A0A077ZAE6_TRITR Loading...

Small nuclear ribonucleoprotein Sm D1

Plays a role in pre-mRNA splicing as a core component of the spliceosomal U1, U2, U4 and U5 small nuclear ribonucleoproteins (snRNPs), the building blocks of the spliceosome.

AlphaFold DB , UniProt , Accession A0A077ZAE6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 121 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
1M65.6Low90Very high157 Ų15774.3 Ų74.377%0.77335%0.354SS*.  0103.90-50.8-40.3176.900111.5L80 D82M1-L80 VanDerWaalsContact CE-O 3.24Å; M1-L80 WeakPolarHBondContact CE-O 3.24Å; M1-D82 PolarHBondContact N-OD2 3.43Å; M1-D82 VanDerWaalsContact SD-CG 3.58Å; M1-D82 VanDerWaalsContact SD-OD2 3.34Å
2K84.4Confident90.5Very high149 Ų14979.1 Ų79.165%0.64838%0.375SS*.  trans-104.2113.4168.2-69.1-174.4177.3-175.10107.7V4 R5 F6K2-V4 PolarHBondContact O-N 2.83Å; K2-V4 VanDerWaalsContact O-N 3.08Å; K2-R5 HydrophobicContact CB-CB 4.29Å; K2-R5 HydrophobicContact CB-CG 4.1Å; K2-R5 WeakPolarHBondContact O-CA 3.19Å; K2-R5 WeakPolarHBondContact O-CB 2.95Å; K2-R5 PolarHBondContact O-N 3.34Å; K2-F6 PolarHBondContact O-N 3.14Å
3L90.2Very high91Very high120 Ų12075.5 Ų75.563%0.62836%0.358SS*.Hα-helixtrans-44-45.5179.7172.663.5000112.5R5 F6 L7L3-R5 VanDerWaalsContact C-N 3.31Å; L3-R5 PolarHBondContact O-N 2.78Å; L3-F6 WeakPolarHBondContact O-CB 3.05Å; L3-F6 PolarHBondContact O-N 2.95Å; L3-F6 VanDerWaalsContact O-N 3.11Å; L3-L7 HydrophobicContact CD1-CG 4.44Å; L3-L7 HydrophobicContact CG-CD1 4.4Å; L3-L7 PolarHBondContact O-N 3.1Å
4V92.3Very high91.5Very high38 Ų3873.4 Ų73.423%0.2335%0.353CS..Hα-helixtrans-58.4-41.3178.7178.90000112K2 F6 L7 M8 V34 M36K2-V4 PolarHBondContact O-N 2.83Å; K2-V4 VanDerWaalsContact O-N 3.08Å; V4-F6 VanDerWaalsContact C-N 3.31Å; V4-F6 PolarHBondContact O-N 3.29Å; V4-L7 PolarHBondContact O-N 2.96Å; V4-M8 HydrophobicContact CG1-CG 4.43Å; V4-M8 HydrophobicContact CG1-SD 4.33Å; V4-M8 VanDerWaalsContact O-CG 3.23Å; V4-M8 WeakPolarHBondContact O-CG 3.45Å; V4-M8 PolarHBondContact O-N 2.79Å; V4-V34 WeakPolarHBondContact CG1-O 3.48Å; V4-M36 HydrophobicContact CG2-CG 4.05Å; V4-M36 HydrophobicContact CG2-SD 4.41Å
5R91.3Very high92Very high143 Ų14368.7 Ų68.754%0.5433%0.33SS..Hα-helixtrans-64.7-35.8177.1-74.3-167.6171.2-131.4-1.5112.6K2 L3 M8 K9K2-R5 HydrophobicContact CB-CB 4.29Å; K2-R5 HydrophobicContact CB-CG 4.1Å; K2-R5 WeakPolarHBondContact O-CA 3.19Å; K2-R5 WeakPolarHBondContact O-CB 2.95Å; K2-R5 PolarHBondContact O-N 3.34Å; L3-R5 VanDerWaalsContact C-N 3.31Å; L3-R5 PolarHBondContact O-N 2.78Å; R5-M8 PolarHBondContact O-N 2.96Å; R5-K9 PolarHBondContact O-N 3Å
6F93.4Very high92.4Very high25 Ų2567.7 Ų67.711%0.1133%0.33CS..Hα-helixtrans-62.7-48172163.9-93.8000110.5K2 L3 V4 M8 K9 L10 L70 L76 Y79 L80K2-F6 PolarHBondContact O-N 3.14Å; L3-F6 WeakPolarHBondContact O-CB 3.05Å; L3-F6 PolarHBondContact O-N 2.95Å; L3-F6 VanDerWaalsContact O-N 3.11Å; V4-F6 VanDerWaalsContact C-N 3.31Å; V4-F6 PolarHBondContact O-N 3.29Å; F6-M8 VanDerWaalsContact C-N 3.3Å; F6-M8 PolarHBondContact O-N 2.87Å; F6-K9 WeakPolarHBondContact O-CB 3.26Å; F6-K9 PolarHBondContact O-N 2.91Å; F6-L10 HydrophobicContact CE1-CD1 4.04Å; F6-L10 HydrophobicContact CE1-CD2 4.34Å; F6-L10 HydrophobicContact CE1-CG 4.42Å; F6-L10 HydrophobicContact CE2-CD2 4.45Å; F6-L10 HydrophobicContact CZ-CD1 4.5Å; F6-L10 HydrophobicContact CZ-CD2 4Å; F6-L70 HydrophobicContact CE1-CD1 3.93Å; F6-L70 HydrophobicContact CZ-CD1 3.8Å; F6-L76 HydrophobicContact CE2-CD2 3.91Å; F6-L76 HydrophobicContact CZ-CD2 3.71Å; F6-Y79 HydrophobicContact CE2-CD2 4.43Å; F6-L80 HydrophobicContact CD2-CD2 3.83Å; F6-L80 HydrophobicContact CD2-CG 4.23Å; F6-L80 HydrophobicContact CE2-CD2 4.28Å; F6-L80 HydrophobicContact CE2-CG 4.4Å; F6-L80 HydrophobicContact CG-CD2 4.36Å
7L95Very high92.7Very high17 Ų1763.7 Ų63.79%0.08931%0.31CS..Hα-helixtrans-60.2-39.1177.8-63.9179000112.4L3 V4 K9 L10 I32 M36 I68L3-L7 HydrophobicContact CD1-CG 4.44Å; L3-L7 HydrophobicContact CG-CD1 4.4Å; L3-L7 PolarHBondContact O-N 3.1Å; V4-L7 PolarHBondContact O-N 2.96Å; L7-K9 PolarHBondContact O-N 3.09Å; L7-L10 HydrophobicContact CD2-CD1 3.67Å; L7-L10 WeakPolarHBondContact O-CB 3.39Å; L7-L10 PolarHBondContact O-N 2.88Å; L7-I32 HydrophobicContact CB-CD1 4.02Å; L7-I32 HydrophobicContact CB-CG2 4.15Å; L7-I32 WeakPolarHBondContact O-CD1 3.43Å; L7-M36 HydrophobicContact CD1-CG 4.3Å; L7-M36 HydrophobicContact CD1-SD 4.03Å; L7-I68 HydrophobicContact CD2-CD1 4.4Å
8M95Very high93.1Very high76 Ų7661.7 Ų61.737%0.37430%0.3SS..Hα-helixtrans-59-26.3175-67177.973.200113.3V4 R5 F6 S11 I32 V34V4-M8 HydrophobicContact CG1-CG 4.43Å; V4-M8 HydrophobicContact CG1-SD 4.33Å; V4-M8 VanDerWaalsContact O-CG 3.23Å; V4-M8 WeakPolarHBondContact O-CG 3.45Å; V4-M8 PolarHBondContact O-N 2.79Å; R5-M8 PolarHBondContact O-N 2.96Å; F6-M8 VanDerWaalsContact C-N 3.3Å; F6-M8 PolarHBondContact O-N 2.87Å; M8-S11 PolarHBondContact O-OG 2.82Å; M8-I32 WeakPolarHBondContact CG-O 3.49Å; M8-V34 HydrophobicContact SD-CG2 4.36Å
9K93.9Very high93.3Very high55 Ų5559.5 Ų59.524%0.23929%0.29CS..Hα-helixtrans-79.9-15177.1-67.6179.7176.4-162.30113.6R5 F6 L7 S11 Y79 I81 D83R5-K9 PolarHBondContact O-N 3Å; F6-K9 WeakPolarHBondContact O-CB 3.26Å; F6-K9 PolarHBondContact O-N 2.91Å; L7-K9 PolarHBondContact O-N 3.09Å; K9-S11 PolarHBondContact O-N 2.82Å; K9-Y79 HydrophobicContact CB-CD1 3.97Å; K9-Y79 HydrophobicContact CB-CG 4.18Å; K9-Y79 HydrophobicContact CD-CD1 4.4Å; K9-Y79 WeakPolarHBondContact CD-O 3.39Å; K9-I81 PolarHBondContact NZ-O 2.86Å; K9-D83 VanDerWaalsContact CE-OD2 3.22Å; K9-D83 WeakPolarHBondContact CE-OD2 3.38Å; K9-D83 IonicContact NZ-OD1 3.7Å; K9-D83 IonicContact NZ-OD2 2.8Å; K9-D83 PolarHBondContact NZ-OD2 2.69Å
