  trans-61.7132.5169.5-55.2-149.14300107.2Q266 K349Q266-E268 VanDerWaalsContact C-N 3.28Å; Q266-E268 PolarHBondContact O-N 2.67Å; E268-K349 IonicContact OE1-NZ 2.62Å; E268-K349 PolarHBondContact OE1-NZ 3.41Å; E268-K349 IonicContact OE2-NZ 2.72Å; E268-K349 PolarHBondContact OE2-NZ 3.42Å
269G73.1Confident70.3Confident10 Ų1084 Ų8410%0.10343%0.43CS..  trans-67.9177.6175.200000110.8R267 N274 F321R267-G269 PolarHBondContact O-N 3.23Å; G269-N274 PolarHBondContact N-OD1 3.33Å; G269-N274 PolarHBondContact O-ND2 3.37Å; G269-F321 WeakPolarHBondContact CA-O 3.37Å
270P79Confident72.5Confident72 Ų7278.7 Ų78.747%0.46840%0.395SS..SBendtrans-52.1160170-17.126.1000111.6C273 N274P270-C273 WeakPolarHBondContact O-CB 3.17Å; P270-C273 PolarHBondContact O-N 2.89Å; P270-C273 PolarHBondContact O-SG 2.94Å; P270-C273 VanDerWaalsContact O-SG 3.37Å; P270-N274 PolarHBondContact O-ND2 2.69Å
271E80.2Confident74.5Confident181 Ų18174.4 Ų74.485%0.84637%0.367SS*.THydrogen-bonded Turntrans-55.4144.8172.961.1-175.5101.100111.5C273E271-C273 PolarHBondContact O-N 2.98Å
272G81.9Confident76.3Confident35 Ų3571.6 Ų71.636%0.36135%0.35SS..THydrogen-bonded Turntrans75-9.8-16900000116.1L348G272-L348 WeakPolarHBondContact O-CD2 3.47Å
273C90.1Very high78.3Confident0 Ų074.5 Ų74.50%036%0.361CS..  trans-96-10.7179.3-48.40000113.8P270 E271 F321 P324P270-C273 WeakPolarHBondContact O-CB 3.17Å; P270-C273 PolarHBondContact O-N 2.89Å; P270-C273 PolarHBondContact O-SG 2.94Å; P270-C273 VanDerWaalsContact O-SG 3.37Å; E271-C273 PolarHBondContact O-N 2.98Å; C273-F321 HydrophobicContact CB-CB 4.45Å; C273-F321 VanDerWaalsContact CB-O 3.26Å; C273-F321 WeakPolarHBondContact CB-O 3.47Å; C273-F321 PolarHBondContact O-N 2.77Å; C273-P324 WeakPolarHBondContact SG-CD 3.5Å
274N92.2Very high80.5Confident15 Ų1573.8 Ų73.88%0.0835%0.353CS..EExtended strand (participates in β ladder)trans-94.3123.1-176.7-62.9-64.2000110.7G269 P270 S320 K349G269-N274 PolarHBondContact N-OD1 3.33Å; G269-N274 PolarHBondContact O-ND2 3.37Å; P270-N274 PolarHBondContact O-ND2 2.69Å; N274-S320 VanDerWaalsContact OD1-CB 3.22Å; N274-S320 WeakPolarHBondContact OD1-CB 3.36Å; N274-S320 PolarHBondContact OD1-OG 3Å; N274-K349 HydrophobicContact CB-CB 3.92Å; N274-K349 HydrophobicContact CB-CD 4.13Å; N274-K349 WeakPolarHBondContact O-CB 3.48Å; N274-K349 PolarHBondContact O-N 3.4Å
275L93.3Very high82.6Confident0 Ų067.3 Ų67.30%033%0.332CS..EExtended strand (participates in β ladder)trans-104.4151.3178.9-57.9-170.7000112I277 F293 F318 V319 F321 A327 A330 I331 V346 Q347 L348L275-I277 HydrophobicContact CB-CD1 3.97Å; L275-F293 HydrophobicContact CD1-CD1 4.25Å; L275-F293 HydrophobicContact CD1-CE1 3.96Å; L275-F318 VanDerWaalsContact O-CA 3.27Å; L275-F318 WeakPolarHBondContact O-CA 3.39Å; L275-F318 WeakPolarHBondContact O-CB 3.44Å; L275-F318 WeakPolarHBondContact O-CD1 3.34Å; L275-V319 HydrophobicContact CB-CB 4.46Å; L275-V319 WeakPolarHBondContact CB-O 3.47Å; L275-V319 PolarHBondContact N-O 2.85Å; L275-V319 PolarHBondContact O-N 3.45Å; L275-V319 VanDerWaalsContact O-N 3.16Å; L275-F321 HydrophobicContact CD1-CD2 4.18Å; L275-F321 HydrophobicContact CD1-CE2 3.7Å; L275-F321 HydrophobicContact CG-CD2 4.38Å; L275-F321 HydrophobicContact CG-CE2 4.37Å; L275-A327 HydrophobicContact CD2-CB 3.92Å; L275-A327 HydrophobicContact CG-CB 4.28Å; L275-A330 HydrophobicContact CD1-CB 3.83Å; L275-I331 HydrophobicContact CD1-CG1 4.4Å; L275-I331 HydrophobicContact CD2-CD1 3.56Å; L275-I331 HydrophobicContact CD2-CG1 3.64Å; L275-V346 HydrophobicContact CB-CG1 4.47Å; L275-V346 HydrophobicContact CD1-CG1 3.79Å; L275-Q347 CarbonylContact C-O 3.46Å; L275-Q347 WeakPolarHBondContact CA-O 3.35Å; L275-L348 HydrophobicContact CD2-CD2 4Å
276F94.2Very high84.6Confident40 Ų4063.3 Ų63.318%0.17532%0.315CS..EExtended strand (participates in β ladder)trans-123.4122.3170.1-167.9-156.8000109.7Y278 F316 G317 F318 Q347F276-Y278 HydrophobicContact CD1-CD2 4.48Å; F276-Y278 AromaticContact CD1-CE2 3.51Å; F276-Y278 HydrophobicContact CD1-CE2 3.51Å; F276-Y278 AromaticContact CD1-CZ 3.72Å; F276-Y278 HydrophobicContact CE1-CE1 4.12Å; F276-Y278 AromaticContact CE1-CE2 3.66Å; F276-Y278 HydrophobicContact CE1-CE2 3.66Å; F276-Y278 AromaticContact CE1-CZ 3.36Å; F276-Y278 WeakPolarHBondContact CE1-OH 3.41Å; F276-Y278 HydrophobicContact CG-CE2 4.04Å; F276-Y278 HydrophobicContact CZ-CE1 4.26Å; F276-Y278 HydrophobicContact CZ-CE2 4.28Å; F276-Y278 AromaticContact CZ-CZ 3.92Å; F276-F316 HydrophobicContact CE2-CB 4.3Å; F276-F316 AromaticContact CE2-CD2 3.69Å; F276-F316 HydrophobicContact CE2-CD2 3.69Å; F276-F316 HydrophobicContact CE2-CE2 4.34Å; F276-F316 HydrophobicContact CE2-CG 4.28Å; F276-F316 HydrophobicContact CZ-CD2 4.15Å; F276-G317 WeakPolarHBondContact CD2-O 3.44Å; F276-F318 HydrophobicContact CB-CD1 3.94Å; F276-F318 HydrophobicContact CB-CE1 3.88Å; F276-F318 HydrophobicContact CD1-CE1 4.12Å; F276-F318 HydrophobicContact CD1-CZ 4.48Å; F276-F318 AromaticContact CD2-CD1 3.54Å; F276-F318 HydrophobicContact CD2-CD1 3.54Å; F276-F318 HydrophobicContact CD2-CD2 4.23Å; F276-F318 AromaticContact CD2-CE1 3.22Å; F276-F318 HydrophobicContact CD2-CE1 3.22Å; F276-F318 AromaticContact CD2-CE2 3.96Å; F276-F318 HydrophobicContact CD2-CE2 3.96Å; F276-F318 HydrophobicContact CD2-CG 4.05Å; F276-F318 AromaticContact CD2-CZ 3.46Å; F276-F318 HydrophobicContact CD2-CZ 3.46Å; F276-F318 VanDerWaalsContact CD2-CZ 3.46Å; F276-F318 HydrophobicContact CE1-CE1 4.46Å; F276-F318 HydrophobicContact CE1-CZ 4.38Å; F276-F318 HydrophobicContact CE2-CD1 4.28Å; F276-F318 HydrophobicContact CE2-CD2 4.32Å; F276-F318 AromaticContact CE2-CE1 3.67Å; F276-F318 HydrophobicContact CE2-CE1 3.67Å; F276-F318 AromaticContact CE2-CE2 3.71Å; F276-F318 HydrophobicContact CE2-CE2 3.71Å; F276-F318 AromaticContact CE2-CZ 3.35Å; F276-F318 HydrophobicContact CE2-CZ 3.35Å; F276-F318 AromaticContact CG-CD1 3.95Å; F276-F318 HydrophobicContact CG-CD1 3.95Å; F276-F318 AromaticContact CG-CE1 3.5Å; F276-F318 HydrophobicContact CG-CE1 3.5Å; F276-F318 VanDerWaalsContact CG-CE1 3.5Å; F276-F318 HydrophobicContact CG-CZ 4.07Å; F276-F318 HydrophobicContact CZ-CE1 4.28Å; F276-F318 HydrophobicContact CZ-CE2 4.48Å; F276-F318 AromaticContact CZ-CZ 3.86Å; F276-F318 HydrophobicContact CZ-CZ 3.86Å; F276-Q347 PolarHBondContact N-O 2.85Å; F276-Q347 PolarHBondContact O-N 3.01Å
