| 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 | 49.3 | Very low | 50.9 | Low | 240 Ų | 240 | 142.9 Ų | 142.9 | 100% | 1.182 | 83% | 0.828 | S | S | * | * | 0 | 91.2 | 0 | -62.8 | 171.6 | -178.2 | 0 | 0 | 103.5 | |||||
| 2 | E | 53.9 | Low | 50.7 | Low | 202 Ų | 202 | 142.9 Ų | 142.9 | 94% | 0.944 | 83% | 0.832 | S | S | * | * | -131.5 | 155.6 | 82.2 | -74.3 | 146.1 | 108.5 | 0 | 0 | 113.8 | |||||
| 3 | N | 44.1 | Very low | 51.3 | Low | 147 Ų | 147 | 140.4 Ų | 140.4 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | trans | -107.2 | 147.8 | -169.4 | -176.3 | 34 | 0 | 0 | 0 | 108.9 | ||||
| 4 | S | 51.6 | Low | 50.8 | Low | 76 Ų | 76 | 142 Ų | 142 | 53% | 0.531 | 83% | 0.827 | S | S | . | * | trans | 76 | 116.3 | 140.7 | -93.6 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 5 | T | 55.9 | Low | 50.4 | Low | 135 Ų | 135 | 143.5 Ų | 143.5 | 83% | 0.828 | 82% | 0.823 | S | S | * | * | 73 | 140.1 | 124.2 | 57.6 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 6 | A | 54.1 | Low | 50.4 | Low | 94 Ų | 94 | 140.1 Ų | 140.1 | 78% | 0.777 | 82% | 0.817 | S | S | * | * | cis | -151.2 | 149.9 | 27.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 7 | V | 56.6 | Low | 50.1 | Low | 147 Ų | 147 | 142.2 Ų | 142.2 | 89% | 0.891 | 81% | 0.814 | S | S | * | * | trans | -68.2 | 141.7 | 160.4 | -82.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 8 | A | 50.3 | Low | 50.4 | Low | 105 Ų | 105 | 140.7 Ų | 140.7 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | trans | -168.4 | 91.2 | 139.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 9 | F | 48.9 | Very low | 50.7 | Low | 210 Ų | 210 | 140.8 Ų | 140.8 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 148.7 | 164.6 | -176.7 | -99.3 | 0 | 0 | 0 | 109.7 | ||
| 10 | N | 44.7 | Very low | 50.9 | Low | 138 Ų | 138 | 137.6 Ų | 137.6 | 74% | 0.738 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 162.2 | -157.6 | -166.6 | 25.4 | 0 | 0 | 0 | 115.5 | ||
| 11 | A | 50.8 | Low | 51.1 | Low | 78 Ų | 78 | 140.6 Ų | 140.6 | 65% | 0.645 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 158.8 | -174 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 12 | T | 48.3 | Very low | 51.2 | Low | 143 Ų | 143 | 134.8 Ų | 134.8 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | -162.2 | 157.6 | 127.4 | -4 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 13 | P | 58.9 | Low | 50.8 | Low | 110 Ų | 110 | 133.1 Ų | 133.1 | 71% | 0.714 | 77% | 0.774 | S | S | * | * | trans | -91 | 150.9 | -153.3 | 38.4 | -37.6 | 0 | 0 | 0 | 112.2 | ||||
| 14 | D | 43.3 | Very low | 51.5 | Low | 163 Ų | 163 | 133.1 Ų | 133.1 | 87% | 0.872 | 77% | 0.773 | S | S | * | * | trans | -131.4 | 133.4 | 158.3 | -161.9 | 19.4 | 0 | 0 | 0 | 111.1 | ||||
| 15 | Q | 44.9 | Very low | 51.6 | Low | 164 Ų | 164 | 137.2 Ų | 137.2 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | trans | -83.4 | 156.6 | -170.9 | -75.6 | -90.4 | -45.8 | 0 | 0 | 110.5 | ||||
| 16 | A | 50.5 | Low | 51.8 | Low | 89 Ų | 89 | 135.1 Ų | 135.1 | 74% | 0.736 | 77% | 0.774 | S | S | * | * | trans | 67.4 | 106.6 | 153.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 17 | K | 46 | Very low | 52.1 | Low | 177 Ų | 177 | 134.8 Ų | 134.8 | 77% | 0.77 | 76% | 0.763 | S | S | * | * | -151 | 93.5 | 129.4 | -168.2 | 169.7 | -178.7 | 171.4 | 0 | 111.7 | E19 | K17-E19 HydrophobicContact CD-CB 4.38Å; K17-E19 HydrophobicContact CD-CG 4.46Å; K17-E19 HydrophobicContact CG-CB 3.78Å; K17-E19 HydrophobicContact CG-CG 3.61Å; K17-E19 PolarHBondContact O-N 3.48Å | |||
| 18 | P | 55.5 | Low | 52.2 | Low | 115 Ų | 115 | 134.3 Ų | 134.3 | 75% | 0.747 | 76% | 0.755 | S | S | * | * | trans | -92.7 | 71 | 162.7 | 36.4 | -26.3 | 0 | 0 | 0 | 108.3 | ||||
| 19 | E | 56.4 | Low | 52.6 | Low | 142 Ų | 142 | 137.4 Ų | 137.4 | 66% | 0.664 | 75% | 0.746 | S | S | * | * | trans | -135.6 | 109.7 | -176.4 | -48 | -95.1 | 134.5 | 0 | 0 | 109.7 | K17 | K17-E19 HydrophobicContact CD-CB 4.38Å; K17-E19 HydrophobicContact CD-CG 4.46Å; K17-E19 HydrophobicContact CG-CB 3.78Å; K17-E19 HydrophobicContact CG-CG 3.61Å; K17-E19 PolarHBondContact O-N 3.48Å | ||
| 20 | A | 54.3 | Low | 53.3 | Low | 76 Ų | 76 | 133.2 Ų | 133.2 | 63% | 0.628 | 73% | 0.733 | S | S | * | * | trans | 82.6 | 67.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | T22 | A20-T22 VanDerWaalsContact C-N 3.28Š| ||
| 21 | M | 53.8 | Low | 54.1 | Low | 202 Ų | 202 | 132.2 Ų | 132.2 | 100% | 0.995 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -99.5 | 32.9 | 141.1 | -72.6 | -170.2 | -174.3 | 0 | 0 | 111.6 | ||
| 22 | T | 51.6 | Low | 54.8 | Low | 118 Ų | 118 | 134.6 Ų | 134.6 | 72% | 0.724 | 73% | 0.734 | S | S | * | * | trans | -118.8 | 49 | 163 | -32.3 | 0 | 0 | 0 | 0 | 108.5 | A20 L24 | A20-T22 VanDerWaalsContact C-N 3.28Å; T22-L24 PolarHBondContact O-N 3.21Å | ||
| 23 | Q | 47 | Very low | 55.9 | Low | 166 Ų | 166 | 132.1 Ų | 132.1 | 78% | 0.776 | 72% | 0.715 | S | S | * | * | trans | -71.4 | 92 | 154.3 | -82.5 | -164.1 | -86.6 | 0 | 0 | 106.4 | M25 | Q23-M25 PolarHBondContact O-N 3.25Š| ||
