| 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 | 31.7 | Very low | 34.7 | Very low | 236 Ų | 236 | 154.1 Ų | 154.1 | 100% | 1.163 | 77% | 0.771 | S | S | * | * | 0 | 85.6 | 0 | -59 | -174 | -168.1 | 0 | 0 | 105 | |||||
| 2 | S | 34.7 | Very low | 34.2 | Very low | 95 Ų | 95 | 148.1 Ų | 148.1 | 66% | 0.664 | 76% | 0.763 | S | S | * | * | 85.5 | 104.9 | 96.9 | -74.6 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 3 | E | 38.3 | Very low | 34 | Very low | 167 Ų | 167 | 143.8 Ų | 143.8 | 78% | 0.78 | 76% | 0.764 | S | S | * | * | 79.1 | 133 | 98.4 | -72.9 | 164.6 | 134.5 | 0 | 0 | 109.9 | |||||
| 4 | D | 37 | Very low | 33.9 | Very low | 134 Ų | 134 | 146.8 Ų | 146.8 | 72% | 0.717 | 77% | 0.77 | S | S | * | * | cis | -163.5 | 140.1 | 31.6 | -103.3 | -61.3 | 0 | 0 | 0 | 107.1 | ||||
| 5 | Q | 42.3 | Very low | 33.7 | Very low | 147 Ų | 147 | 152.3 Ų | 152.3 | 69% | 0.687 | 78% | 0.777 | S | S | * | * | 87.3 | 103.6 | 64.6 | -161.6 | 107.4 | 118.9 | 0 | 0 | 114.9 | |||||
| 6 | Q | 40.1 | Very low | 33.4 | Very low | 136 Ų | 136 | 152.7 Ų | 152.7 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | trans | 81.5 | 128.6 | 132.7 | -78.5 | 173.1 | -21.2 | 0 | 0 | 125.9 | ||||
| 7 | H | 36 | Very low | 33.9 | Very low | 148 Ų | 148 | 155.5 Ų | 155.5 | 69% | 0.685 | 79% | 0.787 | S | S | * | * | trans | 77.1 | 119.1 | 131.7 | -76.1 | 116.8 | 0 | 0 | 0 | 122.3 | ||||
| 8 | Q | 33.9 | Very low | 33.6 | Very low | 169 Ų | 169 | 151.3 Ų | 151.3 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | 143.3 | 116.2 | 109.2 | -101.4 | 172.6 | 81 | 0 | 0 | 116.4 | |||||
| 9 | R | 29.8 | Very low | 33.3 | Very low | 229 Ų | 229 | 147.1 Ų | 147.1 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | 78.2 | 128.9 | 123.5 | -139.5 | -179 | -171.8 | -165.3 | 0.5 | 123.5 | |||||
| 10 | A | 28.6 | Very low | 33.3 | Very low | 84 Ų | 84 | 148.6 Ų | 148.6 | 69% | 0.694 | 79% | 0.792 | S | S | * | * | trans | 68 | 146 | 148 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 11 | D | 29.2 | Very low | 33.3 | Very low | 150 Ų | 150 | 150 Ų | 150 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | cis | -162.1 | 162 | 19.8 | -147.7 | -76.9 | 0 | 0 | 0 | 111.1 | ||||
| 12 | A | 28.8 | Very low | 33.7 | Very low | 82 Ų | 82 | 144.5 Ų | 144.5 | 68% | 0.678 | 78% | 0.776 | S | S | * | * | trans | 25.4 | 130.4 | 160.7 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 13 | A | 32.2 | Very low | 34 | Very low | 93 Ų | 93 | 143.1 Ų | 143.1 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | -179.9 | 125.7 | 93.3 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 14 | H | 31.4 | Very low | 34.1 | Very low | 185 Ų | 185 | 144 Ų | 144 | 86% | 0.856 | 78% | 0.781 | S | S | * | * | trans | 72.4 | 124.2 | 139 | -116.1 | -75.2 | 0 | 0 | 0 | 122.2 | ||||
| 15 | R | 31.6 | Very low | 34.5 | Very low | 229 Ų | 229 | 141.3 Ų | 141.3 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | trans | 110.2 | 93.9 | 131 | -163.5 | 174.7 | 169.9 | 170.1 | -4.2 | 115.1 | ||||
| 16 | D | 29.4 | Very low | 34.5 | Very low | 159 Ų | 159 | 139 Ų | 139 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | -151.7 | 141 | 123 | -155.8 | 16.1 | 0 | 0 | 0 | 112.5 | |||||
| 17 | K | 40.8 | Very low | 35.3 | Very low | 201 Ų | 201 | 137.1 Ų | 137.1 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -81.7 | 128.6 | -179.6 | -85.3 | -176.1 | 165.3 | -170.7 | 0 | 109.1 | ||||
| 18 | G | 28.9 | Very low | 36.1 | Very low | 79 Ų | 79 | 137.2 Ų | 137.2 | 81% | 0.814 | 78% | 0.776 | S | S | * | * | trans | -159.5 | 137.8 | 167.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 19 | G | 27.5 | Very low | 37 | Very low | 71 Ų | 71 | 132.8 Ų | 132.8 | 73% | 0.732 | 76% | 0.763 | S | S | * | * | trans | 106 | 90.1 | 158.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | E21 | G19-E21 PolarHBondContact O-N 3.29Š| ||
| 20 | L | 32.8 | Very low | 38.7 | Very low | 177 Ų | 177 | 124.5 Ų | 124.5 | 93% | 0.927 | 74% | 0.739 | S | S | * | * | trans | -61.5 | 115.2 | 152.6 | -77.8 | 143.4 | 0 | 0 | 0 | 107.9 | P22 | L20-P22 WeakPolarHBondContact O-CD 3.47Š| ||
| 21 | E | 34.9 | Very low | 41 | Very low | 179 Ų | 179 | 123.8 Ų | 123.8 | 84% | 0.836 | 72% | 0.723 | S | S | * | * | trans | -75.7 | 120.5 | 166.9 | -75 | -85.4 | 113.4 | 0 | 0 | 109.3 | G19 | G19-E21 PolarHBondContact O-N 3.29Š| ||
| 22 | P | 40 | Very low | 43.2 | Very low | 120 Ų | 120 | 121.1 Ų | 121.1 | 78% | 0.779 | 71% | 0.709 | S | S | * | * | trans | -88.6 | 97.9 | 151.1 | 30.4 | -17.5 | 0 | 0 | 0 | 107.2 | L20 E24 | L20-P22 WeakPolarHBondContact O-CD 3.47Å; P22-E24 PolarHBondContact O-N 3.15Å | ||
| 23 | G | 39.5 | Very low | 45.3 | Very low | 67 Ų | 67 | 122.8 Ų | 122.8 | 69% | 0.691 | 71% | 0.705 | S | S | * | * | trans | -73.4 | 111.7 | 162 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 24 | E | 40.5 | Very low | 47.4 | Very low | 185 Ų | 185 | 124.3 Ų | 124.3 | 86% | 0.864 | 70% | 0.697 | S | S | * | * | trans | -142.5 | 128.8 | 151.9 | -89.7 | -175.5 | 122.9 | 0 | 0 | 106.8 | P22 D26 | P22-E24 PolarHBondContact O-N 3.15Å; E24-D26 PolarHBondContact O-N 2.61Å | ||
| 25 | G | 46.4 | Very low | 49.7 | Very low | 78 Ų | 78 | 121.8 Ų | 121.8 | 80% | 0.804 | 68% | 0.683 | S | S | * | * | trans | -63.7 | 101 | -176.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | T27 | G25-T27 VanDerWaalsContact C-N 3.35Å; G25-T27 PolarHBondContact O-N 3.49Å | ||
| 26 | D | 41.9 | Very low | 52 | Low | 97 Ų | 97 | 116.4 Ų | 116.4 | 52% | 0.519 | 67% | 0.671 | S | S | . | * | trans | -67.4 | 98.4 | 163.2 | -97.7 | -42.3 | 0 | 0 | 0 | 108 | E24 E28 I31 | E24-D26 PolarHBondContact O-N 2.61Å; D26-E28 PolarHBondContact O-N 3.33Å; D26-I31 HydrophobicContact CB-CD1 3.94Å; D26-I31 HydrophobicContact CB-CG1 3.68Å | ||
| 27 | T | 56.9 | Low | 54.2 | Low | 97 Ų | 97 | 111.1 Ų | 111.1 | 60% | 0.595 | 65% | 0.647 | S | S | * | * | trans | -45.1 | 129.1 | 170.2 | -31 | 0 | 0 | 0 | 0 | 108.6 | G25 P29 S30 | G25-T27 VanDerWaalsContact C-N 3.35Å; G25-T27 PolarHBondContact O-N 3.49Å; T27-P29 HydrophobicContact CG2-CG 3.9Å; T27-P29 WeakPolarHBondContact O-CD 3.35Å; T27-S30 WeakPolarHBondContact O-CB 3.42Å; T27-S30 PolarHBondContact O-N 3.26Å | ||
| 28 | E | 53 | Low | 56.1 | Low | 150 Ų | 150 | 105.7 Ų | 105.7 | 70% | 0.701 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -34.2 | -43 | 178.8 | -167.7 | -171.6 | 159.6 | 0 | 0 | 115.8 | D26 S30 I31 L32 | D26-E28 PolarHBondContact O-N 3.33Å; E28-S30 PolarHBondContact O-N 3.02Å; E28-I31 PolarHBondContact O-N 3.4Å; E28-L32 WeakPolarHBondContact O-CG 3.23Å; E28-L32 PolarHBondContact O-N 2.95Å |
| 29 | P | 53.3 | Low | 58.8 | Low | 77 Ų | 77 | 108.4 Ų | 108.4 | 50% | 0.5 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -60.1 | -35.2 | 173.8 | 20.3 | -34.8 | 0 | 0 | 0 | 115.7 | T27 L33 | T27-P29 HydrophobicContact CG2-CG 3.9Å; T27-P29 WeakPolarHBondContact O-CD 3.35Å; P29-L33 WeakPolarHBondContact O-CB 3.25Å; P29-L33 WeakPolarHBondContact O-CG 3.48Å; P29-L33 PolarHBondContact O-N 3.11Å |
| 30 | S | 64.8 | Low | 61.8 | Low | 54 Ų | 54 | 108.6 Ų | 108.6 | 38% | 0.378 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.8 | -39.6 | 178.5 | -78.3 | 0 | 0 | 0 | 0 | 112.1 | T27 E28 L32 L33 Q34 | T27-S30 WeakPolarHBondContact O-CB 3.42Å; T27-S30 PolarHBondContact O-N 3.26Å; E28-S30 PolarHBondContact O-N 3.02Å; S30-L32 VanDerWaalsContact C-N 3.33Å; S30-L32 PolarHBondContact O-N 3.48Å; S30-L33 PolarHBondContact O-N 3.47Å; S30-Q34 WeakPolarHBondContact O-CB 3.5Å; S30-Q34 PolarHBondContact O-N 3.15Å |
| 31 | I | 77.7 | Confident | 64.6 | Low | 70 Ų | 70 | 103.8 Ų | 103.8 | 36% | 0.359 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -64.5 | -41.3 | 177.9 | -57.8 | 178.4 | 0 | 0 | 0 | 110.4 | D26 E28 Q34 K35 | D26-I31 HydrophobicContact CB-CD1 3.94Å; D26-I31 HydrophobicContact CB-CG1 3.68Å; E28-I31 PolarHBondContact O-N 3.4Å; I31-Q34 PolarHBondContact O-N 3.39Å; I31-K35 WeakPolarHBondContact O-CB 3.22Å; I31-K35 WeakPolarHBondContact O-CG 3.24Å; I31-K35 PolarHBondContact O-N 3.37Å |
| 32 | L | 74.1 | Confident | 67.2 | Low | 94 Ų | 94 | 103.4 Ų | 103.4 | 49% | 0.492 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67 | -43.7 | 177.5 | -68.4 | 175.9 | 0 | 0 | 0 | 111.7 | E28 S30 Q34 K35 L36 | E28-L32 WeakPolarHBondContact O-CG 3.23Å; E28-L32 PolarHBondContact O-N 2.95Å; S30-L32 VanDerWaalsContact C-N 3.33Å; S30-L32 PolarHBondContact O-N 3.48Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-Q34 PolarHBondContact O-N 3.3Å; L32-K35 PolarHBondContact O-N 2.95Å; L32-L36 WeakPolarHBondContact O-CB 3.3Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.41Å; L32-L36 PolarHBondContact O-N 2.98Å |