277I94.2Very high86.1Confident0 Ų061.5 Ų61.50%032%0.316CS..EExtended strand (participates in β ladder)trans-115.3126-171.5-54.182.8000109L275 L280 L289 F293 F316 G317 V319 K345 V346L275-I277 HydrophobicContact CB-CD1 3.97Å; I277-L280 HydrophobicContact CB-CD2 4.49Å; I277-L280 HydrophobicContact CG2-CD2 3.63Å; I277-L280 HydrophobicContact CG2-CG 4.11Å; I277-L289 HydrophobicContact CG1-CD1 4.46Å; I277-F293 HydrophobicContact CD1-CZ 4.49Å; I277-F293 HydrophobicContact CG1-CE1 4.37Å; I277-F293 HydrophobicContact CG1-CE2 4.38Å; I277-F293 HydrophobicContact CG1-CZ 3.82Å; I277-F316 CarbonylContact O-C 3.54Å; I277-F316 WeakPolarHBondContact O-CA 3.44Å; I277-F316 WeakPolarHBondContact O-CB 3.22Å; I277-G317 PolarHBondContact N-O 2.87Å; I277-G317 PolarHBondContact O-N 2.86Å; I277-V319 HydrophobicContact CD1-CB 3.93Å; I277-V319 HydrophobicContact CD1-CG2 3.7Å; I277-K345 WeakPolarHBondContact CA-O 3.15Å; I277-V346 HydrophobicContact CG1-CG1 4.27Å; I277-V346 HydrophobicContact CG1-CG2 4.12Å; I277-V346 HydrophobicContact CG2-CG2 4.09Å
278Y93Very high87.3Confident88 Ų8858.1 Ų58.135%0.34531%0.308SS..EExtended strand (participates in β ladder)trans-112.7163.8174-60.8-108.6000111.5F276 L280 C315 K345 Q347F276-Y278 HydrophobicContact CD1-CD2 4.48Å; F276-Y278 AromaticContact CD1-CE2 3.51Å; F276-Y278 HydrophobicContact CD1-CE2 3.51Å; F276-Y278 AromaticContact CD1-CZ 3.72Å; F276-Y278 HydrophobicContact CE1-CE1 4.12Å; F276-Y278 AromaticContact CE1-CE2 3.66Å; F276-Y278 HydrophobicContact CE1-CE2 3.66Å; F276-Y278 AromaticContact CE1-CZ 3.36Å; F276-Y278 WeakPolarHBondContact CE1-OH 3.41Å; F276-Y278 HydrophobicContact CG-CE2 4.04Å; F276-Y278 HydrophobicContact CZ-CE1 4.26Å; F276-Y278 HydrophobicContact CZ-CE2 4.28Å; F276-Y278 AromaticContact CZ-CZ 3.92Å; Y278-L280 VanDerWaalsContact C-N 3.29Å; Y278-L280 PolarHBondContact O-N 3.3Å; Y278-C315 CarbonylContact C-O 3.53Å; Y278-K345 PolarHBondContact N-O 3.3Å; Y278-K345 PolarHBondContact O-N 3.24Å; Y278-K345 VanDerWaalsContact O-N 3.08Å; Y278-Q347 VanDerWaalsContact CE2-NE2 3.31Å
279H91.3Very high88.3Confident94 Ų9453.1 Ų53.144%0.43529%0.285SS..SBendtrans65.723.9177.5-46.7151.9000115C315 K342 R343H279-C315 WeakPolarHBondContact CA-O 3.39Å; H279-C315 PolarHBondContact N-O 3.33Å; H279-K342 WeakPolarHBondContact O-CE 3.48Å; H279-R343 WeakPolarHBondContact CB-O 3.38Å; H279-R343 PolarHBondContact ND1-O 2.91Å
280L91.4Very high89.2Confident0 Ų056.1 Ų56.10%030%0.297CS..  trans-51.1149.3169.9-63.1174.6000110.9I277 Y278 F284 L289 V304 C315 K342 L344I277-L280 HydrophobicContact CB-CD2 4.49Å; I277-L280 HydrophobicContact CG2-CD2 3.63Å; I277-L280 HydrophobicContact CG2-CG 4.11Å; Y278-L280 VanDerWaalsContact C-N 3.29Å; Y278-L280 PolarHBondContact O-N 3.3Å; L280-F284 HydrophobicContact CB-CB 4.39Å; L280-F284 HydrophobicContact CD2-CD1 4.45Å; L280-L289 HydrophobicContact CD1-CD1 4.42Å; L280-L289 HydrophobicContact CD1-CD2 4.19Å; L280-L289 HydrophobicContact CD2-CD1 3.9Å; L280-V304 HydrophobicContact CD1-CG1 4.38Å; L280-V304 HydrophobicContact CD1-CG2 3.82Å; L280-C315 PolarHBondContact N-O 3.45Å; L280-C315 WeakPolarHBondContact O-CB 3.43Å; L280-C315 PolarHBondContact O-SG 3.17Å; L280-K342 PolarHBondContact O-NZ 3.29Å; L280-L344 HydrophobicContact CD2-CD2 3.96Å
281P87.3Confident89.8Confident19 Ų1958.5 Ų58.512%0.12330%0.302CS..  trans-55.5156.9165.3-24.235.1000111.5E283 F284 I339P281-E283 PolarHBondContact O-N 2.99Å; P281-F284 HydrophobicContact CB-CB 4.41Å; P281-F284 HydrophobicContact CB-CD2 3.72Å; P281-F284 HydrophobicContact CB-CE2 4.42Å; P281-F284 HydrophobicContact CB-CG 4.3Å; P281-F284 HydrophobicContact CG-CD2 3.55Å; P281-F284 HydrophobicContact CG-CE2 3.89Å; P281-F284 HydrophobicContact CG-CG 4.07Å; P281-F284 PolarHBondContact O-N 3.39Å; P281-I339 HydrophobicContact CG-CB 4.44Å; P281-I339 HydrophobicContact CG-CD1 3.62Å; P281-I339 HydrophobicContact CG-CG1 3.74Å; P281-I339 HydrophobicContact CG-CG2 3.87Å
282Q85.6Confident90.3Very high110 Ų11051.7 Ų51.751%0.51427%0.27SS..THydrogen-bonded Turntrans-69.4-26.6179.4-167.2170-45.700112S313Q282-S313 WeakPolarHBondContact O-CB 3.35Å
283E86.9Confident90.8Very high177 Ų17750 Ų5083%0.82725%0.253SS*.THydrogen-bonded Turntrans-83.2-11.6179.8-62.1153.3112.700113.4P281 G285P281-E283 PolarHBondContact O-N 2.99Å; E283-G285 PolarHBondContact O-N 2.95Å
284F87.1Confident90.9Very high35 Ų3553.4 Ų53.415%0.15427%0.271CS..  trans-75.3113-177.2-99.7-123.6000111.5L280 P281 E288 M292 V304 I339L280-F284 HydrophobicContact CB-CB 4.39Å; L280-F284 HydrophobicContact CD2-CD1 4.45Å; P281-F284 HydrophobicContact CB-CB 4.41Å; P281-F284 HydrophobicContact CB-CD2 3.72Å; P281-F284 HydrophobicContact CB-CE2 4.42Å; P281-F284 HydrophobicContact CB-CG 4.3Å; P281-F284 HydrophobicContact CG-CD2 3.55Å; P281-F284 HydrophobicContact CG-CE2 3.89Å; P281-F284 HydrophobicContact CG-CG 4.07Å; P281-F284 PolarHBondContact O-N 3.39Å; F284-E288 HydrophobicContact CD1-CB 3.86Å; F284-E288 HydrophobicContact CD2-CB 4.47Å; F284-E288 HydrophobicContact CE1-CB 4.01Å; F284-E288 HydrophobicContact CG-CB 4.1Å; F284-E288 HydrophobicContact CZ-CB 4.39Å; F284-M292 HydrophobicContact CE1-CB 4.42Å; F284-M292 HydrophobicContact CE1-CE 3.46Å; F284-M292 VanDerWaalsContact CE1-CE 3.46Å; F284-M292 HydrophobicContact CE1-SD 3.8Å; F284-M292 HydrophobicContact CZ-CE 3.61Å; F284-V304 WeakPolarHBondContact O-CG1 3.5Å; F284-I339 HydrophobicContact CE1-CD1 4.38Å; F284-I339 HydrophobicContact CE2-CD1 3.7Å; F284-I339 HydrophobicContact CZ-CD1 3.59Å
285G89.2Confident90.9Very high32 Ų3257.5 Ų57.533%0.3330%0.298SS..  trans-86.4-178.1169.200000113.5E283 L289 V304E283-G285 PolarHBondContact O-N 2.95Å; G285-L289 WeakPolarHBondContact O-CB 3.48Å; G285-L289 PolarHBondContact O-N 3.45Å; G285-V304 VanDerWaalsContact C-CG2 3.5Å; G285-V304 WeakPolarHBondContact O-CG2 3.42Å
286D90.4Very high90.9Very high68 Ų6859.7 Ų59.736%0.36431%0.308SS..Hα-helixtrans-67.6-35.5175.840.2-131.3000113.1L289 M290 S302 K303D286-L289 PolarHBondContact O-N 2.94Å; D286-M290 PolarHBondContact O-N 3.36Å; D286-S302 WeakPolarHBondContact O-CB 3.41Å; D286-S302 PolarHBondContact O-OG 3.45Å; D286-K303 IonicContact OD1-NZ 3.31Å; D286-K303 PolarHBondContact OD1-NZ 3.31Å
287G89.7Confident90.7Very high35 Ų3558.8 Ų58.836%0.36131%0.31SS..Hα-helixtrans-57.3-53.5169.700000113.3L289 M290 Q291G287-L289 VanDerWaalsContact C-N 3.32Å; G287-L289 PolarHBondContact O-N 3.42Å; G287-M290 WeakPolarHBondContact O-CB 2.98Å; G287-M290 PolarHBondContact O-N 2.79Å; G287-M290 VanDerWaalsContact O-N 3.09Å; G287-Q291 WeakPolarHBondContact O-CB 3.27Å; G287-Q291 PolarHBondContact O-N 2.73Å
288E91.7Very high90.6Very high105 Ų10563.2 Ų63.249%0.49133%0.333SS..Hα-helixtrans-59.9-41.5177.4-64.4-56.7105.500112.3F284 M290 Q291 M292F284-E288 HydrophobicContact CD1-CB 3.86Å; F284-E288 HydrophobicContact CD2-CB 4.47Å; F284-E288 HydrophobicContact CE1-CB 4.01Å; F284-E288 HydrophobicContact CG-CB 4.1Å; F284-E288 HydrophobicContact CZ-CB 4.39Å; E288-M290 VanDerWaalsContact C-N 3.31Å; E288-M290 PolarHBondContact O-N 3.1Å; E288-Q291 PolarHBondContact O-N 3.33Å; E288-M292 VanDerWaalsContact O-CB 3.29Å; E288-M292 WeakPolarHBondContact O-CB 3.36Å; E288-M292 PolarHBondContact O-N 2.84Å
