| 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 | 41.8 | Very low | 51.2 | Low | 240 Ų | 240 | 168.4 Ų | 168.4 | 100% | 1.182 | 81% | 0.805 | S | S | * | * | 0 | 116.5 | 0 | -76.6 | 177.6 | -124.5 | 0 | 0 | 108.5 | R3 | M1-R3 PolarHBondContact O-N 2.84Š| |||
| 2 | R | 45.9 | Very low | 51.2 | Low | 237 Ų | 237 | 166 Ų | 166 | 89% | 0.894 | 80% | 0.798 | S | S | * | * | trans | -83.5 | 110.3 | 178.6 | -150.3 | 173.3 | -178.4 | 178.2 | -2 | 106.3 | D4 | R2-D4 PolarHBondContact O-N 2.71Š| ||
| 3 | R | 46 | Very low | 51.2 | Low | 234 Ų | 234 | 160.8 Ų | 160.8 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | trans | -79.5 | 108.6 | 173.6 | -70.3 | -177.9 | -164.1 | 172.5 | 4.5 | 106.8 | M1 K5 | M1-R3 PolarHBondContact O-N 2.84Å; R3-K5 PolarHBondContact O-N 3.15Å | ||
| 4 | D | 52 | Low | 51 | Low | 140 Ų | 140 | 158.9 Ų | 158.9 | 75% | 0.749 | 79% | 0.792 | S | S | * | * | trans | -61.7 | 131.7 | 170.7 | -65.7 | -41.4 | 0 | 0 | 0 | 108.7 | R2 I6 | R2-D4 PolarHBondContact O-N 2.71Å; D4-I6 PolarHBondContact O-N 3.41Å | ||
| 5 | K | 53.6 | Low | 50.8 | Low | 177 Ų | 177 | 157.9 Ų | 157.9 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -71.6 | 101.2 | -174.6 | -69.1 | 177.2 | -179.2 | 178.4 | 0 | 108.4 | R3 H7 | R3-K5 PolarHBondContact O-N 3.15Å; K5-H7 PolarHBondContact O-CD2 3.28Å; K5-H7 VanDerWaalsContact O-CD2 3.22Å; K5-H7 PolarHBondContact O-N 3.33Å; K5-H7 VanDerWaalsContact O-N 3.12Å | ||
| 6 | I | 55.6 | Low | 50.8 | Low | 164 Ų | 164 | 156.5 Ų | 156.5 | 84% | 0.841 | 79% | 0.786 | S | S | * | * | trans | -69.8 | 104.1 | 162.7 | -61.1 | 173.1 | 0 | 0 | 0 | 105.9 | D4 N8 | D4-I6 PolarHBondContact O-N 3.41Å; I6-N8 PolarHBondContact O-N 3.18Å; I6-N8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | H | 53.2 | Low | 50.3 | Low | 152 Ų | 152 | 156 Ų | 156 | 70% | 0.704 | 79% | 0.787 | S | S | * | * | trans | -72 | 107.4 | 177.5 | -73.9 | -86.9 | 0 | 0 | 0 | 109 | K5 L9 | K5-H7 PolarHBondContact O-CD2 3.28Å; K5-H7 VanDerWaalsContact O-CD2 3.22Å; K5-H7 PolarHBondContact O-N 3.33Å; K5-H7 VanDerWaalsContact O-N 3.12Å; H7-L9 PolarHBondContact O-N 3.02Å | ||
| 8 | N | 50.7 | Low | 50.4 | Low | 136 Ų | 136 | 155.4 Ų | 155.4 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -73.2 | 116.2 | 177.2 | -169.4 | 8 | 0 | 0 | 0 | 109.6 | I6 S10 | I6-N8 PolarHBondContact O-N 3.18Å; I6-N8 VanDerWaalsContact O-N 3.17Å; N8-S10 PolarHBondContact ND2-OG 3.04Å; N8-S10 VanDerWaalsContact ND2-OG 3.08Å; N8-S10 PolarHBondContact O-N 2.85Å; N8-S10 VanDerWaalsContact O-N 3.17Å; N8-S10 PolarHBondContact OD1-OG 3.15Å | ||
| 9 | L | 58.6 | Low | 50.5 | Low | 142 Ų | 142 | 156.3 Ų | 156.3 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | trans | -79 | 15.6 | -173.2 | -70.5 | 171.2 | 0 | 0 | 0 | 114.7 | H7 N11 | H7-L9 PolarHBondContact O-N 3.02Å; L9-N11 VanDerWaalsContact C-N 3.31Å; L9-N11 PolarHBondContact O-N 3.1Å | ||
| 10 | S | 55.7 | Low | 50.6 | Low | 81 Ų | 81 | 155.2 Ų | 155.2 | 57% | 0.566 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | 4.2 | -171.4 | 16 | 0 | 0 | 0 | 0 | 115.5 | N8 | N8-S10 PolarHBondContact ND2-OG 3.04Å; N8-S10 VanDerWaalsContact ND2-OG 3.08Å; N8-S10 PolarHBondContact O-N 2.85Å; N8-S10 VanDerWaalsContact O-N 3.17Å; N8-S10 PolarHBondContact OD1-OG 3.15Å |
