| 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 | 40 | Very low | 65.2 | Low | 242 Ų | 242 | 124.4 Ų | 124.4 | 100% | 1.192 | 69% | 0.694 | S | S | * | * | 0 | 90.7 | 0 | -156.9 | 153.9 | -167.8 | 0 | 0 | 105.5 | |||||
| 2 | E | 45.3 | Very low | 67 | Low | 179 Ų | 179 | 123.2 Ų | 123.2 | 84% | 0.836 | 68% | 0.684 | S | S | * | * | trans | -91.9 | 117.9 | -171.2 | -67.1 | 179 | 154.6 | 0 | 0 | 108.5 | L4 | E2-L4 PolarHBondContact O-N 3.46Š| ||
| 3 | C | 53 | Low | 68.4 | Low | 130 Ų | 130 | 122.4 Ų | 122.4 | 88% | 0.878 | 67% | 0.672 | S | S | * | * | trans | -70.4 | 95.4 | 172.1 | -59.8 | 0 | 0 | 0 | 0 | 107.9 | G5 | C3-G5 PolarHBondContact O-N 2.77Š| ||
| 4 | L | 57.9 | Low | 69.6 | Low | 159 Ų | 159 | 117.4 Ų | 117.4 | 83% | 0.832 | 66% | 0.656 | S | S | * | * | trans | -68.5 | 86.6 | 169 | -70.3 | 169 | 0 | 0 | 0 | 108.1 | E2 V6 | E2-L4 PolarHBondContact O-N 3.46Å; L4-V6 PolarHBondContact O-N 3.36Å | ||
| 5 | G | 58.5 | Low | 70.5 | Confident | 70 Ų | 70 | 115.7 Ų | 115.7 | 72% | 0.722 | 64% | 0.644 | S | S | * | * | trans | -62.3 | 116 | 172 | 0 | 0 | 0 | 0 | 0 | 109.3 | C3 S7 | C3-G5 PolarHBondContact O-N 2.77Å; G5-S7 PolarHBondContact O-N 3.39Å | ||
| 6 | V | 62 | Low | 71.4 | Confident | 94 Ų | 94 | 112.3 Ų | 112.3 | 57% | 0.57 | 63% | 0.63 | S | S | * | * | trans | -53 | 123.3 | 166.3 | -177.9 | 0 | 0 | 0 | 0 | 106.9 | L4 S8 Q10 | L4-V6 PolarHBondContact O-N 3.36Å; V6-S8 PolarHBondContact O-N 3.31Å; V6-Q10 HydrophobicContact CG1-CB 3.73Å | ||
| 7 | S | 70.8 | Confident | 72.2 | Confident | 66 Ų | 66 | 110.1 Ų | 110.1 | 46% | 0.462 | 63% | 0.63 | S | S | . | * | trans | -59 | 139.6 | -177.3 | 134 | 0 | 0 | 0 | 0 | 109.4 | G5 Y9 Q10 | G5-S7 PolarHBondContact O-N 3.39Å; S7-Y9 PolarHBondContact O-N 2.96Å; S7-Q10 PolarHBondContact O-N 3.44Å; S7-Q10 PolarHBondContact O-OE1 2.93Å; S7-Q10 PolarHBondContact OG-OE1 2.97Å | ||
| 8 | S | 76 | Confident | 72.9 | Confident | 88 Ų | 88 | 112 Ų | 112 | 62% | 0.615 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -47.4 | -33.9 | -176.7 | 178 | 0 | 0 | 0 | 0 | 113 | V6 N11 L12 | V6-S8 PolarHBondContact O-N 3.31Å; S8-N11 PolarHBondContact O-N 2.75Å; S8-L12 PolarHBondContact O-N 3.16Å; S8-L12 VanDerWaalsContact O-N 3.09Å |
| 9 | Y | 81.1 | Confident | 73.5 | Confident | 155 Ų | 155 | 113.1 Ų | 113.1 | 61% | 0.608 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -60.9 | -45.3 | 177.4 | -174.9 | -97.9 | 0 | 0 | 0 | 113.7 | S7 N11 L12 Q13 | S7-Y9 PolarHBondContact O-N 2.96Å; Y9-N11 VanDerWaalsContact C-N 3.29Å; Y9-N11 PolarHBondContact O-N 2.77Å; Y9-L12 PolarHBondContact O-N 3.44Å; Y9-Q13 PolarHBondContact O-N 2.91Å; Y9-Q13 VanDerWaalsContact O-N 3.09Å |
| 10 | Q | 84.3 | Confident | 73.9 | Confident | 100 Ų | 100 | 111.6 Ų | 111.6 | 47% | 0.467 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -66.1 | -34.3 | 178.9 | -73.5 | 85.9 | -3.6 | 0 | 0 | 111.7 | V6 S7 Q13 A14 | V6-Q10 HydrophobicContact CG1-CB 3.73Å; S7-Q10 PolarHBondContact O-N 3.44Å; S7-Q10 PolarHBondContact O-OE1 2.93Å; S7-Q10 PolarHBondContact OG-OE1 2.97Å; Q10-Q13 PolarHBondContact O-N 3.01Å; Q10-A14 PolarHBondContact O-N 2.91Å |
| 11 | N | 88.3 | Confident | 73.8 | Confident | 85 Ų | 85 | 112.5 Ų | 112.5 | 46% | 0.455 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -66.5 | -41.6 | 175.6 | -73.7 | -44.5 | 0 | 0 | 0 | 111.9 | S8 Y9 Q13 A14 L15 | S8-N11 PolarHBondContact O-N 2.75Å; Y9-N11 VanDerWaalsContact C-N 3.29Å; Y9-N11 PolarHBondContact O-N 2.77Å; N11-Q13 VanDerWaalsContact C-N 3.32Å; N11-Q13 PolarHBondContact O-N 2.72Å; N11-A14 PolarHBondContact O-N 2.86Å; N11-L15 PolarHBondContact O-N 3.4Å |
| 12 | L | 86.3 | Confident | 74.8 | Confident | 110 Ų | 110 | 109.2 Ų | 109.2 | 58% | 0.576 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -63.4 | -38.3 | 176 | -78.6 | 164.9 | 0 | 0 | 0 | 112.2 | S8 Y9 L15 S16 | S8-L12 PolarHBondContact O-N 3.16Å; S8-L12 VanDerWaalsContact O-N 3.09Å; Y9-L12 PolarHBondContact O-N 3.44Å; L12-L15 PolarHBondContact O-N 2.81Å; L12-S16 PolarHBondContact O-N 3.3Å |
| 13 | Q | 85.4 | Confident | 75.2 | Confident | 113 Ų | 113 | 109.3 Ų | 109.3 | 53% | 0.528 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -70.8 | -36.8 | 178.1 | -167.4 | 172.1 | -2.8 | 0 | 0 | 112.6 | Y9 Q10 N11 S16 A17 | Y9-Q13 PolarHBondContact O-N 2.91Å; Y9-Q13 VanDerWaalsContact O-N 3.09Å; Q10-Q13 PolarHBondContact O-N 3.01Å; N11-Q13 VanDerWaalsContact C-N 3.32Å; N11-Q13 PolarHBondContact O-N 2.72Å; Q13-S16 PolarHBondContact O-N 2.97Å; Q13-S16 PolarHBondContact O-OG 3.12Å; Q13-S16 VanDerWaalsContact O-OG 3.06Å; Q13-A17 PolarHBondContact O-N 2.68Å |
| 14 | A | 85.5 | Confident | 75.2 | Confident | 53 Ų | 53 | 110.8 Ų | 110.8 | 44% | 0.438 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -64.3 | -42.1 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q10 N11 A17 L18 | Q10-A14 PolarHBondContact O-N 2.91Å; N11-A14 PolarHBondContact O-N 2.86Å; A14-A17 PolarHBondContact O-N 3.11Å; A14-L18 PolarHBondContact O-N 3.16Å; A14-L18 VanDerWaalsContact O-N 3.16Å |