10L94.9Very high93.6Very high0 Ų062.9 Ų62.90%030%0.303CS..  trans-7523.2-179.8-58.2176.2000113.6F6 L7 H12 E13 I29 L70 V74 Y79F6-L10 HydrophobicContact CE1-CD1 4.04Å; F6-L10 HydrophobicContact CE1-CD2 4.34Å; F6-L10 HydrophobicContact CE1-CG 4.42Å; F6-L10 HydrophobicContact CE2-CD2 4.45Å; F6-L10 HydrophobicContact CZ-CD1 4.5Å; F6-L10 HydrophobicContact CZ-CD2 4Å; L7-L10 HydrophobicContact CD2-CD1 3.67Å; L7-L10 WeakPolarHBondContact O-CB 3.39Å; L7-L10 PolarHBondContact O-N 2.88Å; L10-H12 PolarHBondContact O-N 2.87Å; L10-E13 HydrophobicContact CB-CB 4.39Å; L10-E13 HydrophobicContact CB-CG 4.18Å; L10-E13 HydrophobicContact CD2-CG 4.28Å; L10-E13 WeakPolarHBondContact O-CB 3.31Å; L10-E13 PolarHBondContact O-N 2.82Å; L10-I29 HydrophobicContact CB-CD1 3.89Å; L10-I29 WeakPolarHBondContact O-CB 3.15Å; L10-I29 WeakPolarHBondContact O-CD1 3.12Å; L10-L70 HydrophobicContact CD1-CD2 3.43Å; L10-L70 VanDerWaalsContact CD1-CD2 3.43Å; L10-L70 HydrophobicContact CD2-CD2 4.45Å; L10-V74 HydrophobicContact CD2-CG1 3.89Å; L10-Y79 HydrophobicContact CD2-CD2 3.76Å; L10-Y79 HydrophobicContact CD2-CE2 3.94Å
11S94.2Very high93.8Very high37 Ų3764.9 Ų64.926%0.25932%0.315SS..THydrogen-bonded Turntrans-62.6138.7177-64.70000109.6M8 K9 E13M8-S11 PolarHBondContact O-OG 2.82Å; K9-S11 PolarHBondContact O-N 2.82Å; S11-E13 PolarHBondContact O-N 2.86Å
12H95.8Very high95.3Very high132 Ų13258.5 Ų58.561%0.61129%0.29SS*.THydrogen-bonded Turntrans71.3-2.3-175.6-42.6-77.5000116.2L10 T28 I29 R41L10-H12 PolarHBondContact O-N 2.87Å; H12-T28 VanDerWaalsContact O-CG2 3.26Å; H12-T28 WeakPolarHBondContact O-CG2 3.48Å; H12-I29 WeakPolarHBondContact CA-O 3.4Å; H12-I29 PolarHBondContact N-O 2.95Å; H12-R41 PolarHBondContact ND1-NH2 2.84Å
13E97Very high96Very high33 Ų3352 Ų5215%0.15426%0.262CS..  trans-75.4142.2172-59-64.5172.500110.9L10 S11 V15 T28 I29 V74 Y79L10-E13 HydrophobicContact CB-CB 4.39Å; L10-E13 HydrophobicContact CB-CG 4.18Å; L10-E13 HydrophobicContact CD2-CG 4.28Å; L10-E13 WeakPolarHBondContact O-CB 3.31Å; L10-E13 PolarHBondContact O-N 2.82Å; S11-E13 PolarHBondContact O-N 2.86Å; E13-V15 HydrophobicContact CB-CG1 4.5Å; E13-T28 WeakPolarHBondContact O-CA 3.47Å; E13-I29 PolarHBondContact O-N 3.04Å; E13-V74 HydrophobicContact CG-CG2 4.43Å; E13-Y79 PolarHBondContact OE1-OH 3.21Å
14T98.1Very high96.4Very high46 Ų4651 Ų5128%0.28225%0.254SS..EExtended strand (participates in β ladder)trans-97122.3175.7-60.40000110Y26 G27 T28 P71T14-Y26 HydrophobicContact CG2-CE1 3.98Å; T14-Y26 HydrophobicContact CG2-CE2 3.72Å; T14-Y26 VanDerWaalsContact CG2-CZ 3.41Å; T14-Y26 WeakPolarHBondContact CG2-OH 3.46Å; T14-G27 WeakPolarHBondContact CA-O 3.33Å; T14-T28 PolarHBondContact OG1-OG1 2.74Å; T14-P71 WeakPolarHBondContact O-CD 3.34Å; T14-P71 VanDerWaalsContact O-CG 3.31Å; T14-P71 WeakPolarHBondContact O-CG 3.36Å
15V98.4Very high96.7Very high2 Ų249.2 Ų49.21%0.01224%0.244CC..EExtended strand (participates in β ladder)trans-129.3161-169.5-61.90000111.4E13 I17 Y26 G27 I29 L40 I68 V69 L70E13-V15 HydrophobicContact CB-CG1 4.5Å; V15-I17 HydrophobicContact CG2-CD1 4.08Å; V15-I17 HydrophobicContact CG2-CG1 3.83Å; V15-Y26 WeakPolarHBondContact O-CA 2.96Å; V15-G27 PolarHBondContact N-O 3.43Å; V15-G27 PolarHBondContact O-N 2.86Å; V15-G27 VanDerWaalsContact O-N 3.1Å; V15-I29 HydrophobicContact CB-CD1 4.39Å; V15-I29 HydrophobicContact CG1-CD1 3.65Å; V15-I29 HydrophobicContact CG1-CG1 4.39Å; V15-I29 HydrophobicContact CG2-CD1 3.78Å; V15-I29 HydrophobicContact CG2-CG1 3.78Å; V15-L40 HydrophobicContact CG2-CD2 4.27Å; V15-I68 HydrophobicContact CB-CG2 3.8Å; V15-I68 HydrophobicContact CG1-CG2 3.95Å; V15-I68 HydrophobicContact CG2-CG2 4.05Å; V15-V69 WeakPolarHBondContact CB-O 3.39Å; V15-L70 HydrophobicContact CG1-CD2 4.3Å
16T98.4Very high97Very high53 Ų5347.8 Ų47.833%0.32524%0.239SC..EExtended strand (participates in β ladder)trans-107.1127.9163.9-570000108.9V25 V69T16-V25 CarbonylContact C-O 3.51Å; T16-V25 WeakPolarHBondContact CA-O 3.44Å; T16-V69 PolarHBondContact N-O 2.97Å; T16-V69 PolarHBondContact O-N 2.84Å
17I98.6Very high97.3Very high0 Ų046.6 Ų46.60%023%0.234CC..EExtended strand (participates in β ladder)trans-115.3128.4179.2-51.6-172.4000108.6V15 L19 Q24 V25 T38 L40 I60 I65 I68V15-I17 HydrophobicContact CG2-CD1 4.08Å; V15-I17 HydrophobicContact CG2-CG1 3.83Å; I17-L19 HydrophobicContact CG2-CD2 3.93Å; I17-Q24 WeakPolarHBondContact O-CA 3.48Å; I17-V25 HydrophobicContact CB-CB 4.39Å; I17-V25 PolarHBondContact N-O 2.81Å; I17-V25 PolarHBondContact O-N 2.96Å; I17-T38 HydrophobicContact CD1-CG2 3.8Å; I17-L40 HydrophobicContact CD1-CD1 4.09Å; I17-L40 HydrophobicContact CD1-CD2 4.34Å; I17-I60 HydrophobicContact CD1-CD1 4.28Å; I17-I65 HydrophobicContact CG2-CB 4.48Å; I17-I65 HydrophobicContact CG2-CD1 4.46Å; I17-I65 HydrophobicContact CG2-CG1 4.1Å; I17-I65 HydrophobicContact CG2-CG2 3.84Å; I17-I68 HydrophobicContact CD1-CG1 4.39Å; I17-I68 HydrophobicContact CG1-CG1 4.21Å; I17-I68 HydrophobicContact CG1-CG2 4.32Å; I17-I68 HydrophobicContact CG2-CG1 4.38Å
18E98.5Very high97.4Very high28 Ų2846.8 Ų46.813%0.13124%0.236CC..EExtended strand (participates in β ladder)trans-99.8129.1167.6-170.7169.912300110.1R66 Y67E18-R66 WeakPolarHBondContact O-CA 3.27Å; E18-R66 VanDerWaalsContact O-CB 3.26Å; E18-R66 WeakPolarHBondContact O-CB 3.32Å; E18-R66 PolarHBondContact O-N 3.11Å; E18-R66 WeakPolarHBondContact OE1-CD 3.44Å; E18-R66 IonicContact OE1-CZ 3.58Å; E18-R66 IonicContact OE1-NE 3.9Å; E18-R66 IonicContact OE1-NH1 2.62Å; E18-R66 PolarHBondContact OE1-NH1 3.42Å; E18-Y67 HydrophobicContact CB-CD1 4.39Å; E18-Y67 HydrophobicContact CB-CD2 4.09Å; E18-Y67 HydrophobicContact CB-CE1 3.93Å; E18-Y67 HydrophobicContact CB-CE2 3.63Å; E18-Y67 HydrophobicContact CB-CG 4.46Å; E18-Y67 HydrophobicContact CG-CE1 4.31Å; E18-Y67 PolarHBondContact N-O 2.91Å; E18-Y67 VanDerWaalsContact N-O 3.1Å; E18-Y67 PolarHBondContact O-N 2.73Å; E18-Y67 VanDerWaalsContact OE2-CZ 3.25Å; E18-Y67 PolarHBondContact OE2-OH 3.02Å