289L92Very high90.5Very high0 Ų059.6 Ų59.60%032%0.321CS..Hα-helixtrans-65.2-32.9176-179.161000112.4I277 L280 G285 D286 G287 F293 V304 V319I277-L289 HydrophobicContact CG1-CD1 4.46Å; L280-L289 HydrophobicContact CD1-CD1 4.42Å; L280-L289 HydrophobicContact CD1-CD2 4.19Å; L280-L289 HydrophobicContact CD2-CD1 3.9Å; G285-L289 WeakPolarHBondContact O-CB 3.48Å; G285-L289 PolarHBondContact O-N 3.45Å; D286-L289 PolarHBondContact O-N 2.94Å; G287-L289 VanDerWaalsContact C-N 3.32Å; G287-L289 PolarHBondContact O-N 3.42Å; L289-F293 HydrophobicContact CD1-CD2 3.9Å; L289-F293 HydrophobicContact CD1-CE2 3.73Å; L289-F293 VanDerWaalsContact O-CD2 3.27Å; L289-F293 WeakPolarHBondContact O-CD2 3.29Å; L289-V304 HydrophobicContact CB-CG2 3.95Å; L289-V304 HydrophobicContact CD2-CG2 3.64Å; L289-V304 HydrophobicContact CG-CG2 4.42Å; L289-V319 HydrophobicContact CD1-CG2 3.85Å; L289-V319 HydrophobicContact CD2-CG2 3.91Å; L289-V319 HydrophobicContact CG-CG2 3.57Å
290M91.9Very high90.5Very high73 Ų7358.4 Ų58.436%0.3632%0.317SS..Hα-helixtrans-69.1-53171.7-173.8174.470.700110.5D286 G287 E288 M292 F293 L294 V299D286-M290 PolarHBondContact O-N 3.36Å; G287-M290 WeakPolarHBondContact O-CB 2.98Å; G287-M290 PolarHBondContact O-N 2.79Å; G287-M290 VanDerWaalsContact O-N 3.09Å; E288-M290 VanDerWaalsContact C-N 3.31Å; E288-M290 PolarHBondContact O-N 3.1Å; M290-M292 VanDerWaalsContact C-N 3.27Å; M290-M292 PolarHBondContact O-N 2.81Å; M290-F293 PolarHBondContact O-N 3.23Å; M290-L294 HydrophobicContact CG-CD2 4.34Å; M290-L294 HydrophobicContact CG-CG 4.4Å; M290-L294 WeakPolarHBondContact O-CG 3.48Å; M290-L294 PolarHBondContact O-N 3.09Å; M290-V299 HydrophobicContact CG-CB 4.09Å; M290-V299 HydrophobicContact CG-CG1 3.94Å
291Q91.7Very high90.3Very high122 Ų12259.5 Ų59.557%0.5732%0.324SS*.Hα-helixtrans-56-41.2-176.5-163.772.4-0.200112.3G287 E288 F293G287-Q291 WeakPolarHBondContact O-CB 3.27Å; G287-Q291 PolarHBondContact O-N 2.73Å; E288-Q291 PolarHBondContact O-N 3.33Å; Q291-F293 VanDerWaalsContact C-N 3.28Å; Q291-F293 PolarHBondContact O-N 2.94Å
292M90.8Very high90.6Very high37 Ų3759.4 Ų59.418%0.18232%0.324CS..Hα-helixtrans-63.3-27.6174.8172.8177.1-87.400113.8F284 E288 M290 M334 I339 L344F284-M292 HydrophobicContact CE1-CB 4.42Å; F284-M292 HydrophobicContact CE1-CE 3.46Å; F284-M292 VanDerWaalsContact CE1-CE 3.46Å; F284-M292 HydrophobicContact CE1-SD 3.8Å; F284-M292 HydrophobicContact CZ-CE 3.61Å; E288-M292 VanDerWaalsContact O-CB 3.29Å; E288-M292 WeakPolarHBondContact O-CB 3.36Å; E288-M292 PolarHBondContact O-N 2.84Å; M290-M292 VanDerWaalsContact C-N 3.27Å; M290-M292 PolarHBondContact O-N 2.81Å; M292-M334 HydrophobicContact CE-CE 4.1Å; M292-M334 HydrophobicContact CG-CE 3.5Å; M292-M334 VanDerWaalsContact CG-CE 3.5Å; M292-M334 HydrophobicContact SD-CE 3.5Å; M292-M334 VanDerWaalsContact SD-CE 3.5Å; M292-I339 HydrophobicContact CE-CD1 3.8Å; M292-L344 HydrophobicContact CE-CD1 4.33Å; M292-L344 HydrophobicContact SD-CD1 3.84Å
293F92.3Very high90.9Very high0 Ų058 Ų580%032%0.316CS..Hα-helixtrans-104.3-16.1-173.5-82.8-103.7000114.5L275 I277 L289 M290 Q291 F296 V299 V319 F321 A330 M334 V346L275-F293 HydrophobicContact CD1-CD1 4.25Å; L275-F293 HydrophobicContact CD1-CE1 3.96Å; I277-F293 HydrophobicContact CD1-CZ 4.49Å; I277-F293 HydrophobicContact CG1-CE1 4.37Å; I277-F293 HydrophobicContact CG1-CE2 4.38Å; I277-F293 HydrophobicContact CG1-CZ 3.82Å; L289-F293 HydrophobicContact CD1-CD2 3.9Å; L289-F293 HydrophobicContact CD1-CE2 3.73Å; L289-F293 VanDerWaalsContact O-CD2 3.27Å; L289-F293 WeakPolarHBondContact O-CD2 3.29Å; M290-F293 PolarHBondContact O-N 3.23Å; Q291-F293 VanDerWaalsContact C-N 3.28Å; Q291-F293 PolarHBondContact O-N 2.94Å; F293-F296 HydrophobicContact CD1-CD2 4.47Å; F293-F296 WeakPolarHBondContact O-CD2 3.13Å; F293-F296 PolarHBondContact O-N 3.34Å; F293-F296 VanDerWaalsContact O-N 3.15Å; F293-V299 HydrophobicContact CB-CG2 4.07Å; F293-V319 HydrophobicContact CB-CG1 4.01Å; F293-V319 HydrophobicContact CB-CG2 4.45Å; F293-V319 HydrophobicContact CD1-CB 4.47Å; F293-V319 HydrophobicContact CD1-CG1 4.2Å; F293-V319 HydrophobicContact CD1-CG2 4.39Å; F293-V319 HydrophobicContact CD2-CG2 4.26Å; F293-V319 HydrophobicContact CG-CG1 4.21Å; F293-V319 HydrophobicContact CG-CG2 4.1Å; F293-F321 HydrophobicContact CB-CZ 3.98Å; F293-F321 HydrophobicContact CD1-CE2 4.03Å; F293-F321 AromaticContact CD1-CZ 3.98Å; F293-F321 HydrophobicContact CD1-CZ 3.98Å; F293-F321 HydrophobicContact CG-CZ 4.5Å; F293-F321 WeakPolarHBondContact O-CZ 3.48Å; F293-A330 HydrophobicContact CD1-CB 3.9Å; F293-A330 HydrophobicContact CE1-CB 4.04Å; F293-M334 HydrophobicContact CE1-CB 4.21Å; F293-M334 HydrophobicContact CE1-CG 4.19Å; F293-M334 HydrophobicContact CE2-CE 4.49Å; F293-M334 HydrophobicContact CZ-CB 3.94Å; F293-M334 HydrophobicContact CZ-CG 4.1Å; F293-V346 HydrophobicContact CE1-CG1 4.19Å; F293-V346 HydrophobicContact CZ-CG1 4.44Å; F293-V346 HydrophobicContact CZ-CG2 4.01Å
294L92.1Very high91.1Very high71 Ų7149.9 Ų49.937%0.37228%0.279SS..G310 helixtrans-47.6-40.6170.4-71.9178.7000115.9M290 F296 G297 V299M290-L294 HydrophobicContact CG-CD2 4.34Å; M290-L294 HydrophobicContact CG-CG 4.4Å; M290-L294 WeakPolarHBondContact O-CG 3.48Å; M290-L294 PolarHBondContact O-N 3.09Å; L294-F296 PolarHBondContact O-N 2.93Å; L294-F296 VanDerWaalsContact O-N 3.08Å; L294-G297 PolarHBondContact O-N 3.19Å; L294-G297 VanDerWaalsContact O-N 3.11Å; L294-G297 VanDerWaalsContact O-O 3.04Å; L294-V299 HydrophobicContact CD2-CB 4.3Å; L294-V299 HydrophobicContact CD2-CG2 4.28Å
295P93.3Very high91.3Very high101 Ų10152.2 Ų52.266%0.65629%0.289SS*.G310 helixtrans-65.7-11.7-178.824.1-34.8000114.8
296F92.6Very high91.4Very high46 Ų4654.8 Ų54.820%0.20230%0.298CS..G310 helixtrans-96.7-10176.6-49.8-68000113.3F293 L294 F321 S326 A330 M334F293-F296 HydrophobicContact CD1-CD2 4.47Å; F293-F296 WeakPolarHBondContact O-CD2 3.13Å; F293-F296 PolarHBondContact O-N 3.34Å; F293-F296 VanDerWaalsContact O-N 3.15Å; L294-F296 PolarHBondContact O-N 2.93Å; L294-F296 VanDerWaalsContact O-N 3.08Å; F296-F321 HydrophobicContact CB-CE1 4.39Å; F296-F321 HydrophobicContact CB-CZ 4.18Å; F296-S326 WeakPolarHBondContact O-CA 3.49Å; F296-S326 WeakPolarHBondContact O-CB 3.26Å; F296-S326 PolarHBondContact O-OG 3.3Å; F296-A330 HydrophobicContact CB-CB 3.72Å; F296-A330 HydrophobicContact CD2-CB 3.91Å; F296-A330 HydrophobicContact CG-CB 3.83Å; F296-M334 HydrophobicContact CD2-CG 4.15Å; F296-M334 HydrophobicContact CE2-CG 3.33Å; F296-M334 HydrophobicContact CE2-SD 3.6Å; F296-M334 VanDerWaalsContact CE2-SD 3.6Å; F296-M334 HydrophobicContact CZ-CG 3.6Å; F296-M334 HydrophobicContact CZ-SD 3.54Å; F296-M334 VanDerWaalsContact CZ-SD 3.54Å
