| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.2 | Very low | 73.7 | Confident | 241 Ų | 241 | 134.3 Ų | 134.3 | 100% | 1.187 | 68% | 0.682 | S | S | * | * | 0 | 119.9 | 0 | -78.9 | -178.5 | 176.5 | 0 | 0 | 108.1 | L3 | M1-L3 PolarHBondContact O-N 3.15Š| |||
| 2 | S | 51.3 | Low | 74.8 | Confident | 110 Ų | 110 | 126.1 Ų | 126.1 | 77% | 0.769 | 64% | 0.641 | S | S | * | * | trans | -64.8 | 122.5 | 175.9 | 178 | 0 | 0 | 0 | 0 | 109.4 | R4 | S2-R4 VanDerWaalsContact C-N 3.3Å; S2-R4 PolarHBondContact O-N 2.92Å | ||
| 3 | L | 62.9 | Low | 75.7 | Confident | 170 Ų | 170 | 128.1 Ų | 128.1 | 89% | 0.89 | 64% | 0.643 | S | S | * | * | trans | -62.1 | 92.7 | 167.9 | -83.9 | 153.2 | 0 | 0 | 0 | 107.5 | M1 K5 | M1-L3 PolarHBondContact O-N 3.15Å; L3-K5 PolarHBondContact O-N 3.37Å | ||
| 4 | R | 67.1 | Low | 76.7 | Confident | 231 Ų | 231 | 125.1 Ų | 125.1 | 87% | 0.872 | 63% | 0.626 | S | S | * | * | trans | -60.7 | 108.4 | 173 | -75 | -172.6 | 176.9 | -173.8 | -0.1 | 107.5 | S2 Q6 | S2-R4 VanDerWaalsContact C-N 3.3Å; S2-R4 PolarHBondContact O-N 2.92Å; R4-Q6 PolarHBondContact O-N 2.82Å | ||
| 5 | K | 72.4 | Confident | 77.6 | Confident | 199 Ų | 199 | 117 Ų | 117 | 87% | 0.865 | 59% | 0.585 | S | S | * | * | trans | -56.9 | 109.7 | 168.4 | -83.4 | -177 | 174.6 | 179.6 | 0 | 107.4 | L3 T7 | L3-K5 PolarHBondContact O-N 3.37Å; K5-T7 PolarHBondContact O-N 2.83Å | ||
| 6 | Q | 79.4 | Confident | 78.7 | Confident | 143 Ų | 143 | 114.8 Ų | 114.8 | 67% | 0.668 | 58% | 0.575 | S | S | * | * | trans | -69.2 | 123.5 | 170.7 | -72.9 | -178 | -34.7 | 0 | 0 | 108 | R4 | R4-Q6 PolarHBondContact O-N 2.82Š| ||
| 7 | T | 86.3 | Confident | 79.6 | Confident | 62 Ų | 62 | 111.1 Ų | 111.1 | 38% | 0.38 | 57% | 0.573 | S | S | . | * | trans | -83.4 | 158.2 | 172.7 | 67.9 | 0 | 0 | 0 | 0 | 109.8 | K5 S9 D10 F11 | K5-T7 PolarHBondContact O-N 2.83Å; T7-S9 PolarHBondContact O-N 2.74Å; T7-D10 WeakPolarHBondContact CB-OD2 3.32Å; T7-D10 PolarHBondContact N-OD2 2.91Å; T7-D10 WeakPolarHBondContact O-CB 3.2Å; T7-D10 PolarHBondContact O-N 2.86Å; T7-D10 PolarHBondContact OG1-N 3.28Å; T7-D10 VanDerWaalsContact OG1-N 3.16Å; T7-D10 PolarHBondContact OG1-OD2 3.39Å; T7-F11 PolarHBondContact O-N 2.93Å; T7-F11 VanDerWaalsContact O-N 3.1Å | ||
| 8 | P | 84.9 | Confident | 80.5 | Confident | 104 Ų | 104 | 112.4 Ų | 112.4 | 68% | 0.675 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -53.2 | -39.8 | 170.6 | -27.2 | 35.8 | 0 | 0 | 0 | 112 | D10 F11 L12 | P8-D10 VanDerWaalsContact C-N 3.31Å; P8-D10 PolarHBondContact O-N 2.89Å; P8-F11 WeakPolarHBondContact O-CB 3.48Å; P8-F11 PolarHBondContact O-N 3.13Å; P8-F11 VanDerWaalsContact O-N 3.17Å; P8-L12 VanDerWaalsContact O-CG 3.25Å; P8-L12 WeakPolarHBondContact O-CG 3.46Å; P8-L12 PolarHBondContact O-N 2.9Å |
| 9 | S | 86.2 | Confident | 81.4 | Confident | 72 Ų | 72 | 109.7 Ų | 109.7 | 50% | 0.503 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.5 | -36.7 | 176.5 | -54.1 | 0 | 0 | 0 | 0 | 113.2 | T7 K13 | T7-S9 PolarHBondContact O-N 2.74Å; S9-K13 WeakPolarHBondContact O-CG 3.34Å; S9-K13 PolarHBondContact O-N 3.28Å; S9-K13 VanDerWaalsContact O-N 3.16Å |
| 10 | D | 87.9 | Confident | 82.1 | Confident | 61 Ų | 61 | 104.3 Ų | 104.3 | 33% | 0.326 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -68.3 | -40.3 | 175.2 | -60.9 | -44.4 | 0 | 0 | 0 | 111.5 | T7 P8 K13 Q14 | T7-D10 WeakPolarHBondContact CB-OD2 3.32Å; T7-D10 PolarHBondContact N-OD2 2.91Å; T7-D10 WeakPolarHBondContact O-CB 3.2Å; T7-D10 PolarHBondContact O-N 2.86Å; T7-D10 PolarHBondContact OG1-N 3.28Å; T7-D10 VanDerWaalsContact OG1-N 3.16Å; T7-D10 PolarHBondContact OG1-OD2 3.39Å; P8-D10 VanDerWaalsContact C-N 3.31Å; P8-D10 PolarHBondContact O-N 2.89Å; D10-K13 PolarHBondContact O-N 3.28Å; D10-Q14 VanDerWaalsContact O-CG 3.3Å; D10-Q14 WeakPolarHBondContact O-CG 3.34Å; D10-Q14 PolarHBondContact O-N 2.88Å |
| 11 | F | 85.7 | Confident | 82.9 | Confident | 84 Ų | 84 | 100.1 Ų | 100.1 | 37% | 0.368 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.9 | -47.7 | 174.6 | 170.4 | -100.7 | 0 | 0 | 0 | 111.2 | T7 P8 K13 Q14 I15 | T7-F11 PolarHBondContact O-N 2.93Å; T7-F11 VanDerWaalsContact O-N 3.1Å; P8-F11 WeakPolarHBondContact O-CB 3.48Å; P8-F11 PolarHBondContact O-N 3.13Å; P8-F11 VanDerWaalsContact O-N 3.17Å; F11-K13 VanDerWaalsContact C-N 3.31Å; F11-K13 PolarHBondContact O-N 2.92Å; F11-Q14 WeakPolarHBondContact O-CB 3.4Å; F11-Q14 PolarHBondContact O-N 2.98Å; F11-I15 HydrophobicContact CD1-CD1 4.42Å; F11-I15 HydrophobicContact CD2-CG2 4.34Å; F11-I15 HydrophobicContact CE1-CD1 3.81Å; F11-I15 HydrophobicContact CE1-CG2 4.34Å; F11-I15 HydrophobicContact CE2-CG2 3.83Å; F11-I15 HydrophobicContact CZ-CD1 4.21Å; F11-I15 HydrophobicContact CZ-CG2 3.83Å; F11-I15 PolarHBondContact O-N 2.82Å |
| 12 | L | 86.6 | Confident | 85.2 | Confident | 36 Ų | 36 | 88.6 Ų | 88.6 | 19% | 0.188 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -58.8 | -41.9 | -179.8 | -70.1 | 172.7 | 0 | 0 | 0 | 112 | P8 Q14 I15 L37 | P8-L12 VanDerWaalsContact O-CG 3.25Å; P8-L12 WeakPolarHBondContact O-CG 3.46Å; P8-L12 PolarHBondContact O-N 2.9Å; L12-Q14 VanDerWaalsContact C-N 3.28Å; L12-Q14 PolarHBondContact O-N 2.85Å; L12-I15 HydrophobicContact CD2-CD1 4.23Å; L12-I15 WeakPolarHBondContact O-CG1 3.45Å; L12-I15 PolarHBondContact O-N 2.95Å; L12-L37 HydrophobicContact CB-CD1 3.86Å; L12-L37 HydrophobicContact CB-CD2 4.1Å; L12-L37 HydrophobicContact CD1-CD1 3.63Å; L12-L37 HydrophobicContact CD2-CD1 3.67Å; L12-L37 HydrophobicContact CD2-CD2 3.76Å; L12-L37 HydrophobicContact CD2-CG 4.38Å; L12-L37 HydrophobicContact CG-CD1 3.87Å; L12-L37 HydrophobicContact CG-CD2 4.43Å |
