| 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 | 50 | Low | 52.6 | Low | 203 Ų | 203 | 99.9 Ų | 99.9 | 100% | 1 | 57% | 0.57 | S | S | * | * | 0 | 121.2 | 0 | -125.4 | 83.4 | 177 | 0 | 0 | 108 | |||||
| 2 | S | 49.7 | Very low | 51.4 | Low | 113 Ų | 113 | 100.6 Ų | 100.6 | 79% | 0.79 | 59% | 0.586 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -106.9 | 140.6 | 172 | -59.6 | 0 | 0 | 0 | 0 | 108.8 | C63 | S2-C63 VanDerWaalsContact C-SG 3.57Å |
| 3 | C | 56.8 | Low | 50.2 | Low | 27 Ų | 27 | 104.3 Ų | 104.3 | 18% | 0.182 | 60% | 0.602 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -125.1 | 156.6 | 173.8 | 31 | 0 | 0 | 0 | 0 | 109.6 | S60 G61 C63 | C3-S60 WeakPolarHBondContact O-CA 2.8Å; C3-G61 PolarHBondContact N-O 2.72Å; C3-G61 PolarHBondContact O-N 2.66Å; C3-G61 VanDerWaalsContact O-N 3.17Å; C3-C63 WeakPolarHBondContact CA-SG 3.46Å; C3-C63 HydrophobicContact CB-CB 4.14Å; C3-C63 WeakPolarHBondContact CB-SG 3.29Å; C3-C63 PolarHBondContact N-SG 3.31Å; C3-C63 WeakPolarHBondContact SG-CA 3.36Å; C3-C63 WeakPolarHBondContact SG-CB 3.2Å; C3-C63 PolarHBondContact SG-N 3.24Å; C3-C63 VanDerWaalsContact SG-N 3.36Å; C3-C63 CovalentContact SG-SG 2.03Å; C3-C63 PolarHBondContact SG-SG 2.78Å |
| 4 | V | 54.2 | Low | 49.5 | Very low | 100 Ų | 100 | 105.4 Ų | 105.4 | 61% | 0.606 | 62% | 0.619 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -123.3 | 117.8 | 173.5 | -177.7 | 0 | 0 | 0 | 0 | 105.8 | A58 | V4-A58 HydrophobicContact CG1-CB 4.13Å |
| 5 | T | 57.5 | Low | 48.8 | Very low | 30 Ų | 30 | 109.8 Ų | 109.8 | 18% | 0.184 | 64% | 0.639 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.3 | 131.6 | 168.8 | 50 | 0 | 0 | 0 | 0 | 108.9 | E7 T59 M66 I68 | T5-E7 PolarHBondContact O-N 2.77Å; T5-T59 PolarHBondContact N-O 3.29Å; T5-M66 HydrophobicContact CG2-SD 3.87Å; T5-I68 HydrophobicContact CG2-CD1 3.51Å; T5-I68 HydrophobicContact CG2-CG1 3.75Å; T5-I68 HydrophobicContact CG2-CG2 4.06Å |
| 6 | K | 52.5 | Low | 48.1 | Very low | 186 Ų | 186 | 106.8 Ų | 106.8 | 81% | 0.809 | 64% | 0.638 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -81.5 | 107.6 | 166.5 | -71.2 | -177.2 | 177.5 | 179.1 | 0 | 106.5 | ||
| 7 | E | 53.5 | Low | 47.4 | Very low | 86 Ų | 86 | 108.4 Ų | 108.4 | 40% | 0.402 | 64% | 0.643 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -77.7 | 133.2 | 169 | -59.6 | -167 | 127.8 | 0 | 0 | 107.8 | T5 R57 | T5-E7 PolarHBondContact O-N 2.77Å; E7-R57 HydrophobicContact CB-CB 4.36Å; E7-R57 PolarHBondContact N-O 3.17Å |
| 8 | S | 53.3 | Low | 47.2 | Very low | 98 Ų | 98 | 108.4 Ų | 108.4 | 69% | 0.685 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 143.7 | 167.4 | -65.8 | 0 | 0 | 0 | 0 | 108.1 | ||
| 9 | P | 54 | Low | 46.7 | Very low | 49 Ų | 49 | 109.5 Ų | 109.5 | 32% | 0.318 | 65% | 0.651 | S | S | . | * | P | Polyproline II helix | trans | -49.7 | 133.2 | 174.2 | 19.7 | -30.4 | 0 | 0 | 0 | 108.2 | T11 I54 | P9-T11 PolarHBondContact O-N 2.82Å; P9-I54 HydrophobicContact CB-CG2 4.19Å; P9-I54 HydrophobicContact CG-CG2 4.37Å |