| 11 | N | 49.9 | Very low | 50.8 | Low | 149 Ų | 149 | 155.4 Ų | 155.4 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.8 | 34 | -178.2 | -73.8 | 31.9 | 0 | 0 | 0 | 113.8 | L9 S13 | L9-N11 VanDerWaalsContact C-N 3.31Å; L9-N11 PolarHBondContact O-N 3.1Å; N11-S13 PolarHBondContact O-N 3.06Å |
| 12 | I | 51.5 | Low | 51.3 | Low | 140 Ų | 140 | 150.6 Ų | 150.6 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | trans | -73.2 | 88.9 | 167.2 | -60.4 | 174.1 | 0 | 0 | 0 | 107.6 | T14 | I12-T14 PolarHBondContact O-N 3.38Š| ||
| 13 | S | 51 | Low | 51.6 | Low | 99 Ų | 99 | 142.1 Ų | 142.1 | 69% | 0.692 | 75% | 0.747 | S | S | * | * | trans | -63.4 | 115.3 | 166.6 | 175.9 | 0 | 0 | 0 | 0 | 108.3 | N11 N15 | N11-S13 PolarHBondContact O-N 3.06Å; S13-N15 VanDerWaalsContact C-N 3.32Å; S13-N15 PolarHBondContact O-N 2.96Å | ||
| 14 | T | 48.4 | Very low | 52 | Low | 134 Ų | 134 | 135.4 Ų | 135.4 | 82% | 0.822 | 74% | 0.736 | S | S | * | * | trans | -68.8 | 93 | 161.9 | 47.2 | 0 | 0 | 0 | 0 | 107.5 | I12 | I12-T14 PolarHBondContact O-N 3.38Š| ||
| 15 | N | 48 | Very low | 52.1 | Low | 143 Ų | 143 | 132.1 Ų | 132.1 | 77% | 0.765 | 72% | 0.724 | S | S | * | * | trans | -112.4 | 114.2 | 167 | -168.9 | 60.1 | 0 | 0 | 0 | 108.3 | S13 | S13-N15 VanDerWaalsContact C-N 3.32Å; S13-N15 PolarHBondContact O-N 2.96Å | ||
| 16 | D | 50.6 | Low | 52.1 | Low | 136 Ų | 136 | 127.5 Ų | 127.5 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | trans | -57 | 153.2 | 178.5 | -72.3 | -43 | 0 | 0 | 0 | 113 | ||||
| 17 | N | 42.9 | Very low | 52 | Low | 148 Ų | 148 | 127 Ų | 127 | 79% | 0.791 | 70% | 0.703 | S | S | * | * | trans | 76.4 | 88.6 | 168.5 | -59.5 | -21.3 | 0 | 0 | 0 | 116.6 | ||||
| 18 | D | 52.4 | Low | 52.3 | Low | 145 Ų | 145 | 123.1 Ų | 123.1 | 78% | 0.775 | 69% | 0.69 | S | S | * | * | -143.6 | 136.2 | 113.5 | -84.5 | -40.9 | 0 | 0 | 0 | 107.3 | D20 | D18-D20 PolarHBondContact O-N 2.98Š| |||
| 19 | D | 51.3 | Low | 52.8 | Low | 172 Ų | 172 | 122.8 Ų | 122.8 | 92% | 0.92 | 68% | 0.684 | S | S | * | * | trans | -63.9 | 64.4 | 167.6 | -74.8 | -52.3 | 0 | 0 | 0 | 109.2 | D21 | D19-D21 VanDerWaalsContact C-N 3.27Å; D19-D21 PolarHBondContact O-N 2.81Å | ||
| 20 | D | 53.9 | Low | 52.8 | Low | 134 Ų | 134 | 118.8 Ų | 118.8 | 72% | 0.717 | 67% | 0.668 | S | S | * | * | trans | -70.6 | 96.8 | 167.1 | -82.8 | -30.9 | 0 | 0 | 0 | 105.8 | D18 I22 | D18-D20 PolarHBondContact O-N 2.98Å; D20-I22 PolarHBondContact O-N 3.47Å | ||
| 21 | D | 53.8 | Low | 53.4 | Low | 161 Ų | 161 | 118.7 Ų | 118.7 | 86% | 0.861 | 66% | 0.66 | S | S | * | * | trans | -49.7 | 76.8 | 160.2 | -139.9 | 0.7 | 0 | 0 | 0 | 107.3 | D19 S23 | D19-D21 VanDerWaalsContact C-N 3.27Å; D19-D21 PolarHBondContact O-N 2.81Å; D21-S23 PolarHBondContact O-N 3.43Å | ||
| 22 | I | 52.9 | Low | 54.3 | Low | 138 Ų | 138 | 115.7 Ų | 115.7 | 71% | 0.708 | 64% | 0.644 | S | S | * | * | trans | -62.7 | 91.8 | 166.4 | -94.9 | 176 | 0 | 0 | 0 | 102.7 | D20 S24 | D20-I22 PolarHBondContact O-N 3.47Å; I22-S24 VanDerWaalsContact C-N 3.33Å; I22-S24 PolarHBondContact O-N 2.93Å | ||
| 23 | S | 52.2 | Low | 55.4 | Low | 59 Ų | 59 | 111.7 Ų | 111.7 | 41% | 0.413 | 63% | 0.626 | S | S | . | * | trans | -54 | 109.9 | 167.3 | -177 | 0 | 0 | 0 | 0 | 104.7 | D21 S25 S26 | D21-S23 PolarHBondContact O-N 3.43Å; S23-S25 PolarHBondContact O-N 3.5Å; S23-S25 PolarHBondContact OG-OG 2.95Å; S23-S26 PolarHBondContact O-N 3.28Å | ||