| 24 | L | 58.4 | Low | 56.8 | Low | 148 Ų | 148 | 128.9 Ų | 128.9 | 78% | 0.775 | 70% | 0.702 | S | S | * | * | trans | -44.7 | 112.3 | 155.9 | -68.5 | 167.3 | 0 | 0 | 0 | 105.9 | T22 P26 | T22-L24 PolarHBondContact O-N 3.21Å; L24-P26 VanDerWaalsContact O-CD 3.26Å; L24-P26 WeakPolarHBondContact O-CD 3.48Å; L24-P26 VanDerWaalsContact O-N 3.1Å | ||
| 25 | M | 53.1 | Low | 58.8 | Low | 162 Ų | 162 | 129 Ų | 129 | 80% | 0.798 | 69% | 0.691 | S | S | * | * | trans | -56.5 | 120.2 | 175.4 | -48.4 | -164.1 | -177.8 | 0 | 0 | 105.4 | Q23 T27 | Q23-M25 PolarHBondContact O-N 3.25Å; M25-T27 PolarHBondContact O-N 3.3Å | ||
| 26 | P | 59.9 | Low | 60.8 | Low | 90 Ų | 90 | 126.7 Ų | 126.7 | 58% | 0.584 | 68% | 0.683 | S | S | * | * | trans | -66.8 | 95.9 | 163.5 | 28.1 | -28.2 | 0 | 0 | 0 | 103.9 | L24 N28 | L24-P26 VanDerWaalsContact O-CD 3.26Å; L24-P26 WeakPolarHBondContact O-CD 3.48Å; L24-P26 VanDerWaalsContact O-N 3.1Å; P26-N28 PolarHBondContact O-N 2.79Å; P26-N28 PolarHBondContact O-ND2 3.04Å | ||
| 27 | T | 61.5 | Low | 62.6 | Low | 88 Ų | 88 | 128 Ų | 128 | 54% | 0.54 | 68% | 0.678 | S | S | . | * | trans | -54.9 | 105.1 | 161.2 | 47.2 | 0 | 0 | 0 | 0 | 103.5 | M25 Y29 | M25-T27 PolarHBondContact O-N 3.3Å; T27-Y29 VanDerWaalsContact O-CD1 3.22Å; T27-Y29 WeakPolarHBondContact O-CD1 3.49Å; T27-Y29 VanDerWaalsContact O-CD2 3.24Å; T27-Y29 WeakPolarHBondContact O-CD2 3.25Å; T27-Y29 WeakPolarHBondContact O-CE1 3.42Å; T27-Y29 WeakPolarHBondContact O-CE2 3.09Å; T27-Y29 VanDerWaalsContact O-CG 3.24Å; T27-Y29 PolarHBondContact O-N 3.33Å; T27-Y29 WeakPolarHBondContact OG1-CD1 3.3Å; T27-Y29 WeakPolarHBondContact OG1-CE1 3.09Å | ||
| 28 | N | 57.4 | Low | 64.8 | Low | 136 Ų | 136 | 122.4 Ų | 122.4 | 73% | 0.727 | 67% | 0.665 | S | S | * | * | trans | -62.1 | 99.1 | 172.5 | -86.1 | -107.9 | 0 | 0 | 0 | 104.9 | P26 D30 | P26-N28 PolarHBondContact O-N 2.79Å; P26-N28 PolarHBondContact O-ND2 3.04Å; N28-D30 PolarHBondContact O-N 2.95Å | ||
| 29 | Y | 60 | Low | 66.6 | Low | 171 Ų | 171 | 120.2 Ų | 120.2 | 67% | 0.671 | 65% | 0.646 | S | S | * | * | trans | -75.9 | 70.1 | 169.9 | -9.2 | -101.7 | 0 | 0 | 0 | 105.6 | T27 | T27-Y29 VanDerWaalsContact O-CD1 3.22Å; T27-Y29 WeakPolarHBondContact O-CD1 3.49Å; T27-Y29 VanDerWaalsContact O-CD2 3.24Å; T27-Y29 WeakPolarHBondContact O-CD2 3.25Å; T27-Y29 WeakPolarHBondContact O-CE1 3.42Å; T27-Y29 WeakPolarHBondContact O-CE2 3.09Å; T27-Y29 VanDerWaalsContact O-CG 3.24Å; T27-Y29 PolarHBondContact O-N 3.33Å; T27-Y29 WeakPolarHBondContact OG1-CD1 3.3Å; T27-Y29 WeakPolarHBondContact OG1-CE1 3.09Å | ||
| 30 | D | 63.8 | Low | 68.4 | Low | 121 Ų | 121 | 118.3 Ų | 118.3 | 65% | 0.647 | 64% | 0.64 | S | S | * | * | trans | -95.2 | 105.3 | -174.4 | -159.1 | 54.4 | 0 | 0 | 0 | 107.7 | N28 D32 | N28-D30 PolarHBondContact O-N 2.95Å; D30-D32 VanDerWaalsContact C-N 3.3Å; D30-D32 PolarHBondContact O-N 3.32Å | ||
| 31 | V | 61.3 | Low | 70.3 | Confident | 118 Ų | 118 | 116.5 Ų | 116.5 | 72% | 0.715 | 63% | 0.629 | S | S | * | * | S | Bend | trans | 69.3 | -16.6 | 153 | -170.9 | 0 | 0 | 0 | 0 | 119.2 | ||
| 32 | D | 65.2 | Low | 72.3 | Confident | 127 Ų | 127 | 109.7 Ų | 109.7 | 68% | 0.679 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -96.2 | -9.6 | 175.2 | -83.2 | -62.4 | 0 | 0 | 0 | 114.8 | D30 | D30-D32 VanDerWaalsContact C-N 3.3Å; D30-D32 PolarHBondContact O-N 3.32Å |
| 33 | D | 70.6 | Confident | 74.5 | Confident | 91 Ų | 91 | 108 Ų | 108 | 49% | 0.487 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68.1 | -39.2 | -179.3 | 62.3 | -18.5 | 0 | 0 | 0 | 112.8 | Y35 L36 D37 | D33-Y35 PolarHBondContact O-N 3.31Å; D33-L36 PolarHBondContact O-N 3.05Å; D33-D37 WeakPolarHBondContact O-CB 3.06Å; D33-D37 PolarHBondContact O-N 3.39Å |
| 34 | G | 79.1 | Confident | 76.9 | Confident | 42 Ų | 42 | 104.6 Ų | 104.6 | 43% | 0.433 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.2 | -29.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A38 | G34-A38 WeakPolarHBondContact O-CB 3.31Å; G34-A38 PolarHBondContact O-N 3.41Å |
| 35 | Y | 85.5 | Confident | 78.7 | Confident | 166 Ų | 166 | 100.3 Ų | 100.3 | 65% | 0.651 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71.8 | -44.2 | 175 | 178.8 | -109.1 | 0 | 0 | 0 | 111.6 | D33 A38 I39 | D33-Y35 PolarHBondContact O-N 3.31Å; Y35-A38 PolarHBondContact O-N 3.17Å; Y35-I39 HydrophobicContact CD1-CD1 3.64Å; Y35-I39 HydrophobicContact CD2-CD1 4.42Å; Y35-I39 HydrophobicContact CE1-CD1 3.19Å; Y35-I39 HydrophobicContact CE1-CG1 4.31Å; Y35-I39 HydrophobicContact CE2-CD1 4.04Å; Y35-I39 HydrophobicContact CE2-CG1 4.37Å; Y35-I39 HydrophobicContact CG-CD1 4.24Å; Y35-I39 VanDerWaalsContact CZ-CD1 3.41Å; Y35-I39 VanDerWaalsContact O-CG1 3.28Å; Y35-I39 WeakPolarHBondContact O-CG1 3.35Å; Y35-I39 PolarHBondContact O-N 3.46Å |
| 36 | L | 86.6 | Confident | 80.8 | Confident | 116 Ų | 116 | 95 Ų | 95 | 61% | 0.607 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.6 | -39.9 | 177.2 | -63.6 | -179.9 | 0 | 0 | 0 | 111.8 | D33 I39 L40 | D33-L36 PolarHBondContact O-N 3.05Å; L36-I39 HydrophobicContact CD2-CD1 4.48Å; L36-I39 PolarHBondContact O-N 3.26Å; L36-L40 WeakPolarHBondContact O-CB 3.25Å; L36-L40 PolarHBondContact O-N 3.46Å |