| 33 | L | 73.1 | Confident | 69.7 | Low | 116 Ų | 116 | 102.2 Ų | 102.2 | 61% | 0.607 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.1 | -40.9 | 175 | -77.5 | 169.1 | 0 | 0 | 0 | 112 | P29 S30 L36 S37 | P29-L33 WeakPolarHBondContact O-CB 3.25Å; P29-L33 WeakPolarHBondContact O-CG 3.48Å; P29-L33 PolarHBondContact O-N 3.11Å; S30-L33 PolarHBondContact O-N 3.47Å; L33-L36 PolarHBondContact O-N 2.86Å; L33-S37 WeakPolarHBondContact O-CB 3.45Å; L33-S37 PolarHBondContact O-N 2.99Å |
| 34 | Q | 76.1 | Confident | 72.1 | Confident | 125 Ų | 125 | 102.1 Ų | 102.1 | 58% | 0.584 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68.6 | -39.6 | 177.9 | -166.8 | 179.1 | 32.2 | 0 | 0 | 112.3 | S30 I31 L32 S37 S38 | S30-Q34 WeakPolarHBondContact O-CB 3.5Å; S30-Q34 PolarHBondContact O-N 3.15Å; I31-Q34 PolarHBondContact O-N 3.39Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-Q34 PolarHBondContact O-N 3.3Å; Q34-S37 PolarHBondContact O-OG 2.99Å; Q34-S38 WeakPolarHBondContact O-CB 3.38Å; Q34-S38 PolarHBondContact O-N 3.46Å; Q34-S38 PolarHBondContact O-OG 3.49Å |
| 35 | K | 80.9 | Confident | 74.4 | Confident | 133 Ų | 133 | 96 Ų | 96 | 58% | 0.578 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64 | -43.2 | 172.5 | -79.8 | -177.2 | 176 | 177 | 0 | 111.6 | I31 L32 S38 N39 | I31-K35 WeakPolarHBondContact O-CB 3.22Å; I31-K35 WeakPolarHBondContact O-CG 3.24Å; I31-K35 PolarHBondContact O-N 3.37Å; L32-K35 PolarHBondContact O-N 2.95Å; K35-S38 PolarHBondContact O-N 3.35Å; K35-S38 PolarHBondContact O-OG 3.22Å; K35-N39 PolarHBondContact O-N 2.93Å; K35-N39 PolarHBondContact O-ND2 3.03Å |
| 36 | L | 80.4 | Confident | 76.6 | Confident | 116 Ų | 116 | 96.6 Ų | 96.6 | 61% | 0.607 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.4 | -42.1 | 177.7 | -71.8 | 169.3 | 0 | 0 | 0 | 111.8 | L32 L33 S38 N39 I40 | L32-L36 WeakPolarHBondContact O-CB 3.3Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.41Å; L32-L36 PolarHBondContact O-N 2.98Å; L33-L36 PolarHBondContact O-N 2.86Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 2.99Å; L36-N39 PolarHBondContact O-N 3.22Å; L36-N39 VanDerWaalsContact O-N 3.11Å; L36-I40 PolarHBondContact O-N 2.95Å |
| 37 | S | 74.3 | Confident | 79 | Confident | 48 Ų | 48 | 97.9 Ų | 97.9 | 34% | 0.336 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 176.8 | 77.5 | 0 | 0 | 0 | 0 | 110.6 | L33 Q34 N39 I40 Q45 | L33-S37 WeakPolarHBondContact O-CB 3.45Å; L33-S37 PolarHBondContact O-N 2.99Å; Q34-S37 PolarHBondContact O-OG 2.99Å; S37-N39 PolarHBondContact O-N 3.38Å; S37-N39 VanDerWaalsContact O-N 3.11Å; S37-I40 WeakPolarHBondContact O-CG1 3.44Å; S37-I40 PolarHBondContact O-N 3.03Å; S37-Q45 PolarHBondContact O-NE2 3.4Å |
| 38 | S | 81.1 | Confident | 80.6 | Confident | 86 Ų | 86 | 96.3 Ų | 96.3 | 60% | 0.601 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.6 | -18.9 | 177.7 | 73.1 | 0 | 0 | 0 | 0 | 114.8 | Q34 K35 L36 | Q34-S38 WeakPolarHBondContact O-CB 3.38Å; Q34-S38 PolarHBondContact O-N 3.46Å; Q34-S38 PolarHBondContact O-OG 3.49Å; K35-S38 PolarHBondContact O-N 3.35Å; K35-S38 PolarHBondContact O-OG 3.22Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 2.99Å |
| 39 | N | 86.3 | Confident | 82.4 | Confident | 136 Ų | 136 | 93.4 Ų | 93.4 | 73% | 0.727 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -95.5 | -7.1 | -179.7 | -82.9 | -84.7 | 0 | 0 | 0 | 114.3 | K35 L36 S37 | K35-N39 PolarHBondContact O-N 2.93Å; K35-N39 PolarHBondContact O-ND2 3.03Å; L36-N39 PolarHBondContact O-N 3.22Å; L36-N39 VanDerWaalsContact O-N 3.11Å; S37-N39 PolarHBondContact O-N 3.38Å; S37-N39 VanDerWaalsContact O-N 3.11Å |
| 40 | I | 89 | Confident | 84.3 | Confident | 76 Ų | 76 | 94.3 Ų | 94.3 | 39% | 0.39 | 50% | 0.5 | S | S | . | . | S | Bend | trans | -107.2 | 155.2 | 178.6 | 57.9 | 164.4 | 0 | 0 | 0 | 111.5 | L36 S37 V44 Q45 | L36-I40 PolarHBondContact O-N 2.95Å; S37-I40 WeakPolarHBondContact O-CG1 3.44Å; S37-I40 PolarHBondContact O-N 3.03Å; I40-V44 HydrophobicContact CD1-CB 4.4Å; I40-V44 HydrophobicContact CD1-CG1 4Å; I40-Q45 HydrophobicContact CD1-CG 3.86Å; I40-Q45 HydrophobicContact CG1-CG 3.79Å; I40-Q45 PolarHBondContact O-NE2 3.02Å |
| 41 | S | 91.7 | Very high | 85.7 | Confident | 76 Ų | 76 | 96.6 Ų | 96.6 | 53% | 0.531 | 51% | 0.507 | S | S | . | . | trans | -60.8 | 143.6 | -178.3 | 176.8 | 0 | 0 | 0 | 0 | 112.3 | N43 V44 Q45 | S41-N43 PolarHBondContact O-N 3.46Å; S41-N43 VanDerWaalsContact O-N 3.11Å; S41-V44 WeakPolarHBondContact O-CA 3.49Å; S41-V44 WeakPolarHBondContact O-CB 3.4Å; S41-V44 PolarHBondContact O-N 2.9Å; S41-Q45 PolarHBondContact O-N 2.88Å | ||
| 42 | K | 89.9 | Confident | 86.4 | Confident | 171 Ų | 171 | 98.3 Ų | 98.3 | 74% | 0.743 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -53.4 | -32.9 | 176.6 | -66.4 | -174.2 | 178.8 | -178.6 | 0 | 113.2 | V44 T46 | K42-V44 VanDerWaalsContact C-N 3.33Å; K42-T46 PolarHBondContact O-N 3.27Å; K42-T46 PolarHBondContact O-OG1 3.32Å |
| 43 | N | 91.9 | Very high | 87.3 | Confident | 94 Ų | 94 | 98.8 Ų | 98.8 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65 | -38.3 | 175.7 | -173.9 | -94.6 | 0 | 0 | 0 | 112.1 | S41 K47 | S41-N43 PolarHBondContact O-N 3.46Å; S41-N43 VanDerWaalsContact O-N 3.11Å; N43-K47 WeakPolarHBondContact O-CG 3.39Å; N43-K47 PolarHBondContact O-N 3.14Å; N43-K47 VanDerWaalsContact OD1-CE 3.3Å; N43-K47 WeakPolarHBondContact OD1-CE 3.45Å; N43-K47 PolarHBondContact OD1-NZ 3.49Å |
| 44 | V | 91.4 | Very high | 88.3 | Confident | 66 Ų | 66 | 96.3 Ų | 96.3 | 40% | 0.4 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -72.5 | -43.8 | 178.4 | -178.6 | 0 | 0 | 0 | 0 | 110 | I40 S41 K42 T46 K47 V48 | I40-V44 HydrophobicContact CD1-CB 4.4Å; I40-V44 HydrophobicContact CD1-CG1 4Å; S41-V44 WeakPolarHBondContact O-CA 3.49Å; S41-V44 WeakPolarHBondContact O-CB 3.4Å; S41-V44 PolarHBondContact O-N 2.9Å; K42-V44 VanDerWaalsContact C-N 3.33Å; V44-T46 VanDerWaalsContact C-N 3.33Å; V44-T46 PolarHBondContact O-N 3.06Å; V44-K47 PolarHBondContact O-N 3.32Å; V44-K47 VanDerWaalsContact O-N 3.15Å; V44-V48 HydrophobicContact CG1-CG2 4.37Å; V44-V48 WeakPolarHBondContact O-CG2 3.48Å; V44-V48 PolarHBondContact O-N 2.94Å |
| 45 | Q | 88.7 | Confident | 89.1 | Confident | 55 Ų | 55 | 92.2 Ų | 92.2 | 26% | 0.257 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -54.3 | -50 | 174.3 | -64.2 | 174.2 | 13.7 | 0 | 0 | 111.2 | S37 I40 S41 K47 V48 D49 | S37-Q45 PolarHBondContact O-NE2 3.4Å; I40-Q45 HydrophobicContact CD1-CG 3.86Å; I40-Q45 HydrophobicContact CG1-CG 3.79Å; I40-Q45 PolarHBondContact O-NE2 3.02Å; S41-Q45 PolarHBondContact O-N 2.88Å; Q45-K47 VanDerWaalsContact C-N 3.28Å; Q45-K47 PolarHBondContact O-N 3.23Å; Q45-V48 WeakPolarHBondContact O-CB 3.44Å; Q45-V48 PolarHBondContact O-N 3.41Å; Q45-D49 PolarHBondContact O-N 2.92Å |
| 46 | T | 91.6 | Very high | 89.6 | Confident | 92 Ų | 92 | 93.1 Ų | 93.1 | 56% | 0.564 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58.7 | -39.7 | 179.1 | -52 | 0 | 0 | 0 | 0 | 112 | K42 V44 Q50 | K42-T46 PolarHBondContact O-N 3.27Å; K42-T46 PolarHBondContact O-OG1 3.32Å; V44-T46 VanDerWaalsContact C-N 3.33Å; V44-T46 PolarHBondContact O-N 3.06Å; T46-Q50 WeakPolarHBondContact O-CB 3.23Å; T46-Q50 PolarHBondContact O-N 3.2Å |
| 47 | K | 92.5 | Very high | 90.2 | Very high | 123 Ų | 123 | 97.1 Ų | 97.1 | 54% | 0.535 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.1 | -41.3 | 176.2 | -74.8 | 174.9 | 176.7 | 175.6 | 0 | 112.1 | N43 V44 Q45 Q50 I51 | N43-K47 WeakPolarHBondContact O-CG 3.39Å; N43-K47 PolarHBondContact O-N 3.14Å; N43-K47 VanDerWaalsContact OD1-CE 3.3Å; N43-K47 WeakPolarHBondContact OD1-CE 3.45Å; N43-K47 PolarHBondContact OD1-NZ 3.49Å; V44-K47 PolarHBondContact O-N 3.32Å; V44-K47 VanDerWaalsContact O-N 3.15Å; Q45-K47 VanDerWaalsContact C-N 3.28Å; Q45-K47 PolarHBondContact O-N 3.23Å; K47-Q50 PolarHBondContact O-N 2.78Å; K47-I51 WeakPolarHBondContact O-CD1 3.4Å; K47-I51 VanDerWaalsContact O-CG1 3.23Å; K47-I51 WeakPolarHBondContact O-CG1 3.3Å; K47-I51 PolarHBondContact O-N 3.11Å |