| 13 | K | 86.8 | Confident | 87.4 | Confident | 152 Ų | 152 | 85.7 Ų | 85.7 | 66% | 0.661 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -63.1 | -32.6 | 174.8 | -72.5 | 174 | -177.8 | 177 | 0 | 113.2 | S9 D10 F11 I15 | S9-K13 WeakPolarHBondContact O-CG 3.34Å; S9-K13 PolarHBondContact O-N 3.28Å; S9-K13 VanDerWaalsContact O-N 3.16Å; D10-K13 PolarHBondContact O-N 3.28Å; F11-K13 VanDerWaalsContact C-N 3.31Å; F11-K13 PolarHBondContact O-N 2.92Å; K13-I15 VanDerWaalsContact C-N 3.34Å |
| 14 | Q | 88.6 | Confident | 89.1 | Confident | 87 Ų | 87 | 78.6 Ų | 78.6 | 41% | 0.407 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -75.4 | -22.3 | -178.3 | -72.2 | 171.3 | 23.9 | 0 | 0 | 113.6 | D10 F11 L12 R18 | D10-Q14 VanDerWaalsContact O-CG 3.3Å; D10-Q14 WeakPolarHBondContact O-CG 3.34Å; D10-Q14 PolarHBondContact O-N 2.88Å; F11-Q14 WeakPolarHBondContact O-CB 3.4Å; F11-Q14 PolarHBondContact O-N 2.98Å; L12-Q14 VanDerWaalsContact C-N 3.28Å; L12-Q14 PolarHBondContact O-N 2.85Å; Q14-R18 WeakPolarHBondContact O-CD 3.39Å; Q14-R18 VanDerWaalsContact O-CZ 3.27Å; Q14-R18 PolarHBondContact O-NE 3.2Å |
| 15 | I | 91.1 | Very high | 90.6 | Very high | 3 Ų | 3 | 72.2 Ų | 72.2 | 2% | 0.015 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -97.1 | -9.8 | -175.2 | 61.4 | 163.6 | 0 | 0 | 0 | 113.9 | F11 L12 K13 G17 R18 L34 L37 I73 T75 | F11-I15 HydrophobicContact CD1-CD1 4.42Å; F11-I15 HydrophobicContact CD2-CG2 4.34Å; F11-I15 HydrophobicContact CE1-CD1 3.81Å; F11-I15 HydrophobicContact CE1-CG2 4.34Å; F11-I15 HydrophobicContact CE2-CG2 3.83Å; F11-I15 HydrophobicContact CZ-CD1 4.21Å; F11-I15 HydrophobicContact CZ-CG2 3.83Å; F11-I15 PolarHBondContact O-N 2.82Å; L12-I15 HydrophobicContact CD2-CD1 4.23Å; L12-I15 WeakPolarHBondContact O-CG1 3.45Å; L12-I15 PolarHBondContact O-N 2.95Å; K13-I15 VanDerWaalsContact C-N 3.34Å; I15-G17 PolarHBondContact O-N 2.81Å; I15-R18 WeakPolarHBondContact O-CB 3.32Å; I15-R18 PolarHBondContact O-N 2.62Å; I15-R18 VanDerWaalsContact O-N 3.1Å; I15-L34 HydrophobicContact CB-CD2 4.14Å; I15-L34 HydrophobicContact CD1-CD2 3.59Å; I15-L34 HydrophobicContact CG1-CD2 3.53Å; I15-L34 WeakPolarHBondContact O-CD2 3.15Å; I15-L37 HydrophobicContact CD1-CD2 4.38Å; I15-I73 HydrophobicContact CD1-CG2 3.91Å; I15-T75 HydrophobicContact CB-CG2 4.21Å; I15-T75 HydrophobicContact CG2-CG2 3.45Å; I15-T75 VanDerWaalsContact CG2-CG2 3.45Å |
| 16 | I | 94.2 | Very high | 91.7 | Very high | 82 Ų | 82 | 67.1 Ų | 67.1 | 42% | 0.421 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | 136.8 | 171.9 | -65.4 | 170.6 | 0 | 0 | 0 | 109.6 | R18 L34 L37 | I16-R18 PolarHBondContact O-N 2.87Å; I16-L34 HydrophobicContact CG1-CD2 4.48Å; I16-L37 HydrophobicContact CG1-CD2 4.48Å |
| 17 | G | 95.2 | Very high | 92.5 | Very high | 52 Ų | 52 | 61.9 Ų | 61.9 | 54% | 0.536 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.8 | 2.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | I15 L34 | I15-G17 PolarHBondContact O-N 2.81Å; G17-L34 WeakPolarHBondContact CA-O 3.42Å; G17-L34 PolarHBondContact N-O 2.83Å |
| 18 | R | 95.6 | Very high | 93.1 | Very high | 134 Ų | 134 | 60.1 Ų | 60.1 | 51% | 0.506 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -98.8 | 151.5 | 178.6 | -58.2 | -168.7 | -178.5 | -172.7 | 1.1 | 111.5 | Q14 I15 I16 V20 L34 | Q14-R18 WeakPolarHBondContact O-CD 3.39Å; Q14-R18 VanDerWaalsContact O-CZ 3.27Å; Q14-R18 PolarHBondContact O-NE 3.2Å; I15-R18 WeakPolarHBondContact O-CB 3.32Å; I15-R18 PolarHBondContact O-N 2.62Å; I15-R18 VanDerWaalsContact O-N 3.1Å; I16-R18 PolarHBondContact O-N 2.87Å; R18-V20 PolarHBondContact O-N 3.25Å; R18-L34 PolarHBondContact O-N 3.18Å |
| 19 | P | 96.7 | Very high | 93.7 | Very high | 62 Ų | 62 | 56.1 Ų | 56.1 | 40% | 0.403 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.8 | 128.9 | 165.4 | -24.2 | 35.9 | 0 | 0 | 0 | 110.7 | G32 Q76 | P19-G32 CarbonylContact C-O 3.57Å; P19-G32 WeakPolarHBondContact CA-O 3.17Å; P19-Q76 HydrophobicContact CB-CB 4.02Å; P19-Q76 PolarHBondContact O-N 2.79Å |
| 20 | V | 96.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 157.9 | -179.6 | -64.4 | 0 | 0 | 0 | 0 | 111.6 | R18 V22 R31 G32 L34 I45 I73 S74 | R18-V20 PolarHBondContact O-N 3.25Å; V20-V22 HydrophobicContact CG2-CG2 4.1Å; V20-R31 WeakPolarHBondContact O-CA 3.21Å; V20-G32 PolarHBondContact N-O 3.2Å; V20-G32 PolarHBondContact O-N 3.49Å; V20-L34 HydrophobicContact CG1-CB 4.03Å; V20-L34 HydrophobicContact CG1-CD2 4.35Å; V20-L34 HydrophobicContact CG2-CB 3.89Å; V20-L34 HydrophobicContact CG2-CD1 4.49Å; V20-I45 HydrophobicContact CG2-CD1 4.05Å; V20-I73 HydrophobicContact CB-CG2 4.22Å; V20-I73 HydrophobicContact CG1-CG2 4.26Å; V20-S74 CarbonylContact C-O 3.46Å; V20-S74 WeakPolarHBondContact CA-O 3.38Å; V20-S74 WeakPolarHBondContact CB-O 3.31Å |
| 21 | V | 97.1 | Very high | 94.7 | Very high | 17 Ų | 17 | 54.3 Ų | 54.3 | 10% | 0.103 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 122.3 | 162.8 | -175.2 | 0 | 0 | 0 | 0 | 107.6 | D29 Y30 R31 S74 Q76 | V21-D29 HydrophobicContact CG1-CB 4.14Å; V21-Y30 CarbonylContact C-O 3.59Å; V21-Y30 WeakPolarHBondContact CA-O 3.36Å; V21-R31 HydrophobicContact CG1-CG 4.22Å; V21-R31 HydrophobicContact CG2-CG 4.03Å; V21-S74 PolarHBondContact N-O 3.27Å; V21-S74 PolarHBondContact O-N 2.69Å; V21-Q76 HydrophobicContact CG2-CB 4.32Å; V21-Q76 HydrophobicContact CG2-CG 4.5Å |