19L98.6Very high97.6Very high20 Ų2043.1 Ų43.111%0.10522%0.218CC..EExtended strand (participates in β ladder)trans-91.8157.4176-54.5-170.6000111.3I17 N21 G22 T23 V25 I60 N64 I65I17-L19 HydrophobicContact CG2-CD2 3.93Å; L19-N21 WeakPolarHBondContact CB-OD1 3.21Å; L19-N21 PolarHBondContact O-N 2.83Å; L19-N21 VanDerWaalsContact O-N 3.09Å; L19-G22 PolarHBondContact O-N 2.84Å; L19-T23 HydrophobicContact CD1-CG2 4.16Å; L19-T23 PolarHBondContact N-O 3.19Å; L19-V25 HydrophobicContact CD1-CG2 4.33Å; L19-V25 HydrophobicContact CG-CG2 4.45Å; L19-I60 HydrophobicContact CD1-CG2 4.47Å; L19-I60 HydrophobicContact CD2-CD1 4.27Å; L19-I60 HydrophobicContact CD2-CG2 3.63Å; L19-N64 CarbonylContact C-O 3.54Å; L19-N64 WeakPolarHBondContact CA-O 3.47Å; L19-I65 HydrophobicContact CD2-CG1 4.2Å
20K98.6Very high97.8Very high126 Ų12643.4 Ų43.455%0.54823%0.227SC..THydrogen-bonded Turntrans-59.3-23.4-179.9-72.1178.5178.2175.80114.4G22 N63 N64 R66K20-G22 VanDerWaalsContact C-N 3.31Å; K20-N63 WeakPolarHBondContact CD-O 3.31Å; K20-N63 WeakPolarHBondContact CE-O 3.39Å; K20-N63 PolarHBondContact NZ-O 2.99Å; K20-N64 PolarHBondContact N-O 3.32Å; K20-R66 HydrophobicContact CG-CB 4.43Å; K20-R66 PolarHBondContact O-NH2 2.89Å
21N97.1Very high98Very high105 Ų10544.2 Ų44.256%0.56124%0.235SC*.THydrogen-bonded Turntrans-87.33.8175.768.10.7000113.4L19 T23L19-N21 WeakPolarHBondContact CB-OD1 3.21Å; L19-N21 PolarHBondContact O-N 2.83Å; L19-N21 VanDerWaalsContact O-N 3.09Å; N21-T23 PolarHBondContact ND2-OG1 3.12Å; N21-T23 WeakPolarHBondContact OD1-CB 3.46Å; N21-T23 PolarHBondContact OD1-N 2.89Å; N21-T23 PolarHBondContact OD1-OG1 3.16Å
22G97.8Very high98.1Very high23 Ų2343 Ų4324%0.23723%0.225CC..SBendtrans82.57.4-177.200000114.7L19 K20L19-G22 PolarHBondContact O-N 2.84Å; K20-G22 VanDerWaalsContact C-N 3.31Å
23T98.4Very high98.2Very high12 Ų1239.2 Ų39.27%0.07421%0.21CC..  trans-70.3133170.1-570000109.3L19 N21 V25 L45 T46L19-T23 HydrophobicContact CD1-CG2 4.16Å; L19-T23 PolarHBondContact N-O 3.19Å; N21-T23 PolarHBondContact ND2-OG1 3.12Å; N21-T23 WeakPolarHBondContact OD1-CB 3.46Å; N21-T23 PolarHBondContact OD1-N 2.89Å; N21-T23 PolarHBondContact OD1-OG1 3.16Å; T23-V25 HydrophobicContact CG2-CG2 4.15Å; T23-L45 HydrophobicContact CG2-CD1 4.23Å; T23-L45 HydrophobicContact CG2-CD2 4.14Å; T23-L45 HydrophobicContact CG2-CG 3.89Å; T23-T46 WeakPolarHBondContact CA-O 3.48Å
24Q98.4Very high98.1Very high99 Ų9943 Ų4346%0.46324%0.235SC..EExtended strand (participates in β ladder)trans-102.6137.8172.2-67.7-177.7-15.200109.6I17 T46I17-Q24 WeakPolarHBondContact O-CA 3.48Å; Q24-T46 PolarHBondContact N-O 2.85Å; Q24-T46 PolarHBondContact O-N 3.45Å
25V98.7Very high98Very high1 Ų143.7 Ų43.71%0.00625%0.245CC..EExtended strand (participates in β ladder)trans-129.7118.8179-1740000108.4T16 I17 L19 T23 L40 V43 L45 L58 I60T16-V25 CarbonylContact C-O 3.51Å; T16-V25 WeakPolarHBondContact CA-O 3.44Å; I17-V25 HydrophobicContact CB-CB 4.39Å; I17-V25 PolarHBondContact N-O 2.81Å; I17-V25 PolarHBondContact O-N 2.96Å; L19-V25 HydrophobicContact CD1-CG2 4.33Å; L19-V25 HydrophobicContact CG-CG2 4.45Å; T23-V25 HydrophobicContact CG2-CG2 4.15Å; V25-L40 HydrophobicContact CG1-CD1 3.49Å; V25-L40 VanDerWaalsContact CG1-CD1 3.49Å; V25-V43 HydrophobicContact CG1-CG1 3.47Å; V25-V43 VanDerWaalsContact CG1-CG1 3.47Å; V25-L45 HydrophobicContact CG2-CD1 4.34Å; V25-L45 HydrophobicContact CG2-CG 4.43Å; V25-L58 HydrophobicContact CG1-CD2 3.73Å; V25-L58 HydrophobicContact CG2-CD2 4.12Å; V25-I60 HydrophobicContact CB-CD1 4.17Å; V25-I60 HydrophobicContact CG1-CD1 4.12Å; V25-I60 HydrophobicContact CG2-CD1 3.95Å
26Y98.6Very high98Very high113 Ų11346.9 Ų46.944%0.44326%0.261SS..EExtended strand (participates in β ladder)trans-103.9132.2169.1174.8-91.8000108.8T14 V15 V43 K44T14-Y26 HydrophobicContact CG2-CE1 3.98Å; T14-Y26 HydrophobicContact CG2-CE2 3.72Å; T14-Y26 VanDerWaalsContact CG2-CZ 3.41Å; T14-Y26 WeakPolarHBondContact CG2-OH 3.46Å; V15-Y26 WeakPolarHBondContact O-CA 2.96Å; Y26-V43 CarbonylContact O-C 3.52Å; Y26-V43 WeakPolarHBondContact O-CA 3.4Å; Y26-K44 HydrophobicContact CD1-CD 4.29Å; Y26-K44 PolarHBondContact N-O 3.33Å; Y26-K44 PolarHBondContact O-N 2.88Å
27G98.5Very high98Very high0 Ų046.3 Ų46.30%026%0.256CS..EExtended strand (participates in β ladder)trans178.7173.1177.600000113.7T14 V15T14-G27 WeakPolarHBondContact CA-O 3.33Å; V15-G27 PolarHBondContact N-O 3.43Å; V15-G27 PolarHBondContact O-N 2.86Å; V15-G27 VanDerWaalsContact O-N 3.1Å
28T98.5Very high98Very high21 Ų2146.3 Ų46.313%0.12926%0.256CS..EExtended strand (participates in β ladder)trans-95.3127179.8-49.40000110.9H12 E13 T14 S30 L40 R41H12-T28 VanDerWaalsContact O-CG2 3.26Å; H12-T28 WeakPolarHBondContact O-CG2 3.48Å; E13-T28 WeakPolarHBondContact O-CA 3.47Å; T14-T28 PolarHBondContact OG1-OG1 2.74Å; T28-S30 PolarHBondContact O-N 2.62Å; T28-L40 CarbonylContact O-C 3.54Å; T28-L40 VanDerWaalsContact O-CA 3.28Å; T28-L40 WeakPolarHBondContact O-CA 3.26Å; T28-R41 VanDerWaalsContact CG2-CZ 3.5Å; T28-R41 VanDerWaalsContact CG2-NH2 3.31Å; T28-R41 PolarHBondContact N-O 3.44Å; T28-R41 PolarHBondContact O-N 2.54Å
29I98.4Very high98Very high0 Ų048.4 Ų48.40%027%0.265CS..EExtended strand (participates in β ladder)trans-63.9126.3178.7-62.2166.8000109.7L10 H12 E13 V15 I32 T38 L40 R41L10-I29 HydrophobicContact CB-CD1 3.89Å; L10-I29 WeakPolarHBondContact O-CB 3.15Å; L10-I29 WeakPolarHBondContact O-CD1 3.12Å; H12-I29 WeakPolarHBondContact CA-O 3.4Å; H12-I29 PolarHBondContact N-O 2.95Å; E13-I29 PolarHBondContact O-N 3.04Å; V15-I29 HydrophobicContact CB-CD1 4.39Å; V15-I29 HydrophobicContact CG1-CD1 3.65Å; V15-I29 HydrophobicContact CG1-CG1 4.39Å; V15-I29 HydrophobicContact CG2-CD1 3.78Å; V15-I29 HydrophobicContact CG2-CG1 3.78Å; I29-I32 HydrophobicContact CD1-CD1 4.02Å; I29-I32 HydrophobicContact CG2-CD1 4.29Å; I29-I32 HydrophobicContact CG2-CG1 3.88Å; I29-T38 HydrophobicContact CG1-CG2 4.31Å; I29-L40 HydrophobicContact CB-CD2 4.5Å; I29-L40 HydrophobicContact CG1-CD2 3.84Å; I29-R41 PolarHBondContact O-NH1 2.94Å
30S98.4Very high98Very high61 Ų6147.5 Ų47.543%0.42726%0.261SS..EExtended strand (participates in β ladder)trans-94-29.2165.7550000111.9T28 H39T28-S30 PolarHBondContact O-N 2.62Å; S30-H39 PolarHBondContact N-O 3.47Å; S30-H39 WeakPolarHBondContact OG-CB 3.34Å; S30-H39 PolarHBondContact OG-O 2.83Å