| 48 | V | 91.3 | Very high | 91.2 | Very high | 64 Ų | 64 | 98.6 Ų | 98.6 | 39% | 0.388 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.1 | -45.6 | 177 | 171.9 | 0 | 0 | 0 | 0 | 110.4 | V44 Q45 Q50 I51 L52 | V44-V48 HydrophobicContact CG1-CG2 4.37Å; V44-V48 WeakPolarHBondContact O-CG2 3.48Å; V44-V48 PolarHBondContact O-N 2.94Å; Q45-V48 WeakPolarHBondContact O-CB 3.44Å; Q45-V48 PolarHBondContact O-N 3.41Å; V48-Q50 VanDerWaalsContact C-N 3.31Å; V48-Q50 PolarHBondContact O-N 3.37Å; V48-I51 PolarHBondContact O-N 2.89Å; V48-L52 HydrophobicContact CG1-CD1 4.08Å; V48-L52 HydrophobicContact CG1-CG 4.49Å; V48-L52 WeakPolarHBondContact O-CG 3.34Å; V48-L52 PolarHBondContact O-N 3.25Å |
| 49 | D | 90.6 | Very high | 91.8 | Very high | 90 Ų | 90 | 97.1 Ų | 97.1 | 48% | 0.481 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.3 | -39.3 | 177.5 | -68.6 | -31.2 | 0 | 0 | 0 | 111.9 | Q45 L52 Q53 | Q45-D49 PolarHBondContact O-N 2.92Å; D49-L52 PolarHBondContact O-N 3.15Å; D49-Q53 PolarHBondContact O-N 2.98Å |
| 50 | Q | 94 | Very high | 92 | Very high | 95 Ų | 95 | 95.8 Ų | 95.8 | 44% | 0.444 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 175.4 | -171.5 | 60.6 | 61.3 | 0 | 0 | 111.7 | T46 K47 V48 L52 Q53 D54 | T46-Q50 WeakPolarHBondContact O-CB 3.23Å; T46-Q50 PolarHBondContact O-N 3.2Å; K47-Q50 PolarHBondContact O-N 2.78Å; V48-Q50 VanDerWaalsContact C-N 3.31Å; V48-Q50 PolarHBondContact O-N 3.37Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 3.27Å; Q50-Q53 PolarHBondContact O-N 2.95Å; Q50-D54 PolarHBondContact NE2-OD1 2.95Å; Q50-D54 VanDerWaalsContact NE2-OD1 3.11Å; Q50-D54 PolarHBondContact O-N 3.19Å |
| 51 | I | 93.3 | Very high | 92.2 | Very high | 102 Ų | 102 | 98.2 Ų | 98.2 | 52% | 0.523 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.7 | -42.7 | 176.3 | -67.3 | 161.9 | 0 | 0 | 0 | 110.3 | K47 V48 Q53 D54 V55 | K47-I51 WeakPolarHBondContact O-CD1 3.4Å; K47-I51 VanDerWaalsContact O-CG1 3.23Å; K47-I51 WeakPolarHBondContact O-CG1 3.3Å; K47-I51 PolarHBondContact O-N 3.11Å; V48-I51 PolarHBondContact O-N 2.89Å; I51-Q53 PolarHBondContact O-N 3.4Å; I51-D54 PolarHBondContact O-N 3.01Å; I51-V55 HydrophobicContact CG2-CG2 4.14Å; I51-V55 WeakPolarHBondContact O-CB 3.35Å; I51-V55 VanDerWaalsContact O-CG2 3.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.36Å; I51-V55 PolarHBondContact O-N 3.07Å |
| 52 | L | 91.7 | Very high | 92.3 | Very high | 106 Ų | 106 | 98.6 Ų | 98.6 | 56% | 0.555 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.5 | -43.6 | 177.6 | -75.3 | 170.8 | 0 | 0 | 0 | 111.9 | V48 D49 Q50 D54 V55 Q56 | V48-L52 HydrophobicContact CG1-CD1 4.08Å; V48-L52 HydrophobicContact CG1-CG 4.49Å; V48-L52 WeakPolarHBondContact O-CG 3.34Å; V48-L52 PolarHBondContact O-N 3.25Å; D49-L52 PolarHBondContact O-N 3.15Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 3.27Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.34Å; L52-V55 PolarHBondContact O-N 3.39Å; L52-Q56 WeakPolarHBondContact O-CB 3.17Å; L52-Q56 PolarHBondContact O-N 2.67Å |
| 53 | Q | 93.3 | Very high | 92.4 | Very high | 104 Ų | 104 | 94.1 Ų | 94.1 | 49% | 0.486 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 174.2 | -77.3 | -173.1 | 28.6 | 0 | 0 | 112.3 | D49 Q50 I51 Q56 R57 | D49-Q53 PolarHBondContact O-N 2.98Å; Q50-Q53 PolarHBondContact O-N 2.95Å; I51-Q53 PolarHBondContact O-N 3.4Å; Q53-Q56 PolarHBondContact O-N 3.18Å; Q53-R57 PolarHBondContact O-N 3.33Å |
| 54 | D | 93.4 | Very high | 92.2 | Very high | 65 Ų | 65 | 93.8 Ų | 93.8 | 35% | 0.348 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -67.1 | -43.7 | 179.7 | -67.9 | -15.4 | 0 | 0 | 0 | 111 | Q50 I51 L52 Q56 R57 F58 | Q50-D54 PolarHBondContact NE2-OD1 2.95Å; Q50-D54 VanDerWaalsContact NE2-OD1 3.11Å; Q50-D54 PolarHBondContact O-N 3.19Å; I51-D54 PolarHBondContact O-N 3.01Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.34Å; D54-Q56 VanDerWaalsContact C-N 3.3Å; D54-Q56 PolarHBondContact O-N 3.11Å; D54-R57 WeakPolarHBondContact O-CB 3.46Å; D54-R57 PolarHBondContact O-N 3.37Å; D54-R57 VanDerWaalsContact O-N 3.15Å; D54-F58 VanDerWaalsContact O-CD1 3.22Å; D54-F58 WeakPolarHBondContact O-CD1 3.42Å; D54-F58 WeakPolarHBondContact O-CE1 3.45Å |
| 55 | V | 93.3 | Very high | 92.2 | Very high | 38 Ų | 38 | 97.1 Ų | 97.1 | 23% | 0.23 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -66.4 | -31.1 | 176.7 | 174.5 | 0 | 0 | 0 | 0 | 111.9 | I51 L52 R57 F58 K63 L66 | I51-V55 HydrophobicContact CG2-CG2 4.14Å; I51-V55 WeakPolarHBondContact O-CB 3.35Å; I51-V55 VanDerWaalsContact O-CG2 3.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.36Å; I51-V55 PolarHBondContact O-N 3.07Å; L52-V55 PolarHBondContact O-N 3.39Å; V55-R57 PolarHBondContact O-N 3.4Å; V55-F58 HydrophobicContact CB-CD2 4.47Å; V55-F58 HydrophobicContact CG1-CD2 4.42Å; V55-F58 HydrophobicContact CG2-CD2 4.38Å; V55-F58 HydrophobicContact CG2-CE2 4.1Å; V55-F58 VanDerWaalsContact O-CB 3.3Å; V55-F58 WeakPolarHBondContact O-CB 3.36Å; V55-F58 PolarHBondContact O-N 3.05Å; V55-F58 VanDerWaalsContact O-N 3.15Å; V55-K63 HydrophobicContact CG1-CG 4.49Å; V55-K63 VanDerWaalsContact O-CE 3.25Å; V55-K63 WeakPolarHBondContact O-CE 3.4Å; V55-L66 HydrophobicContact CB-CD2 4.46Å; V55-L66 HydrophobicContact CG1-CD2 4.03Å; V55-L66 HydrophobicContact CG2-CD2 3.53Å |
| 56 | Q | 92.6 | Very high | 92.3 | Very high | 153 Ų | 153 | 97.1 Ų | 97.1 | 72% | 0.715 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.2 | -27.4 | 175.7 | -169.4 | 168.5 | 16.3 | 0 | 0 | 112.4 | L52 Q53 D54 F58 | L52-Q56 WeakPolarHBondContact O-CB 3.17Å; L52-Q56 PolarHBondContact O-N 2.67Å; Q53-Q56 PolarHBondContact O-N 3.18Å; D54-Q56 VanDerWaalsContact C-N 3.3Å; D54-Q56 PolarHBondContact O-N 3.11Å; Q56-F58 VanDerWaalsContact C-N 3.32Å |
| 57 | R | 93.3 | Very high | 92.1 | Very high | 200 Ų | 200 | 100.6 Ų | 100.6 | 76% | 0.755 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -9.8 | 176.9 | -64.8 | 179 | -179.9 | 177.9 | 2.4 | 113.9 | Q53 D54 V55 | Q53-R57 PolarHBondContact O-N 3.33Å; D54-R57 WeakPolarHBondContact O-CB 3.46Å; D54-R57 PolarHBondContact O-N 3.37Å; D54-R57 VanDerWaalsContact O-N 3.15Å; V55-R57 PolarHBondContact O-N 3.4Å |
| 58 | F | 95.3 | Very high | 91.8 | Very high | 79 Ų | 79 | 100.8 Ų | 100.8 | 35% | 0.346 | 49% | 0.493 | S | S | . | . | S | Bend | trans | -70.7 | 146.3 | -179.3 | -72.4 | 2.6 | 0 | 0 | 0 | 111.5 | D54 V55 Q56 D62 K63 L66 | D54-F58 VanDerWaalsContact O-CD1 3.22Å; D54-F58 WeakPolarHBondContact O-CD1 3.42Å; D54-F58 WeakPolarHBondContact O-CE1 3.45Å; V55-F58 HydrophobicContact CB-CD2 4.47Å; V55-F58 HydrophobicContact CG1-CD2 4.42Å; V55-F58 HydrophobicContact CG2-CD2 4.38Å; V55-F58 HydrophobicContact CG2-CE2 4.1Å; V55-F58 VanDerWaalsContact O-CB 3.3Å; V55-F58 WeakPolarHBondContact O-CB 3.36Å; V55-F58 PolarHBondContact O-N 3.05Å; V55-F58 VanDerWaalsContact O-N 3.15Å; Q56-F58 VanDerWaalsContact C-N 3.32Å; F58-D62 HydrophobicContact CB-CB 3.86Å; F58-D62 HydrophobicContact CD2-CB 4.28Å; F58-D62 HydrophobicContact CG-CB 4.13Å; F58-K63 HydrophobicContact CB-CG 3.72Å; F58-K63 VanDerWaalsContact O-CE 3.23Å; F58-K63 WeakPolarHBondContact O-CE 3.44Å; F58-K63 PolarHBondContact O-NZ 3.1Å; F58-L66 HydrophobicContact CD2-CD2 4.34Å; F58-L66 HydrophobicContact CE2-CD2 4.05Å |
| 59 | S | 93.8 | Very high | 91.6 | Very high | 55 Ų | 55 | 103.9 Ų | 103.9 | 39% | 0.385 | 50% | 0.503 | S | S | . | . | trans | -67.5 | 161.9 | 166.9 | 76.6 | 0 | 0 | 0 | 0 | 110.2 | N61 D62 K63 | S59-N61 PolarHBondContact O-N 3Å; S59-D62 WeakPolarHBondContact CB-OD2 3.36Å; S59-D62 PolarHBondContact N-OD2 2.92Å; S59-D62 PolarHBondContact O-N 2.98Å; S59-D62 PolarHBondContact OG-N 2.87Å; S59-D62 PolarHBondContact OG-OD2 3.32Å; S59-K63 WeakPolarHBondContact O-CG 3.38Å; S59-K63 PolarHBondContact O-N 3.45Å | ||
| 60 | D | 90.4 | Very high | 91.4 | Very high | 107 Ų | 107 | 104.2 Ų | 104.2 | 57% | 0.572 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -31.1 | -179 | -60.2 | -34.6 | 0 | 0 | 0 | 112.2 | K63 L64 | D60-K63 IonicContact OD1-NZ 3.77Å; D60-L64 WeakPolarHBondContact O-CB 3.5Å; D60-L64 PolarHBondContact O-N 3.03Å |
| 61 | N | 92.4 | Very high | 90.5 | Very high | 128 Ų | 128 | 105.5 Ų | 105.5 | 68% | 0.684 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67 | -40.7 | 173 | -72.3 | -73.4 | 0 | 0 | 0 | 112.2 | S59 L64 F65 | S59-N61 PolarHBondContact O-N 3Å; N61-L64 WeakPolarHBondContact O-CB 3.35Å; N61-L64 PolarHBondContact O-N 2.89Å; N61-F65 PolarHBondContact O-N 2.97Å |