| 15 | L | 83.9 | Confident | 74.6 | Confident | 92 Ų | 92 | 111 Ų | 111 | 48% | 0.482 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.9 | -42.1 | 175.9 | -91.4 | 158.9 | 0 | 0 | 0 | 112.6 | N11 L12 A17 L18 L19 | N11-L15 PolarHBondContact O-N 3.4Å; L12-L15 PolarHBondContact O-N 2.81Å; L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 2.82Å; L15-L18 PolarHBondContact O-N 3.08Å; L15-L19 HydrophobicContact CD2-CD1 4.27Å; L15-L19 WeakPolarHBondContact O-CB 3.12Å; L15-L19 WeakPolarHBondContact O-CG 3.22Å; L15-L19 PolarHBondContact O-N 2.9Å |
| 16 | S | 84.4 | Confident | 74 | Confident | 61 Ų | 61 | 115.3 Ų | 115.3 | 43% | 0.427 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -64.7 | -35.8 | 179.4 | 74.6 | 0 | 0 | 0 | 0 | 112.3 | L12 Q13 S20 | L12-S16 PolarHBondContact O-N 3.3Å; Q13-S16 PolarHBondContact O-N 2.97Å; Q13-S16 PolarHBondContact O-OG 3.12Å; Q13-S16 VanDerWaalsContact O-OG 3.06Å; S16-S20 VanDerWaalsContact O-CB 3.23Å; S16-S20 WeakPolarHBondContact O-CB 3.33Å; S16-S20 PolarHBondContact O-N 2.87Å; S16-S20 PolarHBondContact O-OG 3.05Å |
| 17 | A | 84.2 | Confident | 73.1 | Confident | 75 Ų | 75 | 119.2 Ų | 119.2 | 62% | 0.62 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -68.1 | -36.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q13 A14 L15 | Q13-A17 PolarHBondContact O-N 2.68Å; A14-A17 PolarHBondContact O-N 3.11Å; L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 2.82Å |
| 18 | L | 84.8 | Confident | 72 | Confident | 144 Ų | 144 | 123.7 Ų | 123.7 | 75% | 0.754 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -70.7 | -38.9 | 175.7 | -87.2 | 150.6 | 0 | 0 | 0 | 112.8 | A14 L15 | A14-L18 PolarHBondContact O-N 3.16Å; A14-L18 VanDerWaalsContact O-N 3.16Å; L15-L18 PolarHBondContact O-N 3.08Å |
| 19 | L | 85.8 | Confident | 70.5 | Confident | 132 Ų | 132 | 127.5 Ų | 127.5 | 69% | 0.691 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -87.6 | -19.6 | -174.8 | -66.9 | 172.5 | 0 | 0 | 0 | 113.3 | L15 T21 | L15-L19 HydrophobicContact CD2-CD1 4.27Å; L15-L19 WeakPolarHBondContact O-CB 3.12Å; L15-L19 WeakPolarHBondContact O-CG 3.22Å; L15-L19 PolarHBondContact O-N 2.9Å; L19-T21 PolarHBondContact O-N 3.04Å |
| 20 | S | 81.3 | Confident | 68.5 | Low | 84 Ų | 84 | 124.9 Ų | 124.9 | 59% | 0.587 | 66% | 0.66 | S | S | * | * | trans | -80.9 | 98.9 | 174.8 | -57.6 | 0 | 0 | 0 | 0 | 108.6 | S16 Q22 | S16-S20 VanDerWaalsContact O-CB 3.23Å; S16-S20 WeakPolarHBondContact O-CB 3.33Å; S16-S20 PolarHBondContact O-N 2.87Å; S16-S20 PolarHBondContact O-OG 3.05Å; S20-Q22 PolarHBondContact O-N 3.12Å; S20-Q22 VanDerWaalsContact O-N 3.1Å | ||
| 21 | T | 71.3 | Confident | 66.6 | Low | 131 Ų | 131 | 126.5 Ų | 126.5 | 80% | 0.804 | 68% | 0.681 | S | S | * | * | trans | -60.8 | 112.8 | 162.8 | 51.6 | 0 | 0 | 0 | 0 | 106.9 | L19 Q23 | L19-T21 PolarHBondContact O-N 3.04Å; T21-Q23 PolarHBondContact O-N 2.74Å | ||
| 22 | Q | 61.1 | Low | 64.7 | Low | 173 Ų | 173 | 129.4 Ų | 129.4 | 81% | 0.808 | 69% | 0.689 | S | S | * | * | trans | -51.2 | 118.3 | 170.2 | -147.6 | 160.1 | 49.7 | 0 | 0 | 105.9 | S20 E24 | S20-Q22 PolarHBondContact O-N 3.12Å; S20-Q22 VanDerWaalsContact O-N 3.1Å; Q22-E24 PolarHBondContact O-N 3.36Å | ||
| 23 | Q | 54 | Low | 63.2 | Low | 181 Ų | 181 | 132.5 Ų | 132.5 | 85% | 0.846 | 70% | 0.701 | S | S | * | * | trans | -65.9 | 86.8 | 179.9 | -173.3 | 169.9 | 13 | 0 | 0 | 106.4 | T21 E25 | T21-Q23 PolarHBondContact O-N 2.74Å; Q23-E25 PolarHBondContact O-N 2.76Å | ||
| 24 | E | 52 | Low | 61.6 | Low | 160 Ų | 160 | 134.1 Ų | 134.1 | 75% | 0.748 | 71% | 0.713 | S | S | * | * | trans | -66.7 | 110.5 | 162.2 | -62 | -161.1 | -170.6 | 0 | 0 | 104.4 | Q22 D26 | Q22-E24 PolarHBondContact O-N 3.36Å; E24-D26 PolarHBondContact O-N 3.19Å; E24-D26 VanDerWaalsContact O-N 3.12Å | ||
| 25 | E | 45.9 | Very low | 59.8 | Low | 165 Ų | 165 | 139.2 Ų | 139.2 | 77% | 0.771 | 73% | 0.728 | S | S | * | * | trans | -51.3 | 117.6 | 168.6 | -69.5 | 170.9 | 160.8 | 0 | 0 | 106.4 | Q23 E27 | Q23-E25 PolarHBondContact O-N 2.76Å; E25-E27 PolarHBondContact O-N 3.1Å | ||
| 26 | D | 46.2 | Very low | 58.6 | Low | 160 Ų | 160 | 139.4 Ų | 139.4 | 86% | 0.856 | 73% | 0.733 | S | S | * | * | trans | -61.2 | 84.2 | 174 | -65.9 | -58.4 | 0 | 0 | 0 | 108.3 | E24 D28 | E24-D26 PolarHBondContact O-N 3.19Å; E24-D26 VanDerWaalsContact O-N 3.12Å; D26-D28 PolarHBondContact O-N 2.76Å | ||
| 27 | E | 43 | Very low | 57.3 | Low | 175 Ų | 175 | 139.9 Ų | 139.9 | 82% | 0.818 | 74% | 0.741 | S | S | * | * | trans | -81.9 | 98.4 | 162.8 | -80.6 | -171.8 | 166.1 | 0 | 0 | 107.7 | E25 E29 | E25-E27 PolarHBondContact O-N 3.1Å; E27-E29 PolarHBondContact O-N 2.89Å; E27-E29 VanDerWaalsContact O-N 3.11Å | ||
| 28 | D | 47.5 | Very low | 56 | Low | 161 Ų | 161 | 145.5 Ų | 145.5 | 86% | 0.861 | 75% | 0.747 | S | S | * | * | trans | -49.7 | 108.4 | 163.1 | -65.2 | -68 | 0 | 0 | 0 | 110.5 | D26 | D26-D28 PolarHBondContact O-N 2.76Š| ||
| 29 | E | 43.4 | Very low | 54.8 | Low | 167 Ų | 167 | 142.1 Ų | 142.1 | 78% | 0.78 | 75% | 0.747 | S | S | * | * | trans | -134.7 | 116.1 | 159.1 | -104.9 | -68.5 | 155.4 | 0 | 0 | 110.8 | E27 C31 | E27-E29 PolarHBondContact O-N 2.89Å; E27-E29 VanDerWaalsContact O-N 3.11Å; E29-C31 PolarHBondContact O-N 2.93Å; E29-C31 VanDerWaalsContact O-N 3.12Å | ||