| 24 | S | 53.7 | Low | 56.7 | Low | 94 Ų | 94 | 110.8 Ų | 110.8 | 66% | 0.657 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -51.7 | -22.4 | 177.2 | 36.6 | 0 | 0 | 0 | 0 | 111.3 | I22 T28 | I22-S24 VanDerWaalsContact C-N 3.33Å; I22-S24 PolarHBondContact O-N 2.93Å; S24-T28 WeakPolarHBondContact O-CG2 3.46Å; S24-T28 PolarHBondContact O-N 3.46Å; S24-T28 PolarHBondContact O-OG1 3.42Å |
| 25 | S | 54.7 | Low | 58.3 | Low | 70 Ų | 70 | 110.1 Ų | 110.1 | 49% | 0.49 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.9 | -36.1 | 173.2 | 88.1 | 0 | 0 | 0 | 0 | 114.6 | S23 T28 H29 | S23-S25 PolarHBondContact O-N 3.5Å; S23-S25 PolarHBondContact OG-OG 2.95Å; S25-T28 WeakPolarHBondContact CA-OG1 3.36Å; S25-T28 PolarHBondContact O-OG1 2.98Å; S25-H29 WeakPolarHBondContact O-CB 3.38Å; S25-H29 PolarHBondContact O-N 3.35Å |
| 26 | S | 53.1 | Low | 59.6 | Low | 81 Ų | 81 | 108.1 Ų | 108.1 | 57% | 0.566 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -73.6 | -37 | -178.4 | -63.6 | 0 | 0 | 0 | 0 | 111.4 | S23 S30 | S23-S26 PolarHBondContact O-N 3.28Å; S26-S30 PolarHBondContact O-N 3.01Å |
| 27 | Y | 53 | Low | 61.1 | Low | 152 Ų | 152 | 106 Ų | 106 | 60% | 0.596 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.9 | -45.4 | 175.8 | -175 | -107 | 0 | 0 | 0 | 111.2 | H29 S30 I31 | Y27-H29 PolarHBondContact O-N 2.82Å; Y27-S30 PolarHBondContact O-N 3.05Å; Y27-S30 PolarHBondContact O-OG 3.26Å; Y27-I31 HydrophobicContact CD1-CD1 3.8Å; Y27-I31 HydrophobicContact CE1-CD1 3.32Å; Y27-I31 HydrophobicContact CE1-CG1 4.47Å; Y27-I31 HydrophobicContact CE2-CD1 4.43Å; Y27-I31 PolarHBondContact O-N 2.95Å |
| 28 | T | 59.3 | Low | 63.1 | Low | 71 Ų | 71 | 103.3 Ų | 103.3 | 44% | 0.436 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.9 | -40.3 | 176.9 | 54.7 | 0 | 0 | 0 | 0 | 112 | S24 S25 S30 I31 D32 | S24-T28 WeakPolarHBondContact O-CG2 3.46Å; S24-T28 PolarHBondContact O-N 3.46Å; S24-T28 PolarHBondContact O-OG1 3.42Å; S25-T28 WeakPolarHBondContact CA-OG1 3.36Å; S25-T28 PolarHBondContact O-OG1 2.98Å; T28-S30 VanDerWaalsContact C-N 3.3Å; T28-S30 PolarHBondContact O-N 2.97Å; T28-I31 PolarHBondContact O-N 3.45Å; T28-I31 VanDerWaalsContact O-N 3.17Å; T28-D32 VanDerWaalsContact O-CG 3.25Å; T28-D32 PolarHBondContact O-N 3.13Å |
| 29 | H | 61.4 | Low | 64.5 | Low | 129 Ų | 129 | 101.6 Ų | 101.6 | 60% | 0.597 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -62 | -36.8 | 178.6 | -167 | 66.8 | 0 | 0 | 0 | 113.1 | S25 Y27 T33 | S25-H29 WeakPolarHBondContact O-CB 3.38Å; S25-H29 PolarHBondContact O-N 3.35Å; Y27-H29 PolarHBondContact O-N 2.82Å; H29-T33 WeakPolarHBondContact O-CB 3.46Å; H29-T33 PolarHBondContact O-N 3.08Å; H29-T33 PolarHBondContact O-OG1 3.03Å |
| 30 | S | 59.9 | Low | 66.3 | Low | 58 Ų | 58 | 96.7 Ų | 96.7 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.9 | -40.7 | 175.7 | 74.8 | 0 | 0 | 0 | 0 | 112.1 | S26 Y27 T28 T33 T34 | S26-S30 PolarHBondContact O-N 3.01Å; Y27-S30 PolarHBondContact O-N 3.05Å; Y27-S30 PolarHBondContact O-OG 3.26Å; T28-S30 VanDerWaalsContact C-N 3.3Å; T28-S30 PolarHBondContact O-N 2.97Å; S30-T33 PolarHBondContact O-N 3.42Å; S30-T34 PolarHBondContact O-N 3.02Å; S30-T34 PolarHBondContact O-OG1 3.47Å |