| 62 | D | 94.1 | Very high | 89 | Confident | 84 Ų | 84 | 105.9 Ų | 105.9 | 45% | 0.449 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69.9 | -37.9 | 178.7 | -59.3 | -42.9 | 0 | 0 | 0 | 111.4 | F58 S59 L64 F65 L66 | F58-D62 HydrophobicContact CB-CB 3.86Å; F58-D62 HydrophobicContact CD2-CB 4.28Å; F58-D62 HydrophobicContact CG-CB 4.13Å; S59-D62 WeakPolarHBondContact CB-OD2 3.36Å; S59-D62 PolarHBondContact N-OD2 2.92Å; S59-D62 PolarHBondContact O-N 2.98Å; S59-D62 PolarHBondContact OG-N 2.87Å; S59-D62 PolarHBondContact OG-OD2 3.32Å; D62-L64 VanDerWaalsContact C-N 3.33Å; D62-F65 PolarHBondContact O-N 3.38Å; D62-L66 WeakPolarHBondContact O-CB 3.45Å; D62-L66 PolarHBondContact O-N 3.29Å |
| 63 | K | 91.4 | Very high | 87.3 | Confident | 76 Ų | 76 | 103.6 Ų | 103.6 | 33% | 0.33 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 172.5 | -70 | 175.6 | -174.2 | 156.8 | 0 | 111.4 | V55 F58 S59 D60 L66 Y67 | V55-K63 HydrophobicContact CG1-CG 4.49Å; V55-K63 VanDerWaalsContact O-CE 3.25Å; V55-K63 WeakPolarHBondContact O-CE 3.4Å; F58-K63 HydrophobicContact CB-CG 3.72Å; F58-K63 VanDerWaalsContact O-CE 3.23Å; F58-K63 WeakPolarHBondContact O-CE 3.44Å; F58-K63 PolarHBondContact O-NZ 3.1Å; S59-K63 WeakPolarHBondContact O-CG 3.38Å; S59-K63 PolarHBondContact O-N 3.45Å; D60-K63 IonicContact OD1-NZ 3.77Å; K63-L66 PolarHBondContact O-N 2.77Å; K63-Y67 WeakPolarHBondContact O-CB 3.42Å; K63-Y67 PolarHBondContact O-N 2.78Å |
| 64 | L | 88.5 | Confident | 85.3 | Confident | 88 Ų | 88 | 104.9 Ų | 104.9 | 46% | 0.461 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.6 | -44.7 | 175.7 | 179.8 | 61.4 | 0 | 0 | 0 | 111.2 | D60 N61 D62 L66 Y67 L68 | D60-L64 WeakPolarHBondContact O-CB 3.5Å; D60-L64 PolarHBondContact O-N 3.03Å; N61-L64 WeakPolarHBondContact O-CB 3.35Å; N61-L64 PolarHBondContact O-N 2.89Å; D62-L64 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 3.45Å; L64-Y67 PolarHBondContact O-N 3.08Å; L64-L68 HydrophobicContact CG-CD1 4.47Å; L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 2.86Å; L64-L68 VanDerWaalsContact O-N 3.14Å |
| 65 | F | 90.4 | Very high | 83.1 | Confident | 135 Ų | 135 | 107.4 Ų | 107.4 | 59% | 0.592 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.5 | -43.1 | 176.2 | -176.7 | -99.8 | 0 | 0 | 0 | 112.2 | N61 D62 L68 Q69 | N61-F65 PolarHBondContact O-N 2.97Å; D62-F65 PolarHBondContact O-N 3.38Å; F65-L68 PolarHBondContact O-N 3.11Å; F65-Q69 HydrophobicContact CE1-CG 4.19Å; F65-Q69 HydrophobicContact CZ-CG 4.19Å; F65-Q69 PolarHBondContact O-N 3.34Å |
| 66 | L | 91.1 | Very high | 80.6 | Confident | 56 Ų | 56 | 111.3 Ų | 111.3 | 29% | 0.293 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.5 | -46.8 | 175.3 | 179.8 | 69 | 0 | 0 | 0 | 111.6 | V55 F58 D62 K63 L64 L68 Q69 L70 | V55-L66 HydrophobicContact CB-CD2 4.46Å; V55-L66 HydrophobicContact CG1-CD2 4.03Å; V55-L66 HydrophobicContact CG2-CD2 3.53Å; F58-L66 HydrophobicContact CD2-CD2 4.34Å; F58-L66 HydrophobicContact CE2-CD2 4.05Å; D62-L66 WeakPolarHBondContact O-CB 3.45Å; D62-L66 PolarHBondContact O-N 3.29Å; K63-L66 PolarHBondContact O-N 2.77Å; L64-L66 PolarHBondContact O-N 3.45Å; L66-L68 VanDerWaalsContact C-N 3.27Å; L66-L68 PolarHBondContact O-N 2.78Å; L66-Q69 PolarHBondContact O-N 3.4Å; L66-L70 HydrophobicContact CG-CG 4.47Å; L66-L70 WeakPolarHBondContact O-CG 3.15Å; L66-L70 PolarHBondContact O-N 2.71Å |
| 67 | Y | 87.9 | Confident | 78.4 | Confident | 165 Ų | 165 | 107.1 Ų | 107.1 | 65% | 0.647 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -57.1 | -41.4 | 179.4 | -179 | -98.2 | 0 | 0 | 0 | 112.1 | K63 L64 Q69 | K63-Y67 WeakPolarHBondContact O-CB 3.42Å; K63-Y67 PolarHBondContact O-N 2.78Å; L64-Y67 PolarHBondContact O-N 3.08Å; Y67-Q69 VanDerWaalsContact C-N 3.28Å; Y67-Q69 PolarHBondContact O-N 2.64Å |
| 68 | L | 86.9 | Confident | 75.7 | Confident | 126 Ų | 126 | 105.2 Ų | 105.2 | 66% | 0.66 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.8 | -24 | 177.7 | -69.1 | 171.5 | 0 | 0 | 0 | 113.6 | L64 F65 L66 | L64-L68 HydrophobicContact CG-CD1 4.47Å; L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 2.86Å; L64-L68 VanDerWaalsContact O-N 3.14Å; F65-L68 PolarHBondContact O-N 3.11Å; L66-L68 VanDerWaalsContact C-N 3.27Å; L66-L68 PolarHBondContact O-N 2.78Å |
| 69 | Q | 87 | Confident | 74 | Confident | 129 Ų | 129 | 110.2 Ų | 110.2 | 60% | 0.603 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -94.9 | -18 | -179.8 | -73.7 | -63.3 | 6.9 | 0 | 0 | 114.8 | F65 L66 Y67 | F65-Q69 HydrophobicContact CE1-CG 4.19Å; F65-Q69 HydrophobicContact CZ-CG 4.19Å; F65-Q69 PolarHBondContact O-N 3.34Å; L66-Q69 PolarHBondContact O-N 3.4Å; Y67-Q69 VanDerWaalsContact C-N 3.28Å; Y67-Q69 PolarHBondContact O-N 2.64Å |
| 70 | L | 86.2 | Confident | 71.6 | Confident | 98 Ų | 98 | 114.8 Ų | 114.8 | 51% | 0.513 | 65% | 0.654 | S | S | . | * | S | Bend | trans | -62 | 129 | 174.7 | -73.6 | 172.1 | 0 | 0 | 0 | 108.9 | L66 S72 | L66-L70 HydrophobicContact CG-CG 4.47Å; L66-L70 WeakPolarHBondContact O-CG 3.15Å; L66-L70 PolarHBondContact O-N 2.71Å; L70-S72 PolarHBondContact O-N 3.33Å |
| 71 | P | 74 | Confident | 69.2 | Low | 122 Ų | 122 | 113.6 Ų | 113.6 | 79% | 0.792 | 67% | 0.667 | S | S | * | * | trans | -61.9 | 101.3 | 178.5 | 21.2 | -29.1 | 0 | 0 | 0 | 109 | G73 | P71-G73 PolarHBondContact O-N 2.9Å; P71-G73 VanDerWaalsContact O-N 3.1Å | ||
| 72 | S | 62.9 | Low | 66.8 | Low | 110 Ų | 110 | 111.2 Ų | 111.2 | 77% | 0.769 | 67% | 0.673 | S | S | * | * | trans | -63.2 | 111.8 | 167 | -65.7 | 0 | 0 | 0 | 0 | 105.7 | L70 | L70-S72 PolarHBondContact O-N 3.33Š| ||
| 73 | G | 55.7 | Low | 64.1 | Low | 58 Ų | 58 | 114.2 Ų | 114.2 | 60% | 0.598 | 69% | 0.689 | S | S | * | * | trans | -49.8 | 166.4 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | P71 S75 | P71-G73 PolarHBondContact O-N 2.9Å; P71-G73 VanDerWaalsContact O-N 3.1Å; G73-S75 PolarHBondContact O-N 3.06Å | ||
| 74 | P | 51.8 | Low | 62 | Low | 131 Ų | 131 | 116.3 Ų | 116.3 | 85% | 0.851 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -54.7 | 117.8 | -178.9 | 25.1 | -33 | 0 | 0 | 0 | 108.6 | S76 | P74-S76 PolarHBondContact O-N 3.26Š|
| 75 | S | 45.8 | Very low | 59.8 | Low | 118 Ų | 118 | 115.2 Ų | 115.2 | 83% | 0.825 | 71% | 0.71 | S | S | * | * | trans | -39.7 | 111.9 | 177.6 | 175.9 | 0 | 0 | 0 | 0 | 109.3 | G73 G77 | G73-S75 PolarHBondContact O-N 3.06Å; S75-G77 PolarHBondContact O-N 3.02Å | ||
| 76 | S | 42.2 | Very low | 57.6 | Low | 119 Ų | 119 | 115.1 Ų | 115.1 | 83% | 0.832 | 73% | 0.726 | S | S | * | * | trans | -58.2 | 102.5 | -177.2 | -169.6 | 0 | 0 | 0 | 0 | 108.9 | P74 | P74-S76 PolarHBondContact O-N 3.26Š| ||
| 77 | G | 45.1 | Very low | 55.9 | Low | 66 Ų | 66 | 118.2 Ų | 118.2 | 68% | 0.68 | 74% | 0.737 | S | S | * | * | trans | -124.8 | 61.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | S75 | S75-G77 PolarHBondContact O-N 3.02Š| ||
| 78 | D | 37.2 | Very low | 54.9 | Low | 160 Ų | 160 | 115.7 Ų | 115.7 | 86% | 0.856 | 74% | 0.735 | S | S | * | * | trans | -86.1 | 130.4 | 172.6 | -135.5 | -17.9 | 0 | 0 | 0 | 110.1 | ||||
| 79 | K | 59.7 | Low | 54.6 | Low | 183 Ų | 183 | 115 Ų | 115 | 80% | 0.796 | 74% | 0.736 | S | S | * | * | trans | -86.2 | 144.7 | -162.3 | -59.7 | -161.7 | 176.9 | -173.8 | 0 | 110.9 | ||||
| 80 | T | 42.3 | Very low | 54.3 | Low | 152 Ų | 152 | 111.3 Ų | 111.3 | 93% | 0.933 | 73% | 0.727 | S | S | * | * | trans | -143.9 | 110.7 | 150.1 | -65.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 81 | G | 41.4 | Very low | 54.2 | Low | 82 Ų | 82 | 108.1 Ų | 108.1 | 85% | 0.845 | 71% | 0.711 | S | S | * | * | S | Bend | trans | 87.3 | 91 | 146.9 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||
| 82 | G | 41.1 | Very low | 54.9 | Low | 78 Ų | 78 | 107.2 Ų | 107.2 | 80% | 0.804 | 70% | 0.696 | S | S | * | * | trans | 130.3 | 109.1 | 142.7 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 83 | D | 37.3 | Very low | 56.1 | Low | 147 Ų | 147 | 106.8 Ų | 106.8 | 79% | 0.786 | 68% | 0.684 | S | S | * | * | trans | 90.3 | 137.9 | 147.2 | -138.6 | 29.2 | 0 | 0 | 0 | 119.6 | S85 | D83-S85 PolarHBondContact O-N 3.27Å; D83-S85 VanDerWaalsContact O-N 3.08Å | ||
| 84 | P | 48.2 | Very low | 57.7 | Low | 119 Ų | 119 | 107.4 Ų | 107.4 | 77% | 0.773 | 67% | 0.672 | S | S | * | * | trans | -84.1 | 90.6 | -167.4 | 35.4 | -29.3 | 0 | 0 | 0 | 110 | ||||