297G89.8Confident91.3Very high21 Ų2154 Ų5422%0.21629%0.294CS..SBendtrans151.4-177.1178.100000113.6L294 V299 F321L294-G297 PolarHBondContact O-N 3.19Å; L294-G297 VanDerWaalsContact O-N 3.11Å; L294-G297 VanDerWaalsContact O-O 3.04Å; G297-V299 PolarHBondContact O-N 2.98Å; G297-F321 WeakPolarHBondContact O-CE1 3.34Å
298N91.8Very high91.1Very high93 Ų9363.3 Ų63.350%0.49732%0.318SS..  trans-75.9113.4-177.2171.641.2000111.1I300 F321 D322N298-I300 PolarHBondContact O-N 2.87Å; N298-F321 WeakPolarHBondContact O-CA 3.45Å; N298-D322 WeakPolarHBondContact CB-OD2 3.48Å; N298-D322 PolarHBondContact ND2-OD2 3.46Å; N298-D322 PolarHBondContact O-N 3.39Å
299V92.1Very high90.9Very high13 Ų1362.7 Ų62.78%0.07933%0.331CS..EExtended strand (participates in β ladder)trans-85111.5179.5176.40000109.4M290 F293 L294 G297 V319 S320 F321M290-V299 HydrophobicContact CG-CB 4.09Å; M290-V299 HydrophobicContact CG-CG1 3.94Å; F293-V299 HydrophobicContact CB-CG2 4.07Å; L294-V299 HydrophobicContact CD2-CB 4.3Å; L294-V299 HydrophobicContact CD2-CG2 4.28Å; G297-V299 PolarHBondContact O-N 2.98Å; V299-V319 HydrophobicContact CG1-CG1 3.87Å; V299-V319 HydrophobicContact CG2-CG1 3.96Å; V299-S320 CarbonylContact C-O 3.46Å; V299-F321 HydrophobicContact CG2-CD1 4.13Å; V299-F321 HydrophobicContact CG2-CE1 3.66Å; V299-F321 HydrophobicContact CG2-CZ 4.05Å
300I90.3Very high90.7Very high69 Ų6966.7 Ų66.735%0.35436%0.356SS..EExtended strand (participates in β ladder)trans-69.3-37.9173.3-64.2-175.2000111.1R267 N298 S320 D322R267-I300 HydrophobicContact CB-CG2 3.39Å; R267-I300 WeakPolarHBondContact O-CG2 3.14Å; N298-I300 PolarHBondContact O-N 2.87Å; I300-S320 PolarHBondContact N-O 3.11Å; I300-D322 HydrophobicContact CD1-CB 3.71Å; I300-D322 HydrophobicContact CG1-CB 3.9Å
301S88.2Confident90.4Very high22 Ų2269.2 Ų69.215%0.15437%0.371CS..EExtended strand (participates in β ladder)trans-160.4134.8-178.6-165.70000113.2Q266 V319 S320Q266-S301 WeakPolarHBondContact CG-OG 3.36Å; S301-V319 CarbonylContact O-C 3.54Å; S301-V319 WeakPolarHBondContact O-CA 3.45Å; S301-S320 PolarHBondContact N-O 3.5Å; S301-S320 PolarHBondContact O-N 3.22Å
302S92.3Very high90.1Very high18 Ų1867.8 Ų67.813%0.12636%0.364CS..EExtended strand (participates in β ladder)trans-111.1152.2164.766.10000110.7D286 F318D286-S302 WeakPolarHBondContact O-CB 3.41Å; D286-S302 PolarHBondContact O-OG 3.45Å; S302-F318 CarbonylContact C-O 3.52Å; S302-F318 WeakPolarHBondContact CA-O 3.17Å
303K92.1Very high90Very high79 Ų7966.6 Ų66.634%0.34336%0.359SS..EExtended strand (participates in β ladder)trans-153.9110.3169.2-165.273-153.4151.30112.5D286 F305 G317 F318D286-K303 IonicContact OD1-NZ 3.31Å; D286-K303 PolarHBondContact OD1-NZ 3.31Å; K303-F305 HydrophobicContact CB-CE2 4.42Å; K303-F305 HydrophobicContact CG-CD2 4.37Å; K303-F305 HydrophobicContact CG-CE2 3.93Å; K303-G317 CarbonylContact O-C 3.55Å; K303-G317 WeakPolarHBondContact O-CA 3.21Å; K303-F318 PolarHBondContact N-O 3.25Å; K303-F318 PolarHBondContact O-N 2.91Å
304V92.9Very high89.9Confident7 Ų771.7 Ų71.74%0.04238%0.381CS..EExtended strand (participates in β ladder)trans-81.3143.7164.31790000109.7L280 F284 G285 L289 S313L280-V304 HydrophobicContact CD1-CG1 4.38Å; L280-V304 HydrophobicContact CD1-CG2 3.82Å; F284-V304 WeakPolarHBondContact O-CG1 3.5Å; G285-V304 VanDerWaalsContact C-CG2 3.5Å; G285-V304 WeakPolarHBondContact O-CG2 3.42Å; L289-V304 HydrophobicContact CB-CG2 3.95Å; L289-V304 HydrophobicContact CD2-CG2 3.64Å; L289-V304 HydrophobicContact CG-CG2 4.42Å; V304-S313 WeakPolarHBondContact CG1-OG 3.38Å
305F91.1Very high89.8Confident84 Ų8469.7 Ų69.737%0.36837%0.373SS..EExtended strand (participates in β ladder)trans-99.6119.5175.3-81.5-111.7000110K303 K314 F316 F318K303-F305 HydrophobicContact CB-CE2 4.42Å; K303-F305 HydrophobicContact CG-CD2 4.37Å; K303-F305 HydrophobicContact CG-CE2 3.93Å; F305-K314 VanDerWaalsContact O-CB 3.29Å; F305-K314 WeakPolarHBondContact O-CB 3.17Å; F305-K314 WeakPolarHBondContact O-CG 3.46Å; F305-K314 PolarHBondContact O-N 2.93Å; F305-F316 HydrophobicContact CB-CD2 3.88Å; F305-F316 HydrophobicContact CB-CE2 3.4Å; F305-F316 VanDerWaalsContact CB-CE2 3.4Å; F305-F316 HydrophobicContact CB-CZ 3.81Å; F305-F316 AromaticContact CD1-CE2 3.95Å; F305-F316 HydrophobicContact CD1-CE2 3.95Å; F305-F316 HydrophobicContact CD1-CZ 4.35Å; F305-F316 HydrophobicContact CD2-CD2 4.24Å; F305-F316 AromaticContact CD2-CE2 3.89Å; F305-F316 HydrophobicContact CD2-CE2 3.89Å; F305-F316 HydrophobicContact CG-CD2 4.12Å; F305-F316 AromaticContact CG-CE2 3.45Å; F305-F316 HydrophobicContact CG-CE2 3.45Å; F305-F316 VanDerWaalsContact CG-CE2 3.45Å; F305-F316 HydrophobicContact CG-CZ 4.13Å; F305-F316 PolarHBondContact N-O 2.76Å; F305-F318 HydrophobicContact CD2-CD2 4.26Å; F305-F318 HydrophobicContact CD2-CE2 4.29Å; F305-F318 AromaticContact CE2-CD2 3.67Å; F305-F318 HydrophobicContact CE2-CD2 3.67Å; F305-F318 AromaticContact CE2-CE2 3.71Å; F305-F318 HydrophobicContact CE2-CE2 3.71Å; F305-F318 HydrophobicContact CZ-CD2 4.47Å; F305-F318 HydrophobicContact CZ-CE2 4.18Å
306V90.4Very high89.8Confident87 Ų8767.3 Ų67.353%0.52735%0.352SS..EExtended strand (participates in β ladder)trans-101152.4172.2-61.80000110.6Q312V306-Q312 CarbonylContact C-O 3.52Å; V306-Q312 WeakPolarHBondContact CA-O 3.4Å
307D89.1Confident89.8Confident50 Ų5065.1 Ų65.127%0.26734%0.343SS..PPolyproline II helixtrans-80127.8169.9179.2-93.6000110A309 T310 N311 Q312 K314D307-A309 PolarHBondContact O-N 3.45Å; D307-A309 PolarHBondContact OD1-N 3.36Å; D307-A309 VanDerWaalsContact OD1-N 3.1Å; D307-T310 WeakPolarHBondContact CB-OG1 3.3Å; D307-T310 PolarHBondContact OD1-N 3.44Å; D307-T310 PolarHBondContact OD1-OG1 3.45Å; D307-N311 WeakPolarHBondContact O-CA 2.99Å; D307-N311 PolarHBondContact O-N 2.95Å; D307-Q312 PolarHBondContact N-O 3.09Å; D307-K314 HydrophobicContact CB-CD 4.38Å; D307-K314 HydrophobicContact CB-CG 4.09Å
308R85.3Confident90Very high231 Ų23165.6 Ų65.687%0.87234%0.339SS*.THydrogen-bonded Turntrans-78.7-19.4-171.1-164.4177.1-177.5-162.60.6113.7
309A87.3Confident90.1Very high93 Ų9361.1 Ų61.177%0.76932%0.315SS*.THydrogen-bonded Turntrans-83.4-38.9178.300000111.4D307D307-A309 PolarHBondContact O-N 3.45Å; D307-A309 PolarHBondContact OD1-N 3.36Å; D307-A309 VanDerWaalsContact OD1-N 3.1Å
310T88.4Confident90.1Very high84 Ų8460.7 Ų60.752%0.51531%0.312SS..THydrogen-bonded Turntrans-102.8-12.4-175.5600000114.2D307 Q312D307-T310 WeakPolarHBondContact CB-OG1 3.3Å; D307-T310 PolarHBondContact OD1-N 3.44Å; D307-T310 PolarHBondContact OD1-OG1 3.45Å; T310-Q312 PolarHBondContact O-N 2.97Å; T310-Q312 VanDerWaalsContact O-N 3.15Å; T310-Q312 PolarHBondContact OG1-N 3.33Å
