| 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 | 33.7 | Very low | 37.1 | Very low | 185 Ų | 185 | 116.8 Ų | 116.8 | 91% | 0.911 | 60% | 0.599 | S | S | * | * | 0 | -44.6 | 0 | -153.8 | 173.3 | -174.5 | 0 | 0 | 110.7 | E3 A4 V5 | M1-E3 PolarHBondContact O-N 3.48Å; M1-A4 PolarHBondContact O-N 2.99Å; M1-V5 PolarHBondContact O-N 3.33Å | |||
| 2 | E | 31.3 | Very low | 37.5 | Very low | 161 Ų | 161 | 108.7 Ų | 108.7 | 75% | 0.752 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -53.1 | -47.4 | 174.1 | -87.1 | 172.9 | 101.5 | 0 | 0 | 115 | A4 V5 W6 | E2-A4 VanDerWaalsContact C-N 3.27Å; E2-A4 PolarHBondContact O-N 2.82Å; E2-V5 PolarHBondContact O-N 2.95Å; E2-W6 PolarHBondContact O-N 3.08Å; E2-W6 VanDerWaalsContact O-N 3.14Å |
| 3 | E | 34.4 | Very low | 37.9 | Very low | 176 Ų | 176 | 105.6 Ų | 105.6 | 82% | 0.822 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.2 | -35.2 | -178.8 | -80.2 | -171.1 | 126.1 | 0 | 0 | 113.5 | M1 W6 S7 | M1-E3 PolarHBondContact O-N 3.48Å; E3-W6 PolarHBondContact O-N 3.13Å; E3-S7 WeakPolarHBondContact O-CB 3.47Å; E3-S7 PolarHBondContact O-N 3.28Å; E3-S7 VanDerWaalsContact O-N 3.08Å |
| 4 | A | 35.9 | Very low | 38.2 | Very low | 46 Ų | 46 | 100.5 Ų | 100.5 | 38% | 0.38 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69.5 | -40 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | M1 E2 S7 A10 | M1-A4 PolarHBondContact O-N 2.99Å; E2-A4 VanDerWaalsContact C-N 3.27Å; E2-A4 PolarHBondContact O-N 2.82Å; A4-S7 PolarHBondContact O-N 3.25Å; A4-S7 PolarHBondContact O-OG 3.17Å; A4-A10 HydrophobicContact CB-CB 3.69Å; A4-A10 WeakPolarHBondContact O-CB 3.5Å |
| 5 | V | 36.7 | Very low | 38.5 | Very low | 49 Ų | 49 | 99.3 Ų | 99.3 | 30% | 0.297 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.4 | -40.4 | 177.2 | 178.5 | 0 | 0 | 0 | 0 | 111.2 | M1 E2 A12 W47 | M1-V5 PolarHBondContact O-N 3.33Å; E2-V5 PolarHBondContact O-N 2.95Å; V5-A12 HydrophobicContact CG2-CB 4.07Å; V5-W47 HydrophobicContact CG1-CH2 4.39Å |
| 6 | W | 37.5 | Very low | 38.9 | Very low | 223 Ų | 223 | 97.7 Ų | 97.7 | 85% | 0.845 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -74.9 | -25.7 | 179.7 | -82.8 | 28.4 | 0 | 0 | 0 | 113.8 | E2 E3 K8 | E2-W6 PolarHBondContact O-N 3.08Å; E2-W6 VanDerWaalsContact O-N 3.14Å; E3-W6 PolarHBondContact O-N 3.13Å; W6-K8 PolarHBondContact O-N 3.14Å; W6-K8 VanDerWaalsContact O-N 3.17Å |
| 7 | S | 45.7 | Very low | 38.9 | Very low | 72 Ų | 72 | 102.2 Ų | 102.2 | 50% | 0.503 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -1.3 | 176.7 | 76.7 | 0 | 0 | 0 | 0 | 114.9 | E3 A4 N9 | E3-S7 WeakPolarHBondContact O-CB 3.47Å; E3-S7 PolarHBondContact O-N 3.28Å; E3-S7 VanDerWaalsContact O-N 3.08Å; A4-S7 PolarHBondContact O-N 3.25Å; A4-S7 PolarHBondContact O-OG 3.17Å; S7-N9 PolarHBondContact O-N 3.47Å; S7-N9 PolarHBondContact OG-N 3.23Å |
| 8 | K | 41.8 | Very low | 39.1 | Very low | 118 Ų | 118 | 98.9 Ų | 98.9 | 51% | 0.513 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57 | 9.1 | -174.3 | -59.5 | -175.5 | 174.6 | -171.5 | 0 | 115.3 | W6 W42 | W6-K8 PolarHBondContact O-N 3.14Å; W6-K8 VanDerWaalsContact O-N 3.17Å; K8-W42 HydrophobicContact CB-CG 4.47Å; K8-W42 HydrophobicContact CD-CZ2 4.46Å |
| 9 | N | 33.2 | Very low | 39.1 | Very low | 154 Ų | 154 | 103.2 Ų | 103.2 | 82% | 0.824 | 54% | 0.542 | S | S | * | . | trans | -107.6 | 5 | -178.5 | -106.7 | -8.4 | 0 | 0 | 0 | 113.5 | S7 | S7-N9 PolarHBondContact O-N 3.47Å; S7-N9 PolarHBondContact OG-N 3.23Å | ||
| 10 | A | 35.2 | Very low | 39.2 | Very low | 24 Ų | 24 | 101.5 Ų | 101.5 | 20% | 0.198 | 55% | 0.55 | C | S | . | . | trans | -105.3 | 125.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A4 A12 | A4-A10 HydrophobicContact CB-CB 3.69Å; A4-A10 WeakPolarHBondContact O-CB 3.5Å; A10-A12 PolarHBondContact O-N 3.49Å; A10-A12 VanDerWaalsContact O-N 3.13Å | ||