| 10 | P | 51.7 | Low | 46.7 | Very low | 80 Ų | 80 | 109.1 Ų | 109.1 | 52% | 0.519 | 65% | 0.654 | S | S | . | * | trans | -53.4 | 114.3 | -175.4 | 19.6 | -30.7 | 0 | 0 | 0 | 107.9 | S12 | P10-S12 PolarHBondContact O-N 3.18Š| ||
| 11 | T | 45 | Very low | 46.4 | Very low | 127 Ų | 127 | 113 Ų | 113 | 78% | 0.779 | 66% | 0.663 | S | S | * | * | trans | -62 | 112.9 | 171 | 45.1 | 0 | 0 | 0 | 0 | 105.2 | P9 N13 | P9-T11 PolarHBondContact O-N 2.82Å; T11-N13 PolarHBondContact O-N 3.07Å | ||
| 12 | S | 38.5 | Very low | 46.1 | Very low | 108 Ų | 108 | 109.1 Ų | 109.1 | 76% | 0.755 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -52 | 123 | 175.7 | -59.4 | 0 | 0 | 0 | 0 | 108.1 | P10 | P10-S12 PolarHBondContact O-N 3.18Š|
| 13 | N | 35.7 | Very low | 45.6 | Very low | 149 Ų | 149 | 109.3 Ų | 109.3 | 80% | 0.797 | 65% | 0.647 | S | S | * | * | trans | 83.4 | 89.6 | 166.3 | -48.9 | -11.4 | 0 | 0 | 0 | 116.4 | T11 | T11-N13 PolarHBondContact O-N 3.07Š| ||
| 14 | S | 40.3 | Very low | 44.9 | Very low | 120 Ų | 120 | 117 Ų | 117 | 84% | 0.839 | 67% | 0.674 | S | S | * | * | trans | -137.6 | 99.3 | 136 | -84.4 | 0 | 0 | 0 | 0 | 108.9 | G16 | S14-G16 PolarHBondContact O-N 2.99Š| ||
| 15 | N | 39.6 | Very low | 44.1 | Very low | 171 Ų | 171 | 119.3 Ų | 119.3 | 91% | 0.914 | 68% | 0.683 | S | S | * | * | trans | -70.2 | 70.4 | 169.9 | -148.8 | 40.9 | 0 | 0 | 0 | 107.7 | N17 | N15-N17 PolarHBondContact O-N 2.89Š| ||
| 16 | G | 37.9 | Very low | 43.3 | Very low | 61 Ų | 61 | 124.2 Ų | 124.2 | 63% | 0.629 | 71% | 0.708 | S | S | * | * | trans | -76.7 | 87.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | S14 S18 | S14-G16 PolarHBondContact O-N 2.99Å; G16-S18 PolarHBondContact O-N 2.86Å | ||
| 17 | N | 36.2 | Very low | 42.6 | Very low | 135 Ų | 135 | 122.4 Ų | 122.4 | 72% | 0.722 | 71% | 0.707 | S | S | * | * | trans | -64.7 | 78.8 | 170.2 | -172.7 | 33.4 | 0 | 0 | 0 | 109.4 | N15 N19 | N15-N17 PolarHBondContact O-N 2.89Å; N17-N19 PolarHBondContact O-N 2.77Å | ||
| 18 | S | 42.5 | Very low | 41.9 | Very low | 108 Ų | 108 | 122.5 Ų | 122.5 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | trans | -76.1 | 78 | 174.2 | -69.3 | 0 | 0 | 0 | 0 | 109.3 | G16 S20 | G16-S18 PolarHBondContact O-N 2.86Å; S18-S20 PolarHBondContact O-N 2.83Å | ||
| 19 | N | 38.3 | Very low | 41.1 | Very low | 129 Ų | 129 | 126 Ų | 126 | 69% | 0.69 | 73% | 0.728 | S | S | * | * | trans | -77.1 | 65 | 175.1 | -147.5 | 15.7 | 0 | 0 | 0 | 109.4 | N17 | N17-N19 PolarHBondContact O-N 2.77Š| ||
| 20 | S | 46.2 | Very low | 40.2 | Very low | 101 Ų | 101 | 126.1 Ų | 126.1 | 71% | 0.706 | 74% | 0.738 | S | S | * | * | trans | -100.1 | 85.2 | 171.3 | 65.2 | 0 | 0 | 0 | 0 | 109.7 | S18 N22 | S18-S20 PolarHBondContact O-N 2.83Å; S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 3.06Å | ||
| 21 | K | 40.2 | Very low | 39.5 | Very low | 191 Ų | 191 | 132.4 Ų | 132.4 | 83% | 0.83 | 76% | 0.757 | S | S | * | * | trans | -62.2 | 87.7 | 160.1 | -75.1 | 177.8 | 178.8 | 174.8 | 0 | 108.7 | ||||