31G98.1Very high98Very high16 Ų1645.9 Ų45.917%0.16525%0.251CS..EExtended strand (participates in β ladder)trans-179.1157.8172.100000112.3H39G31-H39 PolarHBondContact N-O 2.97Å; G31-H39 PolarHBondContact O-N 3.1Å
32I98Very high98Very high12 Ų1244.2 Ų44.26%0.06225%0.252CS..EExtended strand (participates in β ladder)trans-126.8138.8172.3-60.6-175.8000107.9L7 M8 I29 N37 T38 I68L7-I32 HydrophobicContact CB-CD1 4.02Å; L7-I32 HydrophobicContact CB-CG2 4.15Å; L7-I32 WeakPolarHBondContact O-CD1 3.43Å; M8-I32 WeakPolarHBondContact CG-O 3.49Å; I29-I32 HydrophobicContact CD1-CD1 4.02Å; I29-I32 HydrophobicContact CG2-CD1 4.29Å; I29-I32 HydrophobicContact CG2-CG1 3.88Å; I32-N37 WeakPolarHBondContact CA-O 3.32Å; I32-T38 HydrophobicContact CD1-CG2 4.09Å; I32-T38 HydrophobicContact CG1-CG2 3.92Å; I32-I68 HydrophobicContact CD1-CD1 4.46Å
33D96.4Very high98.1Very high52 Ų5243.2 Ų43.228%0.27824%0.241SC..  trans-102.6-179.3177.577.215.5000113.5A35 M36 N37D33-A35 PolarHBondContact O-N 2.83Å; D33-A35 WeakPolarHBondContact OD1-CA 3.34Å; D33-A35 WeakPolarHBondContact OD1-CB 3.44Å; D33-A35 PolarHBondContact OD1-N 2.8Å; D33-M36 WeakPolarHBondContact O-CA 3.32Å; D33-M36 PolarHBondContact O-N 2.88Å; D33-M36 PolarHBondContact OD1-N 3.46Å; D33-M36 VanDerWaalsContact OD1-N 3.16Å; D33-N37 PolarHBondContact N-O 2.85Å; D33-N37 WeakPolarHBondContact OD1-CB 3.46Å; D33-N37 PolarHBondContact OD1-N 2.74Å; D33-N37 PolarHBondContact OD1-ND2 3.32Å; D33-N37 WeakPolarHBondContact OD2-CB 3.48Å; D33-N37 PolarHBondContact OD2-ND2 3.16Å
34V95.6Very high98.1Very high114 Ų11447.8 Ų47.869%0.69126%0.26SS*.THydrogen-bonded Turntrans-63.7-26.8-177.51790000112.8V4 M8 M36V4-V34 WeakPolarHBondContact CG1-O 3.48Å; M8-V34 HydrophobicContact SD-CG2 4.36Å; V34-M36 PolarHBondContact O-N 3.1Å
35A96.4Very high98.1Very high60 Ų6044.8 Ų44.850%0.49625%0.247SC..THydrogen-bonded Turntrans-87.28.1176.600000112.5D33 N37D33-A35 PolarHBondContact O-N 2.83Å; D33-A35 WeakPolarHBondContact OD1-CA 3.34Å; D33-A35 WeakPolarHBondContact OD1-CB 3.44Å; D33-A35 PolarHBondContact OD1-N 2.8Å; A35-N37 PolarHBondContact O-N 3.05Å
36M97.2Very high98.1Very high69 Ų6946.9 Ų46.934%0.3426%0.26SS..  trans59.623.6-171.6-52-176.4-62.200113V4 L7 D33 V34 T38 G62V4-M36 HydrophobicContact CG2-CG 4.05Å; V4-M36 HydrophobicContact CG2-SD 4.41Å; L7-M36 HydrophobicContact CD1-CG 4.3Å; L7-M36 HydrophobicContact CD1-SD 4.03Å; D33-M36 WeakPolarHBondContact O-CA 3.32Å; D33-M36 PolarHBondContact O-N 2.88Å; D33-M36 PolarHBondContact OD1-N 3.46Å; D33-M36 VanDerWaalsContact OD1-N 3.16Å; V34-M36 PolarHBondContact O-N 3.1Å; M36-T38 PolarHBondContact O-N 3.35Å; M36-T38 PolarHBondContact O-OG1 3.3Å; M36-G62 VanDerWaalsContact C-CA 3.43Å; M36-G62 WeakPolarHBondContact O-CA 3.44Å
37N98Very high98Very high40 Ų4042.3 Ų42.321%0.21425%0.246CC..  trans-65.5128.2166.7-54.3-43.1000107.3I32 D33 A35 I60 R61 G62I32-N37 WeakPolarHBondContact CA-O 3.32Å; D33-N37 PolarHBondContact N-O 2.85Å; D33-N37 WeakPolarHBondContact OD1-CB 3.46Å; D33-N37 PolarHBondContact OD1-N 2.74Å; D33-N37 PolarHBondContact OD1-ND2 3.32Å; D33-N37 WeakPolarHBondContact OD2-CB 3.48Å; D33-N37 PolarHBondContact OD2-ND2 3.16Å; A35-N37 PolarHBondContact O-N 3.05Å; N37-I60 CarbonylContact C-O 3.55Å; N37-I60 WeakPolarHBondContact CA-O 3.37Å; N37-R61 VanDerWaalsContact OD1-CA 3.27Å; N37-R61 WeakPolarHBondContact OD1-CA 3.26Å; N37-R61 WeakPolarHBondContact OD1-CG 3.28Å; N37-G62 PolarHBondContact OD1-N 2.84Å
38T98.7Very high97.7Very high0 Ų050.7 Ų50.70%028%0.277CS..EExtended strand (participates in β ladder)trans-114.7120.8-173.2-59.10000108.7I17 I29 I32 M36 L40 I60 I65I17-T38 HydrophobicContact CD1-CG2 3.8Å; I29-T38 HydrophobicContact CG1-CG2 4.31Å; I32-T38 HydrophobicContact CD1-CG2 4.09Å; I32-T38 HydrophobicContact CG1-CG2 3.92Å; M36-T38 PolarHBondContact O-N 3.35Å; M36-T38 PolarHBondContact O-OG1 3.3Å; T38-L40 HydrophobicContact CG2-CD2 4Å; T38-L40 HydrophobicContact CG2-CG 4.11Å; T38-I60 PolarHBondContact N-O 3.08Å; T38-I60 PolarHBondContact O-N 3.18Å; T38-I65 WeakPolarHBondContact OG1-CD1 3.5Å
39H98.6Very high97.5Very high72 Ų7257 Ų5733%0.33331%0.31SS..EExtended strand (participates in β ladder)trans-97.9131.1174.4-56.6-77.4000108.5S30 G31 S59S30-H39 PolarHBondContact N-O 3.47Å; S30-H39 WeakPolarHBondContact OG-CB 3.34Å; S30-H39 PolarHBondContact OG-O 2.83Å; G31-H39 PolarHBondContact N-O 2.97Å; G31-H39 PolarHBondContact O-N 3.1Å; H39-S59 WeakPolarHBondContact ND1-CB 3.35Å; H39-S59 PolarHBondContact ND1-OG 3.25Å
40L98.8Very high97.3Very high2 Ų266 Ų661%0.0134%0.344CS..EExtended strand (participates in β ladder)trans-125.8152-176.6-61.5165.8000110.4V15 I17 V25 T28 I29 T38 V43 T57 L58 I60V15-L40 HydrophobicContact CG2-CD2 4.27Å; I17-L40 HydrophobicContact CD1-CD1 4.09Å; I17-L40 HydrophobicContact CD1-CD2 4.34Å; V25-L40 HydrophobicContact CG1-CD1 3.49Å; V25-L40 VanDerWaalsContact CG1-CD1 3.49Å; T28-L40 CarbonylContact O-C 3.54Å; T28-L40 VanDerWaalsContact O-CA 3.28Å; T28-L40 WeakPolarHBondContact O-CA 3.26Å; I29-L40 HydrophobicContact CB-CD2 4.5Å; I29-L40 HydrophobicContact CG1-CD2 3.84Å; T38-L40 HydrophobicContact CG2-CD2 4Å; T38-L40 HydrophobicContact CG2-CG 4.11Å; L40-V43 HydrophobicContact CB-CG2 3.5Å; L40-V43 VanDerWaalsContact CB-CG2 3.5Å; L40-T57 VanDerWaalsContact O-CA 3.31Å; L40-T57 WeakPolarHBondContact O-CA 3.48Å; L40-L58 PolarHBondContact N-O 3.42Å; L40-L58 PolarHBondContact O-N 3.34Å; L40-I60 HydrophobicContact CD1-CD1 3.77Å
41R98.6Very high97.3Very high92 Ų9271.6 Ų71.635%0.34736%0.363SS..EExtended strand (participates in β ladder)trans-124161.1167.469-179.8-178-76.9-0.5110.6H12 T28 I29 D56H12-R41 PolarHBondContact ND1-NH2 2.84Å; T28-R41 VanDerWaalsContact CG2-CZ 3.5Å; T28-R41 VanDerWaalsContact CG2-NH2 3.31Å; T28-R41 PolarHBondContact N-O 3.44Å; T28-R41 PolarHBondContact O-N 2.54Å; I29-R41 PolarHBondContact O-NH1 2.94Å; R41-D56 CarbonylContact C-O 3.56Å; R41-D56 VanDerWaalsContact CA-O 3.26Å; R41-D56 WeakPolarHBondContact CA-O 3.23Å