| 11 | S | 43.3 | Very low | 39.2 | Very low | 77 Ų | 77 | 98.7 Ų | 98.7 | 54% | 0.538 | 54% | 0.538 | S | S | . | . | trans | -66.4 | 102.4 | 151.5 | -28.6 | 0 | 0 | 0 | 0 | 106.8 | V13 Y40 | S11-V13 PolarHBondContact O-N 3.43Å; S11-Y40 WeakPolarHBondContact CA-O 3.33Å | ||
| 12 | A | 41 | Very low | 39.6 | Very low | 19 Ų | 19 | 95.2 Ų | 95.2 | 16% | 0.157 | 52% | 0.519 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 113 | 172.9 | 0 | 0 | 0 | 0 | 0 | 107 | V5 A10 A14 Y40 | V5-A12 HydrophobicContact CG2-CB 4.07Å; A10-A12 PolarHBondContact O-N 3.49Å; A10-A12 VanDerWaalsContact O-N 3.13Å; A12-A14 PolarHBondContact O-N 3.08Å; A12-Y40 PolarHBondContact N-O 3.1Å; A12-Y40 WeakPolarHBondContact O-CD2 3.12Å; A12-Y40 PolarHBondContact O-N 3.21Å |
| 13 | V | 43 | Very low | 40.2 | Very low | 69 Ų | 69 | 94 Ų | 94 | 42% | 0.418 | 51% | 0.512 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | 105.9 | 166.9 | 178.6 | 0 | 0 | 0 | 0 | 105.8 | S11 T37 F38 Q39 | S11-V13 PolarHBondContact O-N 3.43Å; V13-T37 HydrophobicContact CG1-CG2 3.47Å; V13-T37 VanDerWaalsContact CG1-CG2 3.47Å; V13-F38 WeakPolarHBondContact CA-O 3.2Å; V13-Q39 HydrophobicContact CG2-CG 4.15Å |
| 14 | A | 42.4 | Very low | 40.4 | Very low | 34 Ų | 34 | 90.5 Ų | 90.5 | 28% | 0.281 | 50% | 0.497 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 114.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | A12 L16 F38 Y40 | A12-A14 PolarHBondContact O-N 3.08Å; A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 HydrophobicContact CB-CD1 4.4Å; A14-L16 PolarHBondContact O-N 3.31Å; A14-L16 VanDerWaalsContact O-N 3.1Å; A14-F38 PolarHBondContact N-O 2.86Å; A14-F38 PolarHBondContact O-N 3.24Å; A14-Y40 HydrophobicContact CB-CD2 4.32Å; A14-Y40 HydrophobicContact CB-CE2 3.68Å |
| 15 | A | 43 | Very low | 40.7 | Very low | 82 Ų | 82 | 92.1 Ų | 92.1 | 68% | 0.678 | 50% | 0.503 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 92.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | Y17 | A15-Y17 PolarHBondContact O-N 3.45Å |
| 16 | L | 44.2 | Very low | 41.1 | Very low | 74 Ų | 74 | 97.1 Ų | 97.1 | 39% | 0.387 | 53% | 0.534 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 105.7 | 169.6 | -87.8 | 142.2 | 0 | 0 | 0 | 107 | A14 T18 F38 Y40 | A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 HydrophobicContact CB-CD1 4.4Å; A14-L16 PolarHBondContact O-N 3.31Å; A14-L16 VanDerWaalsContact O-N 3.1Å; L16-T18 VanDerWaalsContact C-N 3.28Å; L16-T18 HydrophobicContact CB-CG2 4.01Å; L16-T18 PolarHBondContact O-N 2.81Å; L16-F38 HydrophobicContact CB-CD2 3.98Å; L16-F38 HydrophobicContact CB-CE2 4.05Å; L16-F38 HydrophobicContact CD1-CD2 3.81Å; L16-F38 HydrophobicContact CD1-CE2 4.27Å; L16-F38 HydrophobicContact CD1-CG 4.46Å; L16-Y40 VanDerWaalsContact CD1-OH 3.26Å; L16-Y40 WeakPolarHBondContact CD1-OH 3.4Å |
| 17 | Y | 39.5 | Very low | 41.7 | Very low | 175 Ų | 175 | 90.6 Ų | 90.6 | 69% | 0.686 | 54% | 0.536 | S | S | * | . | trans | -65.4 | 93.9 | 163.4 | -114.5 | -88.8 | 0 | 0 | 0 | 107.4 | A15 | A15-Y17 PolarHBondContact O-N 3.45Š| ||
| 18 | T | 42.3 | Very low | 41.8 | Very low | 43 Ų | 43 | 89.1 Ų | 89.1 | 26% | 0.264 | 53% | 0.526 | S | S | . | . | trans | -97.2 | 98.2 | 174.4 | 62.4 | 0 | 0 | 0 | 0 | 108.3 | L16 G20 C21 | L16-T18 VanDerWaalsContact C-N 3.28Å; L16-T18 HydrophobicContact CB-CG2 4.01Å; L16-T18 PolarHBondContact O-N 2.81Å; T18-G20 PolarHBondContact O-N 2.89Å; T18-C21 PolarHBondContact OG1-SG 2.79Å | ||