| 22 | V | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 113.8 | 173.9 | -174.5 | 0 | 0 | 0 | 0 | 107.8 | V20 L24 Y30 I43 I45 L65 V70 Y72 I73 | V20-V22 HydrophobicContact CG2-CG2 4.1Å; V22-L24 HydrophobicContact CG1-CD2 4.41Å; V22-Y30 PolarHBondContact N-O 3.49Å; V22-Y30 PolarHBondContact O-N 2.81Å; V22-I43 HydrophobicContact CG1-CD1 3.77Å; V22-I43 HydrophobicContact CG2-CD1 4.01Å; V22-I45 HydrophobicContact CG2-CD1 4.46Å; V22-L65 HydrophobicContact CB-CD1 3.84Å; V22-L65 HydrophobicContact CG1-CD1 3.69Å; V22-L65 HydrophobicContact CG2-CD1 4.2Å; V22-V70 HydrophobicContact CG1-CG1 4Å; V22-V70 HydrophobicContact CG1-CG2 4.07Å; V22-Y72 WeakPolarHBondContact CA-O 3.46Å; V22-I73 HydrophobicContact CG1-CG1 4.5Å; V22-I73 HydrophobicContact CG2-CG1 4.45Å; V22-I73 HydrophobicContact CG2-CG2 4.35Å |
| 23 | K | 97.7 | Very high | 95.8 | Very high | 48 Ų | 48 | 50.7 Ų | 50.7 | 21% | 0.209 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 131 | 175.7 | -170.6 | 168.9 | -163.8 | 88.1 | 0 | 109.4 | G27 D29 L71 Y72 | K23-G27 PolarHBondContact NZ-O 3.01Å; K23-D29 WeakPolarHBondContact CD-OD1 3.34Å; K23-D29 VanDerWaalsContact CG-OD1 3.23Å; K23-D29 WeakPolarHBondContact CG-OD1 3.48Å; K23-D29 IonicContact NZ-OD1 2.71Å; K23-D29 PolarHBondContact NZ-OD1 3.1Å; K23-D29 IonicContact NZ-OD2 3.71Å; K23-L71 HydrophobicContact CD-CD2 4.2Å; K23-L71 HydrophobicContact CG-CD2 4.34Å; K23-L71 WeakPolarHBondContact O-CB 3.45Å; K23-L71 PolarHBondContact O-N 3.16Å; K23-Y72 HydrophobicContact CB-CD1 3.86Å; K23-Y72 HydrophobicContact CB-CD2 4.36Å; K23-Y72 HydrophobicContact CB-CE1 3.51Å; K23-Y72 HydrophobicContact CB-CE2 4.02Å; K23-Y72 HydrophobicContact CB-CG 4.27Å; K23-Y72 HydrophobicContact CD-CD1 4.23Å; K23-Y72 HydrophobicContact CD-CE1 3.37Å; K23-Y72 HydrophobicContact CG-CE1 4.02Å; K23-Y72 PolarHBondContact N-O 3.03Å; K23-Y72 PolarHBondContact O-N 3.38Å |
| 24 | L | 97.9 | Very high | 96.3 | Very high | 21 Ų | 21 | 43.4 Ų | 43.4 | 11% | 0.11 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 160.5 | 173.3 | -57.3 | -168.2 | 0 | 0 | 0 | 111.4 | V22 S26 G27 V28 Y30 N69 V70 | V22-L24 HydrophobicContact CG1-CD2 4.41Å; L24-S26 PolarHBondContact O-N 3.03Å; L24-S26 VanDerWaalsContact O-N 3.12Å; L24-G27 PolarHBondContact O-N 3.34Å; L24-V28 PolarHBondContact N-O 3.38Å; L24-Y30 HydrophobicContact CD1-CD2 4.08Å; L24-Y30 HydrophobicContact CD1-CE2 3.49Å; L24-Y30 VanDerWaalsContact CD1-CE2 3.49Å; L24-Y30 HydrophobicContact CG-CD2 3.97Å; L24-Y30 HydrophobicContact CG-CE2 3.88Å; L24-N69 CarbonylContact C-O 3.6Å; L24-N69 WeakPolarHBondContact CA-O 3.25Å; L24-V70 HydrophobicContact CD2-CG2 4.26Å |
| 25 | N | 97.8 | Very high | 96.7 | Very high | 97 Ų | 97 | 40.9 Ų | 40.9 | 52% | 0.519 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -24.6 | 174.1 | -68.9 | -28.6 | 0 | 0 | 0 | 113 | G27 N68 N69 | N25-G27 PolarHBondContact O-N 2.77Å; N25-N68 PolarHBondContact ND2-O 3.17Å; N25-N69 PolarHBondContact N-O 3.37Å |
| 26 | S | 96.7 | Very high | 96.8 | Very high | 92 Ų | 92 | 44 Ų | 44 | 64% | 0.643 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -10.4 | 173.7 | 59.1 | 0 | 0 | 0 | 0 | 114.1 | L24 V28 | L24-S26 PolarHBondContact O-N 3.03Å; L24-S26 VanDerWaalsContact O-N 3.12Å; S26-V28 WeakPolarHBondContact OG-CG2 3.49Å |
| 27 | G | 96.5 | Very high | 96.8 | Very high | 34 Ų | 34 | 41.8 Ų | 41.8 | 35% | 0.351 | 25% | 0.249 | S | C | . | . | S | Bend | trans | 92.6 | -7.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115 | K23 L24 N25 | K23-G27 PolarHBondContact NZ-O 3.01Å; L24-G27 PolarHBondContact O-N 3.34Å; N25-G27 PolarHBondContact O-N 2.77Å |
| 28 | V | 98 | Very high | 96.5 | Very high | 25 Ų | 25 | 42.1 Ų | 42.1 | 15% | 0.152 | 24% | 0.239 | C | C | . | . | trans | -70.9 | 135.6 | 177 | -177.4 | 0 | 0 | 0 | 0 | 110.3 | L24 S26 Y30 E50 V52 | L24-V28 PolarHBondContact N-O 3.38Å; S26-V28 WeakPolarHBondContact OG-CG2 3.49Å; V28-Y30 HydrophobicContact CB-CE2 4.21Å; V28-Y30 HydrophobicContact CG1-CD2 4.12Å; V28-Y30 HydrophobicContact CG1-CE2 3.55Å; V28-E50 HydrophobicContact CG1-CG 3.65Å; V28-V52 HydrophobicContact CG1-CG2 4.28Å; V28-V52 HydrophobicContact CG2-CG2 4.27Å | ||
| 29 | D | 97.8 | Very high | 96.2 | Very high | 19 Ų | 19 | 39.5 Ų | 39.5 | 10% | 0.102 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 129.5 | 175.4 | -54.5 | -34.6 | 0 | 0 | 0 | 110.2 | V21 K23 Y51 | V21-D29 HydrophobicContact CG1-CB 4.14Å; K23-D29 WeakPolarHBondContact CD-OD1 3.34Å; K23-D29 VanDerWaalsContact CG-OD1 3.23Å; K23-D29 WeakPolarHBondContact CG-OD1 3.48Å; K23-D29 IonicContact NZ-OD1 2.71Å; K23-D29 PolarHBondContact NZ-OD1 3.1Å; K23-D29 IonicContact NZ-OD2 3.71Å; D29-Y51 PolarHBondContact N-O 3.12Å; D29-Y51 PolarHBondContact O-N 3.19Å |
| 30 | Y | 98 | Very high | 96 | Very high | 33 Ų | 33 | 45.5 Ų | 45.5 | 13% | 0.129 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | 129.7 | 169.4 | -70.6 | -93 | 0 | 0 | 0 | 109.1 | V21 V22 L24 V28 T48 E49 E50 Y60 L65 | V21-Y30 CarbonylContact C-O 3.59Å; V21-Y30 WeakPolarHBondContact CA-O 3.36Å; V22-Y30 PolarHBondContact N-O 3.49Å; V22-Y30 PolarHBondContact O-N 2.81Å; L24-Y30 HydrophobicContact CD1-CD2 4.08Å; L24-Y30 HydrophobicContact CD1-CE2 3.49Å; L24-Y30 VanDerWaalsContact CD1-CE2 3.49Å; L24-Y30 HydrophobicContact CG-CD2 3.97Å; L24-Y30 HydrophobicContact CG-CE2 3.88Å; V28-Y30 HydrophobicContact CB-CE2 4.21Å; V28-Y30 HydrophobicContact CG1-CD2 4.12Å; V28-Y30 HydrophobicContact CG1-CE2 3.55Å; Y30-T48 HydrophobicContact CD1-CG2 3.6Å; Y30-T48 HydrophobicContact CE1-CG2 4.48Å; Y30-T48 HydrophobicContact CG-CG2 4.42Å; Y30-E49 CarbonylContact C-O 3.6Å; Y30-E49 WeakPolarHBondContact CA-O 3.47Å; Y30-E50 HydrophobicContact CD1-CB 4.48Å; Y30-E50 HydrophobicContact CE1-CB 4.22Å; Y30-E50 HydrophobicContact CE1-CG 4.27Å; Y30-E50 PolarHBondContact OH-OE1 2.85Å; Y30-Y60 HydrophobicContact CD1-CD2 4.47Å; Y30-Y60 AromaticContact CE1-CD2 3.91Å; Y30-Y60 HydrophobicContact CE1-CD2 3.91Å; Y30-Y60 AromaticContact CE1-CE2 3.73Å; Y30-Y60 HydrophobicContact CE1-CE2 3.73Å; Y30-L65 HydrophobicContact CD1-CD2 4.12Å; Y30-L65 HydrophobicContact CD2-CD1 4.38Å; Y30-L65 HydrophobicContact CD2-CD2 4.06Å; Y30-L65 HydrophobicContact CE1-CD2 4.21Å; Y30-L65 HydrophobicContact CE2-CD2 4.2Å; Y30-L65 HydrophobicContact CG-CD1 4.15Å; Y30-L65 HydrophobicContact CG-CD2 4.02Å |