42A98.4Very high97.3Very high69 Ų6974.6 Ų74.657%0.5738%0.379SS*.EExtended strand (participates in β ladder)trans5259.6-179.800000111.6D56A42-D56 PolarHBondContact N-O 2.83Å
43V98.8Very high97.3Very high3 Ų377.8 Ų77.82%0.01840%0.399CS..EExtended strand (participates in β ladder)trans-98.4136.2-164.3-178.90000111.4V25 Y26 L40 Q54 L55 L58V25-V43 HydrophobicContact CG1-CG1 3.47Å; V25-V43 VanDerWaalsContact CG1-CG1 3.47Å; Y26-V43 CarbonylContact O-C 3.52Å; Y26-V43 WeakPolarHBondContact O-CA 3.4Å; L40-V43 HydrophobicContact CB-CG2 3.5Å; L40-V43 VanDerWaalsContact CB-CG2 3.5Å; V43-Q54 WeakPolarHBondContact O-CA 3.35Å; V43-L55 HydrophobicContact CB-CB 4.24Å; V43-L55 PolarHBondContact N-O 2.76Å; V43-L55 PolarHBondContact O-N 3.25Å; V43-L58 HydrophobicContact CB-CB 4.39Å; V43-L58 HydrophobicContact CG1-CB 4.12Å; V43-L58 HydrophobicContact CG1-CD2 3.95Å; V43-L58 HydrophobicContact CG2-CB 3.95Å
44K98.6Very high97.4Very high107 Ų10782.9 Ų82.947%0.46542%0.42SS..EExtended strand (participates in β ladder)trans-110.8115.4163.5-63.6178.9-177.9177.20108.1Y26 T52Y26-K44 HydrophobicContact CD1-CD 4.29Å; Y26-K44 PolarHBondContact N-O 3.33Å; Y26-K44 PolarHBondContact O-N 2.88Å; K44-T52 HydrophobicContact CB-CG2 3.92Å
45L98.5Very high97.5Very high37 Ų3780.4 Ų80.419%0.19440%0.403CS..EExtended strand (participates in β ladder)trans-108.4124.1179.6-179.5148.6000109.7T23 V25 A47 T52 V53 L55 L58T23-L45 HydrophobicContact CG2-CD1 4.23Å; T23-L45 HydrophobicContact CG2-CD2 4.14Å; T23-L45 HydrophobicContact CG2-CG 3.89Å; V25-L45 HydrophobicContact CG2-CD1 4.34Å; V25-L45 HydrophobicContact CG2-CG 4.43Å; L45-A47 HydrophobicContact CD2-CB 4.28Å; L45-T52 CarbonylContact O-C 3.56Å; L45-T52 WeakPolarHBondContact O-CA 3.48Å; L45-V53 PolarHBondContact N-O 3.18Å; L45-V53 PolarHBondContact O-N 3.05Å; L45-L55 HydrophobicContact CB-CD1 4.42Å; L45-L55 HydrophobicContact CD1-CD1 4.4Å; L45-L58 HydrophobicContact CD1-CD2 3.87Å
46T98.3Very high97.6Very high44 Ų4484.6 Ų84.627%0.2742%0.417SS..EExtended strand (participates in β ladder)trans-118.897.8175.7-50.30000108.1T23 Q24 T52T23-T46 WeakPolarHBondContact CA-O 3.48Å; Q24-T46 PolarHBondContact N-O 2.85Å; Q24-T46 PolarHBondContact O-N 3.45Å; T46-T52 PolarHBondContact OG1-OG1 3.33Å
47A96.6Very high97.6Very high18 Ų1886.3 Ų86.315%0.14943%0.432CS..  trans-67.8151.717200000109.9L45 N49 R50L45-A47 HydrophobicContact CD2-CB 4.28Å; A47-N49 PolarHBondContact O-N 2.94Å; A47-N49 VanDerWaalsContact O-N 3.14Å; A47-R50 HydrophobicContact CB-CB 4.05Å; A47-R50 HydrophobicContact CB-CG 4.28Å; A47-R50 PolarHBondContact O-N 3.49Å
48R93.7Very high97.7Very high176 Ų17686.2 Ų86.266%0.66443%0.431SS*.THydrogen-bonded Turntrans-53.5123.4-177.6-173.5-179.4-177.3-145.50.9110.6R50R48-R50 PolarHBondContact O-N 2.91Å
49N92.9Very high97.7Very high152 Ų15290.1 Ų90.181%0.81346%0.458SS*.THydrogen-bonded Turntrans57.928.7-179.9-50-22.8000114A47A47-N49 PolarHBondContact O-N 2.94Å; A47-N49 VanDerWaalsContact O-N 3.14Å
50R95.4Very high97.7Very high191 Ų19187.1 Ų87.172%0.72145%0.445SS*.SBendtrans-126161.8175.2-63.9-172.8-178.8177.7-1.3110.4A47 R48A47-R50 HydrophobicContact CB-CB 4.05Å; A47-R50 HydrophobicContact CB-CG 4.28Å; A47-R50 PolarHBondContact O-N 3.49Å; R48-R50 PolarHBondContact O-N 2.91Å
51E96.9Very high97.7Very high177 Ų17794.8 Ų94.883%0.82747%0.474SS*.  trans-65.2155.3174.1-65.1-178.3175.500111.9
52T98.1Very high97.6Very high80 Ų8090.5 Ų90.549%0.49146%0.458SS..EExtended strand (participates in β ladder)trans-76.4128.6178.8-57.80000110.5K44 L45 T46K44-T52 HydrophobicContact CB-CG2 3.92Å; L45-T52 CarbonylContact O-C 3.56Å; L45-T52 WeakPolarHBondContact O-CA 3.48Å; T46-T52 PolarHBondContact OG1-OG1 3.33Å
53V98.2Very high97.6Very high79 Ų7990.7 Ų90.748%0.47945%0.449SS..EExtended strand (participates in β ladder)trans-107.5138.8175.9-178.20000109.5L45 L55L45-V53 PolarHBondContact N-O 3.18Å; L45-V53 PolarHBondContact O-N 3.05Å; V53-L55 HydrophobicContact CG1-CD2 4.15Å; V53-L55 HydrophobicContact CG1-CG 4.46Å
54Q98.4Very high97.6Very high158 Ų15894.1 Ų94.174%0.73847%0.468SS*.EExtended strand (participates in β ladder)trans-93136.5173.2-62.5-175.915.100110.1V43V43-Q54 WeakPolarHBondContact O-CA 3.35Å
55L98.3Very high97.6Very high63 Ų6390.2 Ų90.233%0.3345%0.451SS..EExtended strand (participates in β ladder)trans-134.9140.5177.7-57.5170.4000109.2V43 L45 V53 L58V43-L55 HydrophobicContact CB-CB 4.24Å; V43-L55 PolarHBondContact N-O 2.76Å; V43-L55 PolarHBondContact O-N 3.25Å; L45-L55 HydrophobicContact CB-CD1 4.42Å; L45-L55 HydrophobicContact CD1-CD1 4.4Å; V53-L55 HydrophobicContact CG1-CD2 4.15Å; V53-L55 HydrophobicContact CG1-CG 4.46Å; L55-L58 HydrophobicContact CD1-CD1 4.15Å
56D98.4Very high97.6Very high147 Ų14794.5 Ų94.579%0.78647%0.465SS*.EExtended strand (participates in β ladder)trans-66.1-42.4175.7-66.2-28.6000111.3R41 A42R41-D56 CarbonylContact C-O 3.56Å; R41-D56 VanDerWaalsContact CA-O 3.26Å; R41-D56 WeakPolarHBondContact CA-O 3.23Å; A42-D56 PolarHBondContact N-O 2.83Å
57T98.5Very high97.6Very high105 Ų10597.7 Ų97.764%0.64447%0.473SS*.EExtended strand (participates in β ladder)trans-140.2150.9179.264.80000111.3L40L40-T57 VanDerWaalsContact O-CA 3.31Å; L40-T57 WeakPolarHBondContact O-CA 3.48Å
58L98.5Very high97.7Very high38 Ų3898.4 Ų98.420%0.19947%0.474CS..EExtended strand (participates in β ladder)trans-146138.9172.9-178.466.9000109.6V25 L40 V43 L45 L55 I60V25-L58 HydrophobicContact CG1-CD2 3.73Å; V25-L58 HydrophobicContact CG2-CD2 4.12Å; L40-L58 PolarHBondContact N-O 3.42Å; L40-L58 PolarHBondContact O-N 3.34Å; V43-L58 HydrophobicContact CB-CB 4.39Å; V43-L58 HydrophobicContact CG1-CB 4.12Å; V43-L58 HydrophobicContact CG1-CD2 3.95Å; V43-L58 HydrophobicContact CG2-CB 3.95Å; L45-L58 HydrophobicContact CD1-CD2 3.87Å; L55-L58 HydrophobicContact CD1-CD1 4.15Å; L58-I60 HydrophobicContact CD2-CD1 3.97Å; L58-I60 HydrophobicContact CD2-CG1 3.88Å; L58-I60 HydrophobicContact CG-CG1 4.02Å
59S98.5Very high97.8Very high82 Ų8293.5 Ų93.557%0.57346%0.464SS*.EExtended strand (participates in β ladder)trans-116124.4171.4-60.30000109.6H39H39-S59 WeakPolarHBondContact ND1-CB 3.35Å; H39-S59 PolarHBondContact ND1-OG 3.25Å