| 19 | E | 39.2 | Very low | 42.3 | Very low | 180 Ų | 180 | 87.9 Ų | 87.9 | 84% | 0.841 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | -4.2 | 171.7 | -62.9 | -174.6 | 163.7 | 0 | 0 | 112.9 | ||
| 20 | G | 40.5 | Very low | 42.9 | Very low | 68 Ų | 68 | 87.1 Ų | 87.1 | 70% | 0.701 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | -4.1 | -169.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | T18 H22 | T18-G20 PolarHBondContact O-N 2.89Å; G20-H22 VanDerWaalsContact C-N 3.3Å; G20-H22 PolarHBondContact O-N 2.88Å |
| 21 | C | 39.9 | Very low | 43.8 | Very low | 44 Ų | 44 | 88.8 Ų | 88.8 | 30% | 0.297 | 52% | 0.518 | S | S | . | . | trans | -87.5 | 67.9 | -177.6 | -67.8 | 0 | 0 | 0 | 0 | 112.1 | T18 F23 Y36 | T18-C21 PolarHBondContact OG1-SG 2.79Å; C21-F23 VanDerWaalsContact C-N 3.3Å; C21-F23 PolarHBondContact O-N 2.86Å; C21-Y36 HydrophobicContact CB-CD2 4.21Å; C21-Y36 HydrophobicContact CB-CE2 3.4Å; C21-Y36 VanDerWaalsContact CB-CE2 3.4Å | ||
| 22 | H | 41.9 | Very low | 44.2 | Very low | 112 Ų | 112 | 86.7 Ų | 86.7 | 52% | 0.519 | 50% | 0.502 | S | S | . | . | trans | -71.4 | 88.4 | 160.8 | -83.6 | 174.4 | 0 | 0 | 0 | 109.4 | G20 M24 I31 | G20-H22 VanDerWaalsContact C-N 3.3Å; G20-H22 PolarHBondContact O-N 2.88Å; H22-M24 VanDerWaalsContact C-N 3.26Å; H22-M24 PolarHBondContact O-N 3.19Å; H22-M24 VanDerWaalsContact O-N 3.08Å; H22-I31 WeakPolarHBondContact NE2-CG2 3.45Å | ||
| 23 | F | 43 | Very low | 44.9 | Very low | 136 Ų | 136 | 89.6 Ų | 89.6 | 60% | 0.596 | 52% | 0.515 | S | S | * | . | trans | -73.3 | 91.5 | 153.9 | -84.8 | -88.5 | 0 | 0 | 0 | 107.3 | C21 P25 Y36 | C21-F23 VanDerWaalsContact C-N 3.3Å; C21-F23 PolarHBondContact O-N 2.86Å; F23-P25 VanDerWaalsContact O-CD 3.32Å; F23-P25 WeakPolarHBondContact O-CD 3.33Å; F23-Y36 WeakPolarHBondContact CD2-OH 3.36Å; F23-Y36 WeakPolarHBondContact CE2-OH 3.47Å | ||
| 24 | M | 38.5 | Very low | 45.5 | Very low | 102 Ų | 102 | 86.8 Ų | 86.8 | 50% | 0.502 | 50% | 0.5 | S | S | . | . | trans | -93.3 | 103.3 | 157.6 | -69.8 | -171.8 | 76.8 | 0 | 0 | 106.9 | H22 T26 | H22-M24 VanDerWaalsContact C-N 3.26Å; H22-M24 PolarHBondContact O-N 3.19Å; H22-M24 VanDerWaalsContact O-N 3.08Å; M24-T26 PolarHBondContact O-N 3.27Å | ||
| 25 | P | 42.4 | Very low | 46.4 | Very low | 80 Ų | 80 | 87.2 Ų | 87.2 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | trans | -58.3 | 126.3 | 163.4 | -6.5 | 17.8 | 0 | 0 | 0 | 106.7 | F23 G27 S28 | F23-P25 VanDerWaalsContact O-CD 3.32Å; F23-P25 WeakPolarHBondContact O-CD 3.33Å; P25-G27 PolarHBondContact O-N 3.03Å; P25-S28 VanDerWaalsContact CB-OG 3.32Å; P25-S28 WeakPolarHBondContact CB-OG 3.47Å; P25-S28 WeakPolarHBondContact CD-OG 3.37Å; P25-S28 VanDerWaalsContact CG-OG 3.26Å; P25-S28 WeakPolarHBondContact CG-OG 3.42Å; P25-S28 WeakPolarHBondContact O-CB 3.08Å; P25-S28 PolarHBondContact O-N 2.9Å; P25-S28 PolarHBondContact O-OG 3.49Å | ||
| 26 | T | 45.8 | Very low | 47.3 | Very low | 154 Ų | 154 | 84.6 Ų | 84.6 | 95% | 0.945 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | 117.2 | 178.4 | 28.8 | 0 | 0 | 0 | 0 | 109.6 | M24 | M24-T26 PolarHBondContact O-N 3.27Š|
| 27 | G | 50.2 | Low | 48 | Very low | 86 Ų | 86 | 83.3 Ų | 83.3 | 89% | 0.887 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 104.6 | -0.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | P25 | P25-G27 PolarHBondContact O-N 3.03Š|
| 28 | S | 48.4 | Very low | 49 | Very low | 41 Ų | 41 | 76.7 Ų | 76.7 | 29% | 0.287 | 44% | 0.44 | S | S | . | . | trans | -92.7 | 122.5 | 179.2 | -40.9 | 0 | 0 | 0 | 0 | 111.8 | P25 R30 | P25-S28 VanDerWaalsContact CB-OG 3.32Å; P25-S28 WeakPolarHBondContact CB-OG 3.47Å; P25-S28 WeakPolarHBondContact CD-OG 3.37Å; P25-S28 VanDerWaalsContact CG-OG 3.26Å; P25-S28 WeakPolarHBondContact CG-OG 3.42Å; P25-S28 WeakPolarHBondContact O-CB 3.08Å; P25-S28 PolarHBondContact O-N 2.9Å; P25-S28 PolarHBondContact O-OG 3.49Å; S28-R30 PolarHBondContact O-N 3.3Å; S28-R30 VanDerWaalsContact O-N 3.08Å | ||