| 37 | D | 88.6 | Confident | 82.7 | Confident | 116 Ų | 116 | 94.7 Ų | 94.7 | 62% | 0.62 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.2 | -42.1 | 174.6 | -169.6 | 43.8 | 0 | 0 | 0 | 111.3 | D33 I39 L40 G41 | D33-D37 WeakPolarHBondContact O-CB 3.06Å; D33-D37 PolarHBondContact O-N 3.39Å; D37-I39 PolarHBondContact O-N 3.35Å; D37-L40 PolarHBondContact O-N 3.16Å; D37-G41 PolarHBondContact O-N 3.26Å |
| 38 | A | 91.5 | Very high | 84.4 | Confident | 60 Ų | 60 | 94.3 Ų | 94.3 | 50% | 0.496 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G34 Y35 A42 | G34-A38 WeakPolarHBondContact O-CB 3.31Å; G34-A38 PolarHBondContact O-N 3.41Å; Y35-A38 PolarHBondContact O-N 3.17Å; A38-A42 WeakPolarHBondContact O-CB 3.45Å; A38-A42 PolarHBondContact O-N 2.99Å |
| 39 | I | 93.7 | Very high | 86.3 | Confident | 69 Ų | 69 | 93 Ų | 93 | 35% | 0.354 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.4 | -48.4 | 174.4 | -71 | 163.4 | 0 | 0 | 0 | 110.2 | Y35 L36 D37 G41 A42 V43 | Y35-I39 HydrophobicContact CD1-CD1 3.64Å; Y35-I39 HydrophobicContact CD2-CD1 4.42Å; Y35-I39 HydrophobicContact CE1-CD1 3.19Å; Y35-I39 HydrophobicContact CE1-CG1 4.31Å; Y35-I39 HydrophobicContact CE2-CD1 4.04Å; Y35-I39 HydrophobicContact CE2-CG1 4.37Å; Y35-I39 HydrophobicContact CG-CD1 4.24Å; Y35-I39 VanDerWaalsContact CZ-CD1 3.41Å; Y35-I39 VanDerWaalsContact O-CG1 3.28Å; Y35-I39 WeakPolarHBondContact O-CG1 3.35Å; Y35-I39 PolarHBondContact O-N 3.46Å; L36-I39 HydrophobicContact CD2-CD1 4.48Å; L36-I39 PolarHBondContact O-N 3.26Å; D37-I39 PolarHBondContact O-N 3.35Å; I39-G41 VanDerWaalsContact C-N 3.35Å; I39-G41 PolarHBondContact O-N 3.38Å; I39-A42 PolarHBondContact O-N 3.49Å; I39-V43 HydrophobicContact CG2-CG2 4.27Å; I39-V43 VanDerWaalsContact O-CG2 3.3Å; I39-V43 WeakPolarHBondContact O-CG2 3.35Å; I39-V43 PolarHBondContact O-N 3.12Å |
| 40 | L | 92.5 | Very high | 88.1 | Confident | 102 Ų | 102 | 89.2 Ų | 89.2 | 53% | 0.534 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.9 | -47.7 | -179.3 | -178.3 | 63.8 | 0 | 0 | 0 | 110.7 | L36 D37 A42 V43 I44 | L36-L40 WeakPolarHBondContact O-CB 3.25Å; L36-L40 PolarHBondContact O-N 3.46Å; D37-L40 PolarHBondContact O-N 3.16Å; L40-A42 PolarHBondContact O-N 3.02Å; L40-V43 PolarHBondContact O-N 3.06Å; L40-I44 HydrophobicContact CD1-CD1 4.13Å; L40-I44 HydrophobicContact CG-CD1 3.97Å; L40-I44 VanDerWaalsContact O-CG1 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.09Å; L40-I44 PolarHBondContact O-N 2.66Å |
| 41 | G | 95 | Very high | 89.7 | Confident | 38 Ų | 38 | 88.6 Ų | 88.6 | 39% | 0.392 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.2 | -42.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D37 I39 I44 A45 | D37-G41 PolarHBondContact O-N 3.26Å; I39-G41 VanDerWaalsContact C-N 3.35Å; I39-G41 PolarHBondContact O-N 3.38Å; G41-I44 PolarHBondContact O-N 3.16Å; G41-A45 WeakPolarHBondContact O-CB 3.27Å; G41-A45 PolarHBondContact O-N 2.89Å |
| 42 | A | 95.9 | Very high | 91.5 | Very high | 59 Ų | 59 | 86.9 Ų | 86.9 | 49% | 0.488 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.1 | -41 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | A38 I39 L40 A45 A46 | A38-A42 WeakPolarHBondContact O-CB 3.45Å; A38-A42 PolarHBondContact O-N 2.99Å; I39-A42 PolarHBondContact O-N 3.49Å; L40-A42 PolarHBondContact O-N 3.02Å; A42-A45 PolarHBondContact O-N 3.45Å; A42-A46 WeakPolarHBondContact O-CB 3.35Å; A42-A46 PolarHBondContact O-N 2.86Å |
| 43 | V | 97.4 | Very high | 93 | Very high | 82 Ų | 82 | 83.9 Ų | 83.9 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.8 | -47.8 | 176.9 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | I39 L40 A45 A46 V47 | I39-V43 HydrophobicContact CG2-CG2 4.27Å; I39-V43 VanDerWaalsContact O-CG2 3.3Å; I39-V43 WeakPolarHBondContact O-CG2 3.35Å; I39-V43 PolarHBondContact O-N 3.12Å; L40-V43 PolarHBondContact O-N 3.06Å; V43-A45 VanDerWaalsContact C-N 3.35Å; V43-A45 PolarHBondContact O-N 3Å; V43-A46 PolarHBondContact O-N 3.37Å; V43-V47 WeakPolarHBondContact O-CG2 3.28Å; V43-V47 PolarHBondContact O-N 3.22Å |
| 44 | I | 97.4 | Very high | 94.2 | Very high | 95 Ų | 95 | 84.4 Ų | 84.4 | 49% | 0.487 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 177.7 | -65 | 165.4 | 0 | 0 | 0 | 110 | L40 G41 A46 V47 V48 | L40-I44 HydrophobicContact CD1-CD1 4.13Å; L40-I44 HydrophobicContact CG-CD1 3.97Å; L40-I44 VanDerWaalsContact O-CG1 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.09Å; L40-I44 PolarHBondContact O-N 2.66Å; G41-I44 PolarHBondContact O-N 3.16Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 3.26Å; I44-V47 PolarHBondContact O-N 2.8Å; I44-V48 HydrophobicContact CG2-CG2 4.43Å; I44-V48 WeakPolarHBondContact O-CG2 3.19Å; I44-V48 PolarHBondContact O-N 2.87Å |
| 45 | A | 97.1 | Very high | 95 | Very high | 57 Ų | 57 | 84.6 Ų | 84.6 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G41 A42 V43 V48 L49 | G41-A45 WeakPolarHBondContact O-CB 3.27Å; G41-A45 PolarHBondContact O-N 2.89Å; A42-A45 PolarHBondContact O-N 3.45Å; V43-A45 VanDerWaalsContact C-N 3.35Å; V43-A45 PolarHBondContact O-N 3Å; A45-V48 PolarHBondContact O-N 3.39Å; A45-L49 WeakPolarHBondContact O-CB 3.49Å; A45-L49 PolarHBondContact O-N 3.01Å |