| 30 | D | 40 | Very low | 53.9 | Low | 101 Ų | 101 | 142.2 Ų | 142.2 | 54% | 0.54 | 74% | 0.744 | S | S | . | * | trans | -46.4 | 104.3 | 175.4 | -172.3 | 24.1 | 0 | 0 | 0 | 110.9 | K32 | D30-K32 PolarHBondContact O-N 3.32Å; D30-K32 WeakPolarHBondContact OD2-CD 3.45Å; D30-K32 WeakPolarHBondContact OD2-CE 3.15Å; D30-K32 IonicContact OD2-NZ 2.63Å; D30-K32 PolarHBondContact OD2-NZ 3.42Å | ||
| 31 | C | 43.7 | Very low | 53.5 | Low | 134 Ų | 134 | 143.6 Ų | 143.6 | 91% | 0.905 | 74% | 0.744 | S | S | * | * | trans | -69.1 | 69.3 | 171.8 | -79.2 | 0 | 0 | 0 | 0 | 111 | E29 Q33 | E29-C31 PolarHBondContact O-N 2.93Å; E29-C31 VanDerWaalsContact O-N 3.12Å; C31-Q33 PolarHBondContact O-N 2.77Å | ||
| 32 | K | 49.2 | Very low | 53.9 | Low | 146 Ų | 146 | 138.9 Ų | 138.9 | 64% | 0.635 | 72% | 0.722 | S | S | * | * | trans | -84.8 | 106.6 | 167.5 | -86.1 | 179.7 | -176 | 136 | 0 | 110.5 | D30 | D30-K32 PolarHBondContact O-N 3.32Å; D30-K32 WeakPolarHBondContact OD2-CD 3.45Å; D30-K32 WeakPolarHBondContact OD2-CE 3.15Å; D30-K32 IonicContact OD2-NZ 2.63Å; D30-K32 PolarHBondContact OD2-NZ 3.42Å | ||
| 33 | Q | 54.3 | Low | 54.6 | Low | 174 Ų | 174 | 136.6 Ų | 136.6 | 81% | 0.813 | 72% | 0.722 | S | S | * | * | trans | 62.8 | 83.5 | 135.7 | -58.7 | 176.7 | -1.6 | 0 | 0 | 116.7 | C31 | C31-Q33 PolarHBondContact O-N 2.77Š| ||
| 34 | N | 52.6 | Low | 55.3 | Low | 147 Ų | 147 | 131.6 Ų | 131.6 | 79% | 0.786 | 72% | 0.719 | S | S | * | * | trans | -135.4 | 59.2 | 143.4 | 65.3 | -11.8 | 0 | 0 | 0 | 109.9 | T36 | N34-T36 PolarHBondContact O-N 2.63Š| ||
| 35 | E | 48.4 | Very low | 56.5 | Low | 161 Ų | 161 | 130.9 Ų | 130.9 | 75% | 0.752 | 72% | 0.715 | S | S | * | * | trans | -64.3 | 91.5 | 167.2 | -69.7 | -169.6 | 179.5 | 0 | 0 | 108.9 | ||||
| 36 | T | 56.8 | Low | 58 | Low | 95 Ų | 95 | 130.5 Ų | 130.5 | 58% | 0.583 | 72% | 0.717 | S | S | * | * | trans | -59.9 | 137.6 | 162.5 | 59.5 | 0 | 0 | 0 | 0 | 107.7 | N34 Y38 G39 | N34-T36 PolarHBondContact O-N 2.63Å; T36-Y38 PolarHBondContact O-N 3.18Å; T36-G39 PolarHBondContact O-N 3.02Å | ||
| 37 | A | 58.7 | Low | 59.3 | Low | 72 Ų | 72 | 125.5 Ų | 125.5 | 60% | 0.595 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -54.2 | -8.9 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | G39 | A37-G39 VanDerWaalsContact C-N 3.34Š|
| 38 | Y | 57.1 | Low | 61 | Low | 192 Ų | 192 | 122.9 Ų | 122.9 | 75% | 0.753 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -72.5 | -21.7 | 174.1 | -66 | -80.3 | 0 | 0 | 0 | 113.8 | T36 Q40 L41 | T36-Y38 PolarHBondContact O-N 3.18Å; Y38-Q40 VanDerWaalsContact C-N 3.3Å; Y38-Q40 PolarHBondContact O-N 3.4Å; Y38-L41 HydrophobicContact CD1-CD1 4.37Å |
| 39 | G | 59.2 | Low | 62.3 | Low | 73 Ų | 73 | 120.8 Ų | 120.8 | 75% | 0.753 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -74.4 | -15.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | T36 A37 | T36-G39 PolarHBondContact O-N 3.02Å; A37-G39 VanDerWaalsContact C-N 3.34Å |
| 40 | Q | 65.7 | Low | 63.4 | Low | 134 Ų | 134 | 118.6 Ų | 118.6 | 63% | 0.626 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -92 | -4.1 | -176.9 | -72.7 | 174.8 | 5.1 | 0 | 0 | 113.6 | Y38 | Y38-Q40 VanDerWaalsContact C-N 3.3Å; Y38-Q40 PolarHBondContact O-N 3.4Å |
| 41 | L | 74.6 | Confident | 64.8 | Low | 113 Ų | 113 | 122.5 Ų | 122.5 | 59% | 0.592 | 71% | 0.709 | S | S | * | * | trans | -96.3 | 100.6 | -174.2 | -33.7 | 176.7 | 0 | 0 | 0 | 109.7 | Y38 | Y38-L41 HydrophobicContact CD1-CD1 4.37Š| ||
| 42 | G | 78.3 | Confident | 65.8 | Low | 33 Ų | 33 | 126.4 Ų | 126.4 | 34% | 0.34 | 71% | 0.71 | S | S | . | * | trans | -90.1 | 163.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113 | G44 H45 | G42-G44 PolarHBondContact O-N 2.96Å; G42-H45 PolarHBondContact O-N 3.25Å | ||
| 43 | P | 76.8 | Confident | 66.3 | Low | 124 Ų | 124 | 127.4 Ų | 127.4 | 81% | 0.805 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -51.6 | -25.8 | 177.2 | -26.1 | 33.2 | 0 | 0 | 0 | 114.8 | H45 I46 | P43-H45 PolarHBondContact O-N 2.95Å; P43-I46 PolarHBondContact O-N 3.16Å |
| 44 | G | 68.4 | Low | 66.4 | Low | 77 Ų | 77 | 128.5 Ų | 128.5 | 79% | 0.794 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -71.9 | -5.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | G42 | G42-G44 PolarHBondContact O-N 2.96Š|
| 45 | H | 75.9 | Confident | 66.5 | Low | 144 Ų | 144 | 130.4 Ų | 130.4 | 67% | 0.667 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -90.7 | 0.7 | 174.4 | -72.7 | 78.3 | 0 | 0 | 0 | 113.1 | G42 P43 G47 | G42-H45 PolarHBondContact O-N 3.25Å; P43-H45 PolarHBondContact O-N 2.95Å; H45-G47 PolarHBondContact O-N 2.7Å |
| 46 | I | 78.9 | Confident | 66.6 | Low | 158 Ų | 158 | 128.8 Ų | 128.8 | 81% | 0.81 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -85.9 | 102.1 | 176.2 | -55.3 | -173.3 | 0 | 0 | 0 | 109.3 | P43 | P43-I46 PolarHBondContact O-N 3.16Š|
| 47 | G | 72.5 | Confident | 66.3 | Low | 54 Ų | 54 | 129 Ų | 129 | 56% | 0.557 | 73% | 0.73 | S | S | * | * | S | Bend | trans | 134.3 | 178.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | H45 | H45-G47 PolarHBondContact O-N 2.7Š|
| 48 | P | 79.8 | Confident | 66.1 | Low | 121 Ų | 121 | 130.5 Ų | 130.5 | 79% | 0.786 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -58.1 | 144.4 | 174.6 | -19.6 | 31.2 | 0 | 0 | 0 | 111.2 | ||