| 31 | I | 67.2 | Low | 67.9 | Low | 79 Ų | 79 | 95.1 Ų | 95.1 | 41% | 0.405 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.6 | -45.5 | 177.4 | -68 | 171.3 | 0 | 0 | 0 | 110.7 | Y27 T28 T33 T34 H35 | Y27-I31 HydrophobicContact CD1-CD1 3.8Å; Y27-I31 HydrophobicContact CE1-CD1 3.32Å; Y27-I31 HydrophobicContact CE1-CG1 4.47Å; Y27-I31 HydrophobicContact CE2-CD1 4.43Å; Y27-I31 PolarHBondContact O-N 2.95Å; T28-I31 PolarHBondContact O-N 3.45Å; T28-I31 VanDerWaalsContact O-N 3.17Å; I31-T33 VanDerWaalsContact C-N 3.27Å; I31-T33 PolarHBondContact O-N 3.3Å; I31-T34 PolarHBondContact O-N 3.39Å; I31-H35 VanDerWaalsContact O-CB 3.27Å; I31-H35 WeakPolarHBondContact O-CB 3.29Å; I31-H35 PolarHBondContact O-N 3.32Å |
| 32 | D | 69.9 | Low | 69.7 | Low | 86 Ų | 86 | 91.8 Ų | 91.8 | 46% | 0.46 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 178.4 | -68.5 | -23.4 | 0 | 0 | 0 | 110.7 | T28 H35 N36 | T28-D32 VanDerWaalsContact O-CG 3.25Å; T28-D32 PolarHBondContact O-N 3.13Å; D32-H35 PolarHBondContact O-N 2.78Å; D32-N36 VanDerWaalsContact O-CB 3.26Å; D32-N36 WeakPolarHBondContact O-CB 3.41Å; D32-N36 PolarHBondContact O-N 3.04Å; D32-N36 PolarHBondContact O-ND2 2.88Å |
| 33 | T | 74.6 | Confident | 71.3 | Confident | 57 Ų | 57 | 88.4 Ų | 88.4 | 35% | 0.35 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.1 | -47.3 | 177.2 | -58.4 | 0 | 0 | 0 | 0 | 111.4 | H29 S30 I31 H35 N36 N37 | H29-T33 WeakPolarHBondContact O-CB 3.46Å; H29-T33 PolarHBondContact O-N 3.08Å; H29-T33 PolarHBondContact O-OG1 3.03Å; S30-T33 PolarHBondContact O-N 3.42Å; I31-T33 VanDerWaalsContact C-N 3.27Å; I31-T33 PolarHBondContact O-N 3.3Å; T33-H35 PolarHBondContact O-N 3.03Å; T33-N36 PolarHBondContact O-N 3.41Å; T33-N37 WeakPolarHBondContact O-CB 3.48Å; T33-N37 PolarHBondContact O-N 3.31Å; T33-N37 PolarHBondContact O-ND2 3.26Å |
| 34 | T | 76.9 | Confident | 73.1 | Confident | 80 Ų | 80 | 89.1 Ų | 89.1 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 176.8 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | S30 I31 N37 N38 | S30-T34 PolarHBondContact O-N 3.02Å; S30-T34 PolarHBondContact O-OG1 3.47Å; I31-T34 PolarHBondContact O-N 3.39Å; T34-N37 PolarHBondContact O-N 3.39Å; T34-N38 WeakPolarHBondContact O-CB 3.36Å; T34-N38 PolarHBondContact O-N 3.48Å; T34-N38 PolarHBondContact O-ND2 2.87Å |
| 35 | H | 82 | Confident | 74.9 | Confident | 119 Ų | 119 | 88.4 Ų | 88.4 | 55% | 0.551 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.4 | -48.2 | 177 | -178.2 | 72 | 0 | 0 | 0 | 111.3 | I31 D32 T33 N37 N38 H39 | I31-H35 VanDerWaalsContact O-CB 3.27Å; I31-H35 WeakPolarHBondContact O-CB 3.29Å; I31-H35 PolarHBondContact O-N 3.32Å; D32-H35 PolarHBondContact O-N 2.78Å; T33-H35 PolarHBondContact O-N 3.03Å; H35-N37 PolarHBondContact O-N 3.21Å; H35-N38 PolarHBondContact O-N 3.46Å; H35-H39 WeakPolarHBondContact O-CB 3.36Å; H35-H39 PolarHBondContact O-N 3.46Å |
| 36 | N | 75.6 | Confident | 76.6 | Confident | 101 Ų | 101 | 91.8 Ų | 91.8 | 54% | 0.54 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 178.5 | -73.3 | -23.2 | 0 | 0 | 0 | 112.3 | D32 T33 H39 S40 | D32-N36 VanDerWaalsContact O-CB 3.26Å; D32-N36 WeakPolarHBondContact O-CB 3.41Å; D32-N36 PolarHBondContact O-N 3.04Å; D32-N36 PolarHBondContact O-ND2 2.88Å; T33-N36 PolarHBondContact O-N 3.41Å; N36-H39 PolarHBondContact O-N 2.79Å; N36-S40 VanDerWaalsContact O-CB 3.31Å; N36-S40 WeakPolarHBondContact O-CB 3.49Å; N36-S40 PolarHBondContact O-N 3.44Å |