| 29 | T | 52.4 | Low | 50 | Low | 92 Ų | 92 | 78.9 Ų | 78.9 | 56% | 0.564 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -78 | 27.6 | 167.6 | 55.4 | 0 | 0 | 0 | 0 | 112.4 | K61 G62 | T29-K61 CarbonylContact O-C 3.56Å; T29-K61 WeakPolarHBondContact O-CA 2.97Å; T29-G62 PolarHBondContact O-N 2.92Å |
| 30 | R | 44 | Very low | 51.3 | Low | 137 Ų | 137 | 73.2 Ų | 73.2 | 52% | 0.517 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 124.6 | -176.7 | -75.2 | -177.9 | 168.3 | 175.8 | -3.1 | 110.1 | S28 V59 A60 K61 | S28-R30 PolarHBondContact O-N 3.3Å; S28-R30 VanDerWaalsContact O-N 3.08Å; R30-V59 HydrophobicContact CB-CG1 4.06Å; R30-V59 HydrophobicContact CG-CG1 4.18Å; R30-A60 CarbonylContact C-O 3.57Å; R30-A60 VanDerWaalsContact CA-O 3.25Å; R30-A60 WeakPolarHBondContact CA-O 3.26Å; R30-K61 HydrophobicContact CG-CB 4.42Å; R30-K61 HydrophobicContact CG-CG 4.19Å |
| 31 | I | 54 | Low | 52.4 | Low | 59 Ų | 59 | 71.1 Ų | 71.1 | 30% | 0.303 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.3 | 121.4 | 171.4 | -61.7 | 171 | 0 | 0 | 0 | 106.5 | H22 V59 A60 | H22-I31 WeakPolarHBondContact NE2-CG2 3.45Å; I31-V59 WeakPolarHBondContact O-CA 3.36Å; I31-A60 PolarHBondContact N-O 2.77Å; I31-A60 PolarHBondContact O-N 3.08Å |
| 32 | V | 53.1 | Low | 53.9 | Low | 33 Ų | 33 | 72.8 Ų | 72.8 | 20% | 0.2 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 114.1 | 177 | -174.4 | 0 | 0 | 0 | 0 | 107.8 | F54 V56 V59 | V32-F54 HydrophobicContact CG1-CE1 3.9Å; V32-F54 HydrophobicContact CG1-CZ 3.85Å; V32-V56 HydrophobicContact CG1-CB 4.23Å; V32-V56 HydrophobicContact CG1-CG1 3.68Å; V32-V56 HydrophobicContact CG1-CG2 3.65Å; V32-V59 HydrophobicContact CG1-CG2 4.43Å; V32-V59 HydrophobicContact CG2-CG1 4.44Å; V32-V59 HydrophobicContact CG2-CG2 4.4Å |
| 33 | L | 54.3 | Low | 55.3 | Low | 81 Ų | 81 | 75.6 Ų | 75.6 | 42% | 0.424 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 127.4 | 169.1 | -71.2 | 160.5 | 0 | 0 | 0 | 107.4 | V57 S58 | L33-V57 PolarHBondContact O-N 3.08Å; L33-S58 PolarHBondContact N-O 2.89Å; L33-S58 PolarHBondContact O-N 2.77Å; L33-S58 VanDerWaalsContact O-N 3.12Å |
| 34 | G | 57.3 | Low | 57.2 | Low | 10 Ų | 10 | 75.2 Ų | 75.2 | 10% | 0.103 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145 | 151 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | N55 | G34-N55 CarbonylContact C-O 3.39Å; G34-N55 WeakPolarHBondContact CA-O 3.25Å |
| 35 | D | 60.5 | Low | 59.2 | Low | 43 Ų | 43 | 74.7 Ų | 74.7 | 23% | 0.23 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 134.1 | 173 | -68.3 | -41.9 | 0 | 0 | 0 | 109.7 | N55 V57 | D35-N55 PolarHBondContact N-O 3.21Å; D35-N55 PolarHBondContact O-N 2.76Å; D35-V57 HydrophobicContact CB-CG2 4.25Å; D35-V57 VanDerWaalsContact OD2-CG2 3.22Å; D35-V57 WeakPolarHBondContact OD2-CG2 3.45Å |
| 36 | Y | 61.4 | Low | 60.8 | Low | 27 Ų | 27 | 76.3 Ų | 76.3 | 11% | 0.106 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 129 | 170.9 | -72.2 | -91.5 | 0 | 0 | 0 | 109.7 | C21 F23 F38 V51 F54 | C21-Y36 HydrophobicContact CB-CD2 4.21Å; C21-Y36 HydrophobicContact CB-CE2 3.4Å; C21-Y36 VanDerWaalsContact CB-CE2 3.4Å; F23-Y36 WeakPolarHBondContact CD2-OH 3.36Å; F23-Y36 WeakPolarHBondContact CE2-OH 3.47Å; Y36-F38 HydrophobicContact CD1-CZ 4.32Å; Y36-F38 HydrophobicContact CG-CE2 4.21Å; Y36-F38 HydrophobicContact CG-CZ 4.04Å; Y36-V51 HydrophobicContact CD1-CG1 4.23Å; Y36-F54 HydrophobicContact CD1-CB 