| 46 | A | 97.6 | Very high | 95.4 | Very high | 52 Ų | 52 | 80.9 Ų | 80.9 | 43% | 0.43 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A42 V43 I44 L49 V50 | A42-A46 WeakPolarHBondContact O-CB 3.35Å; A42-A46 PolarHBondContact O-N 2.86Å; V43-A46 PolarHBondContact O-N 3.37Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 3.26Å; A46-L49 PolarHBondContact O-N 3.47Å; A46-V50 WeakPolarHBondContact O-CB 3.49Å; A46-V50 VanDerWaalsContact O-CG2 3.26Å; A46-V50 WeakPolarHBondContact O-CG2 3.4Å; A46-V50 PolarHBondContact O-N 2.73Å |
| 47 | V | 98.1 | Very high | 95.8 | Very high | 83 Ų | 83 | 79.7 Ų | 79.7 | 50% | 0.503 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61 | -49.8 | 176.3 | 172.7 | 0 | 0 | 0 | 0 | 110.4 | V43 I44 L49 V50 L51 | V43-V47 WeakPolarHBondContact O-CG2 3.28Å; V43-V47 PolarHBondContact O-N 3.22Å; I44-V47 PolarHBondContact O-N 2.8Å; V47-L49 VanDerWaalsContact C-N 3.32Å; V47-L49 PolarHBondContact O-N 3.13Å; V47-V50 PolarHBondContact O-N 2.82Å; V47-L51 HydrophobicContact CG1-CD1 4.21Å; V47-L51 WeakPolarHBondContact O-CG 3.44Å; V47-L51 PolarHBondContact O-N 2.87Å |
| 48 | V | 98 | Very high | 95.9 | Very high | 79 Ų | 79 | 77.3 Ų | 77.3 | 48% | 0.479 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -44 | 178 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | I44 A45 V50 L51 V52 | I44-V48 HydrophobicContact CG2-CG2 4.43Å; I44-V48 WeakPolarHBondContact O-CG2 3.19Å; I44-V48 PolarHBondContact O-N 2.87Å; A45-V48 PolarHBondContact O-N 3.39Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.66Å; V48-L51 PolarHBondContact O-N 3.19Å; V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.39Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.32Å; V48-V52 PolarHBondContact O-N 2.99Å |
| 49 | L | 97.8 | Very high | 95.9 | Very high | 109 Ų | 109 | 78.4 Ų | 78.4 | 57% | 0.571 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.1 | -41.4 | 178 | -177.6 | 137.1 | 0 | 0 | 0 | 111.7 | A45 A46 V47 V52 C53 | A45-L49 WeakPolarHBondContact O-CB 3.49Å; A45-L49 PolarHBondContact O-N 3.01Å; A46-L49 PolarHBondContact O-N 3.47Å; V47-L49 VanDerWaalsContact C-N 3.32Å; V47-L49 PolarHBondContact O-N 3.13Å; L49-V52 PolarHBondContact O-N 2.81Å; L49-C53 WeakPolarHBondContact O-CB 3.37Å; L49-C53 PolarHBondContact O-N 3.45Å; L49-C53 PolarHBondContact O-SG 2.76Å |
| 50 | V | 97.7 | Very high | 95.7 | Very high | 92 Ų | 92 | 82.8 Ų | 82.8 | 56% | 0.558 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.4 | -44.1 | 175.1 | 169.6 | 0 | 0 | 0 | 0 | 110.9 | A46 V47 V48 C53 L54 | A46-V50 WeakPolarHBondContact O-CB 3.49Å; A46-V50 VanDerWaalsContact O-CG2 3.26Å; A46-V50 WeakPolarHBondContact O-CG2 3.4Å; A46-V50 PolarHBondContact O-N 2.73Å; V47-V50 PolarHBondContact O-N 2.82Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.66Å; V50-C53 PolarHBondContact O-N 2.85Å; V50-L54 VanDerWaalsContact O-CB 3.31Å; V50-L54 WeakPolarHBondContact O-CB 3.12Å; V50-L54 PolarHBondContact O-N 3.21Å |
| 51 | L | 97.4 | Very high | 95.4 | Very high | 107 Ų | 107 | 84.8 Ų | 84.8 | 56% | 0.56 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.3 | -43.8 | 177.4 | -67.6 | 176.3 | 0 | 0 | 0 | 112 | V47 V48 L54 A55 | V47-L51 HydrophobicContact CG1-CD1 4.21Å; V47-L51 WeakPolarHBondContact O-CG 3.44Å; V47-L51 PolarHBondContact O-N 2.87Å; V48-L51 PolarHBondContact O-N 3.19Å; L51-L54 PolarHBondContact O-N 2.83Å; L51-A55 WeakPolarHBondContact O-CB 3.47Å; L51-A55 PolarHBondContact O-N 3.21Å |
| 52 | V | 97.9 | Very high | 94.8 | Very high | 82 Ų | 82 | 88.2 Ų | 88.2 | 50% | 0.497 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -45.6 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | V48 L49 L54 A55 V56 | V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.39Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.32Å; V48-V52 PolarHBondContact O-N 2.99Å; L49-V52 PolarHBondContact O-N 2.81Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.42Å; V52-A55 PolarHBondContact O-N 3.33Å; V52-V56 HydrophobicContact CG1-CG2 4.37Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.28Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.83Å |
| 53 | C | 96.9 | Very high | 94.1 | Very high | 65 Ų | 65 | 94.8 Ų | 94.8 | 44% | 0.439 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.7 | -45.8 | 175.4 | -78.7 | 0 | 0 | 0 | 0 | 111.3 | L49 V50 V56 V57 | L49-C53 WeakPolarHBondContact O-CB 3.37Å; L49-C53 PolarHBondContact O-N 3.45Å; L49-C53 PolarHBondContact O-SG 2.76Å; V50-C53 PolarHBondContact O-N 2.85Å; C53-V56 PolarHBondContact O-N 3.2Å; C53-V57 WeakPolarHBondContact O-CB 3.28Å; C53-V57 VanDerWaalsContact O-CG2 3.27Å; C53-V57 WeakPolarHBondContact O-CG2 3.27Å; C53-V57 PolarHBondContact O-N 3.43Å |