| 37 | N | 81.4 | Confident | 78.4 | Confident | 91 Ų | 91 | 92.4 Ų | 92.4 | 49% | 0.487 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -45.4 | 176.2 | -72.7 | -18.4 | 0 | 0 | 0 | 111.4 | T33 T34 H35 S40 I41 | T33-N37 WeakPolarHBondContact O-CB 3.48Å; T33-N37 PolarHBondContact O-N 3.31Å; T33-N37 PolarHBondContact O-ND2 3.26Å; T34-N37 PolarHBondContact O-N 3.39Å; H35-N37 PolarHBondContact O-N 3.21Å; N37-S40 PolarHBondContact O-N 2.91Å; N37-I41 WeakPolarHBondContact O-CG1 3.4Å; N37-I41 PolarHBondContact O-N 3.33Å |
| 38 | N | 84.9 | Confident | 80.3 | Confident | 92 Ų | 92 | 91.8 Ų | 91.8 | 49% | 0.492 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.1 | -43.8 | 178 | -71.8 | -14.2 | 0 | 0 | 0 | 111.6 | T34 H35 S40 I41 V42 | T34-N38 WeakPolarHBondContact O-CB 3.36Å; T34-N38 PolarHBondContact O-N 3.48Å; T34-N38 PolarHBondContact O-ND2 2.87Å; H35-N38 PolarHBondContact O-N 3.46Å; N38-S40 VanDerWaalsContact C-N 3.35Å; N38-S40 PolarHBondContact O-N 3.47Å; N38-I41 PolarHBondContact O-N 3.49Å; N38-V42 WeakPolarHBondContact O-CG2 3.29Å; N38-V42 PolarHBondContact O-N 2.91Å |
| 39 | H | 82.9 | Confident | 81.7 | Confident | 109 Ų | 109 | 93.2 Ų | 93.2 | 51% | 0.505 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.8 | -46.5 | 175.1 | -177.3 | -67.5 | 0 | 0 | 0 | 111.4 | H35 N36 I41 V42 E43 | H35-H39 WeakPolarHBondContact O-CB 3.36Å; H35-H39 PolarHBondContact O-N 3.46Å; N36-H39 PolarHBondContact O-N 2.79Å; H39-I41 VanDerWaalsContact C-N 3.32Å; H39-I41 PolarHBondContact O-N 3.43Å; H39-V42 PolarHBondContact O-N 3.17Å; H39-E43 VanDerWaalsContact CE1-CG 3.49Å; H39-E43 WeakPolarHBondContact CE1-CG 3.47Å; H39-E43 PolarHBondContact O-N 2.95Å |
| 40 | S | 87.9 | Confident | 83.2 | Confident | 70 Ų | 70 | 92.2 Ų | 92.2 | 49% | 0.49 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.9 | -40.1 | 178.7 | -174.4 | 0 | 0 | 0 | 0 | 112.6 | N36 N37 N38 S44 | N36-S40 VanDerWaalsContact O-CB 3.31Å; N36-S40 WeakPolarHBondContact O-CB 3.49Å; N36-S40 PolarHBondContact O-N 3.44Å; N37-S40 PolarHBondContact O-N 2.91Å; N38-S40 VanDerWaalsContact C-N 3.35Å; N38-S40 PolarHBondContact O-N 3.47Å; S40-S44 WeakPolarHBondContact O-CB 3.45Å; S40-S44 PolarHBondContact O-N 3.17Å; S40-S44 PolarHBondContact O-OG 3.08Å |
| 41 | I | 88.6 | Confident | 84.7 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.6 | -46.7 | 176.2 | -68.1 | 164.7 | 0 | 0 | 0 | 110.9 | N37 N38 H39 E43 S44 V45 | N37-I41 WeakPolarHBondContact O-CG1 3.4Å; N37-I41 PolarHBondContact O-N 3.33Å; N38-I41 PolarHBondContact O-N 3.49Å; H39-I41 VanDerWaalsContact C-N 3.32Å; H39-I41 PolarHBondContact O-N 3.43Å; I41-E43 PolarHBondContact O-N 3.43Å; I41-S44 PolarHBondContact O-N 3.12Å; I41-V45 WeakPolarHBondContact O-CG2 3.39Å; I41-V45 PolarHBondContact O-N 3.03Å |
| 42 | V | 90.7 | Very high | 85.9 | Confident | 91 Ų | 91 | 94.5 Ų | 94.5 | 55% | 0.552 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60 | -46.1 | -179.9 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | N38 H39 S44 V45 R46 | N38-V42 WeakPolarHBondContact O-CG2 3.29Å; N38-V42 PolarHBondContact O-N 2.91Å; H39-V42 PolarHBondContact O-N 3.17Å; V42-S44 VanDerWaalsContact C-N 3.32Å; V42-S44 PolarHBondContact O-N 3.32Å; V42-V45 PolarHBondContact O-N 3.43Å; V42-R46 WeakPolarHBondContact O-CB 3.37Å; V42-R46 PolarHBondContact O-N 3.38Å |