| 22 | N | 44.5 | Very low | 39.5 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 66% | 0.658 | 76% | 0.757 | S | S | * | * | trans | -120.3 | 94.1 | 162.8 | -100.3 | 11 | 0 | 0 | 0 | 108.9 | S20 Y24 | S20-N22 VanDerWaalsContact C-N 3.27Å; S20-N22 PolarHBondContact O-N 3.06Å; N22-Y24 HydrophobicContact CB-CD2 4.13Å; N22-Y24 HydrophobicContact CB-CE2 4.21Å; N22-Y24 PolarHBondContact O-N 3.21Å; N22-Y24 VanDerWaalsContact O-N 3.09Å | ||
| 23 | S | 39.2 | Very low | 39.3 | Very low | 116 Ų | 116 | 129.4 Ų | 129.4 | 81% | 0.811 | 75% | 0.751 | S | S | * | * | trans | -62.8 | 97.9 | 164.3 | -176.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 24 | Y | 41.9 | Very low | 39.7 | Very low | 190 Ų | 190 | 126.3 Ų | 126.3 | 75% | 0.745 | 74% | 0.742 | S | S | * | * | trans | -111.2 | 88.7 | 160.7 | -81.7 | -79.7 | 0 | 0 | 0 | 108.1 | N22 N26 | N22-Y24 HydrophobicContact CB-CD2 4.13Å; N22-Y24 HydrophobicContact CB-CE2 4.21Å; N22-Y24 PolarHBondContact O-N 3.21Å; N22-Y24 VanDerWaalsContact O-N 3.09Å; Y24-N26 VanDerWaalsContact C-N 3.31Å; Y24-N26 PolarHBondContact O-N 3.23Å | ||
| 25 | N | 37.3 | Very low | 39.9 | Very low | 147 Ų | 147 | 125.4 Ų | 125.4 | 79% | 0.786 | 73% | 0.734 | S | S | * | * | trans | -61.4 | 91.3 | 160.7 | 179.7 | 20.6 | 0 | 0 | 0 | 108.2 | ||||
| 26 | N | 41.9 | Very low | 40.3 | Very low | 133 Ų | 133 | 124.4 Ų | 124.4 | 71% | 0.711 | 72% | 0.724 | S | S | * | * | trans | -106.3 | 89.2 | 174.1 | -153 | -6.6 | 0 | 0 | 0 | 109.1 | Y24 S28 | Y24-N26 VanDerWaalsContact C-N 3.31Å; Y24-N26 PolarHBondContact O-N 3.23Å; N26-S28 PolarHBondContact O-N 3.42Å; N26-S28 PolarHBondContact OD1-OG 2.8Å | ||
| 27 | N | 37.7 | Very low | 41 | Very low | 149 Ų | 149 | 125.5 Ų | 125.5 | 80% | 0.797 | 72% | 0.718 | S | S | * | * | trans | -69.7 | 78.2 | 171.9 | -161.4 | 31.4 | 0 | 0 | 0 | 108.6 | ||||
| 28 | S | 38.2 | Very low | 42 | Very low | 88 Ų | 88 | 127 Ų | 127 | 62% | 0.615 | 72% | 0.721 | S | S | * | * | trans | -116.7 | 101.9 | 174.5 | -76 | 0 | 0 | 0 | 0 | 108.8 | N26 G30 | N26-S28 PolarHBondContact O-N 3.42Å; N26-S28 PolarHBondContact OD1-OG 2.8Å; S28-G30 PolarHBondContact O-N 2.89Å | ||
| 29 | N | 35.7 | Very low | 43 | Very low | 171 Ų | 171 | 124.5 Ų | 124.5 | 91% | 0.914 | 71% | 0.707 | S | S | * | * | trans | -67.3 | 39.2 | 173.4 | -126 | 18.9 | 0 | 0 | 0 | 112.1 | ||||
| 30 | G | 36.2 | Very low | 44.4 | Very low | 51 Ų | 51 | 122 Ų | 122 | 53% | 0.526 | 70% | 0.696 | S | S | . | * | trans | -77.6 | 125.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 107.2 | S28 S32 | S28-G30 PolarHBondContact O-N 2.89Å; G30-S32 PolarHBondContact O-N 2.9Å | ||
| 31 | K | 36.6 | Very low | 45.6 | Very low | 213 Ų | 213 | 120.9 Ų | 120.9 | 93% | 0.926 | 69% | 0.685 | S | S | * | * | trans | -57.1 | 76.8 | 162.2 | -71.2 | 171.8 | 176.3 | 172.8 | 0 | 108 | G33 | K31-G33 PolarHBondContact O-N 2.81Š| ||
| 32 | S | 44.3 | Very low | 47.3 | Very low | 110 Ų | 110 | 115.5 Ų | 115.5 | 77% | 0.769 | 67% | 0.669 | S | S | * | * | trans | -71.4 | 85.6 | 168.5 | 54 | 0 | 0 | 0 | 0 | 104 | G30 S34 | G30-S32 PolarHBondContact O-N 2.9Å; S32-S34 VanDerWaalsContact C-N 3.29Å; S32-S34 PolarHBondContact O-N 2.78Å | ||