311N84.2Confident90.3Very high125 Ų12557.4 Ų57.467%0.66830%0.295SS*.  trans57.911-169-71.1-93.7000115.1D307D307-N311 WeakPolarHBondContact O-CA 2.99Å; D307-N311 PolarHBondContact O-N 2.95Å
312Q86.2Confident90.4Very high93 Ų9359.4 Ų59.444%0.43530%0.304SS..  trans-82.1144.6179-57.9-654.100111.6V306 D307 T310 K314V306-Q312 CarbonylContact C-O 3.52Å; V306-Q312 WeakPolarHBondContact CA-O 3.4Å; D307-Q312 PolarHBondContact N-O 3.09Å; T310-Q312 PolarHBondContact O-N 2.97Å; T310-Q312 VanDerWaalsContact O-N 3.15Å; T310-Q312 PolarHBondContact OG1-N 3.33Å; Q312-K314 PolarHBondContact O-N 2.89Å
313S88.8Confident90.3Very high11 Ų1162.1 Ų62.18%0.07732%0.318CS..EExtended strand (participates in β ladder)trans-62.5130171.7176.80000111.1Q282 V304 C315Q282-S313 WeakPolarHBondContact O-CB 3.35Å; V304-S313 WeakPolarHBondContact CG1-OG 3.38Å; S313-C315 PolarHBondContact O-N 3.31Å; S313-C315 PolarHBondContact O-SG 3.27Å; S313-C315 PolarHBondContact OG-N 3.33Å; S313-C315 VanDerWaalsContact OG-N 3.15Å
314K89.7Confident90.2Very high108 Ų10861.4 Ų61.447%0.4732%0.321SS..EExtended strand (participates in β ladder)trans-71.98.2172.4-53.2-172.169.8153.50112.2F305 D307 Q312 F316F305-K314 VanDerWaalsContact O-CB 3.29Å; F305-K314 WeakPolarHBondContact O-CB 3.17Å; F305-K314 WeakPolarHBondContact O-CG 3.46Å; F305-K314 PolarHBondContact O-N 2.93Å; D307-K314 HydrophobicContact CB-CD 4.38Å; D307-K314 HydrophobicContact CB-CG 4.09Å; Q312-K314 PolarHBondContact O-N 2.89Å; K314-F316 HydrophobicContact CB-CD1 3.84Å; K314-F316 HydrophobicContact CB-CE1 3.6Å; K314-F316 HydrophobicContact CB-CZ 4.3Å; K314-F316 HydrophobicContact CD-CE1 4.31Å; K314-F316 HydrophobicContact CD-CZ 4.42Å; K314-F316 VanDerWaalsContact O-CD1 3.3Å; K314-F316 WeakPolarHBondContact O-CD1 3.34Å; K314-F316 PolarHBondContact O-N 3.49Å
315C90.1Very high90.2Very high28 Ų2863 Ų6319%0.18934%0.339CS..EExtended strand (participates in β ladder)trans60.824.7176.8-59.70000114Y278 H279 L280 S313 K342Y278-C315 CarbonylContact C-O 3.53Å; H279-C315 WeakPolarHBondContact CA-O 3.39Å; H279-C315 PolarHBondContact N-O 3.33Å; L280-C315 PolarHBondContact N-O 3.45Å; L280-C315 WeakPolarHBondContact O-CB 3.43Å; L280-C315 PolarHBondContact O-SG 3.17Å; S313-C315 PolarHBondContact O-N 3.31Å; S313-C315 PolarHBondContact O-SG 3.27Å; S313-C315 PolarHBondContact OG-N 3.33Å; S313-C315 VanDerWaalsContact OG-N 3.15Å; C315-K342 PolarHBondContact SG-NZ 3.47Å
316F93.4Very high90.4Very high51 Ų5159.9 Ų59.922%0.22433%0.328CS..EExtended strand (participates in β ladder)trans-142156.7173.170.3-105.6000112.1F276 I277 F305 K314F276-F316 HydrophobicContact CE2-CB 4.3Å; F276-F316 AromaticContact CE2-CD2 3.69Å; F276-F316 HydrophobicContact CE2-CD2 3.69Å; F276-F316 HydrophobicContact CE2-CE2 4.34Å; F276-F316 HydrophobicContact CE2-CG 4.28Å; F276-F316 HydrophobicContact CZ-CD2 4.15Å; I277-F316 CarbonylContact O-C 3.54Å; I277-F316 WeakPolarHBondContact O-CA 3.44Å; I277-F316 WeakPolarHBondContact O-CB 3.22Å; F305-F316 HydrophobicContact CB-CD2 3.88Å; F305-F316 HydrophobicContact CB-CE2 3.4Å; F305-F316 VanDerWaalsContact CB-CE2 3.4Å; F305-F316 HydrophobicContact CB-CZ 3.81Å; F305-F316 AromaticContact CD1-CE2 3.95Å; F305-F316 HydrophobicContact CD1-CE2 3.95Å; F305-F316 HydrophobicContact CD1-CZ 4.35Å; F305-F316 HydrophobicContact CD2-CD2 4.24Å; F305-F316 AromaticContact CD2-CE2 3.89Å; F305-F316 HydrophobicContact CD2-CE2 3.89Å; F305-F316 HydrophobicContact CG-CD2 4.12Å; F305-F316 AromaticContact CG-CE2 3.45Å; F305-F316 HydrophobicContact CG-CE2 3.45Å; F305-F316 VanDerWaalsContact CG-CE2 3.45Å; F305-F316 HydrophobicContact CG-CZ 4.13Å; F305-F316 PolarHBondContact N-O 2.76Å; K314-F316 HydrophobicContact CB-CD1 3.84Å; K314-F316 HydrophobicContact CB-CE1 3.6Å; K314-F316 HydrophobicContact CB-CZ 4.3Å; K314-F316 HydrophobicContact CD-CE1 4.31Å; K314-F316 HydrophobicContact CD-CZ 4.42Å; K314-F316 VanDerWaalsContact O-CD1 3.3Å; K314-F316 WeakPolarHBondContact O-CD1 3.34Å; K314-F316 PolarHBondContact O-N 3.49Å
317G93.4Very high90.5Very high0 Ų055.7 Ų55.70%030%0.302CS..EExtended strand (participates in β ladder)trans-164.8171.9177.800000113F276 I277 K303F276-G317 WeakPolarHBondContact CD2-O 3.44Å; I277-G317 PolarHBondContact N-O 2.87Å; I277-G317 PolarHBondContact O-N 2.86Å; K303-G317 CarbonylContact O-C 3.55Å; K303-G317 WeakPolarHBondContact O-CA 3.21Å
318F94Very high90.7Very high31 Ų3157 Ų5714%0.13631%0.307CS..EExtended strand (participates in β ladder)trans-113150.4175.3-59.7-92.5000110.5L275 F276 S302 K303 F305 K349L275-F318 VanDerWaalsContact O-CA 3.27Å; L275-F318 WeakPolarHBondContact O-CA 3.39Å; L275-F318 WeakPolarHBondContact O-CB 3.44Å; L275-F318 WeakPolarHBondContact O-CD1 3.34Å; F276-F318 HydrophobicContact CB-CD1 3.94Å; F276-F318 HydrophobicContact CB-CE1 3.88Å; F276-F318 HydrophobicContact CD1-CE1 4.12Å; F276-F318 HydrophobicContact CD1-CZ 4.48Å; F276-F318 AromaticContact CD2-CD1 3.54Å; F276-F318 HydrophobicContact CD2-CD1 3.54Å; F276-F318 HydrophobicContact CD2-CD2 4.23Å; F276-F318 AromaticContact CD2-CE1 3.22Å; F276-F318 HydrophobicContact CD2-CE1 3.22Å; F276-F318 AromaticContact CD2-CE2 3.96Å; F276-F318 HydrophobicContact CD2-CE2 3.96Å; F276-F318 HydrophobicContact CD2-CG 4.05Å; F276-F318 AromaticContact CD2-CZ 3.46Å; F276-F318 HydrophobicContact CD2-CZ 3.46Å; F276-F318 VanDerWaalsContact CD2-CZ 3.46Å; F276-F318 HydrophobicContact CE1-CE1 4.46Å; F276-F318 HydrophobicContact CE1-CZ 4.38Å; F276-F318 HydrophobicContact CE2-CD1 4.28Å; F276-F318 HydrophobicContact CE2-CD2 4.32Å; F276-F318 AromaticContact CE2-CE1 3.67Å; F276-F318 HydrophobicContact CE2-CE1 3.67Å; F276-F318 AromaticContact CE2-CE2 3.71Å; F276-F318 HydrophobicContact CE2-CE2 3.71Å; F276-F318 AromaticContact CE2-CZ 3.35Å; F276-F318 HydrophobicContact CE2-CZ 3.35Å; F276-F318 AromaticContact CG-CD1 3.95Å; F276-F318 HydrophobicContact CG-CD1 3.95Å; F276-F318 AromaticContact CG-CE1 3.5Å; F276-F318 HydrophobicContact CG-CE1 3.5Å; F276-F318 VanDerWaalsContact CG-CE1 3.5Å; F276-F318 HydrophobicContact CG-CZ 4.07Å; F276-F318 HydrophobicContact CZ-CE1 4.28Å; F276-F318 HydrophobicContact CZ-CE2 4.48Å; F276-F318 AromaticContact CZ-CZ 3.86Å; F276-F318 HydrophobicContact CZ-CZ 3.86Å; S302-F318 CarbonylContact C-O 3.52Å; S302-F318 WeakPolarHBondContact CA-O 3.17Å; K303-F318 PolarHBondContact N-O 3.25Å; K303-F318 PolarHBondContact O-N 2.91Å; F305-F318 HydrophobicContact CD2-CD2 4.26Å; F305-F318 HydrophobicContact CD2-CE2 4.29Å; F305-F318 AromaticContact CE2-CD2 3.67Å; F305-F318 HydrophobicContact CE2-CD2 3.67Å; F305-F318 AromaticContact CE2-CE2 3.71Å; F305-F318 HydrophobicContact CE2-CE2 3.71Å; F305-F318 HydrophobicContact CZ-CD2 4.47Å; F305-F318 HydrophobicContact CZ-CE2 4.18Å; F318-K349 HydrophobicContact CD1-CB 4.45Å; F318-K349 HydrophobicContact CD1-CD 3.79Å; F318-K349 HydrophobicContact CD1-CG 4.14Å; F318-K349 HydrophobicContact CE1-CD 3.82Å; F318-K349 HydrophobicContact CE1-CG 3.91Å