| 49 | P | 73.7 | Confident | 65.9 | Low | 117 Ų | 117 | 125.1 Ų | 125.1 | 76% | 0.76 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -60 | 132.5 | -177.7 | 24.3 | -33.1 | 0 | 0 | 0 | 110.3 | K51 | P49-K51 PolarHBondContact O-N 3.47Š|
| 50 | P | 67.4 | Low | 65.9 | Low | 120 Ų | 120 | 131.1 Ų | 131.1 | 78% | 0.779 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 138.4 | 179.2 | 24.3 | -31.8 | 0 | 0 | 0 | 109.9 | ||
| 51 | K | 68.5 | Low | 65.9 | Low | 183 Ų | 183 | 130.3 Ų | 130.3 | 80% | 0.796 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 142.3 | 170.9 | -66.6 | 176.6 | -177.8 | 172.3 | 0 | 107.6 | P49 E53 | P49-K51 PolarHBondContact O-N 3.47Å; K51-E53 PolarHBondContact O-N 3Å |
| 52 | K | 64.3 | Low | 65.3 | Low | 216 Ų | 216 | 134.4 Ų | 134.4 | 94% | 0.939 | 75% | 0.746 | S | S | * | * | trans | -66.3 | 86 | 175.3 | -65.7 | -170.3 | -178.7 | -174.6 | 0 | 109.3 | ||||
| 53 | E | 60.3 | Low | 64.7 | Low | 167 Ų | 167 | 138.4 Ų | 138.4 | 78% | 0.78 | 75% | 0.754 | S | S | * | * | trans | -78.1 | 136.4 | 168.3 | -57.8 | -168.5 | -160.4 | 0 | 0 | 107.6 | K51 E55 | K51-E53 PolarHBondContact O-N 3Å; E53-E55 PolarHBondContact O-N 3.43Å; E53-E55 VanDerWaalsContact O-N 3.16Å | ||
| 54 | K | 56.8 | Low | 64.8 | Low | 198 Ų | 198 | 140 Ų | 140 | 86% | 0.861 | 76% | 0.761 | S | S | * | * | trans | -48.6 | 123 | 179.3 | -99.7 | 176.1 | 171.7 | 176.5 | 0 | 108.9 | V56 | K54-V56 PolarHBondContact O-N 3.04Š| ||
| 55 | E | 53.8 | Low | 65.2 | Low | 187 Ų | 187 | 139 Ų | 139 | 87% | 0.874 | 74% | 0.742 | S | S | * | * | trans | -50.9 | 108 | 165.2 | -77.7 | 179 | 149.1 | 0 | 0 | 108.4 | E53 S57 | E53-E55 PolarHBondContact O-N 3.43Å; E53-E55 VanDerWaalsContact O-N 3.16Å; E55-S57 PolarHBondContact O-N 3.4Å | ||
| 56 | V | 50.3 | Low | 65.6 | Low | 127 Ų | 127 | 142.1 Ų | 142.1 | 77% | 0.77 | 75% | 0.754 | S | S | * | * | trans | -72.3 | 91.2 | 158.6 | -178.2 | 0 | 0 | 0 | 0 | 104.2 | K54 T58 | K54-V56 PolarHBondContact O-N 3.04Å; V56-T58 HydrophobicContact CG1-CG2 4.41Å; V56-T58 PolarHBondContact O-N 3.39Å | ||
| 57 | S | 51.2 | Low | 65.8 | Low | 100 Ų | 100 | 140.2 Ų | 140.2 | 70% | 0.699 | 75% | 0.746 | S | S | * | * | trans | -69.9 | 91.6 | 169.6 | 62.1 | 0 | 0 | 0 | 0 | 107.5 | E55 A59 | E55-S57 PolarHBondContact O-N 3.4Å; S57-A59 PolarHBondContact O-N 3.02Å | ||
| 58 | T | 54.2 | Low | 66.4 | Low | 103 Ų | 103 | 145 Ų | 145 | 63% | 0.632 | 76% | 0.757 | S | S | * | * | trans | -65.2 | 89.6 | 154 | 52.9 | 0 | 0 | 0 | 0 | 105.3 | V56 Y60 | V56-T58 HydrophobicContact CG1-CG2 4.41Å; V56-T58 PolarHBondContact O-N 3.39Å; T58-Y60 PolarHBondContact O-N 3.22Å | ||
| 59 | A | 53.6 | Low | 66.7 | Low | 79 Ų | 79 | 147.3 Ų | 147.3 | 65% | 0.653 | 75% | 0.75 | S | S | * | * | trans | -58.7 | 101.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | S57 T61 | S57-A59 PolarHBondContact O-N 3.02Å; A59-T61 PolarHBondContact O-N 3.27Å; A59-T61 PolarHBondContact O-OG1 3.06Å | ||
| 60 | Y | 58.2 | Low | 67.1 | Low | 199 Ų | 199 | 142.8 Ų | 142.8 | 78% | 0.78 | 72% | 0.721 | S | S | * | * | trans | -62.9 | 92.2 | 167.6 | -97 | -89.6 | 0 | 0 | 0 | 106.9 | T58 K62 | T58-Y60 PolarHBondContact O-N 3.22Å; Y60-K62 PolarHBondContact O-N 3.31Å; Y60-K62 VanDerWaalsContact O-N 3.08Å | ||
| 61 | T | 65.5 | Low | 67.7 | Low | 116 Ų | 116 | 145.9 Ų | 145.9 | 71% | 0.712 | 73% | 0.725 | S | S | * | * | trans | -67.9 | 109.6 | 172.8 | -44.9 | 0 | 0 | 0 | 0 | 105.3 | A59 K63 | A59-T61 PolarHBondContact O-N 3.27Å; A59-T61 PolarHBondContact O-OG1 3.06Å; T61-K63 WeakPolarHBondContact O-CG 3.2Å; T61-K63 PolarHBondContact O-N 3.41Å | ||
| 62 | K | 62.7 | Low | 68.1 | Low | 200 Ų | 200 | 145.9 Ų | 145.9 | 87% | 0.87 | 73% | 0.728 | S | S | * | * | trans | -61.7 | 103.1 | 179.5 | -71.6 | -177.4 | 179.8 | 179 | 0 | 108.3 | Y60 | Y60-K62 PolarHBondContact O-N 3.31Å; Y60-K62 VanDerWaalsContact O-N 3.08Å | ||
| 63 | K | 66.7 | Low | 68.6 | Low | 116 Ų | 116 | 140.2 Ų | 140.2 | 50% | 0.504 | 71% | 0.705 | S | S | . | * | trans | -68.1 | 135.6 | 173.8 | -48.1 | 173.9 | -171.7 | 164 | 0 | 106.4 | T61 S65 S70 E73 | T61-K63 WeakPolarHBondContact O-CG 3.2Å; T61-K63 PolarHBondContact O-N 3.41Å; K63-S65 PolarHBondContact O-N 3.01Å; K63-S65 VanDerWaalsContact O-N 3.12Å; K63-S70 PolarHBondContact NZ-OG 2.87Å; K63-E73 IonicContact NZ-OE2 2.87Å | ||
| 64 | T | 77.6 | Confident | 69.5 | Low | 157 Ų | 157 | 136.3 Ų | 136.3 | 96% | 0.963 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -76.6 | 13.2 | -179.5 | 51.1 | 0 | 0 | 0 | 0 | 113.3 | ||
| 65 | S | 78.2 | Confident | 70.1 | Confident | 57 Ų | 57 | 129.6 Ų | 129.6 | 40% | 0.399 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -92.9 | 154.1 | 176 | 59.7 | 0 | 0 | 0 | 0 | 110.5 | K63 D67 | K63-S65 PolarHBondContact O-N 3.01Å; K63-S65 VanDerWaalsContact O-N 3.12Å; S65-D67 WeakPolarHBondContact CB-OD2 3.48Å |
| 66 | K | 83.4 | Confident | 70.8 | Confident | 210 Ų | 210 | 130.3 Ų | 130.3 | 91% | 0.913 | 68% | 0.677 | S | S | * | * | trans | -86.6 | 5.5 | 169.8 | -65.3 | 177.7 | -179.6 | 175.4 | 0 | 111.8 | I68 | K66-I68 PolarHBondContact O-N 2.71Š| ||