| 85 | S | 41.7 | Very low | 59.7 | Low | 66 Ų | 66 | 101.2 Ų | 101.2 | 46% | 0.462 | 63% | 0.631 | S | S | . | * | trans | -148.9 | 95.4 | 155.5 | 67.3 | 0 | 0 | 0 | 0 | 109.4 | D83 F87 | D83-S85 PolarHBondContact O-N 3.27Å; D83-S85 VanDerWaalsContact O-N 3.08Å; S85-F87 VanDerWaalsContact CB-CD2 3.46Å; S85-F87 PolarHBondContact O-N 2.78Å; S85-F87 WeakPolarHBondContact OG-CD2 3.38Å | ||
| 86 | S | 43.7 | Very low | 61.9 | Low | 132 Ų | 132 | 96.5 Ų | 96.5 | 92% | 0.923 | 60% | 0.598 | S | S | * | * | trans | -66.7 | 74 | 168.3 | 175.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 87 | F | 57 | Low | 64.2 | Low | 122 Ų | 122 | 94.8 Ų | 94.8 | 54% | 0.535 | 58% | 0.58 | S | S | . | * | trans | -97.8 | 144.6 | 160.5 | -60.2 | -59.7 | 0 | 0 | 0 | 107.5 | S85 T89 | S85-F87 VanDerWaalsContact CB-CD2 3.46Å; S85-F87 PolarHBondContact O-N 2.78Å; S85-F87 WeakPolarHBondContact OG-CD2 3.38Å; F87-T89 PolarHBondContact O-N 3.47Å | ||
| 88 | N | 67 | Low | 66.5 | Low | 111 Ų | 111 | 91.9 Ų | 91.9 | 59% | 0.594 | 55% | 0.548 | S | S | * | . | trans | -48.8 | 111.8 | -179.1 | -100.5 | -30.2 | 0 | 0 | 0 | 110.4 | A90 D91 Q92 | N88-A90 PolarHBondContact O-N 3.29Å; N88-A90 VanDerWaalsContact O-N 3.13Å; N88-D91 HydrophobicContact CB-CB 4.05Å; N88-D91 VanDerWaalsContact CB-OD2 3.22Å; N88-D91 WeakPolarHBondContact CB-OD2 3.28Å; N88-D91 PolarHBondContact ND2-OD2 2.91Å; N88-D91 PolarHBondContact O-N 3.37Å; N88-Q92 PolarHBondContact O-N 3.43Å | ||
| 89 | T | 79.8 | Confident | 69.3 | Low | 113 Ų | 113 | 84.2 Ų | 84.2 | 69% | 0.693 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -53.4 | -34.1 | 175.8 | -48 | 0 | 0 | 0 | 0 | 110.8 | F87 Q92 L93 | F87-T89 PolarHBondContact O-N 3.47Å; T89-Q92 PolarHBondContact O-N 3.03Å; T89-L93 WeakPolarHBondContact O-CB 3.43Å; T89-L93 PolarHBondContact O-N 2.95Å |
| 90 | A | 80.4 | Confident | 70.9 | Confident | 50 Ų | 50 | 82.2 Ų | 82.2 | 41% | 0.413 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.3 | -52.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | N88 Q92 L93 H94 | N88-A90 PolarHBondContact O-N 3.29Å; N88-A90 VanDerWaalsContact O-N 3.13Å; A90-Q92 VanDerWaalsContact C-N 3.29Å; A90-Q92 PolarHBondContact O-N 3.42Å; A90-L93 WeakPolarHBondContact O-CB 3.21Å; A90-L93 PolarHBondContact O-N 3.34Å; A90-L93 VanDerWaalsContact O-N 3.1Å; A90-H94 PolarHBondContact O-N 2.89Å; A90-H94 PolarHBondContact O-ND1 2.82Å |
| 91 | D | 84.8 | Confident | 73.1 | Confident | 32 Ų | 32 | 77.1 Ų | 77.1 | 17% | 0.171 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -64.3 | -36.5 | -176.8 | -62.1 | -19.2 | 0 | 0 | 0 | 111.8 | N88 T95 L132 | N88-D91 HydrophobicContact CB-CB 4.05Å; N88-D91 VanDerWaalsContact CB-OD2 3.22Å; N88-D91 WeakPolarHBondContact CB-OD2 3.28Å; N88-D91 PolarHBondContact ND2-OD2 2.91Å; N88-D91 PolarHBondContact O-N 3.37Å; D91-T95 WeakPolarHBondContact O-CB 3.4Å; D91-T95 PolarHBondContact O-N 3.39Å; D91-T95 PolarHBondContact O-OG1 3.4Å; D91-L132 HydrophobicContact CB-CD2 3.94Å |
| 92 | Q | 87.6 | Confident | 75.5 | Confident | 103 Ų | 103 | 76.8 Ų | 76.8 | 48% | 0.481 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.8 | -46.5 | 172.6 | -174.7 | 179.1 | 88.9 | 0 | 0 | 111.2 | N88 T89 A90 H94 T95 C96 I140 | N88-Q92 PolarHBondContact O-N 3.43Å; T89-Q92 PolarHBondContact O-N 3.03Å; A90-Q92 VanDerWaalsContact C-N 3.29Å; A90-Q92 PolarHBondContact O-N 3.42Å; Q92-H94 PolarHBondContact O-N 3.46Å; Q92-T95 WeakPolarHBondContact O-CB 3.29Å; Q92-T95 PolarHBondContact O-N 2.84Å; Q92-C96 PolarHBondContact O-N 2.72Å; Q92-C96 PolarHBondContact O-SG 3.43Å; Q92-I140 HydrophobicContact CG-CD1 3.83Å; Q92-I140 HydrophobicContact CG-CG1 4.3Å |
| 93 | L | 88.3 | Confident | 78.1 | Confident | 100 Ų | 100 | 73.3 Ų | 73.3 | 52% | 0.524 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.3 | -44.8 | 178.3 | -169.8 | 72.1 | 0 | 0 | 0 | 111.8 | T89 A90 T95 C96 N97 | T89-L93 WeakPolarHBondContact O-CB 3.43Å; T89-L93 PolarHBondContact O-N 2.95Å; A90-L93 WeakPolarHBondContact O-CB 3.21Å; A90-L93 PolarHBondContact O-N 3.34Å; A90-L93 VanDerWaalsContact O-N 3.1Å; L93-T95 VanDerWaalsContact C-N 3.28Å; L93-T95 PolarHBondContact O-N 3.47Å; L93-C96 WeakPolarHBondContact O-CB 3.5Å; L93-C96 PolarHBondContact O-N 3.21Å; L93-N97 WeakPolarHBondContact O-CB 3.46Å; L93-N97 VanDerWaalsContact O-CG 3.24Å; L93-N97 PolarHBondContact O-N 3.45Å |
| 94 | H | 89.1 | Confident | 80.7 | Confident | 72 Ų | 72 | 68.2 Ų | 68.2 | 33% | 0.333 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -58.9 | -42.7 | 175.5 | -74.8 | 82.2 | 0 | 0 | 0 | 111.3 | A90 Q92 N97 W98 H129 | A90-H94 PolarHBondContact O-N 2.89Å; A90-H94 PolarHBondContact O-ND1 2.82Å; Q92-H94 PolarHBondContact O-N 3.46Å; H94-N97 PolarHBondContact O-N 3.04Å; H94-W98 WeakPolarHBondContact O-CB 3.39Å; H94-W98 PolarHBondContact O-N 3.11Å; H94-H129 AromaticContact CD2-NE2 3.96Å; H94-H129 AromaticContact NE2-NE2 3.88Å |
| 95 | T | 93.2 | Very high | 82.9 | Confident | 0 Ų | 0 | 67.6 Ų | 67.6 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 177.3 | -54.4 | 0 | 0 | 0 | 0 | 111.5 | D91 Q92 L93 N97 W98 I99 Y120 L132 F137 I140 | D91-T95 WeakPolarHBondContact O-CB 3.4Å; D91-T95 PolarHBondContact O-N 3.39Å; D91-T95 PolarHBondContact O-OG1 3.4Å; Q92-T95 WeakPolarHBondContact O-CB 3.29Å; Q92-T95 PolarHBondContact O-N 2.84Å; L93-T95 VanDerWaalsContact C-N 3.28Å; L93-T95 PolarHBondContact O-N 3.47Å; T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 3.43Å; T95-W98 PolarHBondContact O-N 2.8Å; T95-I99 HydrophobicContact CG2-CD1 3.91Å; T95-I99 HydrophobicContact CG2-CG1 4.49Å; T95-I99 VanDerWaalsContact O-CG1 3.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.34Å; T95-I99 PolarHBondContact O-N 3.29Å; T95-Y120 HydrophobicContact CG2-CD2 4.46Å; T95-Y120 HydrophobicContact CG2-CE2 3.75Å; T95-Y120 PolarHBondContact OG1-OH 2.87Å; T95-L132 HydrophobicContact CG2-CD1 4.13Å; T95-L132 VanDerWaalsContact OG1-CD1 3.26Å; T95-L132 WeakPolarHBondContact OG1-CD1 3.22Å; T95-F137 HydrophobicContact CG2-CD2 3.74Å; T95-F137 HydrophobicContact CG2-CE2 4.2Å; T95-I140 HydrophobicContact CG2-CD1 3.88Å; T95-I140 HydrophobicContact CG2-CG2 4.47Å |
| 96 | C | 92.6 | Very high | 85.4 | Confident | 19 Ų | 19 | 66.9 Ų | 66.9 | 13% | 0.128 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.2 | -46.5 | 175.4 | -72.4 | 0 | 0 | 0 | 0 | 111.8 | Q92 L93 I99 R100 I140 I144 | Q92-C96 PolarHBondContact O-N 2.72Å; Q92-C96 PolarHBondContact O-SG 3.43Å; L93-C96 WeakPolarHBondContact O-CB 3.5Å; L93-C96 PolarHBondContact O-N 3.21Å; C96-I99 PolarHBondContact O-N 2.99Å; C96-R100 WeakPolarHBondContact O-CG 3.48Å; C96-R100 PolarHBondContact O-N 3.4Å; C96-I140 WeakPolarHBondContact SG-CG2 3.39Å; C96-I144 HydrophobicContact CB-CD1 4.09Å |
| 97 | N | 90.8 | Very high | 87.6 | Confident | 84 Ų | 84 | 64.8 Ų | 64.8 | 45% | 0.449 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 179.8 | -70.4 | -11.8 | 0 | 0 | 0 | 111.5 | L93 H94 T95 R100 S101 | L93-N97 WeakPolarHBondContact O-CB 3.46Å; L93-N97 VanDerWaalsContact O-CG 3.24Å; L93-N97 PolarHBondContact O-N 3.45Å; H94-N97 PolarHBondContact O-N 3.04Å; T95-N97 VanDerWaalsContact C-N 3.33Å; T95-N97 PolarHBondContact O-N 3.43Å; N97-R100 PolarHBondContact O-N 3.45Å; N97-S101 WeakPolarHBondContact O-CB 3.49Å; N97-S101 PolarHBondContact O-N 3.22Å; N97-S101 PolarHBondContact O-OG 3.4Å |