60I98.5Very high98Very high10 Ų1088.9 Ų88.95%0.05144%0.439CS..EExtended strand (participates in β ladder)trans-111.7128.4-177.4-57.9172.9000108.2I17 L19 V25 N37 T38 L40 L58 I65I17-I60 HydrophobicContact CD1-CD1 4.28Å; L19-I60 HydrophobicContact CD1-CG2 4.47Å; L19-I60 HydrophobicContact CD2-CD1 4.27Å; L19-I60 HydrophobicContact CD2-CG2 3.63Å; V25-I60 HydrophobicContact CB-CD1 4.17Å; V25-I60 HydrophobicContact CG1-CD1 4.12Å; V25-I60 HydrophobicContact CG2-CD1 3.95Å; N37-I60 CarbonylContact C-O 3.55Å; N37-I60 WeakPolarHBondContact CA-O 3.37Å; T38-I60 PolarHBondContact N-O 3.08Å; T38-I60 PolarHBondContact O-N 3.18Å; L40-I60 HydrophobicContact CD1-CD1 3.77Å; L58-I60 HydrophobicContact CD2-CD1 3.97Å; L58-I60 HydrophobicContact CD2-CG1 3.88Å; L58-I60 HydrophobicContact CG-CG1 4.02Å; I60-I65 HydrophobicContact CG2-CD1 4.26Å; I60-I65 HydrophobicContact CG2-CG1 3.79Å
61R98.6Very high98Very high163 Ų16381.5 Ų81.562%0.61542%0.415SS*.  trans-69.9131.4172.6-163.9-176.6166.7-174.1-1.5110.4N37 N63 N64N37-R61 VanDerWaalsContact OD1-CA 3.27Å; N37-R61 WeakPolarHBondContact OD1-CA 3.26Å; N37-R61 WeakPolarHBondContact OD1-CG 3.28Å; R61-N63 VanDerWaalsContact C-N 3.29Å; R61-N63 WeakPolarHBondContact CD-OD1 3.32Å; R61-N63 WeakPolarHBondContact CG-OD1 3.38Å; R61-N63 PolarHBondContact NE-OD1 3.29Å; R61-N63 VanDerWaalsContact NE-OD1 3.1Å; R61-N63 PolarHBondContact O-N 3.42Å; R61-N64 WeakPolarHBondContact O-CB 3.39Å; R61-N64 PolarHBondContact O-N 3.47Å
62G98.3Very high97.8Very high2 Ų283 Ų832%0.02142%0.422CS..G310 helixtrans-61.1-32.6-17100000115M36 N37 N64 I65M36-G62 VanDerWaalsContact C-CA 3.43Å; M36-G62 WeakPolarHBondContact O-CA 3.44Å; N37-G62 PolarHBondContact OD1-N 2.84Å; G62-N64 PolarHBondContact O-N 2.92Å; G62-N64 VanDerWaalsContact O-N 3.16Å; G62-I65 WeakPolarHBondContact O-CB 3.38Å; G62-I65 PolarHBondContact O-N 3.21Å; G62-I65 VanDerWaalsContact O-N 3.12Å
63N98Very high97.6Very high72 Ų7283.9 Ų83.939%0.38543%0.431SS..G310 helixtrans-67.7-13.3176.876.7-50.3000113.8K20 R61K20-N63 WeakPolarHBondContact CD-O 3.31Å; K20-N63 WeakPolarHBondContact CE-O 3.39Å; K20-N63 PolarHBondContact NZ-O 2.99Å; R61-N63 VanDerWaalsContact C-N 3.29Å; R61-N63 WeakPolarHBondContact CD-OD1 3.32Å; R61-N63 WeakPolarHBondContact CG-OD1 3.38Å; R61-N63 PolarHBondContact NE-OD1 3.29Å; R61-N63 VanDerWaalsContact NE-OD1 3.1Å; R61-N63 PolarHBondContact O-N 3.42Å
64N98.4Very high97.3Very high76 Ų7680.7 Ų80.741%0.40641%0.412SS..G310 helixtrans-91.1-11.8176.2-66.5-29.6000112.7L19 K20 R61 G62L19-N64 CarbonylContact C-O 3.54Å; L19-N64 WeakPolarHBondContact CA-O 3.47Å; K20-N64 PolarHBondContact N-O 3.32Å; R61-N64 WeakPolarHBondContact O-CB 3.39Å; R61-N64 PolarHBondContact O-N 3.47Å; G62-N64 PolarHBondContact O-N 2.92Å; G62-N64 VanDerWaalsContact O-N 3.16Å
65I98.4Very high97Very high24 Ų2475.1 Ų75.112%0.12339%0.39CS..EExtended strand (participates in β ladder)trans-74.7135.4177.9-60.3176.3000109.1I17 L19 T38 I60 G62 I68I17-I65 HydrophobicContact CG2-CB 4.48Å; I17-I65 HydrophobicContact CG2-CD1 4.46Å; I17-I65 HydrophobicContact CG2-CG1 4.1Å; I17-I65 HydrophobicContact CG2-CG2 3.84Å; L19-I65 HydrophobicContact CD2-CG1 4.2Å; T38-I65 WeakPolarHBondContact OG1-CD1 3.5Å; I60-I65 HydrophobicContact CG2-CD1 4.26Å; I60-I65 HydrophobicContact CG2-CG1 3.79Å; G62-I65 WeakPolarHBondContact O-CB 3.38Å; G62-I65 PolarHBondContact O-N 3.21Å; G62-I65 VanDerWaalsContact O-N 3.12Å; I65-I68 HydrophobicContact CG2-CG1 4.02Å
66R98.4Very high96.6Very high128 Ų12876.1 Ų76.148%0.48340%0.395SS..EExtended strand (participates in β ladder)trans-93.1-54.3170.2-173.9-179-72.1165.6-2.7110E18 K20E18-R66 WeakPolarHBondContact O-CA 3.27Å; E18-R66 VanDerWaalsContact O-CB 3.26Å; E18-R66 WeakPolarHBondContact O-CB 3.32Å; E18-R66 PolarHBondContact O-N 3.11Å; E18-R66 WeakPolarHBondContact OE1-CD 3.44Å; E18-R66 IonicContact OE1-CZ 3.58Å; E18-R66 IonicContact OE1-NE 3.9Å; E18-R66 IonicContact OE1-NH1 2.62Å; E18-R66 PolarHBondContact OE1-NH1 3.42Å; K20-R66 HydrophobicContact CG-CB 4.43Å; K20-R66 PolarHBondContact O-NH2 2.89Å
67Y98.2Very high96.1Very high110 Ų11075.8 Ų75.843%0.43139%0.393SS..EExtended strand (participates in β ladder)trans-155.5163.3173.956-105.1000111.1E18 V69E18-Y67 HydrophobicContact CB-CD1 4.39Å; E18-Y67 HydrophobicContact CB-CD2 4.09Å; E18-Y67 HydrophobicContact CB-CE1 3.93Å; E18-Y67 HydrophobicContact CB-CE2 3.63Å; E18-Y67 HydrophobicContact CB-CG 4.46Å; E18-Y67 HydrophobicContact CG-CE1 4.31Å; E18-Y67 PolarHBondContact N-O 2.91Å; E18-Y67 VanDerWaalsContact N-O 3.1Å; E18-Y67 PolarHBondContact O-N 2.73Å; E18-Y67 VanDerWaalsContact OE2-CZ 3.25Å; E18-Y67 PolarHBondContact OE2-OH 3.02Å; Y67-V69 HydrophobicContact CD2-CG2 3.93Å; Y67-V69 HydrophobicContact CE2-CG2 3.79Å
68I98Very high95.5Very high34 Ų3476.9 Ų76.917%0.17439%0.391CS..EExtended strand (participates in β ladder)trans-118.7124.4173.4-56.1178.7000107.2L7 V15 I17 I32 I65 L70L7-I68 HydrophobicContact CD2-CD1 4.4Å; V15-I68 HydrophobicContact CB-CG2 3.8Å; V15-I68 HydrophobicContact CG1-CG2 3.95Å; V15-I68 HydrophobicContact CG2-CG2 4.05Å; I17-I68 HydrophobicContact CD1-CG1 4.39Å; I17-I68 HydrophobicContact CG1-CG1 4.21Å; I17-I68 HydrophobicContact CG1-CG2 4.32Å; I17-I68 HydrophobicContact CG2-CG1 4.38Å; I32-I68 HydrophobicContact CD1-CD1 4.46Å; I65-I68 HydrophobicContact CG2-CG1 4.02Å; I68-L70 HydrophobicContact CG2-CD2 4Å
69V97.8Very high95Very high73 Ų7377.5 Ų77.544%0.44239%0.391SS..EExtended strand (participates in β ladder)trans-88115.4170.7-173.40000107.7V15 T16 Y67V15-V69 WeakPolarHBondContact CB-O 3.39Å; T16-V69 PolarHBondContact N-O 2.97Å; T16-V69 PolarHBondContact O-N 2.84Å; Y67-V69 HydrophobicContact CD2-CG2 3.93Å; Y67-V69 HydrophobicContact CE2-CG2 3.79Å