| 31 | R | 97.6 | Very high | 95.9 | Very high | 62 Ų | 62 | 49.5 Ų | 49.5 | 23% | 0.234 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 139.6 | 179.9 | -52.2 | -169.8 | -174.5 | 160.9 | 1.3 | 109.9 | V20 V21 T48 E49 Y51 | V20-R31 WeakPolarHBondContact O-CA 3.21Å; V21-R31 HydrophobicContact CG1-CG 4.22Å; V21-R31 HydrophobicContact CG2-CG 4.03Å; R31-T48 CarbonylContact O-C 3.56Å; R31-T48 VanDerWaalsContact O-CA 3.31Å; R31-T48 WeakPolarHBondContact O-CA 3.44Å; R31-E49 PolarHBondContact N-O 3.3Å; R31-E49 PolarHBondContact O-N 3.35Å; R31-Y51 HydrophobicContact CB-CD2 4.5Å; R31-Y51 HydrophobicContact CB-CE2 4.12Å; R31-Y51 VanDerWaalsContact CD-CE2 3.48Å; R31-Y51 HydrophobicContact CG-CD2 3.82Å; R31-Y51 HydrophobicContact CG-CE2 3.78Å |
| 32 | G | 97.2 | Very high | 95.8 | Very high | 10 Ų | 10 | 51.5 Ų | 51.5 | 10% | 0.103 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 167.3 | -170.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | P19 V20 E46 | P19-G32 CarbonylContact C-O 3.57Å; P19-G32 WeakPolarHBondContact CA-O 3.17Å; V20-G32 PolarHBondContact N-O 3.2Å; V20-G32 PolarHBondContact O-N 3.49Å; G32-E46 CarbonylContact C-O 3.53Å; G32-E46 WeakPolarHBondContact CA-O 3.47Å |
| 33 | V | 97.3 | Very high | 95.8 | Very high | 34 Ų | 34 | 51.6 Ų | 51.6 | 21% | 0.206 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.3 | 126.2 | 179 | -178.5 | 0 | 0 | 0 | 0 | 109.5 | A35 I45 E46 | V33-A35 PolarHBondContact O-N 2.8Å; V33-A35 VanDerWaalsContact O-N 3.13Å; V33-I45 WeakPolarHBondContact O-CA 3.49Å; V33-E46 HydrophobicContact CB-CB 4.4Å; V33-E46 PolarHBondContact N-O 2.93Å; V33-E46 PolarHBondContact O-N 3Å |
| 34 | L | 97 | Very high | 95.8 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72 | 105.5 | 179.4 | -175.4 | 64.1 | 0 | 0 | 0 | 110.6 | I15 I16 G17 R18 V20 L37 I43 | I15-L34 HydrophobicContact CB-CD2 4.14Å; I15-L34 HydrophobicContact CD1-CD2 3.59Å; I15-L34 HydrophobicContact CG1-CD2 3.53Å; I15-L34 WeakPolarHBondContact O-CD2 3.15Å; I16-L34 HydrophobicContact CG1-CD2 4.48Å; G17-L34 WeakPolarHBondContact CA-O 3.42Å; G17-L34 PolarHBondContact N-O 2.83Å; R18-L34 PolarHBondContact O-N 3.18Å; V20-L34 HydrophobicContact CG1-CB 4.03Å; V20-L34 HydrophobicContact CG1-CD2 4.35Å; V20-L34 HydrophobicContact CG2-CB 3.89Å; V20-L34 HydrophobicContact CG2-CD1 4.49Å; L34-L37 HydrophobicContact CD1-CD2 4.36Å; L34-L37 HydrophobicContact CD2-CD2 3.57Å; L34-L37 HydrophobicContact CG-CD2 4.32Å; L34-I43 HydrophobicContact CD1-CG2 3.45Å; L34-I43 VanDerWaalsContact CD1-CG2 3.45Å |
| 35 | A | 96.8 | Very high | 95.8 | Very high | 34 Ų | 34 | 49 Ų | 49 | 28% | 0.281 | 29% | 0.289 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | -51.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | V33 A44 E46 | V33-A35 PolarHBondContact O-N 2.8Å; V33-A35 VanDerWaalsContact O-N 3.13Å; A35-A44 HydrophobicContact CB-CB 4.18Å; A35-A44 PolarHBondContact N-O 2.8Å; A35-E46 HydrophobicContact CB-CG 3.99Å |
| 36 | C | 93.8 | Very high | 95.8 | Very high | 67 Ų | 67 | 48.1 Ų | 48.1 | 45% | 0.453 | 28% | 0.282 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -156.1 | 164.5 | 175.7 | 68.5 | 0 | 0 | 0 | 0 | 111.9 | A44 | C36-A44 PolarHBondContact N-O 2.91Å; C36-A44 PolarHBondContact O-N 3.09Å; C36-A44 WeakPolarHBondContact SG-CB 3.37Å |
| 37 | L | 93.7 | Very high | 95.8 | Very high | 36 Ų | 36 | 50.7 Ų | 50.7 | 19% | 0.188 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.7 | 161.5 | 173.4 | 71 | 95.7 | 0 | 0 | 0 | 111.1 | L12 I15 I16 L34 N42 I43 | L12-L37 HydrophobicContact CB-CD1 3.86Å; L12-L37 HydrophobicContact CB-CD2 4.1Å; L12-L37 HydrophobicContact CD1-CD1 3.63Å; L12-L37 HydrophobicContact CD2-CD1 3.67Å; L12-L37 HydrophobicContact CD2-CD2 3.76Å; L12-L37 HydrophobicContact CD2-CG 4.38Å; L12-L37 HydrophobicContact CG-CD1 3.87Å; L12-L37 HydrophobicContact CG-CD2 4.43Å; I15-L37 HydrophobicContact CD1-CD2 4.38Å; I16-L37 HydrophobicContact CG1-CD2 4.48Å; L34-L37 HydrophobicContact CD1-CD2 4.36Å; L34-L37 HydrophobicContact CD2-CD2 3.57Å; L34-L37 HydrophobicContact CG-CD2 4.32Å; L37-N42 WeakPolarHBondContact CA-O 2.98Å; L37-I43 HydrophobicContact CB-CG1 4.23Å |
| 38 | D | 90.1 | Very high | 95.9 | Very high | 60 Ų | 60 | 49 Ų | 49 | 32% | 0.321 | 27% | 0.267 | S | S | . | . | trans | -118.3 | -179.5 | 174.7 | 72 | 14.6 | 0 | 0 | 0 | 114.1 | Y40 M41 N42 | D38-Y40 PolarHBondContact O-N 3.48Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.2Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.49Å; D38-Y40 PolarHBondContact OD1-N 2.82Å; D38-M41 PolarHBondContact O-N 3Å; D38-M41 VanDerWaalsContact O-N 3.08Å; D38-M41 PolarHBondContact OD1-N 3.17Å; D38-N42 PolarHBondContact N-O 2.98Å; D38-N42 PolarHBondContact OD1-N 3.05Å; D38-N42 PolarHBondContact OD1-ND2 2.92Å; D38-N42 WeakPolarHBondContact OD2-CB 3.44Å; D38-N42 PolarHBondContact OD2-ND2 2.8Å | ||