| 98 | W | 93.9 | Very high | 89.1 | Confident | 4 Ų | 4 | 65.7 Ų | 65.7 | 2% | 0.015 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.3 | -48 | 174.8 | -176.4 | 85 | 0 | 0 | 0 | 111.7 | H94 T95 R100 S101 H102 L103 V116 T119 Y120 Y123 F137 | H94-W98 WeakPolarHBondContact O-CB 3.39Å; H94-W98 PolarHBondContact O-N 3.11Å; T95-W98 PolarHBondContact O-N 2.8Å; W98-R100 PolarHBondContact O-N 3.05Å; W98-S101 WeakPolarHBondContact CA-OG 3.44Å; W98-S101 PolarHBondContact O-N 3.15Å; W98-S101 PolarHBondContact O-OG 2.87Å; W98-H102 AromaticContact CD1-CE1 3.37Å; W98-H102 AromaticContact CD1-CG 3.99Å; W98-H102 AromaticContact CD1-ND1 3.4Å; W98-H102 AromaticContact CD1-NE2 3.91Å; W98-H102 HydrophobicContact CD2-CB 4.43Å; W98-H102 AromaticContact CE2-CG 3.77Å; W98-H102 AromaticContact CE2-ND1 3.96Å; W98-H102 AromaticContact CG-ND1 3.86Å; W98-H102 HydrophobicContact CZ2-CB 4.15Å; W98-H102 AromaticContact NE1-CD2 3.61Å; W98-H102 AromaticContact NE1-CE1 3.45Å; W98-H102 PolarHBondContact NE1-CE1 3.27Å; W98-H102 AromaticContact NE1-CG 3.58Å; W98-H102 AromaticContact NE1-ND1 3.48Å; W98-H102 PolarHBondContact NE1-ND1 2.92Å; W98-H102 AromaticContact NE1-NE2 3.52Å; W98-H102 WeakPolarHBondContact O-CB 3.47Å; W98-H102 PolarHBondContact O-N 3.25Å; W98-H102 PolarHBondContact O-ND1 3.22Å; W98-L103 HydrophobicContact CZ3-CD1 4.39Å; W98-V116 HydrophobicContact CH2-CG1 4.37Å; W98-V116 WeakPolarHBondContact CH2-O 3.37Å; W98-V116 HydrophobicContact CZ3-CG1 4.37Å; W98-T119 HydrophobicContact CZ2-CG2 3.92Å; W98-Y120 AromaticContact CD2-CD2 3.88Å; W98-Y120 HydrophobicContact CD2-CD2 3.88Å; W98-Y120 AromaticContact CE3-CD2 3.85Å; W98-Y120 HydrophobicContact CE3-CD2 3.85Å; W98-Y120 HydrophobicContact CE3-CG 4.31Å; W98-Y120 HydrophobicContact CG-CD2 4.16Å; W98-Y120 HydrophobicContact CZ3-CD2 4.46Å; W98-Y120 HydrophobicContact CZ3-CG 4.48Å; W98-Y123 HydrophobicContact CB-CD1 4.32Å; W98-Y123 HydrophobicContact CB-CE1 4.04Å; W98-Y123 AromaticContact CD1-CD1 3.25Å; W98-Y123 AromaticContact CD1-CD2 3.56Å; W98-Y123 AromaticContact CD1-CE1 3.52Å; W98-Y123 AromaticContact CD1-CE2 3.8Å; W98-Y123 AromaticContact CD1-CG 3.26Å; W98-Y123 AromaticContact CD1-CZ 3.78Å; W98-Y123 AromaticContact CG-CD1 3.88Å; W98-Y123 HydrophobicContact CG-CD1 3.88Å; W98-Y123 HydrophobicContact CG-CE1 4.05Å; W98-Y123 HydrophobicContact CG-CG 4.26Å; W98-Y123 AromaticContact NE1-CD1 3.86Å; W98-Y123 AromaticContact NE1-CD2 3.81Å; W98-Y123 AromaticContact NE1-CG 3.46Å; W98-F137 HydrophobicContact CE3-CE2 4.07Å; W98-F137 HydrophobicContact CE3-CZ 4.48Å; W98-F137 AromaticContact CZ3-CE2 3.85Å; W98-F137 HydrophobicContact CZ3-CE2 3.85Å; W98-F137 AromaticContact CZ3-CZ 3.85Å; W98-F137 HydrophobicContact CZ3-CZ 3.85Å |
| 99 | I | 95.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.6 | -48.4 | 179.1 | -70.4 | 168 | 0 | 0 | 0 | 110.6 | T95 C96 S101 L103 F137 I140 I141 I144 F145 | T95-I99 HydrophobicContact CG2-CD1 3.91Å; T95-I99 HydrophobicContact CG2-CG1 4.49Å; T95-I99 VanDerWaalsContact O-CG1 3.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.34Å; T95-I99 PolarHBondContact O-N 3.29Å; C96-I99 PolarHBondContact O-N 2.99Å; I99-S101 VanDerWaalsContact C-N 3.32Å; I99-S101 PolarHBondContact O-N 3.29Å; I99-L103 HydrophobicContact CG2-CD1 4.28Å; I99-L103 WeakPolarHBondContact O-CB 3.25Å; I99-L103 PolarHBondContact O-N 2.89Å; I99-F137 HydrophobicContact CD1-CD2 4.29Å; I99-F137 HydrophobicContact CD1-CE2 3.83Å; I99-F137 HydrophobicContact CD1-CZ 4.18Å; I99-F137 HydrophobicContact CG1-CE2 3.82Å; I99-F137 HydrophobicContact CG1-CZ 4.1Å; I99-I140 HydrophobicContact CD1-CB 4.24Å; I99-I140 HydrophobicContact CD1-CG2 3.72Å; I99-I141 HydrophobicContact CD1-CB 4.05Å; I99-I141 HydrophobicContact CG2-CG1 4.24Å; I99-I144 HydrophobicContact CB-CD1 3.79Å; I99-I144 HydrophobicContact CD1-CD1 4.05Å; I99-I144 HydrophobicContact CG2-CB 4.26Å; I99-I144 HydrophobicContact CG2-CD1 3.65Å; I99-I144 HydrophobicContact CG2-CG2 4.05Å; I99-F145 HydrophobicContact CG2-CD2 4.14Å; I99-F145 HydrophobicContact CG2-CE2 3.49Å; I99-F145 VanDerWaalsContact CG2-CE2 3.49Å; I99-F145 HydrophobicContact CG2-CZ 4.32Å |
| 100 | R | 92.8 | Very high | 91 | Very high | 140 Ų | 140 | 59.7 Ų | 59.7 | 53% | 0.528 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.4 | -28.7 | -179.7 | -70.6 | -174.3 | -178.4 | 110.7 | 0.9 | 114.1 | C96 N97 W98 I144 | C96-R100 WeakPolarHBondContact O-CG 3.48Å; C96-R100 PolarHBondContact O-N 3.4Å; N97-R100 PolarHBondContact O-N 3.45Å; W98-R100 PolarHBondContact O-N 3.05Å; R100-I144 HydrophobicContact CG-CD1 4.39Å; R100-I144 HydrophobicContact CG-CG2 3.95Å |
| 101 | S | 90 | Very high | 91.7 | Very high | 45 Ų | 45 | 58.3 Ų | 58.3 | 32% | 0.315 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -84.5 | -31.8 | -179.9 | 50.8 | 0 | 0 | 0 | 0 | 112.9 | N97 W98 I99 K169 | N97-S101 WeakPolarHBondContact O-CB 3.49Å; N97-S101 PolarHBondContact O-N 3.22Å; N97-S101 PolarHBondContact O-OG 3.4Å; W98-S101 WeakPolarHBondContact CA-OG 3.44Å; W98-S101 PolarHBondContact O-N 3.15Å; W98-S101 PolarHBondContact O-OG 2.87Å; I99-S101 VanDerWaalsContact C-N 3.32Å; I99-S101 PolarHBondContact O-N 3.29Å; S101-K169 WeakPolarHBondContact O-CD 3.37Å |
| 102 | H | 91.8 | Very high | 92.1 | Very high | 75 Ų | 75 | 58.4 Ų | 58.4 | 35% | 0.347 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -104.4 | -18.1 | -172.4 | -67.3 | 70.6 | 0 | 0 | 0 | 114 | W98 K169 | W98-H102 AromaticContact CD1-CE1 3.37Å; W98-H102 AromaticContact CD1-CG 3.99Å; W98-H102 AromaticContact CD1-ND1 3.4Å; W98-H102 AromaticContact CD1-NE2 3.91Å; W98-H102 HydrophobicContact CD2-CB 4.43Å; W98-H102 AromaticContact CE2-CG 3.77Å; W98-H102 AromaticContact CE2-ND1 3.96Å; W98-H102 AromaticContact CG-ND1 3.86Å; W98-H102 HydrophobicContact CZ2-CB 4.15Å; W98-H102 AromaticContact NE1-CD2 3.61Å; W98-H102 AromaticContact NE1-CE1 3.45Å; W98-H102 PolarHBondContact NE1-CE1 3.27Å; W98-H102 AromaticContact NE1-CG 3.58Å; W98-H102 AromaticContact NE1-ND1 3.48Å; W98-H102 PolarHBondContact NE1-ND1 2.92Å; W98-H102 AromaticContact NE1-NE2 3.52Å; W98-H102 WeakPolarHBondContact O-CB 3.47Å; W98-H102 PolarHBondContact O-N 3.25Å; W98-H102 PolarHBondContact O-ND1 3.22Å; H102-K169 PolarHBondContact O-N 3.02Å |
| 103 | L | 94.4 | Very high | 92.5 | Very high | 6 Ų | 6 | 56.2 Ų | 56.2 | 3% | 0.031 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 148.7 | -178.4 | -55.3 | 175.2 | 0 | 0 | 0 | 110.3 | W98 I99 L111 V116 I141 F145 I166 R167 | W98-L103 HydrophobicContact CZ3-CD1 4.39Å; I99-L103 HydrophobicContact CG2-CD1 4.28Å; I99-L103 WeakPolarHBondContact O-CB 3.25Å; I99-L103 PolarHBondContact O-N 2.89Å; L103-L111 HydrophobicContact CD2-CD1 3.82Å; L103-V116 HydrophobicContact CD1-CG1 3.91Å; L103-I141 HydrophobicContact CD1-CD1 3.82Å; L103-F145 HydrophobicContact CB-CE2 3.86Å; L103-F145 HydrophobicContact CB-CZ 4.06Å; L103-I166 HydrophobicContact CD1-CD1 4.36Å; L103-R167 WeakPolarHBondContact CA-O 3.38Å |
| 104 | E | 93.6 | Very high | 92.8 | Very high | 40 Ų | 40 | 57.7 Ų | 57.7 | 19% | 0.187 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.4 | 155.6 | 174 | 64.8 | -177 | -173.9 | 0 | 0 | 110.9 | I166 R167 K169 | E104-I166 CarbonylContact O-C 3.57Å; E104-I166 VanDerWaalsContact O-CA 3.27Å; E104-I166 WeakPolarHBondContact O-CA 3.49Å; E104-R167 HydrophobicContact CG-CG 3.66Å; E104-R167 PolarHBondContact N-O 2.86Å; E104-R167 PolarHBondContact O-N 3.38Å; E104-R167 IonicContact OE1-CZ 3.15Å; E104-R167 IonicContact OE1-NE 2.66Å; E104-R167 PolarHBondContact OE1-NE 3.03Å; E104-R167 IonicContact OE1-NH2 2.77Å; E104-R167 PolarHBondContact OE1-NH2 3.49Å; E104-K169 HydrophobicContact CG-CB 4.48Å |
| 105 | E | 93.7 | Very high | 93.1 | Very high | 105 Ų | 105 | 58 Ų | 58 | 49% | 0.491 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.8 | 132.7 | 179.1 | -170.6 | 169.5 | -174.5 | 0 | 0 | 110.6 | F145 N147 | E105-F145 HydrophobicContact CB-CD1 4.4Å; E105-N147 WeakPolarHBondContact OE1-CB 3.41Å; E105-N147 PolarHBondContact OE1-ND2 3.12Å |
| 106 | H | 93.2 | Very high | 93.2 | Very high | 51 Ų | 51 | 58.5 Ų | 58.5 | 24% | 0.236 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -159.5 | 114.7 | 177.9 | -171.9 | -89.3 | 0 | 0 | 0 | 111.1 | D108 T109 G165 I166 R167 | H106-D108 VanDerWaalsContact C-N 3.3Å; H106-D108 PolarHBondContact O-N 3.44Å; H106-T109 WeakPolarHBondContact CB-OG1 3.48Å; H106-T109 VanDerWaalsContact ND1-CG2 3.25Å; H106-T109 WeakPolarHBondContact ND1-CG2 3.44Å; H106-T109 PolarHBondContact ND1-OG1 3.1Å; H106-T109 PolarHBondContact O-OG1 3.13Å; H106-G165 PolarHBondContact N-O 3.42Å; H106-G165 CarbonylContact O-C 3.54Å; H106-G165 WeakPolarHBondContact O-CA 3.29Å; H106-I166 PolarHBondContact O-N 3Å; H106-R167 HydrophobicContact CB-CB 4.23Å; H106-R167 HydrophobicContact CB-CG 3.65Å; H106-R167 PolarHBondContact CD2-NH1 3.2Å; H106-R167 PolarHBondContact NE2-NH1 3.42Å |
| 107 | S | 90.1 | Very high | 93.4 | Very high | 88 Ų | 88 | 59.6 Ų | 59.6 | 62% | 0.615 | 31% | 0.307 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -59.5 | -35.5 | -169 | 53.9 | 0 | 0 | 0 | 0 | 114.2 | ||
| 108 | D | 88.5 | Confident | 93.6 | Very high | 141 Ų | 141 | 58.2 Ų | 58.2 | 75% | 0.754 | 30% | 0.298 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 3.7 | -164.9 | -54.5 | -20.4 | 0 | 0 | 0 | 113.2 | H106 | H106-D108 VanDerWaalsContact C-N 3.3Å; H106-D108 PolarHBondContact O-N 3.44Å |