4.33Å; Y36-F54 HydrophobicContact CD1-CD2 4.1Å; Y36-F54 AromaticContact CD2-CD2 3.94Å; Y36-F54 HydrophobicContact CD2-CD2 3.94Å; Y36-F54 HydrophobicContact CD2-CE2 4.3Å; Y36-F54 HydrophobicContact CE1-CB 3.98Å; Y36-F54 AromaticContact CE1-CD2 3.6Å; Y36-F54 HydrophobicContact CE1-CD2 3.6Å; Y36-F54 HydrophobicContact CE1-CE2 4.42Å; Y36-F54 HydrophobicContact CE1-CG 4.15Å; Y36-F54 AromaticContact CE2-CD2 3.36Å; Y36-F54 HydrophobicContact CE2-CD2 3.36Å; Y36-F54 AromaticContact CE2-CE2 3.49Å; Y36-F54 HydrophobicContact CE2-CE2 3.49Å; Y36-F54 VanDerWaalsContact CE2-CE2 3.49Å; Y36-F54 HydrophobicContact CG-CD2 4.26Å; Y36-F54 AromaticContact CZ-CD2 3.18Å; Y36-F54 AromaticContact CZ-CE2 3.57Å; Y36-F54 WeakPolarHBondContact OH-CD2 3.32Å; Y36-F54 WeakPolarHBondContact OH-CE2 3.32Å |
| 37 | T | 59 | Low | 62.2 | Low | 46 Ų | 46 | 74.9 Ų | 74.9 | 28% | 0.282 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 118.6 | 166.7 | -49.9 | 0 | 0 | 0 | 0 | 108.2 | V13 G52 C53 | V13-T37 HydrophobicContact CG1-CG2 3.47Å; V13-T37 VanDerWaalsContact CG1-CG2 3.47Å; T37-G52 WeakPolarHBondContact O-CA 3.33Å; T37-G52 PolarHBondContact O-N 2.99Å; T37-C53 PolarHBondContact N-O 2.97Å |
| 38 | F | 61.6 | Low | 62.9 | Low | 36 Ų | 36 | 75.3 Ų | 75.3 | 16% | 0.158 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 133.6 | 173.1 | -60.5 | -88.5 | 0 | 0 | 0 | 109.4 | V13 A14 L16 Y36 Y40 I49 V51 | V13-F38 WeakPolarHBondContact CA-O 3.2Å; A14-F38 PolarHBondContact N-O 2.86Å; A14-F38 PolarHBondContact O-N 3.24Å; L16-F38 HydrophobicContact CB-CD2 3.98Å; L16-F38 HydrophobicContact CB-CE2 4.05Å; L16-F38 HydrophobicContact CD1-CD2 3.81Å; L16-F38 HydrophobicContact CD1-CE2 4.27Å; L16-F38 HydrophobicContact CD1-CG 4.46Å; Y36-F38 HydrophobicContact CD1-CZ 4.32Å; Y36-F38 HydrophobicContact CG-CE2 4.21Å; Y36-F38 HydrophobicContact CG-CZ 4.04Å; F38-Y40 HydrophobicContact CB-CE2 3.77Å; F38-I49 HydrophobicContact CB-CG2 4.31Å; F38-I49 HydrophobicContact CD1-CG2 3.84Å; F38-I49 HydrophobicContact CG-CG2 4.49Å; F38-V51 HydrophobicContact CD1-CB 4.34Å; F38-V51 HydrophobicContact CD1-CG1 4.22Å; F38-V51 HydrophobicContact CD1-CG2 4.04Å; F38-V51 HydrophobicContact CE1-CB 4.31Å; F38-V51 HydrophobicContact CE1-CG1 3.87Å; F38-V51 HydrophobicContact CE1-CG2 3.89Å |
| 39 | Q | 62.5 | Low | 64 | Low | 90 Ų | 90 | 78 Ų | 78 | 42% | 0.421 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 117.2 | 176.1 | -162.5 | 172.8 | 6.4 | 0 | 0 | 108.5 | V13 H50 | V13-Q39 HydrophobicContact CG2-CG 4.15Å; Q39-H50 HydrophobicContact CB-CB 4.39Å; Q39-H50 PolarHBondContact N-O 3.5Å; Q39-H50 WeakPolarHBondContact O-CB 3.38Å; Q39-H50 PolarHBondContact O-N 3.02Å |
| 40 | Y | 66 | Low | 64.5 | Low | 60 Ų | 60 | 79.6 Ų | 79.6 | 24% | 0.235 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 130 | 179.9 | -61.6 | -100.5 | 0 | 0 | 0 | 108.9 | S11 A12 A14 L16 F38 Y48 I49 | S11-Y40 WeakPolarHBondContact CA-O 3.33Å; A12-Y40 PolarHBondContact N-O 3.1Å; A12-Y40 WeakPolarHBondContact O-CD2 3.12Å; A12-Y40 PolarHBondContact O-N 3.21Å; A14-Y40 HydrophobicContact CB-CD2 4.32Å; A14-Y40 HydrophobicContact CB-CE2 3.68Å; L16-Y40 VanDerWaalsContact CD1-OH 3.26Å; L16-Y40 WeakPolarHBondContact CD1-OH 3.4Å; F38-Y40 HydrophobicContact CB-CE2 3.77Å; Y40-Y48 WeakPolarHBondContact CA-O 3.1Å; Y40-I49 HydrophobicContact CD1-CD1 4.37Å; Y40-I49 HydrophobicContact CD1-CG1 3.77Å; Y40-I49 HydrophobicContact CE1-CD1 3.72Å; Y40-I49 HydrophobicContact CE1-CG1 3.61Å; Y40-I49 HydrophobicContact CE1-CG2 4.34Å |
| 41 | G | 65.1 | Low | 65.4 | Low | 25 Ų | 25 | 77.5 Ų | 77.5 | 26% | 0.258 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 144.6 | 175 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y48 | G41-Y48 PolarHBondContact N-O 3Å; G41-Y48 PolarHBondContact O-N 2.93Å |