| 54 | L | 96.2 | Very high | 93.1 | Very high | 102 Ų | 102 | 99.8 Ų | 99.8 | 53% | 0.534 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -46.5 | 176.6 | -179.5 | 63.1 | 0 | 0 | 0 | 110.9 | V50 L51 V52 V56 V57 V58 | V50-L54 VanDerWaalsContact O-CB 3.31Å; V50-L54 WeakPolarHBondContact O-CB 3.12Å; V50-L54 PolarHBondContact O-N 3.21Å; L51-L54 PolarHBondContact O-N 2.83Å; V52-L54 VanDerWaalsContact C-N 3.34Å; V52-L54 PolarHBondContact O-N 3.42Å; L54-V56 PolarHBondContact O-N 2.8Å; L54-V57 PolarHBondContact O-N 3.25Å; L54-V58 HydrophobicContact CD1-CG2 4.19Å; L54-V58 HydrophobicContact CG-CG2 4.37Å; L54-V58 WeakPolarHBondContact O-CB 3.47Å; L54-V58 VanDerWaalsContact O-CG2 3.28Å; L54-V58 WeakPolarHBondContact O-CG2 3.34Å; L54-V58 PolarHBondContact O-N 3.45Å |
| 55 | A | 95.3 | Very high | 91.7 | Very high | 45 Ų | 45 | 100.5 Ų | 100.5 | 37% | 0.372 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -58.1 | -47.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L51 V52 V57 V58 I59 | L51-A55 WeakPolarHBondContact O-CB 3.47Å; L51-A55 PolarHBondContact O-N 3.21Å; V52-A55 PolarHBondContact O-N 3.33Å; A55-V57 VanDerWaalsContact C-N 3.33Å; A55-V57 PolarHBondContact O-N 3.45Å; A55-V58 PolarHBondContact O-N 3.29Å; A55-I59 VanDerWaalsContact O-CB 3.25Å; A55-I59 WeakPolarHBondContact O-CB 3.33Å; A55-I59 WeakPolarHBondContact O-CD1 3.17Å; A55-I59 WeakPolarHBondContact O-CG1 3.31Å; A55-I59 PolarHBondContact O-N 3.42Å |
| 56 | V | 95.4 | Very high | 90.1 | Very high | 89 Ų | 89 | 106.9 Ų | 106.9 | 54% | 0.539 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 176.8 | 171.2 | 0 | 0 | 0 | 0 | 111.5 | V52 C53 L54 R60 | V52-V56 HydrophobicContact CG1-CG2 4.37Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.28Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.83Å; C53-V56 PolarHBondContact O-N 3.2Å; L54-V56 PolarHBondContact O-N 2.8Å; V56-R60 WeakPolarHBondContact O-CB 3.18Å; V56-R60 PolarHBondContact O-N 3.23Å |
| 57 | V | 93.8 | Very high | 88.5 | Confident | 91 Ų | 91 | 106.7 Ų | 106.7 | 55% | 0.552 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.5 | -47.7 | 176.9 | 169.3 | 0 | 0 | 0 | 0 | 110.9 | C53 L54 A55 R60 Y61 | C53-V57 WeakPolarHBondContact O-CB 3.28Å; C53-V57 VanDerWaalsContact O-CG2 3.27Å; C53-V57 WeakPolarHBondContact O-CG2 3.27Å; C53-V57 PolarHBondContact O-N 3.43Å; L54-V57 PolarHBondContact O-N 3.25Å; A55-V57 VanDerWaalsContact C-N 3.33Å; A55-V57 PolarHBondContact O-N 3.45Å; V57-R60 PolarHBondContact O-N 2.88Å; V57-Y61 WeakPolarHBondContact O-CB 3.48Å; V57-Y61 PolarHBondContact O-N 3.48Å |
| 58 | V | 91.1 | Very high | 86.7 | Confident | 66 Ų | 66 | 109.3 Ų | 109.3 | 40% | 0.4 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.4 | -47.7 | 177.9 | 169.8 | 0 | 0 | 0 | 0 | 110.6 | L54 A55 Y61 M62 | L54-V58 HydrophobicContact CD1-CG2 4.19Å; L54-V58 HydrophobicContact CG-CG2 4.37Å; L54-V58 WeakPolarHBondContact O-CB 3.47Å; L54-V58 VanDerWaalsContact O-CG2 3.28Å; L54-V58 WeakPolarHBondContact O-CG2 3.34Å; L54-V58 PolarHBondContact O-N 3.45Å; A55-V58 PolarHBondContact O-N 3.29Å; V58-Y61 CarbonylContact O-C 3.59Å; V58-Y61 WeakPolarHBondContact O-CB 3.26Å; V58-Y61 PolarHBondContact O-N 2.84Å; V58-M62 HydrophobicContact CG1-CG 4.39Å; V58-M62 HydrophobicContact CG1-SD 3.94Å; V58-M62 WeakPolarHBondContact O-CB 3.22Å; V58-M62 VanDerWaalsContact O-CG 3.27Å; V58-M62 WeakPolarHBondContact O-CG 3.27Å; V58-M62 PolarHBondContact O-N 3.48Å |
| 59 | I | 90.7 | Very high | 84.7 | Confident | 82 Ų | 82 | 115.2 Ų | 115.2 | 42% | 0.421 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.2 | -50.2 | 178.3 | -71.3 | 166.8 | 0 | 0 | 0 | 110.4 | A55 Y61 M62 Y63 | A55-I59 VanDerWaalsContact O-CB 3.25Å; A55-I59 WeakPolarHBondContact O-CB 3.33Å; A55-I59 WeakPolarHBondContact O-CD1 3.17Å; A55-I59 WeakPolarHBondContact O-CG1 3.31Å; A55-I59 PolarHBondContact O-N 3.42Å; I59-Y61 VanDerWaalsContact C-N 3.27Å; I59-Y61 PolarHBondContact O-N 2.84Å; I59-M62 PolarHBondContact O-N 2.85Å; I59-Y63 HydrophobicContact CB-CE2 4.44Å; I59-Y63 HydrophobicContact CG2-CD2 3.48Å; I59-Y63 VanDerWaalsContact CG2-CD2 3.48Å; I59-Y63 HydrophobicContact CG2-CE2 3.05Å; I59-Y63 WeakPolarHBondContact O-CD2 3.34Å; I59-Y63 PolarHBondContact O-N 3.35Å |
| 60 | R | 91 | Very high | 82.8 | Confident | 162 Ų | 162 | 118.1 Ų | 118.1 | 61% | 0.611 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.6 | -36.3 | 177.2 | -175.8 | -109.5 | 179.6 | 103.8 | -3.4 | 111.8 | V56 V57 R64 | V56-R60 WeakPolarHBondContact O-CB 3.18Å; V56-R60 PolarHBondContact O-N 3.23Å; V57-R60 PolarHBondContact O-N 2.88Å; R60-R64 VanDerWaalsContact O-CB 3.31Å; R60-R64 WeakPolarHBondContact O-CB 3.13Å; R60-R64 WeakPolarHBondContact O-CG 3.1Å; R60-R64 PolarHBondContact O-N 2.96Å |
| 61 | Y | 86.3 | Confident | 81 | Confident | 143 Ų | 143 | 117.2 Ų | 117.2 | 56% | 0.561 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.1 | -46.6 | 175.8 | 179.7 | -97.4 | 0 | 0 | 0 | 110.9 | V57 V58 I59 Y63 R64 H65 | V57-Y61 WeakPolarHBondContact O-CB 3.48Å; V57-Y61 PolarHBondContact O-N 3.48Å; V58-Y61 CarbonylContact O-C 3.59Å; V58-Y61 WeakPolarHBondContact O-CB 3.26Å; V58-Y61 PolarHBondContact O-N 2.84Å; I59-Y61 VanDerWaalsContact C-N 3.27Å; I59-Y61 PolarHBondContact O-N 2.84Å; Y61-Y63 VanDerWaalsContact C-N 3.34Å; Y61-Y63 PolarHBondContact O-N 2.8Å; Y61-R64 PolarHBondContact O-N 3.42Å; Y61-H65 AromaticContact CD2-CD2 3.39Å; Y61-H65 WeakPolarHBondContact CD2-CD2 3.39Å; Y61-H65 HydrophobicContact CE1-CB 4.37Å; Y61-H65 HydrophobicContact CE2-CB 4.33Å; Y61-H65 AromaticContact CE2-CD2 3.32Å; Y61-H65 WeakPolarHBondContact CE2-CD2 3.28Å; Y61-H65 AromaticContact CE2-CG 3.85Å; Y61-H65 AromaticContact CE2-NE2 3.9Å; Y61-H65 WeakPolarHBondContact O-CA 3.39Å; Y61-H65 WeakPolarHBondContact O-CB 3.18Å; Y61-H65 PolarHBondContact O-N 2.86Å |