| 33 | G | 36 | Very low | 48.9 | Very low | 62 Ų | 62 | 114.1 Ų | 114.1 | 64% | 0.639 | 66% | 0.664 | S | S | * | * | trans | -46.9 | 110.6 | 159 | 0 | 0 | 0 | 0 | 0 | 104.5 | K31 C35 | K31-G33 PolarHBondContact O-N 2.81Å; G33-C35 PolarHBondContact O-N 3.19Å | ||
| 34 | S | 42.5 | Very low | 51 | Low | 84 Ų | 84 | 112.5 Ų | 112.5 | 59% | 0.587 | 65% | 0.65 | S | S | * | * | trans | -65.5 | 85.3 | 167.5 | -178.5 | 0 | 0 | 0 | 0 | 103.7 | S32 H36 | S32-S34 VanDerWaalsContact C-N 3.29Å; S32-S34 PolarHBondContact O-N 2.78Å; S34-H36 PolarHBondContact O-N 3.36Å; S34-H36 PolarHBondContact OG-CE1 3.2Å; S34-H36 VanDerWaalsContact OG-CE1 3.31Å; S34-H36 PolarHBondContact OG-ND1 2.03Å | ||
| 35 | C | 44.6 | Very low | 52.8 | Low | 101 Ų | 101 | 107.5 Ų | 107.5 | 68% | 0.682 | 64% | 0.639 | S | S | * | * | trans | -56.1 | 89.8 | 148.5 | -64.5 | 0 | 0 | 0 | 0 | 101.8 | G33 T37 | G33-C35 PolarHBondContact O-N 3.19Å; C35-T37 HydrophobicContact CB-CG2 4.48Å; C35-T37 PolarHBondContact O-N 2.93Å | ||
| 36 | H | 48.7 | Very low | 54.9 | Low | 150 Ų | 150 | 103.3 Ų | 103.3 | 69% | 0.694 | 62% | 0.619 | S | S | * | * | trans | -58.4 | 87.2 | 162.2 | -85.9 | 79.1 | 0 | 0 | 0 | 103 | S34 Q38 | S34-H36 PolarHBondContact O-N 3.36Å; S34-H36 PolarHBondContact OG-CE1 3.2Å; S34-H36 VanDerWaalsContact OG-CE1 3.31Å; S34-H36 PolarHBondContact OG-ND1 2.03Å; H36-Q38 PolarHBondContact O-N 3.39Å | ||
| 37 | T | 53.2 | Low | 56.9 | Low | 84 Ų | 84 | 106.8 Ų | 106.8 | 52% | 0.515 | 62% | 0.622 | S | S | . | * | trans | -66.6 | 91.7 | 171.9 | 33.8 | 0 | 0 | 0 | 0 | 103.5 | C35 A39 L65 | C35-T37 HydrophobicContact CB-CG2 4.48Å; C35-T37 PolarHBondContact O-N 2.93Å; T37-A39 PolarHBondContact O-N 2.85Å; T37-L65 HydrophobicContact CG2-CB 4.16Å; T37-L65 HydrophobicContact CG2-CD1 3.36Å; T37-L65 HydrophobicContact CG2-CG 4.36Å | ||
| 38 | Q | 56.9 | Low | 59 | Low | 166 Ų | 166 | 102.6 Ų | 102.6 | 78% | 0.776 | 60% | 0.599 | S | S | * | * | trans | -68.3 | 84.5 | 177 | -68.4 | -176.7 | 62.5 | 0 | 0 | 106.4 | H36 T40 | H36-Q38 PolarHBondContact O-N 3.39Å; Q38-T40 PolarHBondContact O-N 3.16Å | ||
| 39 | A | 64.1 | Low | 61.1 | Low | 56 Ų | 56 | 110.3 Ų | 110.3 | 46% | 0.463 | 62% | 0.615 | S | S | . | * | trans | -71.7 | 107.6 | 161.1 | 0 | 0 | 0 | 0 | 0 | 105.8 | T37 T41 T59 S60 | T37-A39 PolarHBondContact O-N 2.85Å; A39-T41 PolarHBondContact O-N 3.04Å; A39-T59 HydrophobicContact CB-CG2 3.81Å; A39-S60 CarbonylContact C-O 3.57Å; A39-S60 VanDerWaalsContact CA-O 3.29Å; A39-S60 WeakPolarHBondContact CA-O 3.49Å | ||
| 40 | T | 65.7 | Low | 63.7 | Low | 76 Ų | 76 | 109.5 Ų | 109.5 | 47% | 0.466 | 61% | 0.611 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -84.2 | 113.2 | 175.6 | -56.4 | 0 | 0 | 0 | 0 | 107.5 | Q38 T42 S60 | Q38-T40 PolarHBondContact O-N 3.16Å; T40-T42 HydrophobicContact CG2-CG2 4.3Å; T40-S60 PolarHBondContact N-O 2.83Å; T40-S60 PolarHBondContact O-N 2.77Å; T40-S60 PolarHBondContact O-OG 3.02Å; T40-S60 VanDerWaalsContact O-OG 3.13Å |