70L96.5Very high94.5Very high55 Ų5577.5 Ų77.529%0.28838%0.384SS..  trans-81.6149.2178-57-177.6000110.5F6 L10 V15 I68 V74 L76F6-L70 HydrophobicContact CE1-CD1 3.93Å; F6-L70 HydrophobicContact CZ-CD1 3.8Å; L10-L70 HydrophobicContact CD1-CD2 3.43Å; L10-L70 VanDerWaalsContact CD1-CD2 3.43Å; L10-L70 HydrophobicContact CD2-CD2 4.45Å; V15-L70 HydrophobicContact CG1-CD2 4.3Å; I68-L70 HydrophobicContact CG2-CD2 4Å; L70-V74 HydrophobicContact CB-CG2 4.26Å; L70-L76 HydrophobicContact CD1-CD2 4.29Å
71P95.5Very high93.8Very high36 Ų3682 Ų8223%0.23441%0.408CS..  trans-63.9149.3168.414.9-16.1000110.8T14 S73 V74T14-P71 WeakPolarHBondContact O-CD 3.34Å; T14-P71 VanDerWaalsContact O-CG 3.31Å; T14-P71 WeakPolarHBondContact O-CG 3.36Å; P71-S73 PolarHBondContact O-N 2.8Å; P71-V74 HydrophobicContact CB-CG2 4.27Å; P71-V74 VanDerWaalsContact CD-CG2 3.46Å; P71-V74 HydrophobicContact CG-CG2 3.46Å; P71-V74 VanDerWaalsContact CG-CG2 3.46Å; P71-V74 VanDerWaalsContact O-CG2 3.32Å; P71-V74 WeakPolarHBondContact O-CG2 3.22Å; P71-V74 PolarHBondContact O-N 2.76Å
72E93Very high92.8Very high208 Ų20877.9 Ų77.997%0.97240%0.397SS*.THydrogen-bonded Turntrans-64-22.8177.4-63.4-176.7172.900112.5V74E72-V74 VanDerWaalsContact C-N 3.3Å; E72-V74 PolarHBondContact O-N 3.22Å
73S92.9Very high91.6Very high98 Ų9883.1 Ų83.169%0.68543%0.425SS*.THydrogen-bonded Turntrans-80.6-2-179.559.80000114.7P71 P75P71-S73 PolarHBondContact O-N 2.8Å; S73-P75 WeakPolarHBondContact O-CD 3.41Å
74V93.1Very high90.4Very high12 Ų1283.1 Ų83.17%0.07344%0.435CS..  trans-65.5123.4-178174.10000110.2L10 E13 L70 P71 E72 L76 Y79L10-V74 HydrophobicContact CD2-CG1 3.89Å; E13-V74 HydrophobicContact CG-CG2 4.43Å; L70-V74 HydrophobicContact CB-CG2 4.26Å; P71-V74 HydrophobicContact CB-CG2 4.27Å; P71-V74 VanDerWaalsContact CD-CG2 3.46Å; P71-V74 HydrophobicContact CG-CG2 3.46Å; P71-V74 VanDerWaalsContact CG-CG2 3.46Å; P71-V74 VanDerWaalsContact O-CG2 3.32Å; P71-V74 WeakPolarHBondContact O-CG2 3.22Å; P71-V74 PolarHBondContact O-N 2.76Å; E72-V74 VanDerWaalsContact C-N 3.3Å; E72-V74 PolarHBondContact O-N 3.22Å; V74-L76 VanDerWaalsContact C-N 3.31Å; V74-L76 HydrophobicContact CG1-CD2 3.9Å; V74-L76 PolarHBondContact O-N 3.25Å; V74-Y79 HydrophobicContact CG1-CD2 3.6Å; V74-Y79 HydrophobicContact CG1-CE2 3.71Å
75P90.5Very high89.2Confident41 Ų4185.1 Ų85.127%0.26645%0.452SS..  trans-75.780.6177.631.8-35.6000111.1S73 D77 Q78 Y79S73-P75 WeakPolarHBondContact O-CD 3.41Å; P75-D77 VanDerWaalsContact C-N 3.28Å; P75-D77 PolarHBondContact O-N 3.21Å; P75-Q78 HydrophobicContact CB-CB 4.25Å; P75-Q78 HydrophobicContact CB-CG 4.06Å; P75-Q78 PolarHBondContact O-N 3.08Å; P75-Q78 VanDerWaalsContact O-N 3.08Å; P75-Y79 HydrophobicContact CG-CD2 4.41Å; P75-Y79 HydrophobicContact CG-CE1 4.39Å; P75-Y79 HydrophobicContact CG-CE2 3.94Å; P75-Y79 PolarHBondContact O-N 3.43Å
76L90.7Very high87.9Confident85 Ų8593.4 Ų93.445%0.44549%0.487SS..Hα-helixtrans-54.4-42.5-176.6-63.7178.1000112.4F6 L70 V74 Q78 Y79 L80F6-L76 HydrophobicContact CE2-CD2 3.91Å; F6-L76 HydrophobicContact CZ-CD2 3.71Å; L70-L76 HydrophobicContact CD1-CD2 4.29Å; V74-L76 VanDerWaalsContact C-N 3.31Å; V74-L76 HydrophobicContact CG1-CD2 3.9Å; V74-L76 PolarHBondContact O-N 3.25Å; L76-Q78 PolarHBondContact O-N 2.85Å; L76-Y79 PolarHBondContact O-N 3.27Å; L76-L80 HydrophobicContact CB-CD1 4.21Å; L76-L80 VanDerWaalsContact O-CB 3.25Å; L76-L80 WeakPolarHBondContact O-CB 3.42Å; L76-L80 WeakPolarHBondContact O-CD1 3.12Å; L76-L80 WeakPolarHBondContact O-CG 3.5Å; L76-L80 PolarHBondContact O-N 2.85Å
77D87.6Confident86.6Confident139 Ų13995.9 Ų95.974%0.74351%0.506SS*.Hα-helixtrans-58.4-36.7-179.8-65.4-30.1000112.7P75 I81P75-D77 VanDerWaalsContact C-N 3.28Å; P75-D77 PolarHBondContact O-N 3.21Å; D77-I81 WeakPolarHBondContact O-CD1 3.49Å; D77-I81 WeakPolarHBondContact O-CG1 3.25Å
78Q86.8Confident85.2Confident129 Ų129100.2 Ų100.260%0.60353%0.528SS*.Hα-helixtrans-74.9-43179.9-60.9-17915.400111P75 L76P75-Q78 HydrophobicContact CB-CB 4.25Å; P75-Q78 HydrophobicContact CB-CG 4.06Å; P75-Q78 PolarHBondContact O-N 3.08Å; P75-Q78 VanDerWaalsContact O-N 3.08Å; L76-Q78 PolarHBondContact O-N 2.85Å
79Y87.1Confident83.7Confident50 Ų50109.9 Ų109.920%0.19656%0.562CS.*Hα-helixtrans-77-22.2-177.1-63.4-25.6000113.4F6 K9 L10 E13 V74 P75 L76 I81F6-Y79 HydrophobicContact CE2-CD2 4.43Å; K9-Y79 HydrophobicContact CB-CD1 3.97Å; K9-Y79 HydrophobicContact CB-CG 4.18Å; K9-Y79 HydrophobicContact CD-CD1 4.4Å; K9-Y79 WeakPolarHBondContact CD-O 3.39Å; L10-Y79 HydrophobicContact CD2-CD2 3.76Å; L10-Y79 HydrophobicContact CD2-CE2 3.94Å; E13-Y79 PolarHBondContact OE1-OH 3.21Å; V74-Y79 HydrophobicContact CG1-CD2 3.6Å; V74-Y79 HydrophobicContact CG1-CE2 3.71Å; P75-Y79 HydrophobicContact CG-CD2 4.41Å; P75-Y79 HydrophobicContact CG-CE1 4.39Å; P75-Y79 HydrophobicContact CG-CE2 3.94Å; P75-Y79 PolarHBondContact O-N 3.43Å; L76-Y79 PolarHBondContact O-N 3.27Å; Y79-I81 VanDerWaalsContact C-N 3.31Å
80L87.7Confident82.2Confident82 Ų82115.6 Ų115.643%0.42958%0.581SS.*THydrogen-bonded Turntrans-80.1-7.9177.3-70.5172.3000113.9M1 F6 L76 D82M1-L80 VanDerWaalsContact CE-O 3.24Å; M1-L80 WeakPolarHBondContact CE-O 3.24Å; F6-L80 HydrophobicContact CD2-CD2 3.83Å; F6-L80 HydrophobicContact CD2-CG 4.23Å; F6-L80 HydrophobicContact CE2-CD2 4.28Å; F6-L80 HydrophobicContact CE2-CG 4.4Å; F6-L80 HydrophobicContact CG-CD2 4.36Å; L76-L80 HydrophobicContact CB-CD1 4.21Å; L76-L80 VanDerWaalsContact O-CB 3.25Å; L76-L80 WeakPolarHBondContact O-CB 3.42Å; L76-L80 WeakPolarHBondContact O-CD1 3.12Å; L76-L80 WeakPolarHBondContact O-CG 3.5Å; L76-L80 PolarHBondContact O-N 2.85Å; L80-D82 PolarHBondContact O-N 3.5Å
81I85Confident80.3Confident106 Ų106118.3 Ų118.354%0.54460%0.602SS.*SBendtrans-74.3124.3175.3-64.7163.1000109.6K9 D77 Y79 D83K9-I81 PolarHBondContact NZ-O 2.86Å; D77-I81 WeakPolarHBondContact O-CD1 3.49Å; D77-I81 WeakPolarHBondContact O-CG1 3.25Å; Y79-I81 VanDerWaalsContact C-N 3.31Å; I81-D83 PolarHBondContact O-N 2.87Å
82D77.3Confident78.6Confident75 Ų75125.9 Ų125.940%0.40163%0.634SS.*  trans-75120.2171.8-80.2-32.6000109.7M1 L80 A84M1-D82 PolarHBondContact N-OD2 3.43Å; M1-D82 VanDerWaalsContact SD-CG 3.58Å; M1-D82 VanDerWaalsContact SD-OD2 3.34Å; L80-D82 PolarHBondContact O-N 3.5Å; D82-A84 PolarHBondContact O-N 3.24Å