| 62 | M | 81.3 | Confident | 79.1 | Confident | 110 Ų | 110 | 118.7 Ų | 118.7 | 54% | 0.542 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.9 | -35.5 | 175.9 | -69 | 177.6 | 74.5 | 0 | 0 | 112.7 | V58 I59 H65 | V58-M62 HydrophobicContact CG1-CG 4.39Å; V58-M62 HydrophobicContact CG1-SD 3.94Å; V58-M62 WeakPolarHBondContact O-CB 3.22Å; V58-M62 VanDerWaalsContact O-CG 3.27Å; V58-M62 WeakPolarHBondContact O-CG 3.27Å; V58-M62 PolarHBondContact O-N 3.48Å; I59-M62 PolarHBondContact O-N 2.85Å; M62-H65 CarbonylContact O-C 3.46Å |
| 63 | Y | 82 | Confident | 77.5 | Confident | 197 Ų | 197 | 121 Ų | 121 | 77% | 0.773 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -71.6 | -30.2 | 175.1 | -71.6 | -49.5 | 0 | 0 | 0 | 113 | I59 Y61 | I59-Y63 HydrophobicContact CB-CE2 4.44Å; I59-Y63 HydrophobicContact CG2-CD2 3.48Å; I59-Y63 VanDerWaalsContact CG2-CD2 3.48Å; I59-Y63 HydrophobicContact CG2-CE2 3.05Å; I59-Y63 WeakPolarHBondContact O-CD2 3.34Å; I59-Y63 PolarHBondContact O-N 3.35Å; Y61-Y63 VanDerWaalsContact C-N 3.34Å; Y61-Y63 PolarHBondContact O-N 2.8Å |
| 64 | R | 75.7 | Confident | 75.9 | Confident | 188 Ų | 188 | 122.3 Ų | 122.3 | 71% | 0.709 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -86.4 | -39.3 | 178.2 | -80 | -82.1 | -177.8 | 161.6 | -2.4 | 112.6 | R60 Y61 | R60-R64 VanDerWaalsContact O-CB 3.31Å; R60-R64 WeakPolarHBondContact O-CB 3.13Å; R60-R64 WeakPolarHBondContact O-CG 3.1Å; R60-R64 PolarHBondContact O-N 2.96Å; Y61-R64 PolarHBondContact O-N 3.42Å |
| 65 | H | 68.9 | Low | 74.2 | Confident | 109 Ų | 109 | 125.7 Ų | 125.7 | 51% | 0.505 | 62% | 0.621 | S | S | . | * | S | Bend | trans | -109.9 | 93.4 | 179.5 | -61.1 | -80.9 | 0 | 0 | 0 | 106.6 | Y61 M62 G67 | Y61-H65 AromaticContact CD2-CD2 3.39Å; Y61-H65 WeakPolarHBondContact CD2-CD2 3.39Å; Y61-H65 HydrophobicContact CE1-CB 4.37Å; Y61-H65 HydrophobicContact CE2-CB 4.33Å; Y61-H65 AromaticContact CE2-CD2 3.32Å; Y61-H65 WeakPolarHBondContact CE2-CD2 3.28Å; Y61-H65 AromaticContact CE2-CG 3.85Å; Y61-H65 AromaticContact CE2-NE2 3.9Å; Y61-H65 WeakPolarHBondContact O-CA 3.39Å; Y61-H65 WeakPolarHBondContact O-CB 3.18Å; Y61-H65 PolarHBondContact O-N 2.86Å; M62-H65 CarbonylContact O-C 3.46Å; H65-G67 PolarHBondContact O-N 3.41Å; H65-G67 VanDerWaalsContact O-N 3.12Å |
| 66 | K | 62.1 | Low | 72.6 | Confident | 191 Ų | 191 | 126 Ų | 126 | 83% | 0.83 | 63% | 0.63 | S | S | * | * | trans | -16.8 | 113.1 | 166.1 | -64.5 | 162.2 | 179.1 | -85 | 0 | 109.8 | T68 | K66-T68 PolarHBondContact O-N 3.26Š| ||
| 67 | G | 64.6 | Low | 70.7 | Confident | 48 Ų | 48 | 127.6 Ų | 127.6 | 50% | 0.495 | 64% | 0.639 | S | S | . | * | trans | -46.2 | 104.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | H65 Y69 | H65-G67 PolarHBondContact O-N 3.41Å; H65-G67 VanDerWaalsContact O-N 3.12Å; G67-Y69 PolarHBondContact O-N 2.82Å | ||
| 68 | T | 60.3 | Low | 68.9 | Low | 138 Ų | 138 | 129.2 Ų | 129.2 | 85% | 0.847 | 64% | 0.641 | S | S | * | * | trans | -62.3 | 114.6 | 173 | -74 | 0 | 0 | 0 | 0 | 106.6 | K66 H70 | K66-T68 PolarHBondContact O-N 3.26Å; T68-H70 PolarHBondContact O-N 3.45Å | ||
| 69 | Y | 56.6 | Low | 67.2 | Low | 204 Ų | 204 | 134.8 Ų | 134.8 | 80% | 0.8 | 66% | 0.66 | S | S | * | * | trans | -45.5 | 121.6 | 177.6 | -78.1 | -101.3 | 0 | 0 | 0 | 110.2 | G67 T71 | G67-Y69 PolarHBondContact O-N 2.82Å; Y69-T71 HydrophobicContact CG-CG2 4.39Å; Y69-T71 PolarHBondContact O-N 3.45Å | ||
| 70 | H | 58.3 | Low | 65.5 | Low | 169 Ų | 169 | 134.4 Ų | 134.4 | 78% | 0.782 | 67% | 0.669 | S | S | * | * | trans | -77.7 | 69.2 | 156.4 | -155.5 | 77.3 | 0 | 0 | 0 | 107 | T68 N72 | T68-H70 PolarHBondContact O-N 3.45Å; H70-N72 PolarHBondContact O-N 3.25Å | ||
| 71 | T | 60.3 | Low | 63.7 | Low | 73 Ų | 73 | 135.2 Ų | 135.2 | 45% | 0.448 | 68% | 0.68 | S | S | . | * | trans | -71.3 | 93.3 | 157.2 | 120.3 | 0 | 0 | 0 | 0 | 104.4 | Y69 E73 | Y69-T71 HydrophobicContact CG-CG2 4.39Å; Y69-T71 PolarHBondContact O-N 3.45Å; T71-E73 WeakPolarHBondContact CB-OE1 2.88Å; T71-E73 WeakPolarHBondContact CG2-OE1 3.3Å; T71-E73 PolarHBondContact O-N 3.27Å; T71-E73 VanDerWaalsContact O-N 3.13Å; T71-E73 WeakPolarHBondContact OG1-CB 3.17Å; T71-E73 WeakPolarHBondContact OG1-CG 3.2Å; T71-E73 PolarHBondContact OG1-N 2.94Å; T71-E73 PolarHBondContact OG1-OE1 2.82Å | ||
| 72 | N | 57.2 | Low | 62.2 | Low | 138 Ų | 138 | 133 Ų | 133 | 74% | 0.738 | 68% | 0.681 | S | S | * | * | trans | -79.6 | 61 | 152.2 | -132.5 | 19.8 | 0 | 0 | 0 | 105.3 | H70 A74 | H70-N72 PolarHBondContact O-N 3.25Å; N72-A74 PolarHBondContact O-N 2.94Å | ||