| 41 | T | 72.7 | Confident | 66 | Low | 77 Ų | 77 | 109.3 Ų | 109.3 | 47% | 0.472 | 61% | 0.609 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.2 | 121.7 | 172.9 | -56.6 | 0 | 0 | 0 | 0 | 108.6 | A39 A58 T59 | A39-T41 PolarHBondContact O-N 3.04Å; T41-A58 WeakPolarHBondContact CA-O 3.27Å; T41-T59 PolarHBondContact OG1-OG1 3.09Å |
| 42 | T | 74.6 | Confident | 68.4 | Low | 79 Ų | 79 | 100.7 Ų | 100.7 | 49% | 0.485 | 58% | 0.58 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107.5 | 137.3 | 172.2 | 56.2 | 0 | 0 | 0 | 0 | 109.3 | T40 R57 A58 | T40-T42 HydrophobicContact CG2-CG2 4.3Å; T42-R57 WeakPolarHBondContact O-CA 2.88Å; T42-A58 PolarHBondContact N-O 3.13Å; T42-A58 PolarHBondContact O-N 2.89Å; T42-A58 PolarHBondContact OG1-O 2.88Å |
| 43 | T | 78.8 | Confident | 70.4 | Confident | 93 Ų | 93 | 102.2 Ų | 102.2 | 57% | 0.571 | 58% | 0.575 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -114.3 | 128.5 | 176 | 59.5 | 0 | 0 | 0 | 0 | 108.6 | W56 R57 | T43-W56 CarbonylContact C-O 3.48Å; T43-W56 VanDerWaalsContact CA-O 3.32Å; T43-W56 WeakPolarHBondContact CA-O 3.04Å; T43-R57 HydrophobicContact CG2-CG 4.05Å |
| 44 | T | 82.6 | Confident | 72.7 | Confident | 82 Ų | 82 | 101.8 Ų | 101.8 | 50% | 0.503 | 56% | 0.557 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -124.7 | 130.4 | 174.8 | -173.5 | 0 | 0 | 0 | 0 | 109.5 | W56 | T44-W56 HydrophobicContact CG2-CB 3.77Å; T44-W56 PolarHBondContact N-O 3.45Å; T44-W56 PolarHBondContact O-N 3.05Å |
| 45 | T | 81 | Confident | 74.6 | Confident | 86 Ų | 86 | 100 Ų | 100 | 53% | 0.528 | 54% | 0.543 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 126.1 | 174.5 | 49.3 | 0 | 0 | 0 | 0 | 108.6 | E53 T55 | T45-E53 HydrophobicContact CG2-CG 4.23Å; T45-T55 HydrophobicContact CG2-CG2 4.45Å |
| 46 | V | 81.8 | Confident | 76 | Confident | 58 Ų | 58 | 100.2 Ų | 100.2 | 35% | 0.352 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 164.3 | 171.5 | -53.2 | 0 | 0 | 0 | 0 | 108.4 | I54 W56 | V46-I54 HydrophobicContact CG2-CB 3.91Å; V46-I54 HydrophobicContact CG2-CG2 4.44Å; V46-I54 PolarHBondContact N-O 3.21Å; V46-I54 PolarHBondContact O-N 3Å; V46-W56 VanDerWaalsContact CG2-CD1 3.47Å; V46-W56 VanDerWaalsContact CG2-NE1 3.33Å |
| 47 | R | 82.8 | Confident | 77.2 | Confident | 207 Ų | 207 | 98.6 Ų | 98.6 | 78% | 0.781 | 52% | 0.517 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 141.1 | 171.2 | -74.6 | -173.2 | -99.4 | -178.9 | -6.1 | 110.4 | G52 | R47-G52 CarbonylContact C-O 3.49Å; R47-G52 VanDerWaalsContact CA-O 3.27Å; R47-G52 WeakPolarHBondContact CA-O 3.21Å |
| 48 | D | 81.6 | Confident | 78 | Confident | 60 Ų | 60 | 95.8 Ų | 95.8 | 32% | 0.321 | 50% | 0.503 | S | S | . | . | trans | -71.9 | 176.6 | 169 | 77.5 | 18.7 | 0 | 0 | 0 | 110.9 | N50 G51 G52 I54 | D48-N50 PolarHBondContact O-N 2.96Å; D48-N50 WeakPolarHBondContact OD1-CA 3.48Å; D48-N50 WeakPolarHBondContact OD1-CB 3.32Å; D48-N50 PolarHBondContact OD1-N 3.33Å; D48-G51 PolarHBondContact O-N 3.43Å; D48-G51 PolarHBondContact OD1-N 3.24Å; D48-G52 PolarHBondContact N-O 2.94Å; D48-G52 PolarHBondContact OD1-N 3.31Å; D48-I54 HydrophobicContact CB-CD1 3.61Å; D48-I54 HydrophobicContact CB-CG1 4.13Å | ||