| 109 | T | 93.3 | Very high | 93.7 | Very high | 42 Ų | 42 | 60.3 Ų | 60.3 | 26% | 0.258 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 159.6 | -177.1 | 50.6 | 0 | 0 | 0 | 0 | 112.1 | H106 G165 I166 R167 | H106-T109 WeakPolarHBondContact CB-OG1 3.48Å; H106-T109 VanDerWaalsContact ND1-CG2 3.25Å; H106-T109 WeakPolarHBondContact ND1-CG2 3.44Å; H106-T109 PolarHBondContact ND1-OG1 3.1Å; H106-T109 PolarHBondContact O-OG1 3.13Å; T109-G165 PolarHBondContact O-N 2.88Å; T109-I166 PolarHBondContact OG1-O 3.22Å; T109-R167 HydrophobicContact CG2-CB 4.36Å; T109-R167 WeakPolarHBondContact OG1-CB 3.19Å |
| 110 | C | 93.1 | Very high | 93.7 | Very high | 56 Ų | 56 | 60.5 Ų | 60.5 | 38% | 0.378 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 147.9 | 173 | 61.7 | 0 | 0 | 0 | 0 | 110.8 | L153 C162 Y163 | C110-L153 HydrophobicContact CB-CD1 4.03Å; C110-L153 WeakPolarHBondContact SG-CD1 3.26Å; C110-C162 HydrophobicContact CB-CB 4.36Å; C110-Y163 CarbonylContact C-O 3.51Å; C110-Y163 WeakPolarHBondContact CA-O 3.19Å; C110-Y163 WeakPolarHBondContact CB-O 3.16Å |
| 111 | L | 94.9 | Very high | 93.8 | Very high | 21 Ų | 21 | 58 Ų | 58 | 11% | 0.11 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 134.3 | 176.8 | -67.1 | 179.7 | 0 | 0 | 0 | 110.4 | L103 K113 V116 C162 Y163 I166 R168 | L103-L111 HydrophobicContact CD2-CD1 3.82Å; L111-K113 PolarHBondContact O-N 3.31Å; L111-V116 HydrophobicContact CB-CG2 3.8Å; L111-V116 HydrophobicContact CD1-CG2 4.06Å; L111-C162 CarbonylContact O-C 3.51Å; L111-C162 WeakPolarHBondContact O-CA 3.39Å; L111-C162 WeakPolarHBondContact O-CB 3.27Å; L111-Y163 PolarHBondContact N-O 2.94Å; L111-Y163 PolarHBondContact O-N 3.4Å; L111-I166 HydrophobicContact CD1-CD1 4.38Å; L111-I166 HydrophobicContact CD1-CG1 4.34Å; L111-R168 HydrophobicContact CD1-CG 4.06Å; L111-R168 HydrophobicContact CD2-CG 4.34Å |
| 112 | P | 94.9 | Very high | 94.1 | Very high | 35 Ų | 35 | 61.9 Ų | 61.9 | 23% | 0.227 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.9 | 129.4 | 173.1 | -23.3 | 34.8 | 0 | 0 | 0 | 111.2 | Q114 D115 V116 | P112-Q114 PolarHBondContact O-N 3.29Å; P112-D115 HydrophobicContact CB-CB 4.2Å; P112-D115 WeakPolarHBondContact CG-OD2 3.45Å; P112-D115 PolarHBondContact O-N 3.18Å; P112-V116 WeakPolarHBondContact O-CG2 3.4Å; P112-V116 PolarHBondContact O-N 3.5Å |
| 113 | K | 95.4 | Very high | 94.1 | Very high | 56 Ų | 56 | 61.9 Ų | 61.9 | 24% | 0.243 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.9 | -38.1 | -178.2 | -63.7 | -162.6 | 175.8 | -174.8 | 0 | 112 | L111 Y117 Y161 Y163 | L111-K113 PolarHBondContact O-N 3.31Å; K113-Y117 PolarHBondContact O-N 3.04Å; K113-Y117 VanDerWaalsContact O-N 3.08Å; K113-Y161 WeakPolarHBondContact CG-O 3.37Å; K113-Y161 PolarHBondContact N-O 2.92Å; K113-Y163 HydrophobicContact CB-CD2 4.27Å; K113-Y163 HydrophobicContact CB-CE2 3.85Å; K113-Y163 HydrophobicContact CD-CD2 4.46Å; K113-Y163 HydrophobicContact CD-CE1 4.08Å; K113-Y163 HydrophobicContact CD-CE2 3.98Å; K113-Y163 HydrophobicContact CG-CD1 4.44Å; K113-Y163 HydrophobicContact CG-CD2 3.67Å; K113-Y163 HydrophobicContact CG-CE1 4.31Å; K113-Y163 HydrophobicContact CG-CE2 3.49Å; K113-Y163 VanDerWaalsContact CG-CE2 3.49Å; K113-Y163 HydrophobicContact CG-CG 4.14Å |
| 114 | Q | 94.9 | Very high | 94 | Very high | 132 Ų | 132 | 61.9 Ų | 61.9 | 62% | 0.617 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -61.7 | -50 | 178.9 | -174.5 | 177.4 | -1.3 | 0 | 0 | 111 | P112 V116 Y117 E118 | P112-Q114 PolarHBondContact O-N 3.29Å; Q114-V116 VanDerWaalsContact C-N 3.32Å; Q114-V116 PolarHBondContact O-N 3.12Å; Q114-Y117 PolarHBondContact O-N 2.65Å; Q114-E118 VanDerWaalsContact O-CB 3.3Å; Q114-E118 WeakPolarHBondContact O-CB 3.48Å; Q114-E118 PolarHBondContact O-N 3.05Å |
| 115 | D | 94.9 | Very high | 94 | Very high | 79 Ų | 79 | 65.3 Ų | 65.3 | 42% | 0.422 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.6 | -38.8 | -178 | -61.4 | -4.7 | 0 | 0 | 0 | 111.9 | P112 T119 | P112-D115 HydrophobicContact CB-CB 4.2Å; P112-D115 WeakPolarHBondContact CG-OD2 3.45Å; P112-D115 PolarHBondContact O-N 3.18Å; D115-T119 WeakPolarHBondContact O-CB 3.38Å; D115-T119 PolarHBondContact O-N 3.44Å; D115-T119 PolarHBondContact O-OG1 3.3Å |
| 116 | V | 95.8 | Very high | 93.9 | Very high | 9 Ų | 9 | 66.9 Ų | 66.9 | 6% | 0.055 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62 | -50.9 | 175.8 | 175 | 0 | 0 | 0 | 0 | 110.6 | W98 L103 L111 P112 Q114 E118 T119 Y120 F137 I141 | W98-V116 HydrophobicContact CH2-CG1 4.37Å; W98-V116 WeakPolarHBondContact CH2-O 3.37Å; W98-V116 HydrophobicContact CZ3-CG1 4.37Å; L103-V116 HydrophobicContact CD1-CG1 3.91Å; L111-V116 HydrophobicContact CB-CG2 3.8Å; L111-V116 HydrophobicContact CD1-CG2 4.06Å; P112-V116 WeakPolarHBondContact O-CG2 3.4Å; P112-V116 PolarHBondContact O-N 3.5Å; Q114-V116 VanDerWaalsContact C-N 3.32Å; Q114-V116 PolarHBondContact O-N 3.12Å; V116-E118 PolarHBondContact O-N 2.92Å; V116-T119 PolarHBondContact O-N 3.4Å; V116-Y120 PolarHBondContact O-N 3.06Å; V116-Y120 VanDerWaalsContact O-N 3.1Å; V116-F137 HydrophobicContact CG1-CE1 3.9Å; V116-F137 HydrophobicContact CG1-CZ 3.73Å; V116-I141 HydrophobicContact CG1-CD1 4.44Å |
| 117 | Y | 96.4 | Very high | 93.6 | Very high | 43 Ų | 43 | 68.1 Ų | 68.1 | 17% | 0.169 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -68.6 | -34 | -179.4 | -178 | -106.4 | 0 | 0 | 0 | 112.7 | K113 Q114 T119 Y120 R121 L132 A134 F137 | K113-Y117 PolarHBondContact O-N 3.04Å; K113-Y117 VanDerWaalsContact O-N 3.08Å; Q114-Y117 PolarHBondContact O-N 2.65Å; Y117-T119 VanDerWaalsContact C-N 3.34Å; Y117-Y120 AromaticContact CD2-CD1 3.97Å; Y117-Y120 HydrophobicContact CD2-CD1 3.97Å; Y117-Y120 AromaticContact CE2-CD1 3.97Å; Y117-Y120 HydrophobicContact CE2-CD1 3.97Å; Y117-Y120 HydrophobicContact CE2-CE1 4.21Å; Y117-Y120 PolarHBondContact O-N 3.05Å; Y117-R121 HydrophobicContact CD1-CG 4.38Å; Y117-R121 HydrophobicContact CE1-CG 3.89Å; Y117-R121 PolarHBondContact O-N 3.04Å; Y117-L132 WeakPolarHBondContact CE2-O 3.46Å; Y117-L132 PolarHBondContact OH-O 2.73Å; Y117-A134 HydrophobicContact CD1-CB 4.37Å; Y117-A134 HydrophobicContact CD2-CB 4.39Å; Y117-A134 HydrophobicContact CE1-CB 4.08Å; Y117-A134 HydrophobicContact CE2-CB 4.09Å; Y117-A134 PolarHBondContact OH-N 3.22Å; Y117-F137 HydrophobicContact CD2-CB 3.97Å; Y117-F137 AromaticContact CD2-CD1 3.97Å; Y117-F137 HydrophobicContact CD2-CD1 3.97Å; Y117-F137 HydrophobicContact CD2-CD2 4.34Å; Y117-F137 AromaticContact CD2-CG 3.82Å; Y117-F137 HydrophobicContact CD2-CG 3.82Å; Y117-F137 HydrophobicContact CE2-CB 4.01Å; Y117-F137 HydrophobicContact CE2-CG 4.31Å |
| 118 | E | 96.1 | Very high | 93.5 | Very high | 54 Ų | 54 | 72.8 Ų | 72.8 | 25% | 0.252 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 175.2 | -163.7 | 62 | -142.6 | 0 | 0 | 111.9 | Q114 V116 Y120 R121 R122 | Q114-E118 VanDerWaalsContact O-CB 3.3Å; Q114-E118 WeakPolarHBondContact O-CB 3.48Å; Q114-E118 PolarHBondContact O-N 3.05Å; V116-E118 PolarHBondContact O-N 2.92Å; E118-Y120 VanDerWaalsContact C-N 3.35Å; E118-R121 PolarHBondContact O-N 3.41Å; E118-R121 IonicContact OE1-CZ 2.63Å; E118-R121 IonicContact OE1-NH2 3.66Å; E118-R121 IonicContact OE2-CZ 3.87Å; E118-R121 IonicContact OE2-NE 3.4Å; E118-R121 IonicContact OE2-NH2 3.66Å; E118-R121 PolarHBondContact OE2-NH2 3.08Å; E118-R122 PolarHBondContact O-N 3.1Å |
| 119 | T | 95.3 | Very high | 93.4 | Very high | 49 Ų | 49 | 69.4 Ų | 69.4 | 30% | 0.301 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66.3 | -40.9 | 177 | -50.9 | 0 | 0 | 0 | 0 | 110.7 | W98 D115 V116 Y117 R122 Y123 | W98-T119 HydrophobicContact CZ2-CG2 3.92Å; D115-T119 WeakPolarHBondContact O-CB 3.38Å; D115-T119 PolarHBondContact O-N 3.44Å; D115-T119 PolarHBondContact O-OG1 3.3Å; V116-T119 PolarHBondContact O-N 3.4Å; Y117-T119 VanDerWaalsContact C-N 3.34Å; T119-R122 PolarHBondContact O-N 3.1Å; T119-Y123 PolarHBondContact O-N 3.2Å |