319V93.6Very high91.1Very high0 Ų047.8 Ų47.80%028%0.28CS..EExtended strand (participates in β ladder)trans-132130.8169.61740000107.9L275 I277 L289 F293 V299 S301 F321L275-V319 HydrophobicContact CB-CB 4.46Å; L275-V319 WeakPolarHBondContact CB-O 3.47Å; L275-V319 PolarHBondContact N-O 2.85Å; L275-V319 PolarHBondContact O-N 3.45Å; L275-V319 VanDerWaalsContact O-N 3.16Å; I277-V319 HydrophobicContact CD1-CB 3.93Å; I277-V319 HydrophobicContact CD1-CG2 3.7Å; L289-V319 HydrophobicContact CD1-CG2 3.85Å; L289-V319 HydrophobicContact CD2-CG2 3.91Å; L289-V319 HydrophobicContact CG-CG2 3.57Å; F293-V319 HydrophobicContact CB-CG1 4.01Å; F293-V319 HydrophobicContact CB-CG2 4.45Å; F293-V319 HydrophobicContact CD1-CB 4.47Å; F293-V319 HydrophobicContact CD1-CG1 4.2Å; F293-V319 HydrophobicContact CD1-CG2 4.39Å; F293-V319 HydrophobicContact CD2-CG2 4.26Å; F293-V319 HydrophobicContact CG-CG1 4.21Å; F293-V319 HydrophobicContact CG-CG2 4.1Å; V299-V319 HydrophobicContact CG1-CG1 3.87Å; V299-V319 HydrophobicContact CG2-CG1 3.96Å; S301-V319 CarbonylContact O-C 3.54Å; S301-V319 WeakPolarHBondContact O-CA 3.45Å; V319-F321 HydrophobicContact CG1-CD2 4.12Å; V319-F321 HydrophobicContact CG1-CE2 3.72Å; V319-F321 HydrophobicContact CG1-CZ 4.16Å
320S92.3Very high91.4Very high3 Ų343.4 Ų43.42%0.02124%0.244CC..EExtended strand (participates in β ladder)trans-113.9116.3-179.3-64.20000108.7N274 V299 I300 S301N274-S320 VanDerWaalsContact OD1-CB 3.22Å; N274-S320 WeakPolarHBondContact OD1-CB 3.36Å; N274-S320 PolarHBondContact OD1-OG 3Å; V299-S320 CarbonylContact C-O 3.46Å; I300-S320 PolarHBondContact N-O 3.11Å; S301-S320 PolarHBondContact N-O 3.5Å; S301-S320 PolarHBondContact O-N 3.22Å
321F93.3Very high91.7Very high0 Ų040.7 Ų40.70%023%0.226CC..EExtended strand (participates in β ladder)trans-90.2165.1172.1-73.6-84.2000111.5G269 C273 L275 F293 F296 G297 N298 V299 V319 A327 A330G269-F321 WeakPolarHBondContact CA-O 3.37Å; C273-F321 HydrophobicContact CB-CB 4.45Å; C273-F321 VanDerWaalsContact CB-O 3.26Å; C273-F321 WeakPolarHBondContact CB-O 3.47Å; C273-F321 PolarHBondContact O-N 2.77Å; L275-F321 HydrophobicContact CD1-CD2 4.18Å; L275-F321 HydrophobicContact CD1-CE2 3.7Å; L275-F321 HydrophobicContact CG-CD2 4.38Å; L275-F321 HydrophobicContact CG-CE2 4.37Å; F293-F321 HydrophobicContact CB-CZ 3.98Å; F293-F321 HydrophobicContact CD1-CE2 4.03Å; F293-F321 AromaticContact CD1-CZ 3.98Å; F293-F321 HydrophobicContact CD1-CZ 3.98Å; F293-F321 HydrophobicContact CG-CZ 4.5Å; F293-F321 WeakPolarHBondContact O-CZ 3.48Å; F296-F321 HydrophobicContact CB-CE1 4.39Å; F296-F321 HydrophobicContact CB-CZ 4.18Å; G297-F321 WeakPolarHBondContact O-CE1 3.34Å; N298-F321 WeakPolarHBondContact O-CA 3.45Å; V299-F321 HydrophobicContact CG2-CD1 4.13Å; V299-F321 HydrophobicContact CG2-CE1 3.66Å; V299-F321 HydrophobicContact CG2-CZ 4.05Å; V319-F321 HydrophobicContact CG1-CD2 4.12Å; V319-F321 HydrophobicContact CG1-CE2 3.72Å; V319-F321 HydrophobicContact CG1-CZ 4.16Å; F321-A327 HydrophobicContact CB-CB 4.4Å; F321-A327 HydrophobicContact CD2-CB 3.94Å; F321-A327 HydrophobicContact CG-CB 4.47Å; F321-A330 HydrophobicContact CE2-CB 3.74Å; F321-A330 HydrophobicContact CZ-CB 3.83Å
322D90.6Very high92.2Very high64 Ų6442.2 Ų42.234%0.34223%0.229SC..SBendtrans-79.2-27.9170.262.2-12000114N298 I300N298-D322 WeakPolarHBondContact CB-OD2 3.48Å; N298-D322 PolarHBondContact ND2-OD2 3.46Å; N298-D322 PolarHBondContact O-N 3.39Å; I300-D322 HydrophobicContact CD1-CB 3.71Å; I300-D322 HydrophobicContact CG1-CB 3.9Å
323N90.5Very high92.4Very high76 Ų7640.9 Ų40.941%0.40623%0.23SC..SBendtrans-128.9134.7-172.3163.857.9000111.5G325 S326 A327N323-G325 VanDerWaalsContact C-N 3.28Å; N323-G325 PolarHBondContact ND2-N 3.26Å; N323-G325 PolarHBondContact O-N 3.03Å; N323-S326 PolarHBondContact ND2-N 2.96Å; N323-S326 VanDerWaalsContact ND2-N 3.19Å; N323-S326 PolarHBondContact ND2-OG 3.4Å; N323-S326 VanDerWaalsContact ND2-OG 3.16Å; N323-S326 WeakPolarHBondContact O-CB 3.31Å; N323-S326 PolarHBondContact O-N 3.05Å; N323-S326 VanDerWaalsContact O-N 3.17Å; N323-A327 PolarHBondContact O-N 2.94Å
324P89.8Confident92.6Very high63 Ų6340.9 Ų40.941%0.40923%0.229SC..Hα-helixtrans-68.4-26.4-176.826.4-34.1000112.7C273 S326 A327 Q328C273-P324 WeakPolarHBondContact SG-CD 3.5Å; P324-S326 VanDerWaalsContact C-N 3.31Å; P324-S326 PolarHBondContact O-N 2.92Å; P324-A327 PolarHBondContact O-N 3.11Å; P324-Q328 WeakPolarHBondContact O-CG 3.39Å; P324-Q328 PolarHBondContact O-N 3.26Å
325G93.3Very high92.8Very high42 Ų4239.4 Ų39.443%0.43323%0.226SC..Hα-helixtrans-61.6-39.1173.300000112.7N323 Q328 A329N323-G325 VanDerWaalsContact C-N 3.28Å; N323-G325 PolarHBondContact ND2-N 3.26Å; N323-G325 PolarHBondContact O-N 3.03Å; G325-Q328 PolarHBondContact O-N 3.08Å; G325-A329 PolarHBondContact O-N 2.88Å
326S94.1Very high92.8Very high17 Ų1739.4 Ų39.412%0.11923%0.231CC..Hα-helixtrans-66.6-41.9176-61.80000112F296 N323 P324 Q328 A329 A330F296-S326 WeakPolarHBondContact O-CA 3.49Å; F296-S326 WeakPolarHBondContact O-CB 3.26Å; F296-S326 PolarHBondContact O-OG 3.3Å; N323-S326 PolarHBondContact ND2-N 2.96Å; N323-S326 VanDerWaalsContact ND2-N 3.19Å; N323-S326 PolarHBondContact ND2-OG 3.4Å; N323-S326 VanDerWaalsContact ND2-OG 3.16Å; N323-S326 WeakPolarHBondContact O-CB 3.31Å; N323-S326 PolarHBondContact O-N 3.05Å; N323-S326 VanDerWaalsContact O-N 3.17Å; P324-S326 VanDerWaalsContact C-N 3.31Å; P324-S326 PolarHBondContact O-N 2.92Å; S326-Q328 VanDerWaalsContact C-N 3.34Å; S326-Q328 PolarHBondContact O-N 3.15Å; S326-A329 PolarHBondContact O-N 3.38Å; S326-A330 WeakPolarHBondContact O-CB 3.2Å; S326-A330 PolarHBondContact O-N 3.16Å
327A92.8Very high92.7Very high0 Ų041.3 Ų41.30%024%0.239CC..Hα-helixtrans-61.8-39.4173.400000112.4L275 F321 N323 P324 I331L275-A327 HydrophobicContact CD2-CB 3.92Å; L275-A327 HydrophobicContact CG-CB 4.28Å; F321-A327 HydrophobicContact CB-CB 4.4Å; F321-A327 HydrophobicContact CD2-CB 3.94Å; F321-A327 HydrophobicContact CG-CB 4.47Å; N323-A327 PolarHBondContact O-N 2.94Å; P324-A327 PolarHBondContact O-N 3.11Å; A327-I331 VanDerWaalsContact O-CG1 3.3Å; A327-I331 WeakPolarHBondContact O-CG1 3.29Å; A327-I331 PolarHBondContact O-N 3.2Å
328Q93.2Very high92.6Very high78 Ų7846.5 Ų46.536%0.36426%0.263SS..Hα-helixtrans-69.3-43175.8-69.4-66.9-1300112.8P324 G325 S326 A330 I331 Q332P324-Q328 WeakPolarHBondContact O-CG 3.39Å; P324-Q328 PolarHBondContact O-N 3.26Å; G325-Q328 PolarHBondContact O-N 3.08Å; S326-Q328 VanDerWaalsContact C-N 3.34Å; S326-Q328 PolarHBondContact O-N 3.15Å; Q328-A330 VanDerWaalsContact C-N 3.32Å; Q328-A330 PolarHBondContact O-N 2.97Å; Q328-I331 PolarHBondContact O-N 3.49Å; Q328-Q332 WeakPolarHBondContact O-CG 3.35Å; Q328-Q332 PolarHBondContact O-N 3.47Å