| 49 | R | 83.2 | Confident | 78.7 | Confident | 250 Ų | 250 | 88.8 Ų | 88.8 | 94% | 0.943 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -17.1 | -179.5 | -64.2 | -177.4 | -179.1 | 170.3 | 0.2 | 113.8 | ||
| 50 | N | 89.9 | Confident | 78.8 | Confident | 155 Ų | 155 | 88 Ų | 88 | 83% | 0.829 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.3 | 1.4 | 179.4 | -56 | -31.2 | 0 | 0 | 0 | 112.1 | D48 | D48-N50 PolarHBondContact O-N 2.96Å; D48-N50 WeakPolarHBondContact OD1-CA 3.48Å; D48-N50 WeakPolarHBondContact OD1-CB 3.32Å; D48-N50 PolarHBondContact OD1-N 3.33Å |
| 51 | G | 84.6 | Confident | 78.9 | Confident | 47 Ų | 47 | 85 Ų | 85 | 49% | 0.485 | 45% | 0.447 | S | S | . | . | S | Bend | trans | 86.9 | 2.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | D48 | D48-G51 PolarHBondContact O-N 3.43Å; D48-G51 PolarHBondContact OD1-N 3.24Å |
| 52 | G | 86.7 | Confident | 78.4 | Confident | 31 Ų | 31 | 85.5 Ų | 85.5 | 32% | 0.32 | 45% | 0.447 | S | S | . | . | trans | -69.2 | 140.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | R47 D48 | R47-G52 CarbonylContact C-O 3.49Å; R47-G52 VanDerWaalsContact CA-O 3.27Å; R47-G52 WeakPolarHBondContact CA-O 3.21Å; D48-G52 PolarHBondContact N-O 2.94Å; D48-G52 PolarHBondContact OD1-N 3.31Å | ||
| 53 | E | 87.6 | Confident | 77.7 | Confident | 143 Ų | 143 | 83.9 Ų | 83.9 | 67% | 0.668 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 129.4 | 177.4 | -169.7 | 174.6 | 105.7 | 0 | 0 | 110.9 | T45 | T45-E53 HydrophobicContact CG2-CG 4.23Å |
| 54 | I | 82.9 | Confident | 76.6 | Confident | 52 Ų | 52 | 82.9 Ų | 82.9 | 27% | 0.267 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 118.9 | 172.3 | -58.2 | 175.8 | 0 | 0 | 0 | 108.2 | P9 V46 D48 | P9-I54 HydrophobicContact CB-CG2 4.19Å; P9-I54 HydrophobicContact CG-CG2 4.37Å; V46-I54 HydrophobicContact CG2-CB 3.91Å; V46-I54 HydrophobicContact CG2-CG2 4.44Å; V46-I54 PolarHBondContact N-O 3.21Å; V46-I54 PolarHBondContact O-N 3Å; D48-I54 HydrophobicContact CB-CD1 3.61Å; D48-I54 HydrophobicContact CB-CG1 4.13Å |
| 55 | T | 83.1 | Confident | 75.2 | Confident | 47 Ų | 47 | 84.2 Ų | 84.2 | 29% | 0.288 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 115.7 | 174.7 | -58.3 | 0 | 0 | 0 | 0 | 110.2 | T45 | T45-T55 HydrophobicContact CG2-CG2 4.45Å |
| 56 | W | 74.3 | Confident | 74.1 | Confident | 105 Ų | 105 | 81.7 Ų | 81.7 | 40% | 0.398 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94 | 141.3 | 171.4 | -68.5 | 83.1 | 0 | 0 | 0 | 110.3 | T43 T44 V46 | T43-W56 CarbonylContact C-O 3.48Å; T43-W56 VanDerWaalsContact CA-O 3.32Å; T43-W56 WeakPolarHBondContact CA-O 3.04Å; T44-W56 HydrophobicContact CG2-CB 3.77Å; T44-W56 PolarHBondContact N-O 3.45Å; T44-W56 PolarHBondContact O-N 3.05Å; V46-W56 VanDerWaalsContact CG2-CD1 3.47Å; V46-W56 VanDerWaalsContact CG2-NE1 3.33Å |