| 43 | E | 87.7 | Confident | 86.9 | Confident | 67 Ų | 67 | 92.2 Ų | 92.2 | 31% | 0.313 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.7 | -35.7 | 177.9 | -72.7 | -63.5 | 117.5 | 0 | 0 | 112.3 | H39 I41 R46 N47 | H39-E43 VanDerWaalsContact CE1-CG 3.49Å; H39-E43 WeakPolarHBondContact CE1-CG 3.47Å; H39-E43 PolarHBondContact O-N 2.95Å; I41-E43 PolarHBondContact O-N 3.43Å; E43-R46 PolarHBondContact O-N 3.5Å; E43-R46 IonicContact OE1-NH1 3.82Å; E43-N47 WeakPolarHBondContact O-CB 3.43Å; E43-N47 VanDerWaalsContact O-CG 3.31Å; E43-N47 PolarHBondContact O-N 2.78Å; E43-N47 PolarHBondContact O-ND2 2.89Å |
| 44 | S | 89.8 | Confident | 87.8 | Confident | 74 Ų | 74 | 98.9 Ų | 98.9 | 52% | 0.517 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 176 | -61.7 | 0 | 0 | 0 | 0 | 112.1 | S40 I41 V42 Y48 | S40-S44 WeakPolarHBondContact O-CB 3.45Å; S40-S44 PolarHBondContact O-N 3.17Å; S40-S44 PolarHBondContact O-OG 3.08Å; I41-S44 PolarHBondContact O-N 3.12Å; V42-S44 VanDerWaalsContact C-N 3.32Å; V42-S44 PolarHBondContact O-N 3.32Å; S44-Y48 PolarHBondContact O-N 3.17Å; S44-Y48 VanDerWaalsContact O-N 3.08Å |
| 45 | V | 91.4 | Very high | 88.6 | Confident | 80 Ų | 80 | 97.8 Ų | 97.8 | 49% | 0.485 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 176 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | I41 V42 N47 Y48 D49 | I41-V45 WeakPolarHBondContact O-CG2 3.39Å; I41-V45 PolarHBondContact O-N 3.03Å; V42-V45 PolarHBondContact O-N 3.43Å; V45-N47 PolarHBondContact O-N 3.18Å; V45-Y48 WeakPolarHBondContact O-CB 3.49Å; V45-Y48 PolarHBondContact O-N 3.26Å; V45-Y48 VanDerWaalsContact O-N 3.13Å; V45-D49 PolarHBondContact O-N 3.3Å |
| 46 | R | 90.7 | Very high | 89.1 | Confident | 141 Ų | 141 | 95.7 Ų | 95.7 | 53% | 0.532 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -58.5 | -47.1 | 178.1 | -170.9 | -175 | -160.9 | 148.2 | 9.1 | 112.4 | V42 E43 Y48 D49 E50 | V42-R46 WeakPolarHBondContact O-CB 3.37Å; V42-R46 PolarHBondContact O-N 3.38Å; E43-R46 PolarHBondContact O-N 3.5Å; E43-R46 IonicContact OE1-NH1 3.82Å; R46-Y48 VanDerWaalsContact C-N 3.27Å; R46-Y48 PolarHBondContact O-N 3.34Å; R46-D49 PolarHBondContact O-N 3.44Å; R46-E50 IonicContact NE-OE1 3.91Å; R46-E50 WeakPolarHBondContact O-CG 3.27Å; R46-E50 PolarHBondContact O-N 3.39Å |
| 47 | N | 90.6 | Very high | 90 | Very high | 93 Ų | 93 | 94.1 Ų | 94.1 | 50% | 0.497 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.5 | -36.1 | 177.5 | -76.5 | -26 | 0 | 0 | 0 | 112 | E43 V45 F51 | E43-N47 WeakPolarHBondContact O-CB 3.43Å; E43-N47 VanDerWaalsContact O-CG 3.31Å; E43-N47 PolarHBondContact O-N 2.78Å; E43-N47 PolarHBondContact O-ND2 2.89Å; V45-N47 PolarHBondContact O-N 3.18Å; N47-F51 VanDerWaalsContact O-CB 3.29Å; N47-F51 WeakPolarHBondContact O-CB 3.4Å; N47-F51 PolarHBondContact O-N 3.42Å |
| 48 | Y | 92.3 | Very high | 90.6 | Very high | 140 Ų | 140 | 95.7 Ų | 95.7 | 55% | 0.549 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.1 | -45.8 | 175.6 | -178.2 | -97.3 | 0 | 0 | 0 | 111.7 | S44 V45 R46 E50 F51 Q52 | S44-Y48 PolarHBondContact O-N 3.17Å; S44-Y48 VanDerWaalsContact O-N 3.08Å; V45-Y48 WeakPolarHBondContact O-CB 3.49Å; V45-Y48 PolarHBondContact O-N 3.26Å; V45-Y48 VanDerWaalsContact O-N 3.13Å; R46-Y48 VanDerWaalsContact C-N 3.27Å; R46-Y48 PolarHBondContact O-N 3.34Å; Y48-E50 PolarHBondContact O-N 3.04Å; Y48-F51 PolarHBondContact O-N 3.27Å; Y48-Q52 WeakPolarHBondContact O-CB 3.33Å; Y48-Q52 PolarHBondContact O-N 2.95Å |