329A94Very high92.1Very high37 Ų3746.8 Ų46.831%0.30627%0.266SS..Hα-helixtrans-60.5-42.117500000111.9G325 S326 Q332 S333G325-A329 PolarHBondContact O-N 2.88Å; S326-A329 PolarHBondContact O-N 3.38Å; A329-Q332 PolarHBondContact O-N 3.33Å; A329-S333 WeakPolarHBondContact O-CB 3.35Å; A329-S333 PolarHBondContact O-N 3.33Å; A329-S333 PolarHBondContact O-OG 3.32Å
330A94.3Very high91.7Very high0 Ų049.8 Ų49.80%030%0.297CS..Hα-helixtrans-62.5-42173.100000112.4L275 F293 F296 F321 S326 Q328 M334L275-A330 HydrophobicContact CD1-CB 3.83Å; F293-A330 HydrophobicContact CD1-CB 3.9Å; F293-A330 HydrophobicContact CE1-CB 4.04Å; F296-A330 HydrophobicContact CB-CB 3.72Å; F296-A330 HydrophobicContact CD2-CB 3.91Å; F296-A330 HydrophobicContact CG-CB 3.83Å; F321-A330 HydrophobicContact CE2-CB 3.74Å; F321-A330 HydrophobicContact CZ-CB 3.83Å; S326-A330 WeakPolarHBondContact O-CB 3.2Å; S326-A330 PolarHBondContact O-N 3.16Å; Q328-A330 VanDerWaalsContact C-N 3.32Å; Q328-A330 PolarHBondContact O-N 2.97Å; A330-M334 WeakPolarHBondContact O-CA 3.48Å; A330-M334 WeakPolarHBondContact O-CB 3.27Å; A330-M334 PolarHBondContact O-N 3.19Å
331I94.4Very high91.3Very high27 Ų2759 Ų5914%0.13834%0.342CS..Hα-helixtrans-59.2-50.7172.8-70.9160.3000110.3L275 A327 Q328 S333 N335 V346 L348L275-I331 HydrophobicContact CD1-CG1 4.4Å; L275-I331 HydrophobicContact CD2-CD1 3.56Å; L275-I331 HydrophobicContact CD2-CG1 3.64Å; A327-I331 VanDerWaalsContact O-CG1 3.3Å; A327-I331 WeakPolarHBondContact O-CG1 3.29Å; A327-I331 PolarHBondContact O-N 3.2Å; Q328-I331 PolarHBondContact O-N 3.49Å; I331-S333 VanDerWaalsContact C-N 3.28Å; I331-S333 PolarHBondContact O-N 3.31Å; I331-N335 HydrophobicContact CG2-CB 4.33Å; I331-N335 WeakPolarHBondContact O-CB 3.4Å; I331-N335 PolarHBondContact O-N 2.82Å; I331-V346 HydrophobicContact CG1-CG1 3.95Å; I331-L348 HydrophobicContact CD1-CD2 3.85Å; I331-L348 HydrophobicContact CD1-CG 3.85Å
332Q93.8Very high91.1Very high157 Ų15762.7 Ų62.773%0.73436%0.358SS*.Hα-helixtrans-63-32.9-175.8-70175.527.300113.2Q328 A329Q328-Q332 WeakPolarHBondContact O-CG 3.35Å; Q328-Q332 PolarHBondContact O-N 3.47Å; A329-Q332 PolarHBondContact O-N 3.33Å
333S91.9Very high91.1Very high66 Ų6666.1 Ų66.146%0.46237%0.366SS..Hα-helixtrans-92.6-33.8-176.5-49.90000113.6A329 I331A329-S333 WeakPolarHBondContact O-CB 3.35Å; A329-S333 PolarHBondContact O-N 3.33Å; A329-S333 PolarHBondContact O-OG 3.32Å; I331-S333 VanDerWaalsContact C-N 3.28Å; I331-S333 PolarHBondContact O-N 3.31Å
334M92.4Very high91.3Very high11 Ų1162.7 Ų62.75%0.05435%0.348CS..Hα-helixtrans-105-20.1-172.6-58.7-59.4-65.200114M292 F293 F296 A330 G336 F337 L344 V346M292-M334 HydrophobicContact CE-CE 4.1Å; M292-M334 HydrophobicContact CG-CE 3.5Å; M292-M334 VanDerWaalsContact CG-CE 3.5Å; M292-M334 HydrophobicContact SD-CE 3.5Å; M292-M334 VanDerWaalsContact SD-CE 3.5Å; F293-M334 HydrophobicContact CE1-CB 4.21Å; F293-M334 HydrophobicContact CE1-CG 4.19Å; F293-M334 HydrophobicContact CE2-CE 4.49Å; F293-M334 HydrophobicContact CZ-CB 3.94Å; F293-M334 HydrophobicContact CZ-CG 4.1Å; F296-M334 HydrophobicContact CD2-CG 4.15Å; F296-M334 HydrophobicContact CE2-CG 3.33Å; F296-M334 HydrophobicContact CE2-SD 3.6Å; F296-M334 VanDerWaalsContact CE2-SD 3.6Å; F296-M334 HydrophobicContact CZ-CG 3.6Å; F296-M334 HydrophobicContact CZ-SD 3.54Å; F296-M334 VanDerWaalsContact CZ-SD 3.54Å; A330-M334 WeakPolarHBondContact O-CA 3.48Å; A330-M334 WeakPolarHBondContact O-CB 3.27Å; A330-M334 PolarHBondContact O-N 3.19Å; M334-G336 PolarHBondContact O-N 3.46Å; M334-F337 HydrophobicContact CE-CB 4.21Å; M334-F337 HydrophobicContact CE-CD1 3.97Å; M334-F337 HydrophobicContact CE-CG 3.97Å; M334-F337 VanDerWaalsContact O-CB 3.31Å; M334-F337 WeakPolarHBondContact O-CB 3.17Å; M334-F337 PolarHBondContact O-N 3.43Å; M334-F337 VanDerWaalsContact O-N 3.09Å; M334-F337 HydrophobicContact SD-CB 4.48Å; M334-F337 HydrophobicContact SD-CD2 4.44Å; M334-F337 HydrophobicContact SD-CG 4.36Å; M334-L344 HydrophobicContact CE-CD1 4.01Å; M334-V346 HydrophobicContact CB-CG2 3.86Å
335N93.1Very high91.5Very high76 Ų7664.1 Ų64.141%0.40635%0.348SS..THydrogen-bonded Turntrans-70.2116171.7-173.243.8000109.5I331 K345 V346I331-N335 HydrophobicContact CG2-CB 4.33Å; I331-N335 WeakPolarHBondContact O-CB 3.4Å; I331-N335 PolarHBondContact O-N 2.82Å; N335-K345 WeakPolarHBondContact OD1-CA 3.49Å; N335-V346 HydrophobicContact CB-CB 3.98Å; N335-V346 PolarHBondContact OD1-N 3.15Å; N335-V346 PolarHBondContact OD1-O 3.07Å
336G90.8Very high91.6Very high28 Ų2862.2 Ų62.229%0.28933%0.328SS..THydrogen-bonded Turntrans91.7-0.1-172.300000114.4M334 R343 L344M334-G336 PolarHBondContact O-N 3.46Å; G336-R343 VanDerWaalsContact C-CG 3.45Å; G336-R343 VanDerWaalsContact O-CD 3.26Å; G336-R343 WeakPolarHBondContact O-CD 3.49Å; G336-R343 WeakPolarHBondContact O-CG 3.44Å; G336-R343 PolarHBondContact O-NH1 3.42Å; G336-L344 WeakPolarHBondContact CA-O 3.41Å; G336-L344 PolarHBondContact N-O 3.45Å
337F91.7Very high91.5Very high92 Ų9264.6 Ų64.640%0.40434%0.337SS..  trans-64.2135.3174.4-174.7-95.5000110.9M334 I339 R343 L344M334-F337 HydrophobicContact CE-CB 4.21Å; M334-F337 HydrophobicContact CE-CD1 3.97Å; M334-F337 HydrophobicContact CE-CG 3.97Å; M334-F337 VanDerWaalsContact O-CB 3.31Å; M334-F337 WeakPolarHBondContact O-CB 3.17Å; M334-F337 PolarHBondContact O-N 3.43Å; M334-F337 VanDerWaalsContact O-N 3.09Å; M334-F337 HydrophobicContact SD-CB 4.48Å; M334-F337 HydrophobicContact SD-CD2 4.44Å; M334-F337 HydrophobicContact SD-CG 4.36Å; F337-I339 HydrophobicContact CD1-CB 4.49Å; F337-I339 HydrophobicContact CE1-CB 4.36Å; F337-R343 CarbonylContact O-C 3.53Å; F337-R343 WeakPolarHBondContact O-CA 3.45Å; F337-L344 HydrophobicContact CB-CD1 4.41Å; F337-L344 HydrophobicContact CD1-CD1 4.09Å; F337-L344 PolarHBondContact O-N 3.43Å
338Q90.1Very high91.4Very high108 Ų10868.1 Ų68.151%0.50536%0.355SS..EExtended strand (participates in β ladder)trans-98.3128.4-177.8-177.3168.6-1800110.9G340 K342Q338-G340 PolarHBondContact NE2-O 3.49Å; Q338-K342 WeakPolarHBondContact CA-O 3.26Å
339I85.3Confident91.1Very high37 Ų3767.3 Ų67.319%0.1935%0.351CS..EExtended strand (participates in β ladder)trans-133.9112.7178.5-172.4160000109.5P281 F284 M292 F337 M341 K342 L344P281-I339 HydrophobicContact CG-CB 4.44Å; P281-I339 HydrophobicContact CG-CD1 3.62Å; P281-I339 HydrophobicContact CG-CG1 3.74Å; P281-I339 HydrophobicContact CG-CG2 3.87Å; F284-I339 HydrophobicContact CE1-CD1 4.38Å; F284-I339 HydrophobicContact CE2-CD1 3.7Å; F284-I339 HydrophobicContact CZ-CD1 3.59Å; M292-I339 HydrophobicContact CE-CD1 3.8Å; F337-I339 HydrophobicContact CD1-CB 4.49Å; F337-I339 HydrophobicContact CE1-CB 4.36Å; I339-M341 PolarHBondContact O-N 3.31Å; I339-K342 PolarHBondContact N-O 3.48Å; I339-K342 PolarHBondContact O-N 3.41Å; I339-L344 HydrophobicContact CG2-CD1 4.45Å; I339-L344 HydrophobicContact CG2-CD2 3.78Å; I339-L344 HydrophobicContact CG2-CG 3.9Å