| 57 | R | 74.3 | Confident | 72.7 | Confident | 116 Ų | 116 | 86.7 Ų | 86.7 | 44% | 0.438 | 46% | 0.457 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 134.9 | 173.7 | -57.4 | -167.9 | 172.9 | 179.8 | -2.4 | 109 | E7 T42 T43 | E7-R57 HydrophobicContact CB-CB 4.36Å; E7-R57 PolarHBondContact N-O 3.17Å; T42-R57 WeakPolarHBondContact O-CA 2.88Å; T43-R57 HydrophobicContact CG2-CG 4.05Å |
| 58 | A | 69.5 | Low | 71.3 | Confident | 25 Ų | 25 | 80.6 Ų | 80.6 | 21% | 0.207 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 124.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | V4 T41 T42 | V4-A58 HydrophobicContact CG1-CB 4.13Å; T41-A58 WeakPolarHBondContact CA-O 3.27Å; T42-A58 PolarHBondContact N-O 3.13Å; T42-A58 PolarHBondContact O-N 2.89Å; T42-A58 PolarHBondContact OG1-O 2.88Å |
| 59 | T | 71.1 | Confident | 70 | Confident | 19 Ų | 19 | 83.3 Ų | 83.3 | 12% | 0.117 | 46% | 0.46 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 124.6 | 174 | -58.2 | 0 | 0 | 0 | 0 | 108.1 | T5 A39 T41 | T5-T59 PolarHBondContact N-O 3.29Å; A39-T59 HydrophobicContact CB-CG2 3.81Å; T41-T59 PolarHBondContact OG1-OG1 3.09Å |
| 60 | S | 66.7 | Low | 68.4 | Low | 40 Ų | 40 | 84.1 Ų | 84.1 | 28% | 0.28 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 138.3 | 177.6 | 63.5 | 0 | 0 | 0 | 0 | 109.9 | C3 A39 T40 | C3-S60 WeakPolarHBondContact O-CA 2.8Å; A39-S60 CarbonylContact C-O 3.57Å; A39-S60 VanDerWaalsContact CA-O 3.29Å; A39-S60 WeakPolarHBondContact CA-O 3.49Å; T40-S60 PolarHBondContact N-O 2.83Å; T40-S60 PolarHBondContact O-N 2.77Å; T40-S60 PolarHBondContact O-OG 3.02Å; T40-S60 VanDerWaalsContact O-OG 3.13Å |
| 61 | G | 66.9 | Low | 67.3 | Low | 13 Ų | 13 | 80.6 Ų | 80.6 | 13% | 0.134 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 177.1 | -176.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | C3 C63 M66 | C3-G61 PolarHBondContact N-O 2.72Å; C3-G61 PolarHBondContact O-N 2.66Å; C3-G61 VanDerWaalsContact O-N 3.17Å; G61-C63 PolarHBondContact O-N 2.74Å; G61-M66 VanDerWaalsContact CA-CE 3.41Å |
| 62 | N | 63.1 | Low | 66.4 | Low | 87 Ų | 87 | 82.3 Ų | 82.3 | 47% | 0.465 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.4 | 121.9 | 178.1 | -174.6 | -17.4 | 0 | 0 | 0 | 110.7 | G64 L65 M66 | N62-G64 VanDerWaalsContact C-N 3.32Å; N62-G64 PolarHBondContact O-N 2.91Å; N62-G64 PolarHBondContact OD1-N 2.79Å; N62-L65 HydrophobicContact CB-CD1 4.44Å; N62-L65 PolarHBondContact O-N 2.83Å; N62-M66 PolarHBondContact O-N 2.85Å |
| 63 | C | 59.8 | Low | 65.3 | Low | 46 Ų | 46 | 85.2 Ų | 85.2 | 31% | 0.311 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -31.9 | -172.8 | -48.1 | 0 | 0 | 0 | 0 | 115.1 | S2 C3 G61 L65 | S2-C63 VanDerWaalsContact C-SG 3.57Å; C3-C63 WeakPolarHBondContact CA-SG 3.46Å; C3-C63 HydrophobicContact CB-CB 4.14Å; C3-C63 WeakPolarHBondContact CB-SG 3.29Å; C3-C63 PolarHBondContact N-SG 3.31Å; C3-C63 WeakPolarHBondContact SG-CA 3.36Å; C3-C63 WeakPolarHBondContact SG-CB 3.2Å; C3-C63 PolarHBondContact SG-N 3.24Å; C3-C63 VanDerWaalsContact SG-N 3.36Å; C3-C63 CovalentContact SG-SG 2.03Å; C3-C63 PolarHBondContact SG-SG 2.78Å; G61-C63 PolarHBondContact O-N 2.74Å; C63-L65 PolarHBondContact O-N 2.69Å |