| 42 | W | 70.7 | Confident | 65.6 | Low | 79 Ų | 79 | 76.4 Ų | 76.4 | 30% | 0.299 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 121.7 | 171.8 | -178.7 | -92.3 | 0 | 0 | 0 | 109.4 | K8 S45 Q46 W47 | K8-W42 HydrophobicContact CB-CG 4.47Å; K8-W42 HydrophobicContact CD-CZ2 4.46Å; W42-S45 WeakPolarHBondContact CH2-O 3.26Å; W42-Q46 WeakPolarHBondContact CA-O 3.22Å; W42-W47 HydrophobicContact CB-CE3 4.19Å; W42-W47 HydrophobicContact CB-CH2 4.38Å; W42-W47 HydrophobicContact CB-CZ3 4.05Å; W42-W47 HydrophobicContact CE3-CB 4.33Å; W42-W47 AromaticContact CE3-CD1 3.57Å; W42-W47 AromaticContact CE3-CD2 3.46Å; W42-W47 HydrophobicContact CE3-CD2 3.46Å; W42-W47 VanDerWaalsContact CE3-CD2 3.46Å; W42-W47 AromaticContact CE3-CE2 3.39Å; W42-W47 HydrophobicContact CE3-CE3 4.13Å; W42-W47 AromaticContact CE3-CG 3.54Å; W42-W47 HydrophobicContact CE3-CG 3.54Å; W42-W47 AromaticContact CE3-CZ2 4Å; W42-W47 HydrophobicContact CE3-CZ2 4Å; W42-W47 AromaticContact CE3-NE1 3.45Å; W42-W47 AromaticContact CZ3-CD1 3.3Å; W42-W47 HydrophobicContact CZ3-CD2 4.04Å; W42-W47 AromaticContact CZ3-CE2 3.76Å; W42-W47 AromaticContact CZ3-CG 3.73Å; W42-W47 HydrophobicContact CZ3-CG 3.73Å; W42-W47 AromaticContact CZ3-NE1 3.28Å; W42-W47 VanDerWaalsContact CZ3-NE1 3.28Å |
| 43 | Y | 71.1 | Confident | 65.8 | Low | 170 Ų | 170 | 79.2 Ų | 79.2 | 67% | 0.667 | 41% | 0.406 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -143.2 | 140.4 | 179.1 | -177.3 | -100.9 | 0 | 0 | 0 | 110.3 | S45 Q46 Y48 | Y43-S45 PolarHBondContact O-N 2.83Å; Y43-S45 VanDerWaalsContact O-N 3.08Å; Y43-Q46 PolarHBondContact N-O 3.35Å; Y43-Q46 PolarHBondContact O-N 2.88Å; Y43-Q46 VanDerWaalsContact O-O 3.05Å; Y43-Y48 HydrophobicContact CD1-CE2 4.17Å; Y43-Y48 WeakPolarHBondContact O-CE2 3.37Å |
| 44 | N | 82.3 | Confident | 66.2 | Low | 128 Ų | 128 | 78.8 Ų | 78.8 | 68% | 0.684 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.6 | 45.6 | 179 | -162.8 | 34.5 | 0 | 0 | 0 | 115.1 | Q46 | N44-Q46 VanDerWaalsContact C-N 3.27Å; N44-Q46 PolarHBondContact O-N 3.12Å |
| 45 | S | 81.5 | Confident | 66.4 | Low | 92 Ų | 92 | 82.7 Ų | 82.7 | 64% | 0.643 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.4 | 21 | -178.6 | -57.5 | 0 | 0 | 0 | 0 | 116.1 | W42 Y43 | W42-S45 WeakPolarHBondContact CH2-O 3.26Å; Y43-S45 PolarHBondContact O-N 2.83Å; Y43-S45 VanDerWaalsContact O-N 3.08Å |
| 46 | Q | 75.8 | Confident | 66.4 | Low | 113 Ų | 113 | 84.4 Ų | 84.4 | 53% | 0.528 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 150 | 176 | -64.4 | -176.2 | -9.4 | 0 | 0 | 111.5 | W42 Y43 N44 Y48 | W42-Q46 WeakPolarHBondContact CA-O 3.22Å; Y43-Q46 PolarHBondContact N-O 3.35Å; Y43-Q46 PolarHBondContact O-N 2.88Å; Y43-Q46 VanDerWaalsContact O-O 3.05Å; N44-Q46 VanDerWaalsContact C-N 3.27Å; N44-Q46 PolarHBondContact O-N 3.12Å; Q46-Y48 HydrophobicContact CB-CE2 3.94Å |
| 47 | W | 74.6 | Confident | 66.5 | Low | 125 Ų | 125 | 87.3 Ų | 87.3 | 47% | 0.473 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 131.1 | 169.6 | -75.7 | 110.5 | 0 | 0 | 0 | 109.9 | V5 W42 | V5-W47 HydrophobicContact CG1-CH2 4.39Å; W42-W47 HydrophobicContact CB-CE3 4.19Å; W42-W47 HydrophobicContact CB-CH2 4.38Å; W42-W47 HydrophobicContact CB-CZ3 4.05Å; W42-W47 HydrophobicContact CE3-CB 4.33Å; W42-W47 AromaticContact CE3-CD1 3.57Å; W42-W47 AromaticContact CE3-CD2 3.46Å; W42-W47 HydrophobicContact CE3-CD2 3.46Å; W42-W47 VanDerWaalsContact CE3-CD2 3.46Å; W42-W47 AromaticContact CE3-CE2 3.39Å; W42-W47 HydrophobicContact CE3-CE3 4.13Å; W42-W47 AromaticContact CE3-CG 3.54Å; W42-W47 HydrophobicContact CE3-CG 3.54Å; W42-W47 AromaticContact CE3-CZ2 4Å; W42-W47 HydrophobicContact CE3-CZ2 4Å; W42-W47 AromaticContact CE3-NE1 3.45Å; W42-W47 AromaticContact CZ3-CD1 3.3Å; W42-W47 HydrophobicContact CZ3-CD2 4.04Å; W42-W47 AromaticContact CZ3-CE2 3.76Å; W42-W47 AromaticContact CZ3-CG 3.73Å; W42-W47 HydrophobicContact CZ3-CG 3.73Å; W42-W47 AromaticContact CZ3-NE1 3.28Å; W42-W47 VanDerWaalsContact CZ3-NE1 3.28Å |