| 67 | D | 82.8 | Confident | 71.5 | Confident | 118 Ų | 118 | 127 Ų | 127 | 63% | 0.631 | 67% | 0.669 | S | S | * | * | trans | -71.9 | 129.4 | -176.8 | -57.7 | -37.9 | 0 | 0 | 0 | 109 | S65 W69 | S65-D67 WeakPolarHBondContact CB-OD2 3.48Å; D67-W69 WeakPolarHBondContact CB-O 3.43Å; D67-W69 PolarHBondContact O-N 3.19Å | ||
| 68 | I | 85.3 | Confident | 71.9 | Confident | 154 Ų | 154 | 125.5 Ų | 125.5 | 79% | 0.79 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -66.8 | -31.8 | 178.8 | -61.6 | 175.4 | 0 | 0 | 0 | 110 | K66 | K66-I68 PolarHBondContact O-N 2.71Š|
| 69 | W | 85.5 | Confident | 72.4 | Confident | 170 Ų | 170 | 128.5 Ų | 128.5 | 64% | 0.644 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -120.3 | 145.4 | 179.4 | -55.9 | 101.8 | 0 | 0 | 0 | 110.6 | D67 E73 V74 | D67-W69 WeakPolarHBondContact CB-O 3.43Å; D67-W69 PolarHBondContact O-N 3.19Å; W69-E73 HydrophobicContact CE3-CB 4.07Å; W69-V74 HydrophobicContact CB-CG2 3.42Å; W69-V74 VanDerWaalsContact CB-CG2 3.42Å; W69-V74 HydrophobicContact CG-CG2 3.93Å |
| 70 | S | 83 | Confident | 72.8 | Confident | 22 Ų | 22 | 133.8 Ų | 133.8 | 15% | 0.154 | 67% | 0.669 | C | S | . | * | trans | -89.6 | 159.4 | 167.5 | 55.1 | 0 | 0 | 0 | 0 | 112.7 | K63 E72 E73 V74 | K63-S70 PolarHBondContact NZ-OG 2.87Å; S70-E72 PolarHBondContact O-N 3.21Å; S70-E73 PolarHBondContact N-OE2 3.08Å; S70-E73 WeakPolarHBondContact O-CA 3.48Å; S70-E73 WeakPolarHBondContact O-CB 3.43Å; S70-E73 PolarHBondContact O-N 2.73Å; S70-E73 WeakPolarHBondContact OG-CG 3.45Å; S70-E73 PolarHBondContact OG-OE2 2.88Å; S70-V74 PolarHBondContact O-N 3.14Å; S70-V74 VanDerWaalsContact O-N 3.12Å | ||
| 71 | E | 79.7 | Confident | 73.3 | Confident | 184 Ų | 184 | 128.7 Ų | 128.7 | 86% | 0.86 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -31.1 | 179.7 | -166.9 | 164.2 | -160.5 | 0 | 0 | 113 | V74 | E71-V74 CarbonylContact O-C 3.52Š|
| 72 | E | 77.6 | Confident | 73.7 | Confident | 184 Ų | 184 | 128.1 Ų | 128.1 | 86% | 0.86 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -28.3 | 172.9 | -174.4 | 170.9 | -164.4 | 0 | 0 | 113.1 | S70 | S70-E72 PolarHBondContact O-N 3.21Š|
| 73 | E | 75.3 | Confident | 74.2 | Confident | 97 Ų | 97 | 125.6 Ų | 125.6 | 45% | 0.453 | 64% | 0.643 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.5 | -20.5 | 177.6 | -69.8 | 163.9 | 151.8 | 0 | 0 | 112.4 | K63 W69 S70 | K63-E73 IonicContact NZ-OE2 2.87Å; W69-E73 HydrophobicContact CE3-CB 4.07Å; S70-E73 PolarHBondContact N-OE2 3.08Å; S70-E73 WeakPolarHBondContact O-CA 3.48Å; S70-E73 WeakPolarHBondContact O-CB 3.43Å; S70-E73 PolarHBondContact O-N 2.73Å; S70-E73 WeakPolarHBondContact OG-CG 3.45Å; S70-E73 PolarHBondContact OG-OE2 2.88Å |
| 74 | V | 77.4 | Confident | 74.9 | Confident | 85 Ų | 85 | 124.2 Ų | 124.2 | 52% | 0.515 | 65% | 0.654 | S | S | . | * | S | Bend | trans | -116.1 | 69 | 177.9 | -166.3 | 0 | 0 | 0 | 0 | 109.1 | W69 S70 E71 E76 | W69-V74 HydrophobicContact CB-CG2 3.42Å; W69-V74 VanDerWaalsContact CB-CG2 3.42Å; W69-V74 HydrophobicContact CG-CG2 3.93Å; S70-V74 PolarHBondContact O-N 3.14Å; S70-V74 VanDerWaalsContact O-N 3.12Å; E71-V74 CarbonylContact O-C 3.52Å; V74-E76 PolarHBondContact O-N 3.25Å |
| 75 | A | 70.1 | Confident | 75.2 | Confident | 57 Ų | 57 | 119.1 Ų | 119.1 | 47% | 0.471 | 62% | 0.621 | S | S | . | * | trans | -60.2 | 111.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110 | G77 S78 | A75-G77 PolarHBondContact O-N 3.06Å; A75-S78 PolarHBondContact O-N 2.81Å; A75-S78 PolarHBondContact O-OG 3.28Å | ||
| 76 | E | 68.6 | Low | 75.6 | Confident | 201 Ų | 201 | 122.3 Ų | 122.3 | 94% | 0.939 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | 124.5 | 178.2 | -168.9 | 174.5 | -165.5 | 0 | 0 | 109.8 | V74 | V74-E76 PolarHBondContact O-N 3.25Š|
| 77 | G | 64.8 | Low | 75.8 | Confident | 58 Ų | 58 | 121.1 Ų | 121.1 | 60% | 0.598 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 97.1 | -5.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | A75 Q79 | A75-G77 PolarHBondContact O-N 3.06Å; G77-Q79 PolarHBondContact O-N 3.32Å |
| 78 | S | 60.1 | Low | 75.9 | Confident | 69 Ų | 69 | 121.4 Ų | 121.4 | 48% | 0.483 | 64% | 0.638 | S | S | . | * | G | 310 helix | trans | -71.8 | -7.1 | 177.1 | 58.8 | 0 | 0 | 0 | 0 | 114.9 | A75 Y80 D81 | A75-S78 PolarHBondContact O-N 2.81Å; A75-S78 PolarHBondContact O-OG 3.28Å; S78-Y80 PolarHBondContact O-N 3.12Å; S78-D81 PolarHBondContact O-N 3.45Å; S78-D81 VanDerWaalsContact O-N 3.14Å |
| 79 | Q | 64.6 | Low | 75.8 | Confident | 165 Ų | 165 | 121.2 Ų | 121.2 | 77% | 0.771 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -56.6 | -27.4 | -178.9 | -178.2 | 176.8 | -4.4 | 0 | 0 | 113.5 | G77 | G77-Q79 PolarHBondContact O-N 3.32Š|
| 80 | Y | 62.3 | Low | 75.7 | Confident | 190 Ų | 190 | 116.7 Ų | 116.7 | 75% | 0.745 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -101 | -9.5 | -175.7 | -56.6 | -76.5 | 0 | 0 | 0 | 113.5 | S78 D82 | S78-Y80 PolarHBondContact O-N 3.12Å; Y80-D82 PolarHBondContact O-N 3.12Å |
| 81 | D | 68.8 | Low | 75.9 | Confident | 93 Ų | 93 | 125.6 Ų | 125.6 | 50% | 0.497 | 67% | 0.666 | S | S | . | * | trans | -97.7 | 71.2 | -177.7 | -159.1 | 20.9 | 0 | 0 | 0 | 109.4 | S78 L83 | S78-D81 PolarHBondContact O-N 3.45Å; S78-D81 VanDerWaalsContact O-N 3.14Å; D81-L83 PolarHBondContact O-N 3.46Å; D81-L83 WeakPolarHBondContact OD1-CD2 3.41Å; D81-L83 WeakPolarHBondContact OD2-CD2 3.23Å | ||