| 64 | G | 55.3 | Low | 64 | Low | 72 Ų | 72 | 81.8 Ų | 81.8 | 74% | 0.742 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -14 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | N62 | N62-G64 VanDerWaalsContact C-N 3.32Å; N62-G64 PolarHBondContact O-N 2.91Å; N62-G64 PolarHBondContact OD1-N 2.79Å |
| 65 | L | 53 | Low | 62.8 | Low | 109 Ų | 109 | 83.6 Ų | 83.6 | 57% | 0.571 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.5 | -9.8 | -174.3 | -55.7 | 175.3 | 0 | 0 | 0 | 112.5 | T37 N62 C63 N67 | T37-L65 HydrophobicContact CG2-CB 4.16Å; T37-L65 HydrophobicContact CG2-CD1 3.36Å; T37-L65 HydrophobicContact CG2-CG 4.36Å; N62-L65 HydrophobicContact CB-CD1 4.44Å; N62-L65 PolarHBondContact O-N 2.83Å; C63-L65 PolarHBondContact O-N 2.69Å; L65-N67 PolarHBondContact O-N 3.31Å |
| 66 | M | 57.3 | Low | 61.4 | Low | 34 Ų | 34 | 86.1 Ų | 86.1 | 17% | 0.167 | 47% | 0.474 | C | S | . | . | trans | -78.7 | 112.2 | 175.3 | -160.3 | 177.3 | -61.9 | 0 | 0 | 107 | T5 G61 N62 I68 | T5-M66 HydrophobicContact CG2-SD 3.87Å; G61-M66 VanDerWaalsContact CA-CE 3.41Å; N62-M66 PolarHBondContact O-N 2.85Å; M66-I68 HydrophobicContact CB-CD1 4.3Å; M66-I68 HydrophobicContact CB-CG1 3.95Å; M66-I68 HydrophobicContact CG-CD1 4.36Å; M66-I68 HydrophobicContact CG-CG1 3.78Å; M66-I68 PolarHBondContact O-N 3.01Å; M66-I68 HydrophobicContact SD-CD1 4.15Å; M66-I68 HydrophobicContact SD-CG1 4.04Å | ||
| 67 | N | 54 | Low | 60.5 | Low | 162 Ų | 162 | 84.7 Ų | 84.7 | 87% | 0.866 | 48% | 0.479 | S | S | * | . | trans | -73 | 72.2 | 177.3 | -160 | 56.4 | 0 | 0 | 0 | 108.7 | L65 P69 | L65-N67 PolarHBondContact O-N 3.31Å; N67-P69 WeakPolarHBondContact O-CD 3.36Å | ||
| 68 | I | 53.2 | Low | 59.4 | Low | 79 Ų | 79 | 82.3 Ų | 82.3 | 41% | 0.405 | 48% | 0.483 | S | S | . | . | trans | -77.2 | 111.3 | 178.4 | -53.1 | 172.3 | 0 | 0 | 0 | 106.1 | T5 M66 Q70 | T5-I68 HydrophobicContact CG2-CD1 3.51Å; T5-I68 HydrophobicContact CG2-CG1 3.75Å; T5-I68 HydrophobicContact CG2-CG2 4.06Å; M66-I68 HydrophobicContact CB-CD1 4.3Å; M66-I68 HydrophobicContact CB-CG1 3.95Å; M66-I68 HydrophobicContact CG-CD1 4.36Å; M66-I68 HydrophobicContact CG-CG1 3.78Å; M66-I68 PolarHBondContact O-N 3.01Å; M66-I68 HydrophobicContact SD-CD1 4.15Å; M66-I68 HydrophobicContact SD-CG1 4.04Å; I68-Q70 PolarHBondContact O-N 2.64Å | ||
| 69 | P | 52.4 | Low | 58.6 | Low | 118 Ų | 118 | 87.1 Ų | 87.1 | 77% | 0.766 | 51% | 0.506 | S | S | * | . | trans | -58.9 | 124.7 | 169.4 | 23.7 | -29.7 | 0 | 0 | 0 | 108.1 | N67 | N67-P69 WeakPolarHBondContact O-CD 3.36Š| ||
| 70 | Q | 50.2 | Low | 57.5 | Low | 266 Ų | 266 | 93.3 Ų | 93.3 | 100% | 1.243 | 54% | 0.541 | S | S | * | . | trans | -72.3 | 0 | 175.8 | -64.9 | -143.2 | -31.7 | 0 | 0 | 111.5 | I68 | I68-Q70 PolarHBondContact O-N 2.64Š|
Retrieved 70 of 70 residues in 12.4 ms
(Link to these results)