| 39 | G | 88.3 | Confident | 95.9 | Very high | 78 Ų | 78 | 50.1 Ų | 50.1 | 80% | 0.804 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -10.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 40 | Y | 93.1 | Very high | 95.9 | Very high | 188 Ų | 188 | 49.9 Ų | 49.9 | 74% | 0.737 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | 4.8 | 174.1 | -62.2 | -74.5 | 0 | 0 | 0 | 112.3 | D38 N42 G67 | D38-Y40 PolarHBondContact O-N 3.48Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.2Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.49Å; D38-Y40 PolarHBondContact OD1-N 2.82Å; Y40-N42 VanDerWaalsContact C-N 3.27Å; Y40-N42 PolarHBondContact O-N 3.27Å; Y40-G67 WeakPolarHBondContact O-CA 3.42Å |
| 41 | M | 94.1 | Very high | 95.9 | Very high | 84 Ų | 84 | 49.9 Ų | 49.9 | 41% | 0.414 | 27% | 0.269 | S | S | . | . | trans | 64.5 | 24.1 | -175.9 | -50.9 | -176.9 | -70.1 | 0 | 0 | 114.1 | D38 I43 G67 | D38-M41 PolarHBondContact O-N 3Å; D38-M41 VanDerWaalsContact O-N 3.08Å; D38-M41 PolarHBondContact OD1-N 3.17Å; M41-I43 WeakPolarHBondContact O-CG1 3Å; M41-G67 WeakPolarHBondContact O-CA 3.39Å | ||
| 42 | N | 95.7 | Very high | 95.8 | Very high | 60 Ų | 60 | 49.1 Ų | 49.1 | 32% | 0.321 | 27% | 0.271 | S | S | . | . | trans | -66.8 | 136.1 | 163 | -58.8 | -55.7 | 0 | 0 | 0 | 108 | L37 D38 Y40 L65 G67 | L37-N42 WeakPolarHBondContact CA-O 2.98Å; D38-N42 PolarHBondContact N-O 2.98Å; D38-N42 PolarHBondContact OD1-N 3.05Å; D38-N42 PolarHBondContact OD1-ND2 2.92Å; D38-N42 WeakPolarHBondContact OD2-CB 3.44Å; D38-N42 PolarHBondContact OD2-ND2 2.8Å; Y40-N42 VanDerWaalsContact C-N 3.27Å; Y40-N42 PolarHBondContact O-N 3.27Å; N42-L65 WeakPolarHBondContact CA-O 3.4Å; N42-G67 PolarHBondContact OD1-N 3.28Å | ||
| 43 | I | 96.6 | Very high | 95.6 | Very high | 2 Ų | 2 | 56.1 Ų | 56.1 | 1% | 0.01 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.9 | 132.8 | -169.2 | -66.2 | 155.5 | 0 | 0 | 0 | 109.4 | V22 L34 L37 M41 I45 F64 L65 V70 I73 | V22-I43 HydrophobicContact CG1-CD1 3.77Å; V22-I43 HydrophobicContact CG2-CD1 4.01Å; L34-I43 HydrophobicContact CD1-CG2 3.45Å; L34-I43 VanDerWaalsContact CD1-CG2 3.45Å; L37-I43 HydrophobicContact CB-CG1 4.23Å; M41-I43 WeakPolarHBondContact O-CG1 3Å; I43-I45 HydrophobicContact CG2-CB 4.24Å; I43-F64 CarbonylContact O-C 3.48Å; I43-F64 VanDerWaalsContact O-CA 3.32Å; I43-F64 WeakPolarHBondContact O-CA 3.4Å; I43-L65 HydrophobicContact CB-CB 4.27Å; I43-L65 PolarHBondContact N-O 2.88Å; I43-L65 PolarHBondContact O-N 3.36Å; I43-V70 HydrophobicContact CD1-CG1 4.45Å; I43-V70 HydrophobicContact CD1-CG2 3.89Å; I43-I73 HydrophobicContact CD1-CD1 3.6Å; I43-I73 HydrophobicContact CD1-CG1 3.98Å; I43-I73 HydrophobicContact CG1-CD1 4.27Å |
| 44 | A | 97.4 | Very high | 95.3 | Very high | 12 Ų | 12 | 56.9 Ų | 56.9 | 10% | 0.099 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 127.2 | 159.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | A35 C36 A63 F64 | A35-A44 HydrophobicContact CB-CB 4.18Å; A35-A44 PolarHBondContact N-O 2.8Å; C36-A44 PolarHBondContact N-O 2.91Å; C36-A44 PolarHBondContact O-N 3.09Å; C36-A44 WeakPolarHBondContact SG-CB 3.37Å; A44-A63 WeakPolarHBondContact CA-O 3.48Å; A44-F64 HydrophobicContact CB-CD1 3.95Å; A44-F64 HydrophobicContact CB-CE1 3.7Å; A44-F64 HydrophobicContact CB-CZ 4.45Å |
| 45 | I | 97.7 | Very high | 95.3 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.005 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 131.8 | -179.8 | -173.9 | 166.8 | 0 | 0 | 0 | 109.4 | V20 V22 V33 I43 T48 D62 A63 L65 | V20-I45 HydrophobicContact CG2-CD1 4.05Å; V22-I45 HydrophobicContact CG2-CD1 4.46Å; V33-I45 WeakPolarHBondContact O-CA 3.49Å; I43-I45 HydrophobicContact CG2-CB 4.24Å; I45-T48 HydrophobicContact CG2-CG2 3.96Å; I45-T48 WeakPolarHBondContact CG2-OG1 3.34Å; I45-T48 PolarHBondContact O-OG1 3.23Å; I45-D62 CarbonylContact O-C 3.59Å; I45-D62 WeakPolarHBondContact O-CA 3.38Å; I45-A63 HydrophobicContact CG2-CB 4.07Å; I45-A63 WeakPolarHBondContact CG2-O 3.35Å; I45-A63 PolarHBondContact N-O 3.19Å; I45-A63 PolarHBondContact O-N 3.37Å; I45-L65 HydrophobicContact CG2-CD1 4.19Å; I45-L65 HydrophobicContact CG2-CG 4.27Å |
| 46 | E | 97.9 | Very high | 95.3 | Very high | 80 Ų | 80 | 66.3 Ų | 66.3 | 37% | 0.374 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 155.3 | 178.2 | -67.7 | 173.2 | -176.2 | 0 | 0 | 110.2 | G32 V33 A35 T48 D62 | G32-E46 CarbonylContact C-O 3.53Å; G32-E46 WeakPolarHBondContact CA-O 3.47Å; V33-E46 HydrophobicContact CB-CB 4.4Å; V33-E46 PolarHBondContact N-O 2.93Å; V33-E46 PolarHBondContact O-N 3Å; A35-E46 HydrophobicContact CB-CG 3.99Å; E46-T48 PolarHBondContact O-N 3.16Å; E46-D62 WeakPolarHBondContact CG-OD1 3.19Å |
| 47 | Q | 97.1 | Very high | 95.5 | Very high | 145 Ų | 145 | 69.4 Ų | 69.4 | 68% | 0.678 | 37% | 0.367 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 53.8 | 41.5 | 178.4 | -55.8 | 173.8 | 36.3 | 0 | 0 | 112.5 | G61 | Q47-G61 PolarHBondContact N-O 3.34Å; Q47-G61 VanDerWaalsContact N-O 3.15Å |
| 48 | T | 98.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.5 | 127.6 | -167 | -56.2 | 0 | 0 | 0 | 0 | 112.3 | Y30 R31 I45 E46 K59 Y60 G61 A63 | Y30-T48 HydrophobicContact CD1-CG2 3.6Å; Y30-T48 HydrophobicContact CE1-CG2 4.48Å; Y30-T48 HydrophobicContact CG-CG2 4.42Å; R31-T48 CarbonylContact O-C 3.56Å; R31-T48 VanDerWaalsContact O-CA 3.31Å; R31-T48 WeakPolarHBondContact O-CA 3.44Å; I45-T48 HydrophobicContact CG2-CG2 3.96Å; I45-T48 WeakPolarHBondContact CG2-OG1 3.34Å; I45-T48 PolarHBondContact O-OG1 3.23Å; E46-T48 PolarHBondContact O-N 3.16Å; T48-K59 CarbonylContact O-C 3.54Å; T48-K59 WeakPolarHBondContact O-CA 3.21Å; T48-Y60 PolarHBondContact O-N 2.82Å; T48-G61 WeakPolarHBondContact CB-O 3.46Å; T48-G61 PolarHBondContact N-O 2.71Å; T48-G61 PolarHBondContact OG1-O 3Å; T48-A63 HydrophobicContact CG2-CB 4.13Å |