| 49 | D | 90.1 | Very high | 91 | Very high | 100 Ų | 100 | 97.7 Ų | 97.7 | 54% | 0.535 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -42.1 | 178.4 | -70.8 | -16.6 | 0 | 0 | 0 | 111.8 | V45 R46 Q52 G53 | V45-D49 PolarHBondContact O-N 3.3Å; R46-D49 PolarHBondContact O-N 3.44Å; D49-Q52 PolarHBondContact O-N 2.77Å; D49-G53 PolarHBondContact O-N 3.32Å |
| 50 | E | 91.8 | Very high | 91.4 | Very high | 109 Ų | 109 | 98.2 Ų | 98.2 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 175.1 | -74.1 | -177.7 | -168.2 | 0 | 0 | 111.9 | R46 Y48 G53 R54 | R46-E50 IonicContact NE-OE1 3.91Å; R46-E50 WeakPolarHBondContact O-CG 3.27Å; R46-E50 PolarHBondContact O-N 3.39Å; Y48-E50 PolarHBondContact O-N 3.04Å; E50-G53 PolarHBondContact O-N 3.22Å; E50-R54 VanDerWaalsContact O-CG 3.29Å; E50-R54 WeakPolarHBondContact O-CG 3.37Å; E50-R54 PolarHBondContact O-N 3.22Å; E50-R54 VanDerWaalsContact O-N 3.15Å |
| 51 | F | 92 | Very high | 90.1 | Very high | 119 Ų | 119 | 103.9 Ų | 103.9 | 52% | 0.522 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.1 | -46.5 | 175.9 | 177.4 | -103.2 | 0 | 0 | 0 | 111.5 | N47 Y48 G53 R54 I55 | N47-F51 VanDerWaalsContact O-CB 3.29Å; N47-F51 WeakPolarHBondContact O-CB 3.4Å; N47-F51 PolarHBondContact O-N 3.42Å; Y48-F51 PolarHBondContact O-N 3.27Å; F51-G53 PolarHBondContact O-N 2.93Å; F51-R54 PolarHBondContact O-N 3.27Å; F51-I55 HydrophobicContact CD1-CG1 4.34Å; F51-I55 HydrophobicContact CE1-CD1 4.5Å; F51-I55 HydrophobicContact CE1-CG1 3.85Å; F51-I55 HydrophobicContact CE2-CD1 4.21Å; F51-I55 HydrophobicContact CE2-CG1 4.14Å; F51-I55 HydrophobicContact CZ-CD1 3.91Å; F51-I55 HydrophobicContact CZ-CG1 3.74Å; F51-I55 WeakPolarHBondContact O-CG1 3.31Å; F51-I55 PolarHBondContact O-N 3.16Å |
| 52 | Q | 91.5 | Very high | 90.1 | Very high | 66 Ų | 66 | 104.1 Ų | 104.1 | 31% | 0.308 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -59.3 | -46.5 | 178.2 | -174 | 61.9 | 51 | 0 | 0 | 110.9 | Y48 D49 R54 I55 D56 | Y48-Q52 WeakPolarHBondContact O-CB 3.33Å; Y48-Q52 PolarHBondContact O-N 2.95Å; D49-Q52 PolarHBondContact O-N 2.77Å; Q52-R54 VanDerWaalsContact C-N 3.27Å; Q52-R54 PolarHBondContact O-N 3.04Å; Q52-I55 PolarHBondContact O-N 3.38Å; Q52-I55 VanDerWaalsContact O-N 3.1Å; Q52-D56 PolarHBondContact NE2-OD1 2.92Å; Q52-D56 VanDerWaalsContact O-CG 3.3Å; Q52-D56 PolarHBondContact O-N 2.86Å |
| 53 | G | 92 | Very high | 90.1 | Very high | 38 Ų | 38 | 104.7 Ų | 104.7 | 39% | 0.392 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.4 | -34.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | D49 E50 F51 S57 | D49-G53 PolarHBondContact O-N 3.32Å; E50-G53 PolarHBondContact O-N 3.22Å; F51-G53 PolarHBondContact O-N 2.93Å; G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.23Å |
| 54 | R | 93.6 | Very high | 90.2 | Very high | 196 Ų | 196 | 106.8 Ų | 106.8 | 74% | 0.74 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -69.5 | -38.9 | 175.1 | -68.1 | 173.3 | 88.3 | -175.3 | 7.1 | 112.1 | E50 F51 Q52 L58 | E50-R54 VanDerWaalsContact O-CG 3.29Å; E50-R54 WeakPolarHBondContact O-CG 3.37Å; E50-R54 PolarHBondContact O-N 3.22Å; E50-R54 VanDerWaalsContact O-N 3.15Å; F51-R54 PolarHBondContact O-N 3.27Å; Q52-R54 VanDerWaalsContact C-N 3.27Å; Q52-R54 PolarHBondContact O-N 3.04Å; R54-L58 WeakPolarHBondContact O-CB 3.35Å; R54-L58 PolarHBondContact O-N 2.86Å |