| 48 | Y | 66.2 | Low | 66.5 | Low | 94 Ų | 94 | 87.7 Ų | 87.7 | 37% | 0.369 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 137.6 | 172 | -67.6 | -92 | 0 | 0 | 0 | 109.4 | Y40 G41 Y43 Q46 | Y40-Y48 WeakPolarHBondContact CA-O 3.1Å; G41-Y48 PolarHBondContact N-O 3Å; G41-Y48 PolarHBondContact O-N 2.93Å; Y43-Y48 HydrophobicContact CD1-CE2 4.17Å; Y43-Y48 WeakPolarHBondContact O-CE2 3.37Å; Q46-Y48 HydrophobicContact CB-CE2 3.94Å |
| 49 | I | 70.6 | Confident | 66.4 | Low | 99 Ų | 99 | 89.6 Ų | 89.6 | 51% | 0.508 | 47% | 0.47 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 112.4 | 172.1 | -54.1 | 180 | 0 | 0 | 0 | 106.8 | F38 Y40 | F38-I49 HydrophobicContact CB-CG2 4.31Å; F38-I49 HydrophobicContact CD1-CG2 3.84Å; F38-I49 HydrophobicContact CG-CG2 4.49Å; Y40-I49 HydrophobicContact CD1-CD1 4.37Å; Y40-I49 HydrophobicContact CD1-CG1 3.77Å; Y40-I49 HydrophobicContact CE1-CD1 3.72Å; Y40-I49 HydrophobicContact CE1-CG1 3.61Å; Y40-I49 HydrophobicContact CE1-CG2 4.34Å |
| 50 | H | 62.2 | Low | 65.8 | Low | 125 Ų | 125 | 87.5 Ų | 87.5 | 58% | 0.579 | 47% | 0.468 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.4 | 113.1 | 162.8 | -74.9 | -98.6 | 0 | 0 | 0 | 107.6 | Q39 G52 | Q39-H50 HydrophobicContact CB-CB 4.39Å; Q39-H50 PolarHBondContact N-O 3.5Å; Q39-H50 WeakPolarHBondContact O-CB 3.38Å; Q39-H50 PolarHBondContact O-N 3.02Å; H50-G52 PolarHBondContact O-N 2.93Å |
| 51 | V | 64 | Low | 65.3 | Low | 93 Ų | 93 | 92 Ų | 92 | 56% | 0.564 | 49% | 0.489 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 112.2 | 168.3 | -172.7 | 0 | 0 | 0 | 0 | 106.4 | Y36 F38 | Y36-V51 HydrophobicContact CD1-CG1 4.23Å; F38-V51 HydrophobicContact CD1-CB 4.34Å; F38-V51 HydrophobicContact CD1-CG1 4.22Å; F38-V51 HydrophobicContact CD1-CG2 4.04Å; F38-V51 HydrophobicContact CE1-CB 4.31Å; F38-V51 HydrophobicContact CE1-CG1 3.87Å; F38-V51 HydrophobicContact CE1-CG2 3.89Å |
| 52 | G | 58.6 | Low | 64.6 | Low | 36 Ų | 36 | 96 Ų | 96 | 37% | 0.371 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.5 | -155 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | T37 H50 | T37-G52 WeakPolarHBondContact O-CA 3.33Å; T37-G52 PolarHBondContact O-N 2.99Å; H50-G52 PolarHBondContact O-N 2.93Å |
| 53 | C | 55.6 | Low | 64.3 | Low | 92 Ų | 92 | 96.9 Ų | 96.9 | 62% | 0.622 | 54% | 0.542 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.6 | 141.1 | -177 | -62.4 | 0 | 0 | 0 | 0 | 111.6 | T37 | T37-C53 PolarHBondContact N-O 2.97Å |
| 54 | F | 63.6 | Low | 63.9 | Low | 72 Ų | 72 | 93.1 Ų | 93.1 | 32% | 0.316 | 54% | 0.535 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 114.8 | 164 | 173.9 | -109.6 | 0 | 0 | 0 | 108.3 | V32 Y36 V56 | V32-F54 HydrophobicContact CG1-CE1 3.9Å; V32-F54 HydrophobicContact CG1-CZ 3.85Å; Y36-F54 HydrophobicContact CD1-CB 4.33Å; Y36-F54 HydrophobicContact CD1-CD2 4.1Å; Y36-F54 AromaticContact CD2-CD2 3.94Å; Y36-F54 HydrophobicContact CD2-CD2 3.94Å; Y36-F54 HydrophobicContact CD2-CE2 4.3Å; Y36-F54 HydrophobicContact CE1-CB 3.98Å; Y36-F54 AromaticContact CE1-CD2 3.6Å; Y36-F54 HydrophobicContact CE1-CD2 3.6Å; Y36-F54 HydrophobicContact CE1-CE2 4.42Å; Y36-F54 HydrophobicContact CE1-CG 4.15Å; Y36-F54 AromaticContact CE2-CD2 3.36Å; Y36-F54 HydrophobicContact CE2-CD2 3.36Å; Y36-F54 AromaticContact CE2-CE2 3.49Å; Y36-F54 HydrophobicContact CE2-CE2 3.49Å; Y36-F54 VanDerWaalsContact CE2-CE2 3.49Å; Y36-F54 HydrophobicContact CG-CD2 4.26Å; Y36-F54 AromaticContact CZ-CD2 3.18Å; Y36-F54 AromaticContact CZ-CE2 3.57Å; Y36-F54 WeakPolarHBondContact OH-CD2 3.32Å; Y36-F54 WeakPolarHBondContact OH-CE2 3.32Å; F54-V56 HydrophobicContact CD1-CG2 4.01Å; F54-V56 HydrophobicContact CE1-CG2 3.51Å; F54-V56 HydrophobicContact CZ-CG2 4.35Å |