| 82 | D | 73.1 | Confident | 76.1 | Confident | 103 Ų | 103 | 124.7 Ų | 124.7 | 55% | 0.551 | 66% | 0.656 | S | S | * | * | trans | -74.6 | 83.1 | 171.9 | -169.5 | -5.2 | 0 | 0 | 0 | 109.3 | Y80 A84 D85 | Y80-D82 PolarHBondContact O-N 3.12Å; D82-A84 PolarHBondContact O-N 3.47Å; D82-A84 WeakPolarHBondContact OD1-CB 3.36Å; D82-A84 PolarHBondContact OD1-N 3.09Å; D82-A84 VanDerWaalsContact OD1-N 3.16Å; D82-D85 HydrophobicContact CB-CB 4.08Å; D82-D85 WeakPolarHBondContact O-CB 3.33Å; D82-D85 PolarHBondContact O-N 3.42Å | ||
| 83 | L | 74.1 | Confident | 76.3 | Confident | 147 Ų | 147 | 123.9 Ų | 123.9 | 77% | 0.77 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -14 | 178.5 | -62.3 | 178.6 | 0 | 0 | 0 | 113.3 | D81 | D81-L83 PolarHBondContact O-N 3.46Å; D81-L83 WeakPolarHBondContact OD1-CD2 3.41Å; D81-L83 WeakPolarHBondContact OD2-CD2 3.23Å |
| 84 | A | 80.6 | Confident | 76.7 | Confident | 88 Ų | 88 | 125.7 Ų | 125.7 | 73% | 0.727 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -10.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | D82 P86 | D82-A84 PolarHBondContact O-N 3.47Å; D82-A84 WeakPolarHBondContact OD1-CB 3.36Å; D82-A84 PolarHBondContact OD1-N 3.09Å; D82-A84 VanDerWaalsContact OD1-N 3.16Å; A84-P86 WeakPolarHBondContact O-CD 3.45Å |
| 85 | D | 83.9 | Confident | 77 | Confident | 50 Ų | 50 | 128.1 Ų | 128.1 | 27% | 0.267 | 67% | 0.672 | S | S | . | * | trans | -85.1 | 114.9 | 179.2 | -166.4 | -18.1 | 0 | 0 | 0 | 111.1 | D82 R87 | D82-D85 HydrophobicContact CB-CB 4.08Å; D82-D85 WeakPolarHBondContact O-CB 3.33Å; D82-D85 PolarHBondContact O-N 3.42Å; D85-R87 PolarHBondContact O-N 3.29Å; D85-R87 WeakPolarHBondContact OD1-CB 3.4Å; D85-R87 WeakPolarHBondContact OD1-CG 3.41Å; D85-R87 PolarHBondContact OD1-N 3.09Å; D85-R87 IonicContact OD1-NE 2.68Å; D85-R87 PolarHBondContact OD1-NE 3.43Å; D85-R87 IonicContact OD2-CZ 3.94Å; D85-R87 IonicContact OD2-NE 3.04Å; D85-R87 PolarHBondContact OD2-NE 2.93Å; D85-R87 IonicContact OD2-NH2 3.14Å; D85-R87 PolarHBondContact OD2-NH2 2.96Å | ||
| 86 | P | 86.7 | Confident | 77.5 | Confident | 124 Ų | 124 | 132.6 Ų | 132.6 | 81% | 0.805 | 69% | 0.687 | S | S | * | * | trans | -76.4 | -4 | 178.8 | 33.2 | -37.4 | 0 | 0 | 0 | 113.5 | A84 | A84-P86 WeakPolarHBondContact O-CD 3.45Š| ||
| 87 | R | 87.1 | Confident | 78.2 | Confident | 184 Ų | 184 | 132.3 Ų | 132.3 | 69% | 0.694 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -73.5 | 139 | -176.4 | -65.7 | 178.3 | -63.1 | 164.9 | 1.6 | 110.8 | D85 Q89 | D85-R87 PolarHBondContact O-N 3.29Å; D85-R87 WeakPolarHBondContact OD1-CB 3.4Å; D85-R87 WeakPolarHBondContact OD1-CG 3.41Å; D85-R87 PolarHBondContact OD1-N 3.09Å; D85-R87 IonicContact OD1-NE 2.68Å; D85-R87 PolarHBondContact OD1-NE 3.43Å; D85-R87 IonicContact OD2-CZ 3.94Å; D85-R87 IonicContact OD2-NE 3.04Å; D85-R87 PolarHBondContact OD2-NE 2.93Å; D85-R87 IonicContact OD2-NH2 3.14Å; D85-R87 PolarHBondContact OD2-NH2 2.96Å; R87-Q89 PolarHBondContact O-N 3.01Å |
| 88 | P | 85.8 | Confident | 79.1 | Confident | 124 Ų | 124 | 133.4 Ų | 133.4 | 81% | 0.805 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 134.9 | 175 | 27 | -33.5 | 0 | 0 | 0 | 110.3 | ||
| 89 | Q | 82.2 | Confident | 80.2 | Confident | 150 Ų | 150 | 134.9 Ų | 134.9 | 70% | 0.701 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 139.2 | 172 | -69.4 | -172.1 | 7.1 | 0 | 0 | 110 | R87 | R87-Q89 PolarHBondContact O-N 3.01Š|
| 90 | P | 84.6 | Confident | 81.1 | Confident | 76 Ų | 76 | 129.4 Ų | 129.4 | 49% | 0.494 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -70.3 | 145.5 | -179.9 | 26 | -32.3 | 0 | 0 | 0 | 113.1 | Y92 | P90-Y92 HydrophobicContact CB-CD1 3.57Å; P90-Y92 HydrophobicContact CB-CE1 3.2Å; P90-Y92 HydrophobicContact CB-CE2 4.27Å; P90-Y92 HydrophobicContact CB-CG 4.25Å; P90-Y92 HydrophobicContact CG-CD1 4.44Å; P90-Y92 HydrophobicContact CG-CE1 3.9Å; P90-Y92 HydrophobicContact CG-CE2 4.14Å; P90-Y92 PolarHBondContact O-N 3.02Å; P90-Y92 VanDerWaalsContact O-N 3.08Å |
| 91 | E | 87.6 | Confident | 82.3 | Confident | 208 Ų | 208 | 121.2 Ų | 121.2 | 97% | 0.972 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -83.7 | 50.7 | 172.2 | -62.4 | -176.9 | -176.8 | 0 | 0 | 112.1 | ||
| 92 | Y | 83.6 | Confident | 83.3 | Confident | 166 Ų | 166 | 121.4 Ų | 121.4 | 65% | 0.651 | 64% | 0.638 | S | S | * | * | trans | -142.8 | 148.6 | 170.5 | 60.2 | -104.5 | 0 | 0 | 0 | 111 | P90 I94 | P90-Y92 HydrophobicContact CB-CD1 3.57Å; P90-Y92 HydrophobicContact CB-CE1 3.2Å; P90-Y92 HydrophobicContact CB-CE2 4.27Å; P90-Y92 HydrophobicContact CB-CG 4.25Å; P90-Y92 HydrophobicContact CG-CD1 4.44Å; P90-Y92 HydrophobicContact CG-CE1 3.9Å; P90-Y92 HydrophobicContact CG-CE2 4.14Å; P90-Y92 PolarHBondContact O-N 3.02Å; P90-Y92 VanDerWaalsContact O-N 3.08Å; Y92-I94 HydrophobicContact CD2-CG1 4.46Å; Y92-I94 HydrophobicContact CE2-CG1 4.24Å | ||
| 93 | E | 82 | Confident | 84 | Confident | 166 Ų | 166 | 121 Ų | 121 | 78% | 0.776 | 63% | 0.633 | S | S | * | * | trans | -95.2 | 137.1 | 175.8 | -172.3 | 175.4 | -173.2 | 0 | 0 | 110 | I95 | E93-I95 HydrophobicContact CG-CG1 4.48Å; E93-I95 PolarHBondContact O-N 3.49Å | ||