| 49 | E | 98.2 | Very high | 96 | Very high | 47 Ų | 47 | 74.6 Ų | 74.6 | 22% | 0.22 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 134.6 | 171.7 | -65.2 | -171.3 | 151.6 | 0 | 0 | 110.4 | Y30 R31 Y51 L56 K59 | Y30-E49 CarbonylContact C-O 3.6Å; Y30-E49 WeakPolarHBondContact CA-O 3.47Å; R31-E49 PolarHBondContact N-O 3.3Å; R31-E49 PolarHBondContact O-N 3.35Å; E49-Y51 HydrophobicContact CB-CD2 4.29Å; E49-Y51 HydrophobicContact CB-CE2 3.54Å; E49-Y51 PolarHBondContact OE2-OH 3.08Å; E49-L56 HydrophobicContact CB-CD1 3.73Å; E49-L56 HydrophobicContact CG-CD1 4.09Å; E49-K59 HydrophobicContact CG-CD 4.31Å; E49-K59 HydrophobicContact CG-CG 4.21Å; E49-K59 VanDerWaalsContact OE1-CE 3.32Å; E49-K59 WeakPolarHBondContact OE1-CE 3.48Å; E49-K59 IonicContact OE1-NZ 2.74Å; E49-K59 PolarHBondContact OE1-NZ 3.09Å |
| 50 | E | 98 | Very high | 96.3 | Very high | 14 Ų | 14 | 76.2 Ų | 76.2 | 7% | 0.065 | 37% | 0.371 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 130.1 | 177 | -178.9 | -172.4 | -106.8 | 0 | 0 | 110.4 | V28 Y30 V52 K57 N58 Y60 | V28-E50 HydrophobicContact CG1-CG 3.65Å; Y30-E50 HydrophobicContact CD1-CB 4.48Å; Y30-E50 HydrophobicContact CE1-CB 4.22Å; Y30-E50 HydrophobicContact CE1-CG 4.27Å; Y30-E50 PolarHBondContact OH-OE1 2.85Å; E50-V52 HydrophobicContact CG-CG2 4.36Å; E50-K57 PolarHBondContact O-N 2.91Å; E50-K57 WeakPolarHBondContact OE2-CD 3.02Å; E50-N58 HydrophobicContact CB-CB 4.18Å; E50-N58 PolarHBondContact N-O 2.87Å; E50-N58 PolarHBondContact OE2-ND2 3.01Å; E50-Y60 HydrophobicContact CB-CD2 4.22Å; E50-Y60 HydrophobicContact CB-CE2 3.59Å; E50-Y60 VanDerWaalsContact CD-OH 3.28Å; E50-Y60 HydrophobicContact CG-CE2 4.14Å; E50-Y60 PolarHBondContact OE1-OH 3.16Å; E50-Y60 PolarHBondContact OE2-OH 3.33Å |
| 51 | Y | 98.1 | Very high | 96.4 | Very high | 33 Ų | 33 | 68.8 Ų | 68.8 | 13% | 0.129 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 126.4 | 174.8 | -64.3 | -105.8 | 0 | 0 | 0 | 110.5 | D29 R31 E49 Q55 L56 | D29-Y51 PolarHBondContact N-O 3.12Å; D29-Y51 PolarHBondContact O-N 3.19Å; R31-Y51 HydrophobicContact CB-CD2 4.5Å; R31-Y51 HydrophobicContact CB-CE2 4.12Å; R31-Y51 VanDerWaalsContact CD-CE2 3.48Å; R31-Y51 HydrophobicContact CG-CD2 3.82Å; R31-Y51 HydrophobicContact CG-CE2 3.78Å; E49-Y51 HydrophobicContact CB-CD2 4.29Å; E49-Y51 HydrophobicContact CB-CE2 3.54Å; E49-Y51 PolarHBondContact OE2-OH 3.08Å; Y51-Q55 CarbonylContact C-O 3.54Å; Y51-Q55 WeakPolarHBondContact CA-O 3.34Å; Y51-L56 HydrophobicContact CD1-CB 4.27Å; Y51-L56 HydrophobicContact CE1-CB 3.9Å; Y51-L56 HydrophobicContact CE1-CD1 4.41Å; Y51-L56 HydrophobicContact CE2-CD1 4.05Å |
| 52 | V | 96.6 | Very high | 96.5 | Very high | 46 Ų | 46 | 70.7 Ų | 70.7 | 28% | 0.279 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 125.4 | 173 | -176.2 | 0 | 0 | 0 | 0 | 107.3 | V28 E50 G54 Q55 K57 | V28-V52 HydrophobicContact CG1-CG2 4.28Å; V28-V52 HydrophobicContact CG2-CG2 4.27Å; E50-V52 HydrophobicContact CG-CG2 4.36Å; V52-G54 PolarHBondContact O-N 3.22Å; V52-Q55 PolarHBondContact N-O 3.44Å; V52-Q55 PolarHBondContact O-N 3.46Å; V52-Q55 VanDerWaalsContact O-N 3.09Å; V52-K57 HydrophobicContact CB-CD 4.22Å; V52-K57 HydrophobicContact CG2-CB 4.28Å; V52-K57 HydrophobicContact CG2-CD 3.59Å |
| 53 | N | 93.1 | Very high | 96.6 | Very high | 158 Ų | 158 | 68.6 Ų | 68.6 | 85% | 0.845 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.8 | 34.8 | -174.2 | -56.2 | -33.6 | 0 | 0 | 0 | 113.2 | Q55 | N53-Q55 PolarHBondContact O-N 2.89Š|
| 54 | G | 91.1 | Very high | 96.6 | Very high | 49 Ų | 49 | 77 Ų | 77 | 51% | 0.505 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.2 | -3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | V52 | V52-G54 PolarHBondContact O-N 3.22Š|
| 55 | Q | 95.9 | Very high | 96.6 | Very high | 151 Ų | 151 | 77.1 Ų | 77.1 | 71% | 0.706 | 39% | 0.39 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 137.7 | 176.3 | -64.1 | -170.7 | 2.4 | 0 | 0 | 111.1 | Y51 V52 N53 K57 | Y51-Q55 CarbonylContact C-O 3.54Å; Y51-Q55 WeakPolarHBondContact CA-O 3.34Å; V52-Q55 PolarHBondContact N-O 3.44Å; V52-Q55 PolarHBondContact O-N 3.46Å; V52-Q55 VanDerWaalsContact O-N 3.09Å; N53-Q55 PolarHBondContact O-N 2.89Å; Q55-K57 PolarHBondContact O-N 3.02Å |
| 56 | L | 96.9 | Very high | 96.6 | Very high | 82 Ų | 82 | 85.1 Ų | 85.1 | 43% | 0.429 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.6 | 122 | 173.5 | 177.7 | 67.9 | 0 | 0 | 0 | 108.9 | E49 Y51 | E49-L56 HydrophobicContact CB-CD1 3.73Å; E49-L56 HydrophobicContact CG-CD1 4.09Å; Y51-L56 HydrophobicContact CD1-CB 4.27Å; Y51-L56 HydrophobicContact CE1-CB 3.9Å; Y51-L56 HydrophobicContact CE1-CD1 4.41Å; Y51-L56 HydrophobicContact CE2-CD1 4.05Å |
| 57 | K | 97.3 | Very high | 96.6 | Very high | 131 Ų | 131 | 81.4 Ų | 81.4 | 57% | 0.57 | 40% | 0.404 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.3 | -46.9 | -180 | -169.5 | 175.4 | 175.7 | -173.5 | 0 | 111.6 | E50 V52 Q55 | E50-K57 PolarHBondContact O-N 2.91Å; E50-K57 WeakPolarHBondContact OE2-CD 3.02Å; V52-K57 HydrophobicContact CB-CD 4.22Å; V52-K57 HydrophobicContact CG2-CB 4.28Å; V52-K57 HydrophobicContact CG2-CD 3.59Å; Q55-K57 PolarHBondContact O-N 3.02Å |