| 55 | N | 60.9 | Low | 62.9 | Low | 92 Ų | 92 | 91.1 Ų | 91.1 | 49% | 0.492 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 116.8 | 174.7 | -74.1 | -40.5 | 0 | 0 | 0 | 109 | G34 D35 V57 | G34-N55 CarbonylContact C-O 3.39Å; G34-N55 WeakPolarHBondContact CA-O 3.25Å; D35-N55 PolarHBondContact N-O 3.21Å; D35-N55 PolarHBondContact O-N 2.76Å; N55-V57 PolarHBondContact O-N 3.06Å |
| 56 | V | 62.2 | Low | 61.8 | Low | 78 Ų | 78 | 91.1 Ų | 91.1 | 47% | 0.473 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 113.5 | 172.6 | 177.5 | 0 | 0 | 0 | 0 | 108.8 | V32 F54 V59 | V32-V56 HydrophobicContact CG1-CB 4.23Å; V32-V56 HydrophobicContact CG1-CG1 3.68Å; V32-V56 HydrophobicContact CG1-CG2 3.65Å; F54-V56 HydrophobicContact CD1-CG2 4.01Å; F54-V56 HydrophobicContact CE1-CG2 3.51Å; F54-V56 HydrophobicContact CZ-CG2 4.35Å; V56-V59 HydrophobicContact CG1-CG2 3.45Å; V56-V59 VanDerWaalsContact CG1-CG2 3.45Å |
| 57 | V | 62.1 | Low | 60.9 | Low | 89 Ų | 89 | 89.7 Ų | 89.7 | 54% | 0.539 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | -29.6 | 177.6 | -150.1 | 0 | 0 | 0 | 0 | 111.1 | L33 D35 N55 | L33-V57 PolarHBondContact O-N 3.08Å; D35-V57 HydrophobicContact CB-CG2 4.25Å; D35-V57 VanDerWaalsContact OD2-CG2 3.22Å; D35-V57 WeakPolarHBondContact OD2-CG2 3.45Å; N55-V57 PolarHBondContact O-N 3.06Å |
| 58 | S | 58.4 | Low | 60 | Low | 53 Ų | 53 | 87.3 Ų | 87.3 | 37% | 0.371 | 52% | 0.523 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.5 | 145 | -178.6 | 161.9 | 0 | 0 | 0 | 0 | 111.6 | L33 | L33-S58 PolarHBondContact N-O 2.89Å; L33-S58 PolarHBondContact O-N 2.77Å; L33-S58 VanDerWaalsContact O-N 3.12Å |
| 59 | V | 59.8 | Low | 59.6 | Low | 76 Ų | 76 | 86.9 Ų | 86.9 | 46% | 0.461 | 53% | 0.534 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 109.2 | 171.7 | -175.2 | 0 | 0 | 0 | 0 | 108.2 | R30 I31 V32 V56 | R30-V59 HydrophobicContact CB-CG1 4.06Å; R30-V59 HydrophobicContact CG-CG1 4.18Å; I31-V59 WeakPolarHBondContact O-CA 3.36Å; V32-V59 HydrophobicContact CG1-CG2 4.43Å; V32-V59 HydrophobicContact CG2-CG1 4.44Å; V32-V59 HydrophobicContact CG2-CG2 4.4Å; V56-V59 HydrophobicContact CG1-CG2 3.45Å; V56-V59 VanDerWaalsContact CG1-CG2 3.45Å |
| 60 | A | 51.5 | Low | 58.8 | Low | 46 Ų | 46 | 85.9 Ų | 85.9 | 38% | 0.38 | 54% | 0.536 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 132.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | R30 I31 | R30-A60 CarbonylContact C-O 3.57Å; R30-A60 VanDerWaalsContact CA-O 3.25Å; R30-A60 WeakPolarHBondContact CA-O 3.26Å; I31-A60 PolarHBondContact N-O 2.77Å; I31-A60 PolarHBondContact O-N 3.08Å |
| 61 | K | 53.8 | Low | 58.5 | Low | 156 Ų | 156 | 82.7 Ų | 82.7 | 68% | 0.678 | 53% | 0.532 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 118.8 | 171.5 | -161.3 | -177.2 | -179.6 | -173 | 0 | 107.9 | T29 R30 | T29-K61 CarbonylContact O-C 3.56Å; T29-K61 WeakPolarHBondContact O-CA 2.97Å; R30-K61 HydrophobicContact CG-CB 4.42Å; R30-K61 HydrophobicContact CG-CG 4.19Å |
| 62 | G | 51.1 | Low | 58 | Low | 109 Ų | 109 | 81.7 Ų | 81.7 | 100% | 1.124 | 53% | 0.53 | S | S | * | . | trans | -71.7 | 0 | 168.5 | 0 | 0 | 0 | 0 | 0 | 112 | T29 | T29-G62 PolarHBondContact O-N 2.92Š|
Retrieved 62 of 62 residues in 17.3 ms
(Link to these results)