| 94 | I | 82.1 | Confident | 84.6 | Confident | 135 Ų | 135 | 114.7 Ų | 114.7 | 69% | 0.692 | 60% | 0.6 | S | S | * | * | trans | -87 | 110 | 175.9 | -58.6 | 173.8 | 0 | 0 | 0 | 108.3 | Y92 L96 | Y92-I94 HydrophobicContact CD2-CG1 4.46Å; Y92-I94 HydrophobicContact CE2-CG1 4.24Å; I94-L96 HydrophobicContact CG2-CD2 4.37Å | ||
| 95 | I | 84 | Confident | 84.7 | Confident | 136 Ų | 136 | 116 Ų | 116 | 70% | 0.697 | 59% | 0.594 | S | S | * | * | trans | -103.7 | 112.7 | 175.2 | -54.9 | 174.9 | 0 | 0 | 0 | 109 | E93 K97 | E93-I95 HydrophobicContact CG-CG1 4.48Å; E93-I95 PolarHBondContact O-N 3.49Å; I95-K97 PolarHBondContact O-N 3.45Å | ||
| 96 | L | 80 | Confident | 84.8 | Confident | 152 Ų | 152 | 121.5 Ų | 121.5 | 80% | 0.796 | 62% | 0.616 | S | S | * | * | trans | -76.1 | 120 | 174.8 | -60.2 | 174.5 | 0 | 0 | 0 | 109.5 | I94 | I94-L96 HydrophobicContact CG2-CD2 4.37Š| ||
| 97 | K | 85.3 | Confident | 84.9 | Confident | 195 Ų | 195 | 121.3 Ų | 121.3 | 85% | 0.848 | 61% | 0.608 | S | S | * | * | trans | -125.9 | 116.4 | 177.3 | -172.6 | 177.7 | 178.5 | 178.2 | 0 | 110.3 | I95 | I95-K97 PolarHBondContact O-N 3.45Š| ||
| 98 | Q | 82.6 | Confident | 84.7 | Confident | 81 Ų | 81 | 114.7 Ų | 114.7 | 38% | 0.379 | 60% | 0.597 | S | S | . | * | trans | -99.3 | 138.8 | 173.5 | -62.9 | -177.1 | -66.9 | 0 | 0 | 110.2 | V100 S115 C118 | Q98-V100 HydrophobicContact CB-CG2 4.12Å; Q98-S115 PolarHBondContact NE2-O 3.44Å; Q98-C118 PolarHBondContact NE2-O 2.93Å | ||
| 99 | S | 84.1 | Confident | 84.6 | Confident | 100 Ų | 100 | 115 Ų | 115 | 70% | 0.699 | 59% | 0.591 | S | S | * | * | trans | -100.8 | 89.7 | 171.5 | 179.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 100 | V | 83.4 | Confident | 84.4 | Confident | 50 Ų | 50 | 110.2 Ų | 110.2 | 30% | 0.303 | 57% | 0.574 | S | S | . | * | trans | -101.3 | 120.3 | 175.8 | -174.6 | 0 | 0 | 0 | 0 | 108.8 | Q98 D104 L105 | Q98-V100 HydrophobicContact CB-CG2 4.12Å; V100-D104 WeakPolarHBondContact CA-OD2 3.21Å; V100-D104 HydrophobicContact CG1-CB 3.68Å; V100-L105 HydrophobicContact CG1-CD1 4.13Å; V100-L105 HydrophobicContact CG1-CG 4.12Å | ||
| 101 | G | 87.3 | Confident | 84 | Confident | 18 Ų | 18 | 115 Ų | 115 | 19% | 0.186 | 59% | 0.59 | C | S | . | * | trans | -86.8 | 169.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | E103 D104 L105 | G101-E103 PolarHBondContact O-N 3.28Å; G101-D104 PolarHBondContact N-OD2 2.97Å; G101-D104 WeakPolarHBondContact O-CB 3.29Å; G101-D104 PolarHBondContact O-N 3.07Å; G101-L105 PolarHBondContact O-N 2.71Å | ||
| 102 | T | 89 | Confident | 83.9 | Confident | 97 Ų | 97 | 108.5 Ų | 108.5 | 60% | 0.595 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.1 | -32.1 | 171.2 | 46.7 | 0 | 0 | 0 | 0 | 111.5 | D104 L105 F106 | T102-D104 PolarHBondContact O-N 3.2Å; T102-L105 PolarHBondContact O-N 2.84Å; T102-F106 HydrophobicContact CG2-CE2 4.33Å; T102-F106 WeakPolarHBondContact O-CB 3.28Å; T102-F106 WeakPolarHBondContact O-CD2 2.93Å; T102-F106 PolarHBondContact O-N 3.15Å |
| 103 | E | 88.9 | Confident | 83.6 | Confident | 94 Ų | 94 | 104.2 Ų | 104.2 | 44% | 0.439 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.5 | -30.9 | 174.6 | 63.5 | -86 | -156.6 | 0 | 0 | 112.5 | G101 L107 G108 | G101-E103 PolarHBondContact O-N 3.28Å; E103-L107 CarbonylContact O-C 3.34Å; E103-L107 VanDerWaalsContact O-CA 3.27Å; E103-L107 WeakPolarHBondContact O-CA 3.39Å; E103-L107 VanDerWaalsContact O-CB 3.3Å; E103-L107 WeakPolarHBondContact O-CB 2.73Å; E103-L107 PolarHBondContact O-N 3.36Å; E103-G108 PolarHBondContact O-N 3.22Å |
| 104 | D | 86.4 | Confident | 83.4 | Confident | 15 Ų | 15 | 101 Ų | 101 | 8% | 0.08 | 54% | 0.54 | C | S | . | . | H | α-helix | trans | -72.9 | -45.2 | 179.6 | -56.2 | -14.1 | 0 | 0 | 0 | 110.2 | V100 G101 T102 G108 S110 K112 | V100-D104 WeakPolarHBondContact CA-OD2 3.21Å; V100-D104 HydrophobicContact CG1-CB 3.68Å; G101-D104 PolarHBondContact N-OD2 2.97Å; G101-D104 WeakPolarHBondContact O-CB 3.29Å; G101-D104 PolarHBondContact O-N 3.07Å; T102-D104 PolarHBondContact O-N 3.2Å; D104-G108 PolarHBondContact O-N 2.99Å; D104-S110 WeakPolarHBondContact OD1-CB 3.29Å; D104-S110 PolarHBondContact OD1-OG 3.48Å; D104-K112 HydrophobicContact CB-CB 4.4Å |
| 105 | L | 82 | Confident | 83.2 | Confident | 115 Ų | 115 | 96.4 Ų | 96.4 | 60% | 0.602 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -70.5 | -39.2 | -179.4 | -78.6 | 149 | 0 | 0 | 0 | 113.2 | V100 G101 T102 | V100-L105 HydrophobicContact CG1-CD1 4.13Å; V100-L105 HydrophobicContact CG1-CG 4.12Å; G101-L105 PolarHBondContact O-N 2.71Å; T102-L105 PolarHBondContact O-N 2.84Å |
| 106 | F | 86.1 | Confident | 82.9 | Confident | 166 Ų | 166 | 94.4 Ų | 94.4 | 73% | 0.728 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -103.1 | -30.8 | -171.8 | -66.6 | -70.3 | 0 | 0 | 0 | 113.9 | T102 | T102-F106 HydrophobicContact CG2-CE2 4.33Å; T102-F106 WeakPolarHBondContact O-CB 3.28Å; T102-F106 WeakPolarHBondContact O-CD2 2.93Å; T102-F106 PolarHBondContact O-N 3.15Å |