| 58 | N | 96.9 | Very high | 96.6 | Very high | 64 Ų | 64 | 78.8 Ų | 78.8 | 34% | 0.342 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.9 | 162 | -174.9 | -71.4 | -54.9 | 0 | 0 | 0 | 112.4 | E50 Y60 | E50-N58 HydrophobicContact CB-CB 4.18Å; E50-N58 PolarHBondContact N-O 2.87Å; E50-N58 PolarHBondContact OE2-ND2 3.01Å; N58-Y60 HydrophobicContact CB-CE1 4.02Å; N58-Y60 HydrophobicContact CB-CE2 3.98Å; N58-Y60 PolarHBondContact ND2-OH 2.81Å |
| 59 | K | 97.7 | Very high | 96.5 | Very high | 142 Ų | 142 | 82.2 Ų | 82.2 | 62% | 0.617 | 41% | 0.412 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 127.8 | 166.1 | -53.9 | -161.8 | -175.1 | -148.2 | 0 | 109 | T48 E49 | T48-K59 CarbonylContact O-C 3.54Å; T48-K59 WeakPolarHBondContact O-CA 3.21Å; E49-K59 HydrophobicContact CG-CD 4.31Å; E49-K59 HydrophobicContact CG-CG 4.21Å; E49-K59 VanDerWaalsContact OE1-CE 3.32Å; E49-K59 WeakPolarHBondContact OE1-CE 3.48Å; E49-K59 IonicContact OE1-NZ 2.74Å; E49-K59 PolarHBondContact OE1-NZ 3.09Å |
| 60 | Y | 94.9 | Very high | 96.5 | Very high | 111 Ų | 111 | 80.5 Ų | 80.5 | 44% | 0.435 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | -10.6 | -173.4 | -63.7 | -63 | 0 | 0 | 0 | 113.7 | Y30 T48 E50 N58 D62 | Y30-Y60 HydrophobicContact CD1-CD2 4.47Å; Y30-Y60 AromaticContact CE1-CD2 3.91Å; Y30-Y60 HydrophobicContact CE1-CD2 3.91Å; Y30-Y60 AromaticContact CE1-CE2 3.73Å; Y30-Y60 HydrophobicContact CE1-CE2 3.73Å; T48-Y60 PolarHBondContact O-N 2.82Å; E50-Y60 HydrophobicContact CB-CD2 4.22Å; E50-Y60 HydrophobicContact CB-CE2 3.59Å; E50-Y60 VanDerWaalsContact CD-OH 3.28Å; E50-Y60 HydrophobicContact CG-CE2 4.14Å; E50-Y60 PolarHBondContact OE1-OH 3.16Å; E50-Y60 PolarHBondContact OE2-OH 3.33Å; N58-Y60 HydrophobicContact CB-CE1 4.02Å; N58-Y60 HydrophobicContact CB-CE2 3.98Å; N58-Y60 PolarHBondContact ND2-OH 2.81Å; Y60-D62 PolarHBondContact O-N 3.12Å |
| 61 | G | 95.6 | Very high | 96.5 | Very high | 33 Ų | 33 | 84.6 Ų | 84.6 | 34% | 0.34 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 69.1 | -121.1 | -172 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q47 T48 | Q47-G61 PolarHBondContact N-O 3.34Å; Q47-G61 VanDerWaalsContact N-O 3.15Å; T48-G61 WeakPolarHBondContact CB-O 3.46Å; T48-G61 PolarHBondContact N-O 2.71Å; T48-G61 PolarHBondContact OG1-O 3Å |
| 62 | D | 95.8 | Very high | 96.3 | Very high | 123 Ų | 123 | 87.9 Ų | 87.9 | 66% | 0.658 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -84.7 | 123.7 | 177.3 | -58.1 | -17.6 | 0 | 0 | 0 | 110 | I45 E46 Y60 | I45-D62 CarbonylContact O-C 3.59Å; I45-D62 WeakPolarHBondContact O-CA 3.38Å; E46-D62 WeakPolarHBondContact CG-OD1 3.19Å; Y60-D62 PolarHBondContact O-N 3.12Å |
| 63 | A | 97.2 | Very high | 96.3 | Very high | 17 Ų | 17 | 87 Ų | 87 | 14% | 0.14 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 145.7 | -176 | 0 | 0 | 0 | 0 | 0 | 112 | A44 I45 T48 | A44-A63 WeakPolarHBondContact CA-O 3.48Å; I45-A63 HydrophobicContact CG2-CB 4.07Å; I45-A63 WeakPolarHBondContact CG2-O 3.35Å; I45-A63 PolarHBondContact N-O 3.19Å; I45-A63 PolarHBondContact O-N 3.37Å; T48-A63 HydrophobicContact CG2-CB 4.13Å |
| 64 | F | 97.3 | Very high | 96.3 | Very high | 177 Ų | 177 | 81.6 Ų | 81.6 | 78% | 0.776 | 41% | 0.408 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 123.5 | 172.9 | -67.2 | -85.8 | 0 | 0 | 0 | 110.1 | I43 A44 | I43-F64 CarbonylContact O-C 3.48Å; I43-F64 VanDerWaalsContact O-CA 3.32Å; I43-F64 WeakPolarHBondContact O-CA 3.4Å; A44-F64 HydrophobicContact CB-CD1 3.95Å; A44-F64 HydrophobicContact CB-CE1 3.7Å; A44-F64 HydrophobicContact CB-CZ 4.45Å |
| 65 | L | 97.4 | Very high | 96.4 | Very high | 15 Ų | 15 | 81.8 Ų | 81.8 | 8% | 0.079 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 132.6 | 176.2 | -54 | 176.3 | 0 | 0 | 0 | 109.7 | V22 Y30 N42 I43 I45 | V22-L65 HydrophobicContact CB-CD1 3.84Å; V22-L65 HydrophobicContact CG1-CD1 3.69Å; V22-L65 HydrophobicContact CG2-CD1 4.2Å; Y30-L65 HydrophobicContact CD1-CD2 4.12Å; Y30-L65 HydrophobicContact CD2-CD1 4.38Å; Y30-L65 HydrophobicContact CD2-CD2 4.06Å; Y30-L65 HydrophobicContact CE1-CD2 4.21Å; Y30-L65 HydrophobicContact CE2-CD2 4.2Å; Y30-L65 HydrophobicContact CG-CD1 4.15Å; Y30-L65 HydrophobicContact CG-CD2 4.02Å; N42-L65 WeakPolarHBondContact CA-O 3.4Å; I43-L65 HydrophobicContact CB-CB 4.27Å; I43-L65 PolarHBondContact N-O 2.88Å; I43-L65 PolarHBondContact O-N 3.36Å; I45-L65 HydrophobicContact CG2-CD1 4.19Å; I45-L65 HydrophobicContact CG2-CG 4.27Å |
| 66 | R | 97.8 | Very high | 96 | Very high | 170 Ų | 170 | 78.8 Ų | 78.8 | 64% | 0.642 | 39% | 0.385 | S | S | * | . | trans | -79.8 | 125 | 179.3 | -159.7 | -172.7 | 166.4 | 177 | -2.4 | 110.4 | N68 N69 | R66-N68 VanDerWaalsContact C-N 3.33Å; R66-N68 WeakPolarHBondContact CB-OD1 3.23Å; R66-N68 WeakPolarHBondContact CD-OD1 3.47Å; R66-N68 WeakPolarHBondContact CG-OD1 3.3Å; R66-N68 PolarHBondContact NE-OD1 2.91Å; R66-N68 PolarHBondContact O-N 3.46Å; R66-N69 PolarHBondContact O-N 3.26Å | ||
| 67 | G | 96.6 | Very high | 95 | Very high | 2 Ų | 2 | 83.4 Ų | 83.4 | 2% | 0.021 | 40% | 0.402 | C | S | . | . | G | 310 helix | trans | -65.7 | -28.3 | -169.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y40 M41 N42 N69 V70 | Y40-G67 WeakPolarHBondContact O-CA 3.42Å; M41-G67 WeakPolarHBondContact O-CA 3.39Å; N42-G67 PolarHBondContact OD1-N 3.28Å; G67-N69 PolarHBondContact O-N 3.1Å; G67-N69 VanDerWaalsContact O-N 3.16Å; G67-V70 WeakPolarHBondContact O-CB 3.41Å; G67-V70 PolarHBondContact O-N 3.04Å; G67-V70 VanDerWaalsContact O-N 3.09Å |