| 55 | I | 93.1 | Very high | 90.3 | Very high | 57 Ų | 57 | 108.8 Ų | 108.8 | 29% | 0.292 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.4 | -45.1 | 175.2 | -65.9 | -63 | 0 | 0 | 0 | 110.8 | F51 Q52 S57 L58 L59 | F51-I55 HydrophobicContact CD1-CG1 4.34Å; F51-I55 HydrophobicContact CE1-CD1 4.5Å; F51-I55 HydrophobicContact CE1-CG1 3.85Å; F51-I55 HydrophobicContact CE2-CD1 4.21Å; F51-I55 HydrophobicContact CE2-CG1 4.14Å; F51-I55 HydrophobicContact CZ-CD1 3.91Å; F51-I55 HydrophobicContact CZ-CG1 3.74Å; F51-I55 WeakPolarHBondContact O-CG1 3.31Å; F51-I55 PolarHBondContact O-N 3.16Å; Q52-I55 PolarHBondContact O-N 3.38Å; Q52-I55 VanDerWaalsContact O-N 3.1Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.01Å; I55-L58 WeakPolarHBondContact O-CB 3.26Å; I55-L58 PolarHBondContact O-N 2.72Å; I55-L59 HydrophobicContact CG2-CD1 3.83Å; I55-L59 HydrophobicContact CG2-CG 4.31Å; I55-L59 WeakPolarHBondContact O-CG 3.38Å; I55-L59 PolarHBondContact O-N 2.77Å |
| 56 | D | 93.1 | Very high | 90.2 | Very high | 76 Ų | 76 | 110.6 Ų | 110.6 | 41% | 0.406 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.2 | -42.9 | 178 | -67.6 | -14.7 | 0 | 0 | 0 | 111.1 | Q52 L58 L59 T60 | Q52-D56 PolarHBondContact NE2-OD1 2.92Å; Q52-D56 VanDerWaalsContact O-CG 3.3Å; Q52-D56 PolarHBondContact O-N 2.86Å; D56-L58 VanDerWaalsContact C-N 3.3Å; D56-L58 PolarHBondContact O-N 3.01Å; D56-L59 PolarHBondContact O-N 2.85Å; D56-T60 WeakPolarHBondContact O-CB 3.4Å; D56-T60 PolarHBondContact O-N 2.63Å; D56-T60 VanDerWaalsContact O-N 3.15Å; D56-T60 PolarHBondContact O-OG1 2.73Å |
| 57 | S | 93.5 | Very high | 90.2 | Very high | 68 Ų | 68 | 108.5 Ų | 108.5 | 48% | 0.476 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.8 | -31.7 | 174.7 | -175.8 | 0 | 0 | 0 | 0 | 113.2 | G53 I55 N61 | G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.23Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.01Å; S57-N61 PolarHBondContact O-ND2 2.95Å |
| 58 | L | 94.3 | Very high | 90.1 | Very high | 123 Ų | 123 | 109.6 Ų | 109.6 | 64% | 0.644 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -73.4 | -36.9 | 176.9 | -179.7 | 67.6 | 0 | 0 | 0 | 111.6 | R54 I55 D56 | R54-L58 WeakPolarHBondContact O-CB 3.35Å; R54-L58 PolarHBondContact O-N 2.86Å; I55-L58 WeakPolarHBondContact O-CB 3.26Å; I55-L58 PolarHBondContact O-N 2.72Å; D56-L58 VanDerWaalsContact C-N 3.3Å; D56-L58 PolarHBondContact O-N 3.01Å |
| 59 | L | 93.8 | Very high | 90 | Very high | 135 Ų | 135 | 107.3 Ų | 107.3 | 71% | 0.707 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -79 | -19.5 | -177.9 | -67.4 | 173.9 | 0 | 0 | 0 | 113.5 | I55 D56 | I55-L59 HydrophobicContact CG2-CD1 3.83Å; I55-L59 HydrophobicContact CG2-CG 4.31Å; I55-L59 WeakPolarHBondContact O-CG 3.38Å; I55-L59 PolarHBondContact O-N 2.77Å; D56-L59 PolarHBondContact O-N 2.85Å |
| 60 | T | 90.4 | Very high | 90 | Very high | 120 Ų | 120 | 107.9 Ų | 107.9 | 74% | 0.736 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -93.8 | -14.1 | -176.8 | -46.3 | 0 | 0 | 0 | 0 | 113.1 | D56 | D56-T60 WeakPolarHBondContact O-CB 3.4Å; D56-T60 PolarHBondContact O-N 2.63Å; D56-T60 VanDerWaalsContact O-N 3.15Å; D56-T60 PolarHBondContact O-OG1 2.73Å |
| 61 | N | 60.6 | Low | 89.8 | Confident | 188 Ų | 188 | 107.8 Ų | 107.8 | 100% | 1.005 | 57% | 0.566 | S | S | * | * | trans | -105 | 0 | 175.8 | -69.4 | -64.8 | 0 | 0 | 0 | 111.6 | S57 | S57-N61 PolarHBondContact O-ND2 2.95Š|
Retrieved 61 of 61 residues in 60.8 ms
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