| 107 | L | 88.4 | Confident | 82.7 | Confident | 119 Ų | 119 | 95.3 Ų | 95.3 | 62% | 0.623 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -119.8 | -14.6 | -171.7 | -52.7 | 176.8 | 0 | 0 | 0 | 113.3 | E103 L109 | E103-L107 CarbonylContact O-C 3.34Å; E103-L107 VanDerWaalsContact O-CA 3.27Å; E103-L107 WeakPolarHBondContact O-CA 3.39Å; E103-L107 VanDerWaalsContact O-CB 3.3Å; E103-L107 WeakPolarHBondContact O-CB 2.73Å; E103-L107 PolarHBondContact O-N 3.36Å; L107-L109 HydrophobicContact CB-CD1 3.88Å; L107-L109 HydrophobicContact CB-CD2 4.46Å; L107-L109 HydrophobicContact CB-CG 3.66Å; L107-L109 HydrophobicContact CD1-CD1 3.94Å; L107-L109 PolarHBondContact O-N 3.33Å; L107-L109 VanDerWaalsContact O-N 3.12Å |
| 108 | G | 83.9 | Confident | 81.9 | Confident | 45 Ų | 45 | 87.6 Ų | 87.6 | 46% | 0.464 | 49% | 0.491 | S | S | . | . | trans | 60.9 | 19.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | E103 D104 S110 | E103-G108 PolarHBondContact O-N 3.22Å; D104-G108 PolarHBondContact O-N 2.99Å; G108-S110 VanDerWaalsContact C-N 3.33Å; G108-S110 PolarHBondContact O-N 3.43Å | ||
| 109 | L | 82.4 | Confident | 81.2 | Confident | 131 Ų | 131 | 91.2 Ų | 91.2 | 69% | 0.686 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -25.9 | -169.6 | -61.9 | 177.2 | 0 | 0 | 0 | 113.3 | L107 | L107-L109 HydrophobicContact CB-CD1 3.88Å; L107-L109 HydrophobicContact CB-CD2 4.46Å; L107-L109 HydrophobicContact CB-CG 3.66Å; L107-L109 HydrophobicContact CD1-CD1 3.94Å; L107-L109 PolarHBondContact O-N 3.33Å; L107-L109 VanDerWaalsContact O-N 3.12Å |
| 110 | S | 78.7 | Confident | 81 | Confident | 50 Ų | 50 | 90.8 Ų | 90.8 | 35% | 0.35 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | -5.5 | -177 | -177.5 | 0 | 0 | 0 | 0 | 113.7 | D104 G108 K112 | D104-S110 WeakPolarHBondContact OD1-CB 3.29Å; D104-S110 PolarHBondContact OD1-OG 3.48Å; G108-S110 VanDerWaalsContact C-N 3.33Å; G108-S110 PolarHBondContact O-N 3.43Å; S110-K112 PolarHBondContact O-N 3.4Å; S110-K112 VanDerWaalsContact OG-CD 3.29Å; S110-K112 WeakPolarHBondContact OG-CD 3.16Å; S110-K112 VanDerWaalsContact OG-CG 3.29Å; S110-K112 WeakPolarHBondContact OG-CG 3.44Å |
| 111 | Q | 76.9 | Confident | 80.9 | Confident | 177 Ų | 177 | 92.9 Ų | 92.9 | 83% | 0.827 | 53% | 0.526 | S | S | * | . | trans | 53.2 | 15 | -168.4 | -59.4 | 179.3 | -2.9 | 0 | 0 | 114.3 | C118 | Q111-C118 PolarHBondContact O-SG 2.89Š| ||
| 112 | K | 85.3 | Confident | 80.5 | Confident | 70 Ų | 70 | 97.1 Ų | 97.1 | 30% | 0.304 | 55% | 0.545 | S | S | . | . | trans | -89.4 | 135.1 | 173.9 | -68.8 | -179.2 | -171.4 | -164.3 | 0 | 109.6 | D104 S110 | D104-K112 HydrophobicContact CB-CB 4.4Å; S110-K112 PolarHBondContact O-N 3.4Å; S110-K112 VanDerWaalsContact OG-CD 3.29Å; S110-K112 WeakPolarHBondContact OG-CD 3.16Å; S110-K112 VanDerWaalsContact OG-CG 3.29Å; S110-K112 WeakPolarHBondContact OG-CG 3.44Å | ||
| 113 | D | 77.7 | Confident | 80 | Confident | 76 Ų | 76 | 97.1 Ų | 97.1 | 41% | 0.406 | 54% | 0.542 | S | S | . | . | trans | -123.7 | 162.3 | 174 | 74.5 | -21.3 | 0 | 0 | 0 | 109.3 | S115 C118 | D113-S115 VanDerWaalsContact CG-CB 3.49Å; D113-S115 PolarHBondContact O-N 3.36Å; D113-S115 VanDerWaalsContact OD1-CB 3.28Å; D113-S115 WeakPolarHBondContact OD1-CB 3.4Å; D113-S115 PolarHBondContact OD1-N 3.4Å; D113-S115 WeakPolarHBondContact OD2-CB 3.3Å; D113-C118 WeakPolarHBondContact OD1-CB 3.27Å | ||
| 114 | P | 77.1 | Confident | 79.5 | Confident | 99 Ų | 99 | 97.3 Ų | 97.3 | 64% | 0.643 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -71.3 | 10.7 | 178 | 30.6 | -35.8 | 0 | 0 | 0 | 113 | ||
| 115 | S | 78.1 | Confident | 79 | Confident | 39 Ų | 39 | 102.8 Ų | 102.8 | 27% | 0.273 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -77.4 | 139.6 | 175.8 | -179.1 | 0 | 0 | 0 | 0 | 109.9 | Q98 D113 M117 C118 | Q98-S115 PolarHBondContact NE2-O 3.44Å; D113-S115 VanDerWaalsContact CG-CB 3.49Å; D113-S115 PolarHBondContact O-N 3.36Å; D113-S115 VanDerWaalsContact OD1-CB 3.28Å; D113-S115 WeakPolarHBondContact OD1-CB 3.4Å; D113-S115 PolarHBondContact OD1-N 3.4Å; D113-S115 WeakPolarHBondContact OD2-CB 3.3Å; S115-M117 PolarHBondContact O-N 2.88Å; S115-M117 PolarHBondContact OG-N 2.92Å; S115-C118 PolarHBondContact O-N 3.12Å; S115-C118 VanDerWaalsContact O-N 3.15Å |
| 116 | S | 77.4 | Confident | 78.8 | Confident | 93 Ų | 93 | 101.9 Ų | 101.9 | 65% | 0.65 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -9.3 | 170.8 | 63.3 | 0 | 0 | 0 | 0 | 114.7 | ||
| 117 | M | 75.5 | Confident | 78.2 | Confident | 172 Ų | 172 | 97 Ų | 97 | 85% | 0.847 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -9.1 | -179.9 | -60.1 | -179.3 | 72.3 | 0 | 0 | 114 | S115 | S115-M117 PolarHBondContact O-N 2.88Å; S115-M117 PolarHBondContact OG-N 2.92Å |
| 118 | C | 69.5 | Low | 77.4 | Confident | 33 Ų | 33 | 95.2 Ų | 95.2 | 22% | 0.223 | 56% | 0.561 | C | S | . | * | trans | -115.3 | 102.8 | 178.6 | -161.7 | 0 | 0 | 0 | 0 | 110.8 | Q98 Q111 D113 S115 | Q98-C118 PolarHBondContact NE2-O 2.93Å; Q111-C118 PolarHBondContact O-SG 2.89Å; D113-C118 WeakPolarHBondContact OD1-CB 3.27Å; S115-C118 PolarHBondContact O-N 3.12Å; S115-C118 VanDerWaalsContact O-N 3.15Å | ||
| 119 | C | 66.1 | Low | 76.8 | Confident | 157 Ų | 157 | 99.7 Ų | 99.7 | 100% | 1.061 | 57% | 0.57 | S | S | * | * | trans | -105.9 | 0 | -177.2 | -59 | 0 | 0 | 0 | 0 | 111.3 |
Retrieved 119 of 119 residues in 74.8 ms
(Link to these results)