340G83.7Confident90.5Very high64 Ų6475.7 Ų75.766%0.6637%0.374SS*.THydrogen-bonded Turntrans54.7-127.6-165.200000111.6Q338 K342Q338-G340 PolarHBondContact NE2-O 3.49Å; G340-K342 VanDerWaalsContact C-N 3.34Å
341M85Confident89.5Confident197 Ų19779.8 Ų79.897%0.9740%0.401SS*.THydrogen-bonded Turntrans-85.4-0.7177.7-60.5-174.4-70.600114.1I339I339-M341 PolarHBondContact O-N 3.31Å
342K87.8Confident88Confident76 Ų7687.7 Ų87.733%0.3343%0.434SS..EExtended strand (participates in β ladder)trans-113.1152-172.5-64.9171.675.9-1790110.9H279 L280 C315 Q338 I339 G340H279-K342 WeakPolarHBondContact O-CE 3.48Å; L280-K342 PolarHBondContact O-NZ 3.29Å; C315-K342 PolarHBondContact SG-NZ 3.47Å; Q338-K342 WeakPolarHBondContact CA-O 3.26Å; I339-K342 PolarHBondContact N-O 3.48Å; I339-K342 PolarHBondContact O-N 3.41Å; G340-K342 VanDerWaalsContact C-N 3.34Å
343R91.5Very high86.4Confident137 Ų13786.6 Ų86.652%0.51743%0.434SS..EExtended strand (participates in β ladder)trans-115.8117.7176.1-164.8178.5-64.6-77.1-5.1109.7H279 G336 F337H279-R343 WeakPolarHBondContact CB-O 3.38Å; H279-R343 PolarHBondContact ND1-O 2.91Å; G336-R343 VanDerWaalsContact C-CG 3.45Å; G336-R343 VanDerWaalsContact O-CD 3.26Å; G336-R343 WeakPolarHBondContact O-CD 3.49Å; G336-R343 WeakPolarHBondContact O-CG 3.44Å; G336-R343 PolarHBondContact O-NH1 3.42Å; F337-R343 CarbonylContact O-C 3.53Å; F337-R343 WeakPolarHBondContact O-CA 3.45Å
344L94.3Very high84.7Confident3 Ų387.3 Ų87.32%0.01644%0.443CS..  trans-60.2139.9179.4-62.7-174.5000110.3L280 M292 M334 G336 F337 I339L280-L344 HydrophobicContact CD2-CD2 3.96Å; M292-L344 HydrophobicContact CE-CD1 4.33Å; M292-L344 HydrophobicContact SD-CD1 3.84Å; M334-L344 HydrophobicContact CE-CD1 4.01Å; G336-L344 WeakPolarHBondContact CA-O 3.41Å; G336-L344 PolarHBondContact N-O 3.45Å; F337-L344 HydrophobicContact CB-CD1 4.41Å; F337-L344 HydrophobicContact CD1-CD1 4.09Å; F337-L344 PolarHBondContact O-N 3.43Å; I339-L344 HydrophobicContact CG2-CD1 4.45Å; I339-L344 HydrophobicContact CG2-CD2 3.78Å; I339-L344 HydrophobicContact CG2-CG 3.9Å
345K93.9Very high82.7Confident94 Ų9492.9 Ų92.941%0.40947%0.473SS..EExtended strand (participates in β ladder)trans-119.5111.4172-169.8-172.3-173.2-1680108.9I277 Y278 N335 Q347I277-K345 WeakPolarHBondContact CA-O 3.15Å; Y278-K345 PolarHBondContact N-O 3.3Å; Y278-K345 PolarHBondContact O-N 3.24Å; Y278-K345 VanDerWaalsContact O-N 3.08Å; N335-K345 WeakPolarHBondContact OD1-CA 3.49Å; K345-Q347 VanDerWaalsContact CE-CD 3.5Å; K345-Q347 HydrophobicContact CG-CG 4.49Å
346V94.6Very high80.5Confident1 Ų199.3 Ų99.31%0.00649%0.492CS..EExtended strand (participates in β ladder)trans-112.8123.6-174.7-1760000108.4L275 I277 F293 I331 M334 N335L275-V346 HydrophobicContact CB-CG1 4.47Å; L275-V346 HydrophobicContact CD1-CG1 3.79Å; I277-V346 HydrophobicContact CG1-CG1 4.27Å; I277-V346 HydrophobicContact CG1-CG2 4.12Å; I277-V346 HydrophobicContact CG2-CG2 4.09Å; F293-V346 HydrophobicContact CE1-CG1 4.19Å; F293-V346 HydrophobicContact CZ-CG1 4.44Å; F293-V346 HydrophobicContact CZ-CG2 4.01Å; I331-V346 HydrophobicContact CG1-CG1 3.95Å; M334-V346 HydrophobicContact CB-CG2 3.86Å; N335-V346 HydrophobicContact CB-CB 3.98Å; N335-V346 PolarHBondContact OD1-N 3.15Å; N335-V346 PolarHBondContact OD1-O 3.07Å
347Q92.8Very high78.9Confident67 Ų67103.7 Ų103.731%0.31352%0.515SS..EExtended strand (participates in β ladder)trans-138.4161.5-177.1-68.1155.5118.700109.3L275 F276 Y278 K345L275-Q347 CarbonylContact C-O 3.46Å; L275-Q347 WeakPolarHBondContact CA-O 3.35Å; F276-Q347 PolarHBondContact N-O 2.85Å; F276-Q347 PolarHBondContact O-N 3.01Å; Y278-Q347 VanDerWaalsContact CE2-NE2 3.31Å; K345-Q347 VanDerWaalsContact CE-CD 3.5Å; K345-Q347 HydrophobicContact CG-CG 4.49Å
348L91.8Very high76.8Confident74 Ų74113.8 Ų113.839%0.38755%0.553SS.*EExtended strand (participates in β ladder)trans-61.9138.9164.5-69.5175.2000110.5G272 L275 I331G272-L348 WeakPolarHBondContact O-CD2 3.47Å; L275-L348 HydrophobicContact CD2-CD2 4Å; I331-L348 HydrophobicContact CD1-CD2 3.85Å; I331-L348 HydrophobicContact CD1-CG 3.85Å
349K86.6Confident76.2Confident62 Ų62114.1 Ų114.127%0.2756%0.555SS.*PPolyproline II helixtrans-65.6129.9166.2-177.7-179.6-177.7-177.60108.1E268 N274 F318E268-K349 IonicContact OE1-NZ 2.62Å; E268-K349 PolarHBondContact OE1-NZ 3.41Å; E268-K349 IonicContact OE2-NZ 2.72Å; E268-K349 PolarHBondContact OE2-NZ 3.42Å; N274-K349 HydrophobicContact CB-CB 3.92Å; N274-K349 HydrophobicContact CB-CD 4.13Å; N274-K349 WeakPolarHBondContact O-CB 3.48Å; N274-K349 PolarHBondContact O-N 3.4Å; F318-K349 HydrophobicContact CD1-CB 4.45Å; F318-K349 HydrophobicContact CD1-CD 3.79Å; F318-K349 HydrophobicContact CD1-CG 4.14Å; F318-K349 HydrophobicContact CE1-CD 3.82Å; F318-K349 HydrophobicContact CE1-CG 3.91Å
350R80.9Confident75.7Confident212 Ų212118.2 Ų118.280%0.857%0.574SS**PPolyproline II helixtrans-63.8137.3175.4-65.6-177.7179.6-179.1-1.5109.9
351P73Confident75.2Confident86 Ų86121.2 Ų121.256%0.55857%0.57SS**PPolyproline II helixtrans-61.6145.6172.727.2-33.9000110D353 A354P351-D353 PolarHBondContact O-N 3.29Å; P351-A354 HydrophobicContact CG-CB 4.1Å; P351-A354 PolarHBondContact O-N 3.45Å
352K63Low74.7Confident194 Ų194116.7 Ų116.784%0.84355%0.546SS*.G310 helixtrans-66.6-28.8-168.7-162.9172.8-177.5178.40112.8
353D60.6Low73.8Confident134 Ų134119.3 Ų119.372%0.71756%0.56SS**G310 helixtrans-78-21.7-174.9-53.7-87.5000112.9P351 N355P351-D353 PolarHBondContact O-N 3.29Å; D353-N355 PolarHBondContact O-N 3.36Å
354A56.2Low72.7Confident80 Ų80118.1 Ų118.166%0.66156%0.562SS**G310 helixtrans-72.911.2176.900000114.4P351P351-A354 HydrophobicContact CG-CB 4.1Å; P351-A354 PolarHBondContact O-N 3.45Å
355N50.2Low71.1Confident128 Ų128126.3 Ų126.368%0.68460%0.601SS**G310 helixtrans-126.524-178.4-154.498.8000112.9D353 P357D353-N355 PolarHBondContact O-N 3.36Å; N355-P357 WeakPolarHBondContact O-CD 3.35Å
356R45.9Very low69.4Low212 Ų212128.8 Ų128.880%0.862%0.616SS**  trans-102.1101.1161.4-73-174.8178179.20.5109.4
357P57.7Low67.3Low120 Ų120139.4 Ų139.478%0.77967%0.667SS**  trans-58.2141.2148.429.3-33.2000108.2N355N355-P357 WeakPolarHBondContact O-CD 3.35Å
358Y48.6Very low64.9Low304 Ų304146 Ų146100%1.19270%0.699SS**  trans-76.90174.3-110.2-87.6000111

Retrieved 358 of 358 residues in 465.4 ms (Link to these results)