| 68 | N | 97.4 | Very high | 93.3 | Very high | 89 Ų | 89 | 88.3 Ų | 88.3 | 48% | 0.476 | 42% | 0.417 | S | S | . | . | G | 310 helix | trans | -63.5 | -19.9 | 174.2 | 71.6 | -41.8 | 0 | 0 | 0 | 113.6 | N25 R66 | N25-N68 PolarHBondContact ND2-O 3.17Å; R66-N68 VanDerWaalsContact C-N 3.33Å; R66-N68 WeakPolarHBondContact CB-OD1 3.23Å; R66-N68 WeakPolarHBondContact CD-OD1 3.47Å; R66-N68 WeakPolarHBondContact CG-OD1 3.3Å; R66-N68 PolarHBondContact NE-OD1 2.91Å; R66-N68 PolarHBondContact O-N 3.46Å |
| 69 | N | 97.2 | Very high | 91.4 | Very high | 72 Ų | 72 | 95.3 Ų | 95.3 | 39% | 0.385 | 44% | 0.444 | S | S | . | . | G | 310 helix | trans | -97.7 | -4.2 | 178.7 | -66.6 | -32.5 | 0 | 0 | 0 | 112.6 | L24 N25 R66 G67 | L24-N69 CarbonylContact C-O 3.6Å; L24-N69 WeakPolarHBondContact CA-O 3.25Å; N25-N69 PolarHBondContact N-O 3.37Å; R66-N69 PolarHBondContact O-N 3.26Å; G67-N69 PolarHBondContact O-N 3.1Å; G67-N69 VanDerWaalsContact O-N 3.16Å |
| 70 | V | 97.4 | Very high | 89.1 | Confident | 11 Ų | 11 | 98.4 Ų | 98.4 | 7% | 0.067 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.9 | 125.3 | -178.6 | 176.2 | 0 | 0 | 0 | 0 | 109.4 | V22 L24 I43 G67 I73 | V22-V70 HydrophobicContact CG1-CG1 4Å; V22-V70 HydrophobicContact CG1-CG2 4.07Å; L24-V70 HydrophobicContact CD2-CG2 4.26Å; I43-V70 HydrophobicContact CD1-CG1 4.45Å; I43-V70 HydrophobicContact CD1-CG2 3.89Å; G67-V70 WeakPolarHBondContact O-CB 3.41Å; G67-V70 PolarHBondContact O-N 3.04Å; G67-V70 VanDerWaalsContact O-N 3.09Å; V70-I73 HydrophobicContact CG1-CG1 4.03Å |
| 71 | L | 97.6 | Very high | 88.8 | Confident | 100 Ų | 100 | 97.8 Ų | 97.8 | 52% | 0.524 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | -49.4 | 173.2 | 179.4 | 61.5 | 0 | 0 | 0 | 110.9 | K23 | K23-L71 HydrophobicContact CD-CD2 4.2Å; K23-L71 HydrophobicContact CG-CD2 4.34Å; K23-L71 WeakPolarHBondContact O-CB 3.45Å; K23-L71 PolarHBondContact O-N 3.16Å |
| 72 | Y | 95.5 | Very high | 88.4 | Confident | 103 Ų | 103 | 101.2 Ų | 101.2 | 40% | 0.404 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.5 | 162.7 | 173.7 | 71.1 | -106.6 | 0 | 0 | 0 | 112.3 | V22 K23 | V22-Y72 WeakPolarHBondContact CA-O 3.46Å; K23-Y72 HydrophobicContact CB-CD1 3.86Å; K23-Y72 HydrophobicContact CB-CD2 4.36Å; K23-Y72 HydrophobicContact CB-CE1 3.51Å; K23-Y72 HydrophobicContact CB-CE2 4.02Å; K23-Y72 HydrophobicContact CB-CG 4.27Å; K23-Y72 HydrophobicContact CD-CD1 4.23Å; K23-Y72 HydrophobicContact CD-CE1 3.37Å; K23-Y72 HydrophobicContact CG-CE1 4.02Å; K23-Y72 PolarHBondContact N-O 3.03Å; K23-Y72 PolarHBondContact O-N 3.38Å |
| 73 | I | 95 | Very high | 88 | Confident | 28 Ų | 28 | 99.9 Ų | 99.9 | 14% | 0.144 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 133.9 | 169.2 | -50.7 | 170.9 | 0 | 0 | 0 | 107.9 | I15 V20 V22 I43 V70 | I15-I73 HydrophobicContact CD1-CG2 3.91Å; V20-I73 HydrophobicContact CB-CG2 4.22Å; V20-I73 HydrophobicContact CG1-CG2 4.26Å; V22-I73 HydrophobicContact CG1-CG1 4.5Å; V22-I73 HydrophobicContact CG2-CG1 4.45Å; V22-I73 HydrophobicContact CG2-CG2 4.35Å; I43-I73 HydrophobicContact CD1-CD1 3.6Å; I43-I73 HydrophobicContact CD1-CG1 3.98Å; I43-I73 HydrophobicContact CG1-CD1 4.27Å; V70-I73 HydrophobicContact CG1-CG1 4.03Å |
| 74 | S | 94.1 | Very high | 87.5 | Confident | 43 Ų | 43 | 104.8 Ų | 104.8 | 30% | 0.301 | 49% | 0.493 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.2 | 141.4 | 176 | 67.7 | 0 | 0 | 0 | 0 | 111 | V20 V21 Q76 | V20-S74 CarbonylContact C-O 3.46Å; V20-S74 WeakPolarHBondContact CA-O 3.38Å; V20-S74 WeakPolarHBondContact CB-O 3.31Å; V21-S74 PolarHBondContact N-O 3.27Å; V21-S74 PolarHBondContact O-N 2.69Å; S74-Q76 PolarHBondContact O-N 3.39Å |
| 75 | T | 93 | Very high | 86.9 | Confident | 53 Ų | 53 | 100.3 Ų | 100.3 | 33% | 0.325 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 128.9 | 172.7 | 53.7 | 0 | 0 | 0 | 0 | 109.8 | I15 K77 | I15-T75 HydrophobicContact CB-CG2 4.21Å; I15-T75 HydrophobicContact CG2-CG2 3.45Å; I15-T75 VanDerWaalsContact CG2-CG2 3.45Å; T75-K77 PolarHBondContact O-N 2.89Å |
| 76 | Q | 86.4 | Confident | 86.2 | Confident | 89 Ų | 89 | 106 Ų | 106 | 42% | 0.416 | 50% | 0.502 | S | S | . | . | trans | -75.9 | 108 | 173.1 | -169.3 | 177.8 | 11.9 | 0 | 0 | 108.5 | P19 V21 S74 R78 | P19-Q76 HydrophobicContact CB-CB 4.02Å; P19-Q76 PolarHBondContact O-N 2.79Å; V21-Q76 HydrophobicContact CG2-CB 4.32Å; V21-Q76 HydrophobicContact CG2-CG 4.5Å; S74-Q76 PolarHBondContact O-N 3.39Å; Q76-R78 PolarHBondContact O-N 2.96Å | ||
| 77 | K | 77.8 | Confident | 85.4 | Confident | 179 Ų | 179 | 101.4 Ų | 101.4 | 78% | 0.778 | 49% | 0.492 | S | S | * | . | trans | -69.9 | 130.6 | 172.6 | -68.4 | -175.2 | 178.9 | -179.6 | 0 | 108.6 | T75 K79 | T75-K77 PolarHBondContact O-N 2.89Å; K77-K79 PolarHBondContact O-N 3.01Å | ||
| 78 | R | 60.4 | Low | 84.5 | Confident | 234 Ų | 234 | 109.1 Ų | 109.1 | 88% | 0.883 | 53% | 0.528 | S | S | * | . | trans | -58.9 | 122.4 | 162.6 | -80.7 | 175.5 | 85.1 | 167.4 | 4.2 | 106.8 | Q76 V80 | Q76-R78 PolarHBondContact O-N 2.96Å; R78-V80 PolarHBondContact O-N 3.33Å; R78-V80 VanDerWaalsContact O-N 3.12Å | ||
| 79 | K | 56.8 | Low | 83.4 | Confident | 210 Ų | 210 | 110.8 Ų | 110.8 | 91% | 0.913 | 53% | 0.533 | S | S | * | . | trans | -64.3 | 110.3 | 160.3 | -75.9 | -174.7 | 175.7 | -177.5 | 0 | 105.6 | K77 | K77-K79 PolarHBondContact O-N 3.01Š| ||
| 80 | V | 49.6 | Very low | 82.2 | Confident | 207 Ų | 207 | 114.3 Ų | 114.3 | 100% | 1.255 | 55% | 0.546 | S | S | * | . | trans | -75.8 | 0 | 162.6 | -176.1 | 0 | 0 | 0 | 0 | 106.9 | R78 | R78-V80 PolarHBondContact O-N 3.33Å; R78-V80 VanDerWaalsContact O-N 3.12Å |
Retrieved 80 of 80 residues in 120.4 ms
(Link to these results)