83D72.2Confident76.7Confident112 Ų112123 Ų12360%0.59963%0.63SS**  trans-75.740.9176.9-55.5-54.1000112.7K9 I81K9-D83 VanDerWaalsContact CE-OD2 3.22Å; K9-D83 WeakPolarHBondContact CE-OD2 3.38Å; K9-D83 IonicContact NZ-OD1 3.7Å; K9-D83 IonicContact NZ-OD2 2.8Å; K9-D83 PolarHBondContact NZ-OD2 2.69Å; I81-D83 PolarHBondContact O-N 2.87Å
84A73.5Confident74.6Confident72 Ų72121.8 Ų121.860%0.59563%0.633SS**  trans-61.2129.2174.300000108.2D82 K86D82-A84 PolarHBondContact O-N 3.24Å; A84-K86 PolarHBondContact O-N 2.89Å
85P73.7Confident72.6Confident118 Ų118127.5 Ų127.577%0.76667%0.673SS**  trans-56.3114.2172.520.9-29000106.7M87P85-M87 PolarHBondContact O-N 2.75Å
86K71Confident70.2Confident199 Ų199129.5 Ų129.587%0.86570%0.702SS**  trans-51111.3174.7-69-177.2-179.5-179.90105.3A84 K88A84-K86 PolarHBondContact O-N 2.89Å; K86-K88 VanDerWaalsContact C-N 3.32Å; K86-K88 PolarHBondContact O-N 2.84Å
87M71.7Confident67.9Low179 Ų179129.1 Ų129.188%0.88272%0.719SS**  trans-53.2107176.5-79.1-18080.200105.2P85 R89P85-M87 PolarHBondContact O-N 2.75Å; M87-R89 VanDerWaalsContact C-N 3.29Å; M87-R89 PolarHBondContact O-N 3.02Å
88K67.6Low66Low202 Ų202130.6 Ų130.688%0.87873%0.725SS**  trans-57107.8169.3-72.6-170.9178.5-177.30103.1K86 K90K86-K88 VanDerWaalsContact C-N 3.32Å; K86-K88 PolarHBondContact O-N 2.84Å; K88-K90 PolarHBondContact O-N 2.86Å
89R66.7Low64.1Low236 Ų236136.4 Ų136.489%0.89174%0.741SS**  trans-48.7112.7172.6-78.4-178.5155.5-172.1-6104.5M87 P91M87-R89 VanDerWaalsContact C-N 3.29Å; M87-R89 PolarHBondContact O-N 3.02Å; R89-P91 WeakPolarHBondContact O-CD 3.43Å; R89-P91 VanDerWaalsContact O-N 3.09Å
90K66.1Low62.1Low193 Ų193137.5 Ų137.584%0.83977%0.767SS**  trans-51124.1170.2-81.2-176.7176.3-178.90104.6K88 Q92K88-K90 PolarHBondContact O-N 2.86Å; K90-Q92 PolarHBondContact O-N 2.81Å
91P57.4Low60.1Low112 Ų112146.1 Ų146.173%0.72779%0.794SS**  trans-50.3123.2174.3-23.131.8000106.4R89 V93R89-P91 WeakPolarHBondContact O-CD 3.43Å; R89-P91 VanDerWaalsContact O-N 3.09Å; P91-V93 VanDerWaalsContact C-N 3.34Å; P91-V93 PolarHBondContact O-N 2.96Å
92Q58.6Low58.2Low195 Ų195144.2 Ų144.291%0.91180%0.801SS**  trans-53.4108.3171.3-89.2177.4-30.600106.1K90 G94K90-Q92 PolarHBondContact O-N 2.81Å; Q92-G94 PolarHBondContact O-N 2.83Å
93V54.8Low56.8Low148 Ų148153.2 Ų153.290%0.89783%0.829SS**  trans-66.7102.4173.1175.90000105.6P91P91-V93 VanDerWaalsContact C-N 3.34Å; P91-V93 PolarHBondContact O-N 2.96Å
94G48.1Very low55.6Low72 Ų72151.1 Ų151.174%0.74283%0.834SS**  trans75.284.6153.500000117.1Q92Q92-G94 PolarHBondContact O-N 2.83Å
95S50.8Low54.3Low132 Ų132160.1 Ų160.192%0.92385%0.852SS**SBendtrans-141.882.3139.3-177.70000109.2
96G40Very low53Low83 Ų83157.6 Ų157.686%0.85685%0.848SS**SBendtrans131.693.3171.400000112.8
97G42.7Very low51.9Low78 Ų78160.4 Ų160.480%0.80485%0.853SS**  trans16878175.700000114.6R99G97-R99 PolarHBondContact O-N 3.32Å
98I48.5Very low50.7Low169 Ų169155.3 Ų155.387%0.86785%0.847SS**  trans-55.2117.7170.4-63.1153.7000110.5
99R45.8Very low49.8Very low252 Ų252156.7 Ų156.795%0.95185%0.847SS**  trans171.6122.9143.1-101.6163.1174.8167-1.4113.2G97G97-R99 PolarHBondContact O-N 3.32Å
100G44.8Very low48.6Very low72 Ų72149.2 Ų149.274%0.74284%0.843SS**  trans141.270.5163.300000112.1
101R45.5Very low47.8Very low264 Ų264147.3 Ų147.3100%0.99684%0.839SS**  33.887.293.6-94.9-172.4176.8-172.50.4113.4
102G46.2Very low47.4Very low66 Ų66152.9 Ų152.968%0.6885%0.845SS**  trans-16579.1161.500000109.5
103R47.3Very low46.7Very low263 Ų263147 Ų14799%0.99284%0.837SS**  37.892.7104.6-77.9-173.6173.3-179.5-0.9113.5
104G47.5Very low46.6Very low68 Ų68151.8 Ų151.870%0.70184%0.839SS**  trans-17474.416400000110
105R46.4Very low46.3Very low261 Ų261152.4 Ų152.499%0.98585%0.845SS**  44.194.5105.9-75.6-174.5172.4177.6-0.6113.3
106G46.6Very low46.1Very low66 Ų66149.6 Ų149.668%0.6884%0.837SS**  trans-175.571.116300000109.8G108G106-G108 PolarHBondContact O-N 2.89Å
107R46.3Very low46.4Very low257 Ų257152 Ų15297%0.9784%0.837SS**  43.347.1109-72.3-173.8172.4177.9-2.2114.4R109R107-R109 PolarHBondContact O-N 3.46Å
108G47.4Very low46.4Very low73 Ų73159.8 Ų159.875%0.75384%0.842SS**  trans-88.975.7163.600000110.4G106 G110G106-G108 PolarHBondContact O-N 2.89Å; G108-G110 PolarHBondContact O-N 3.36Å
109R49.3Very low46.2Very low231 Ų231164 Ų16487%0.87285%0.848SS**  trans18.5101.9154.3-65.2173.1175.9165.9-2.4115.8R107 M111R107-R109 PolarHBondContact O-N 3.46Å; R109-M111 PolarHBondContact O-N 3.27Å
110G40.4Very low46.2Very low79 Ų79155.5 Ų155.581%0.81484%0.838SS**  trans-58.7120.314400000108.4G108G108-G110 PolarHBondContact O-N 3.36Å
111M48.9Very low46.6Very low153 Ų153167.6 Ų167.675%0.75486%0.861SS**  trans-157.6123.9150.8-98.8-152.4177.600110.1R109R109-M111 PolarHBondContact O-N 3.27Å
112R49.6Very low46.7Very low229 Ų229162.8 Ų162.886%0.86485%0.854SS**  trans70.3106.3152.6-66.8171.7166.3170.6-5.1114.6
113G43.7Very low46.7Very low71 Ų71167.8 Ų167.873%0.73286%0.863SS**  cis92.5137.936.600000110
114R52Low46.7Very low249 Ų249162.6 Ų162.694%0.9486%0.856SS**  trans92100-175.2-58.5175.2175.2-174.5-3.2112.6
115G41.6Very low46.6Very low85 Ų85168.1 Ų168.188%0.87687%0.865SS**  cis73.268.319.400000112
116G46.9Very low46.6Very low72 Ų72162.3 Ų162.374%0.74286%0.858SS**  trans103.1167.3151.200000118
117P47.9Very low46.6Very low133 Ų133168.7 Ų168.786%0.86487%0.87SS**  cis-127.3166.8-14.237.6-20.9000114.5
118R42.2Very low46.7Very low243 Ų243162.4 Ų162.492%0.91786%0.862SS**  trans-98.8114178.4-172.5-178.5-172.8174.42.6108.6
119R43.4Very low46.6Very low258 Ų258169.3 Ų169.397%0.97487%0.871SS**  trans166.7140.8161.9-107.6179.9167.7-178.7-3.9106.8
120G45.4Very low46.4Very low72 Ų72164.2 Ų164.274%0.74287%0.871SS**  cis-174.4155.4-200000107.1
121R54.9Low46.9Very low326 Ų326171.9 Ų171.9100%1.2388%0.876SS**  trans-146.50154-93.3-165.7-179.4-173.50.2106.6

Retrieved 121 of 121 residues in 107.3 ms (Link to these results)

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