| 73 | E | 63.4 | Low | 61.1 | Low | 131 Ų | 131 | 130.9 Ų | 130.9 | 61% | 0.612 | 68% | 0.682 | S | S | * | * | trans | -65.1 | 83.9 | 161.2 | -75.5 | 167.5 | -126.5 | 0 | 0 | 105.1 | T71 K75 | T71-E73 WeakPolarHBondContact CB-OE1 2.88Å; T71-E73 WeakPolarHBondContact CG2-OE1 3.3Å; T71-E73 PolarHBondContact O-N 3.27Å; T71-E73 VanDerWaalsContact O-N 3.13Å; T71-E73 WeakPolarHBondContact OG1-CB 3.17Å; T71-E73 WeakPolarHBondContact OG1-CG 3.2Å; T71-E73 PolarHBondContact OG1-N 2.94Å; T71-E73 PolarHBondContact OG1-OE1 2.82Å; E73-K75 PolarHBondContact O-N 2.85Å | ||
| 74 | A | 63.4 | Low | 60 | Low | 92 Ų | 92 | 128 Ų | 128 | 76% | 0.76 | 68% | 0.679 | S | S | * | * | trans | -53.6 | 102.5 | 148.9 | 0 | 0 | 0 | 0 | 0 | 103.9 | N72 G76 | N72-A74 PolarHBondContact O-N 2.94Å; A74-G76 PolarHBondContact O-N 3.46Å | ||
| 75 | K | 60.5 | Low | 59.1 | Low | 173 Ų | 173 | 122.1 Ų | 122.1 | 75% | 0.752 | 67% | 0.671 | S | S | * | * | trans | -59.4 | 77.7 | -178.7 | -68.6 | -172.5 | 170.5 | -148.8 | 0 | 109.8 | E73 | E73-K75 PolarHBondContact O-N 2.85Š| ||
| 76 | G | 61.3 | Low | 58.6 | Low | 53 Ų | 53 | 120.7 Ų | 120.7 | 55% | 0.546 | 68% | 0.678 | S | S | . | * | trans | -122.4 | 113.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 106.7 | A74 | A74-G76 PolarHBondContact O-N 3.46Š| ||
| 77 | T | 57 | Low | 58.2 | Low | 121 Ų | 121 | 117.5 Ų | 117.5 | 74% | 0.742 | 67% | 0.67 | S | S | * | * | S | Bend | trans | 97.7 | 5 | 163.6 | 84.4 | 0 | 0 | 0 | 0 | 120.9 | F79 A80 | T77-F79 PolarHBondContact O-N 3.29Å; T77-A80 PolarHBondContact O-N 3.47Å; T77-A80 VanDerWaalsContact O-N 3.16Å |
| 78 | E | 54.7 | Low | 57.9 | Low | 126 Ų | 126 | 125.9 Ų | 125.9 | 59% | 0.589 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | -6.5 | 171 | 67.4 | -178.1 | 146.8 | 0 | 0 | 114.6 | A80 | E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 2.89Å |
| 79 | F | 55.6 | Low | 57.8 | Low | 182 Ų | 182 | 122.4 Ų | 122.4 | 80% | 0.798 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -6.7 | 172.6 | -69.8 | -78.9 | 0 | 0 | 0 | 114.7 | T77 | T77-F79 PolarHBondContact O-N 3.29Š|
| 80 | A | 54.7 | Low | 57.9 | Low | 74 Ų | 74 | 116.7 Ų | 116.7 | 61% | 0.612 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -84.8 | -25.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | T77 E78 T82 A83 | T77-A80 PolarHBondContact O-N 3.47Å; T77-A80 VanDerWaalsContact O-N 3.16Å; E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 2.89Å; A80-T82 PolarHBondContact O-N 3.34Å; A80-A83 PolarHBondContact O-N 3.22Å |
| 81 | E | 53.6 | Low | 57.9 | Low | 180 Ų | 180 | 113.4 Ų | 113.4 | 84% | 0.841 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -81.8 | 9.8 | 177.1 | -162.8 | 161.7 | 118.6 | 0 | 0 | 112.8 | ||
| 82 | T | 55.8 | Low | 57.9 | Low | 96 Ų | 96 | 113.2 Ų | 113.2 | 59% | 0.589 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -101.9 | -4.1 | 171.8 | -55.5 | 0 | 0 | 0 | 0 | 112.6 | A80 | A80-T82 PolarHBondContact O-N 3.34Š|
| 83 | A | 57.9 | Low | 57.9 | Low | 66 Ų | 66 | 112.1 Ų | 112.1 | 55% | 0.545 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -72.9 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A80 A85 A86 | A80-A83 PolarHBondContact O-N 3.22Å; A83-A85 VanDerWaalsContact C-N 3.28Å; A83-A85 PolarHBondContact O-N 3.47Å; A83-A86 PolarHBondContact O-N 3.45Å |
| 84 | D | 57.6 | Low | 57.7 | Low | 135 Ų | 135 | 112.3 Ų | 112.3 | 72% | 0.722 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -71 | -24.6 | -178.3 | -116.7 | 49.1 | 0 | 0 | 0 | 112.8 | ||
| 85 | A | 57.8 | Low | 57.4 | Low | 66 Ų | 66 | 113.4 Ų | 113.4 | 55% | 0.545 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -75.6 | -23.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A83 | A83-A85 VanDerWaalsContact C-N 3.28Å; A83-A85 PolarHBondContact O-N 3.47Å |
| 86 | A | 58 | Low | 57.4 | Low | 78 Ų | 78 | 108.3 Ų | 108.3 | 65% | 0.645 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -73.2 | -26 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A83 | A83-A86 PolarHBondContact O-N 3.45Å |
| 87 | L | 54.2 | Low | 57.2 | Low | 125 Ų | 125 | 112.1 Ų | 112.1 | 65% | 0.654 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -80.2 | -19.1 | -179.8 | -86.7 | 153.6 | 0 | 0 | 0 | 114 | G89 | L87-G89 VanDerWaalsContact C-N 3.29Å; L87-G89 PolarHBondContact O-N 3.01Å |
| 88 | R | 56.9 | Low | 57.2 | Low | 223 Ų | 223 | 110.8 Ų | 110.8 | 84% | 0.842 | 63% | 0.632 | S | S | * | * | G | 310 helix | trans | -79.6 | -8.7 | 179.7 | -88.6 | -179.1 | 151 | 166.2 | -3.8 | 114.4 | ||
| 89 | G | 58.7 | Low | 57.5 | Low | 66 Ų | 66 | 111.9 Ų | 111.9 | 68% | 0.68 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -91.9 | -2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | L87 P91 | L87-G89 VanDerWaalsContact C-N 3.29Å; L87-G89 PolarHBondContact O-N 3.01Å; G89-P91 VanDerWaalsContact O-CD 3.25Å; G89-P91 WeakPolarHBondContact O-CD 3.24Å |
| 90 | D | 59 | Low | 57.7 | Low | 83 Ų | 83 | 107.6 Ų | 107.6 | 44% | 0.444 | 63% | 0.63 | S | S | . | * | trans | -76.7 | 113.2 | -176.3 | -163.2 | -31.4 | 0 | 0 | 0 | 110.7 | A92 L93 | D90-A92 PolarHBondContact O-N 3.27Å; D90-A92 VanDerWaalsContact O-N 3.17Å; D90-A92 VanDerWaalsContact OD1-CB 3.3Å; D90-A92 WeakPolarHBondContact OD1-CB 3.22Å; D90-A92 PolarHBondContact OD1-N 2.92Å; D90-L93 PolarHBondContact O-N 2.85Å; D90-L93 VanDerWaalsContact O-N 3.16Å | ||
| 91 | P | 58.8 | Low | 57.8 | Low | 100 Ų | 100 | 112.7 Ų | 112.7 | 65% | 0.649 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -60.9 | -23.3 | -179.7 | 25 | -33.5 | 0 | 0 | 0 | 112.8 | G89 L93 Q94 D95 | G89-P91 VanDerWaalsContact O-CD 3.25Å; G89-P91 WeakPolarHBondContact O-CD 3.24Å; P91-L93 VanDerWaalsContact C-N 3.26Å; P91-L93 PolarHBondContact O-N 3.18Å; P91-Q94 PolarHBondContact O-N 2.89Å; P91-D95 PolarHBondContact O-N 3.35Å |
| 92 | A | 59.1 | Low | 58 | Low | 69 Ų | 69 | 111.3 Ų | 111.3 | 57% | 0.57 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -67.5 | -25.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | D90 | D90-A92 PolarHBondContact O-N 3.27Å; D90-A92 VanDerWaalsContact O-N 3.17Å; D90-A92 VanDerWaalsContact OD1-CB 3.3Å; D90-A92 WeakPolarHBondContact OD1-CB 3.22Å; D90-A92 PolarHBondContact OD1-N 2.92Å |
| 93 | L | 57.2 | Low | 58.4 | Low | 116 Ų | 116 | 113.6 Ų | 113.6 | 61% | 0.607 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -82.9 | -24.6 | 178.8 | -149.6 | 84.7 | 0 | 0 | 0 | 112.3 | D90 P91 M97 | D90-L93 PolarHBondContact O-N 2.85Å; D90-L93 VanDerWaalsContact O-N 3.16Å; P91-L93 VanDerWaalsContact C-N 3.26Å; P91-L93 PolarHBondContact O-N 3.18Å; L93-M97 WeakPolarHBondContact O-CG 3.37Å |
| 94 | Q | 60.2 | Low | 58.2 | Low | 135 Ų | 135 | 119.5 Ų | 119.5 | 63% | 0.631 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -76.6 | -37.2 | 177.6 | -67.3 | -131.1 | 21.9 | 0 | 0 | 112.3 | P91 A96 M97 D98 | P91-Q94 PolarHBondContact O-N 2.89Å; Q94-A96 VanDerWaalsContact C-N 3.29Å; Q94-A96 PolarHBondContact O-N 2.91Å; Q94-M97 PolarHBondContact O-N 3.43Å; Q94-D98 PolarHBondContact O-N 2.9Å |
| 95 | D | 57.8 | Low | 58.1 | Low | 115 Ų | 115 | 122.7 Ų | 122.7 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -59.5 | -40.7 | 175.1 | -95.8 | -5.2 | 0 | 0 | 0 | 111.5 | P91 M97 D98 E99 | P91-D95 PolarHBondContact O-N 3.35Å; D95-M97 VanDerWaalsContact C-N 3.26Å; D95-M97 PolarHBondContact O-N 2.98Å; D95-D98 PolarHBondContact O-N 2.97Å; D95-E99 WeakPolarHBondContact O-CB 3.26Å; D95-E99 PolarHBondContact O-N 2.85Å |
| 96 | A | 58.9 | Low | 58 | Low | 66 Ų | 66 | 131 Ų | 131 | 55% | 0.545 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -65.9 | -27.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q94 | Q94-A96 VanDerWaalsContact C-N 3.29Å; Q94-A96 PolarHBondContact O-N 2.91Å |
| 97 | M | 58 | Low | 58 | Low | 132 Ų | 132 | 133.6 Ų | 133.6 | 65% | 0.65 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -82.5 | -34.2 | 176.4 | -68.5 | -170.7 | 74.1 | 0 | 0 | 112.5 | L93 Q94 D95 S100 | L93-M97 WeakPolarHBondContact O-CG 3.37Å; Q94-M97 PolarHBondContact O-N 3.43Å; D95-M97 VanDerWaalsContact C-N 3.26Å; D95-M97 PolarHBondContact O-N 2.98Å; M97-S100 PolarHBondContact O-OG 2.8Å |
| 98 | D | 57.7 | Low | 58.2 | Low | 93 Ų | 93 | 134.1 Ų | 134.1 | 50% | 0.497 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -71.9 | -39.6 | 177 | -166.3 | 56.1 | 0 | 0 | 0 | 112 | Q94 D95 S100 K101 | Q94-D98 PolarHBondContact O-N 2.9Å; D95-D98 PolarHBondContact O-N 2.97Å; D98-S100 PolarHBondContact O-N 3.22Å; D98-K101 PolarHBondContact O-N 2.81Å |
| 99 | E | 60.3 | Low | 58.3 | Low | 149 Ų | 149 | 129.1 Ų | 129.1 | 70% | 0.696 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -62.2 | -32.3 | 175.8 | -150.8 | 88 | -148.3 | 0 | 0 | 111.6 | D95 K101 K102 | D95-E99 WeakPolarHBondContact O-CB 3.26Å; D95-E99 PolarHBondContact O-N 2.85Å; E99-K101 PolarHBondContact O-N 2.99Å; E99-K102 PolarHBondContact O-N 3.43Å |
| 100 | S | 58.9 | Low | 58.2 | Low | 93 Ų | 93 | 132.8 Ų | 132.8 | 65% | 0.65 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -10.7 | -178.8 | 80.7 | 0 | 0 | 0 | 0 | 114.9 | M97 D98 | M97-S100 PolarHBondContact O-OG 2.8Å; D98-S100 PolarHBondContact O-N 3.22Å |
| 101 | K | 56.8 | Low | 58.2 | Low | 181 Ų | 181 | 135.9 Ų | 135.9 | 79% | 0.787 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | 1.4 | -178.7 | -92 | -169 | 178.5 | -170.6 | 0 | 114.8 | D98 E99 | D98-K101 PolarHBondContact O-N 2.81Å; E99-K101 PolarHBondContact O-N 2.99Å |
| 102 | K | 58.7 | Low | 58.2 | Low | 150 Ų | 150 | 138.3 Ų | 138.3 | 65% | 0.652 | 70% | 0.696 | S | S | * | * | trans | -96.4 | 16.4 | -171 | -72.9 | -161 | 178.7 | 162.7 | 0 | 117.5 | E99 | E99-K102 PolarHBondContact O-N 3.43Š| ||
| 103 | E | 63.4 | Low | 58.1 | Low | 145 Ų | 145 | 143.3 Ų | 143.3 | 68% | 0.678 | 71% | 0.705 | S | S | * | * | trans | -135.9 | 119.8 | -176.2 | -89.4 | -167.2 | 154 | 0 | 0 | 109.2 | ||||
| 104 | Y | 53.8 | Low | 58.2 | Low | 190 Ų | 190 | 145.4 Ų | 145.4 | 75% | 0.745 | 71% | 0.712 | S | S | * | * | cis | -147.4 | 144.9 | 15.7 | -87 | -98.4 | 0 | 0 | 0 | 110.2 | ||||
| 105 | F | 56.6 | Low | 58 | Low | 202 Ų | 202 | 146.3 Ų | 146.3 | 89% | 0.886 | 72% | 0.719 | S | S | * | * | trans | -75.9 | 133.1 | 159.5 | -76.2 | -96.4 | 0 | 0 | 0 | 110.3 | ||||
| 106 | I | 54.9 | Low | 58 | Low | 239 Ų | 239 | 149.1 Ų | 149.1 | 100% | 1.226 | 73% | 0.728 | S | S | * | * | trans | -142.9 | 0 | 134.5 | -55.9 | -177.5 | 0 | 0 | 0 | 107.7 |
Retrieved 106 of 106 residues in 277.8 ms
(Link to these results)