| 120 | Y | 95.8 | Very high | 93.2 | Very high | 4 Ų | 4 | 77.3 Ų | 77.3 | 2% | 0.016 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.7 | -44.5 | 172.5 | 166.4 | -105.7 | 0 | 0 | 0 | 112.3 | T95 W98 V116 Y117 E118 R122 Y123 C124 P131 L132 F137 | T95-Y120 HydrophobicContact CG2-CD2 4.46Å; T95-Y120 HydrophobicContact CG2-CE2 3.75Å; T95-Y120 PolarHBondContact OG1-OH 2.87Å; W98-Y120 AromaticContact CD2-CD2 3.88Å; W98-Y120 HydrophobicContact CD2-CD2 3.88Å; W98-Y120 AromaticContact CE3-CD2 3.85Å; W98-Y120 HydrophobicContact CE3-CD2 3.85Å; W98-Y120 HydrophobicContact CE3-CG 4.31Å; W98-Y120 HydrophobicContact CG-CD2 4.16Å; W98-Y120 HydrophobicContact CZ3-CD2 4.46Å; W98-Y120 HydrophobicContact CZ3-CG 4.48Å; V116-Y120 PolarHBondContact O-N 3.06Å; V116-Y120 VanDerWaalsContact O-N 3.1Å; Y117-Y120 AromaticContact CD2-CD1 3.97Å; Y117-Y120 HydrophobicContact CD2-CD1 3.97Å; Y117-Y120 AromaticContact CE2-CD1 3.97Å; Y117-Y120 HydrophobicContact CE2-CD1 3.97Å; Y117-Y120 HydrophobicContact CE2-CE1 4.21Å; Y117-Y120 PolarHBondContact O-N 3.05Å; E118-Y120 VanDerWaalsContact C-N 3.35Å; Y120-R122 PolarHBondContact O-N 2.97Å; Y120-Y123 WeakPolarHBondContact O-CB 3.37Å; Y120-Y123 PolarHBondContact O-N 3.43Å; Y120-C124 WeakPolarHBondContact CE2-SG 3.3Å; Y120-C124 PolarHBondContact O-N 2.95Å; Y120-C124 PolarHBondContact O-SG 3.34Å; Y120-P131 HydrophobicContact CE1-CB 3.92Å; Y120-L132 HydrophobicContact CE1-CB 4.45Å; Y120-L132 PolarHBondContact OH-N 3.28Å; Y120-F137 AromaticContact CD1-CD2 3.72Å; Y120-F137 HydrophobicContact CD1-CD2 3.72Å; Y120-F137 HydrophobicContact CD1-CE2 4.06Å; Y120-F137 HydrophobicContact CD2-CD2 4.26Å; Y120-F137 HydrophobicContact CD2-CE2 4.07Å; Y120-F137 AromaticContact CE1-CD2 3.98Å; Y120-F137 HydrophobicContact CE1-CD2 3.98Å; Y120-F137 HydrophobicContact CE2-CD2 4.48Å; Y120-F137 AromaticContact CG-CD2 3.87Å; Y120-F137 HydrophobicContact CG-CD2 3.87Å; Y120-F137 AromaticContact CG-CE2 3.73Å; Y120-F137 HydrophobicContact CG-CE2 3.73Å |
| 121 | R | 94.6 | Very high | 93.1 | Very high | 87 Ų | 87 | 76.5 Ų | 76.5 | 33% | 0.328 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.7 | -48 | 176.9 | -89.2 | -159.1 | -71.1 | 167.3 | -6.5 | 112.2 | Y117 E118 Y123 C124 E125 P131 | Y117-R121 HydrophobicContact CD1-CG 4.38Å; Y117-R121 HydrophobicContact CE1-CG 3.89Å; Y117-R121 PolarHBondContact O-N 3.04Å; E118-R121 PolarHBondContact O-N 3.41Å; E118-R121 IonicContact OE1-CZ 2.63Å; E118-R121 IonicContact OE1-NH2 3.66Å; E118-R121 IonicContact OE2-CZ 3.87Å; E118-R121 IonicContact OE2-NE 3.4Å; E118-R121 IonicContact OE2-NH2 3.66Å; E118-R121 PolarHBondContact OE2-NH2 3.08Å; R121-Y123 VanDerWaalsContact C-N 3.31Å; R121-Y123 PolarHBondContact O-N 3.43Å; R121-C124 WeakPolarHBondContact O-CB 3.18Å; R121-C124 PolarHBondContact O-N 2.83Å; R121-C124 VanDerWaalsContact O-N 3.13Å; R121-E125 WeakPolarHBondContact O-CG 3.45Å; R121-E125 PolarHBondContact O-N 2.95Å; R121-P131 HydrophobicContact CG-CB 3.91Å; R121-P131 HydrophobicContact CG-CG 4.13Å |
| 122 | R | 94.8 | Very high | 92.9 | Very high | 126 Ų | 126 | 76.5 Ų | 76.5 | 48% | 0.475 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.7 | -45.1 | 175.2 | -83.7 | -176.8 | -95.4 | 134.6 | -6.5 | 111.6 | E118 T119 Y120 C124 E125 N126 | E118-R122 PolarHBondContact O-N 3.1Å; T119-R122 PolarHBondContact O-N 3.1Å; Y120-R122 PolarHBondContact O-N 2.97Å; R122-C124 VanDerWaalsContact C-N 3.31Å; R122-C124 PolarHBondContact O-N 2.95Å; R122-E125 PolarHBondContact O-N 2.94Å; R122-E125 VanDerWaalsContact O-N 3.16Å; R122-N126 PolarHBondContact O-N 3.4Å; R122-N126 PolarHBondContact O-OD1 3.5Å |
| 123 | Y | 92.8 | Very high | 92.9 | Very high | 76 Ų | 76 | 77.5 Ų | 77.5 | 30% | 0.298 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -56.5 | -43.4 | 174.9 | 171.5 | -96 | 0 | 0 | 0 | 112.8 | W98 T119 Y120 R121 N126 L127 | W98-Y123 HydrophobicContact CB-CD1 4.32Å; W98-Y123 HydrophobicContact CB-CE1 4.04Å; W98-Y123 AromaticContact CD1-CD1 3.25Å; W98-Y123 AromaticContact CD1-CD2 3.56Å; W98-Y123 AromaticContact CD1-CE1 3.52Å; W98-Y123 AromaticContact CD1-CE2 3.8Å; W98-Y123 AromaticContact CD1-CG 3.26Å; W98-Y123 AromaticContact CD1-CZ 3.78Å; W98-Y123 AromaticContact CG-CD1 3.88Å; W98-Y123 HydrophobicContact CG-CD1 3.88Å; W98-Y123 HydrophobicContact CG-CE1 4.05Å; W98-Y123 HydrophobicContact CG-CG 4.26Å; W98-Y123 AromaticContact NE1-CD1 3.86Å; W98-Y123 AromaticContact NE1-CD2 3.81Å; W98-Y123 AromaticContact NE1-CG 3.46Å; T119-Y123 PolarHBondContact O-N 3.2Å; Y120-Y123 WeakPolarHBondContact O-CB 3.37Å; Y120-Y123 PolarHBondContact O-N 3.43Å; R121-Y123 VanDerWaalsContact C-N 3.31Å; R121-Y123 PolarHBondContact O-N 3.43Å; Y123-N126 PolarHBondContact O-N 3.16Å; Y123-L127 HydrophobicContact CD1-CD1 4.09Å; Y123-L127 HydrophobicContact CD2-CD1 4.04Å; Y123-L127 HydrophobicContact CE1-CD1 3.49Å; Y123-L127 VanDerWaalsContact CE1-CD1 3.49Å; Y123-L127 HydrophobicContact CE2-CD1 3.45Å; Y123-L127 VanDerWaalsContact CE2-CD1 3.45Å; Y123-L127 HydrophobicContact CG-CD1 4.34Å; Y123-L127 PolarHBondContact O-N 3.24Å; Y123-L127 WeakPolarHBondContact OH-CD1 3.37Å |
| 124 | C | 92.6 | Very high | 92.8 | Very high | 5 Ų | 5 | 77.6 Ų | 77.6 | 3% | 0.034 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.7 | -44.4 | 175.2 | -69.1 | 0 | 0 | 0 | 0 | 112.4 | Y120 R121 R122 N126 L127 Q128 H129 P131 | Y120-C124 WeakPolarHBondContact CE2-SG 3.3Å; Y120-C124 PolarHBondContact O-N 2.95Å; Y120-C124 PolarHBondContact O-SG 3.34Å; R121-C124 WeakPolarHBondContact O-CB 3.18Å; R121-C124 PolarHBondContact O-N 2.83Å; R121-C124 VanDerWaalsContact O-N 3.13Å; R122-C124 VanDerWaalsContact C-N 3.31Å; R122-C124 PolarHBondContact O-N 2.95Å; C124-N126 VanDerWaalsContact C-N 3.35Å; C124-N126 PolarHBondContact O-N 3.05Å; C124-L127 CarbonylContact O-C 3.48Å; C124-L127 PolarHBondContact O-N 3.31Å; C124-Q128 PolarHBondContact O-N 2.84Å; C124-H129 CarbonylContact C-O 2.94Å; C124-H129 HydrophobicContact CB-CB 4.46Å; C124-H129 WeakPolarHBondContact CB-O 3.35Å; C124-H129 PolarHBondContact O-N 3.35Å; C124-P131 HydrophobicContact CB-CB 3.92Å; C124-P131 HydrophobicContact CB-CG 4.46Å |
| 125 | E | 92.8 | Very high | 92.7 | Very high | 113 Ų | 113 | 74.7 Ų | 74.7 | 53% | 0.528 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.2 | -43.1 | 177.4 | -71.8 | 168.6 | -171.2 | 0 | 0 | 111.9 | R121 R122 L127 Q128 | R121-E125 WeakPolarHBondContact O-CG 3.45Å; R121-E125 PolarHBondContact O-N 2.95Å; R122-E125 PolarHBondContact O-N 2.94Å; R122-E125 VanDerWaalsContact O-N 3.16Å; E125-L127 VanDerWaalsContact C-N 3.28Å; E125-L127 PolarHBondContact O-N 3.33Å; E125-Q128 PolarHBondContact O-N 3.13Å; E125-Q128 VanDerWaalsContact O-N 3.13Å |
| 126 | N | 91.4 | Very high | 92.6 | Very high | 137 Ų | 137 | 73.1 Ų | 73.1 | 73% | 0.733 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.2 | -33.5 | 177 | -82.1 | 91.5 | 0 | 0 | 0 | 113.3 | R122 Y123 C124 | R122-N126 PolarHBondContact O-N 3.4Å; R122-N126 PolarHBondContact O-OD1 3.5Å; Y123-N126 PolarHBondContact O-N 3.16Å; C124-N126 VanDerWaalsContact C-N 3.35Å; C124-N126 PolarHBondContact O-N 3.05Å |
| 127 | L | 87.9 | Confident | 92.6 | Very high | 78 Ų | 78 | 72.8 Ų | 72.8 | 41% | 0.408 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.2 | 5.8 | 178.3 | -69.4 | 165.2 | 0 | 0 | 0 | 113.2 | Y123 C124 E125 H129 | Y123-L127 HydrophobicContact CD1-CD1 4.09Å; Y123-L127 HydrophobicContact CD2-CD1 4.04Å; Y123-L127 HydrophobicContact CE1-CD1 3.49Å; Y123-L127 VanDerWaalsContact CE1-CD1 3.49Å; Y123-L127 HydrophobicContact CE2-CD1 3.45Å; Y123-L127 VanDerWaalsContact CE2-CD1 3.45Å; Y123-L127 HydrophobicContact CG-CD1 4.34Å; Y123-L127 PolarHBondContact O-N 3.24Å; Y123-L127 WeakPolarHBondContact OH-CD1 3.37Å; C124-L127 CarbonylContact O-C 3.48Å; C124-L127 PolarHBondContact O-N 3.31Å; E125-L127 VanDerWaalsContact C-N 3.28Å; E125-L127 PolarHBondContact O-N 3.33Å; L127-H129 WeakPolarHBondContact CB-CD2 3.12Å; L127-H129 PolarHBondContact O-N 2.93Å |
| 128 | Q | 88.4 | Confident | 92.5 | Very high | 185 Ų | 185 | 71 Ų | 71 | 86% | 0.864 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.2 | 27.6 | -174.8 | -54.9 | -121.1 | -45.7 | 0 | 0 | 113.7 | C124 E125 | C124-Q128 PolarHBondContact O-N 2.84Å; E125-Q128 PolarHBondContact O-N 3.13Å; E125-Q128 VanDerWaalsContact O-N 3.13Å |
| 129 | H | 86.1 | Confident | 92.4 | Very high | 70 Ų | 70 | 73.7 Ų | 73.7 | 32% | 0.324 | 37% | 0.367 | S | S | . | . | P | Polyproline II helix | trans | -93 | 149.6 | 173.4 | -69 | -56.5 | 0 | 0 | 0 | 111.1 | H94 C124 L127 P131 | H94-H129 AromaticContact CD2-NE2 3.96Å; H94-H129 AromaticContact NE2-NE2 3.88Å; C124-H129 CarbonylContact C-O 2.94Å; C124-H129 HydrophobicContact CB-CB 4.46Å; C124-H129 WeakPolarHBondContact CB-O 3.35Å; C124-H129 PolarHBondContact O-N 3.35Å; L127-H129 WeakPolarHBondContact CB-CD2 3.12Å; L127-H129 PolarHBondContact O-N 2.93Å; H129-P131 WeakPolarHBondContact O-CD 3.3Å |
| 130 | R | 88.6 | Confident | 92.4 | Very high | 209 Ų | 209 | 71.8 Ų | 71.8 | 79% | 0.789 | 36% | 0.355 | S | S | * | . | P | Polyproline II helix | trans | -77.5 | 121.9 | 173.6 | -172.7 | 177.9 | -178.5 | 172.5 | 1.7 | 109.3 | ||
| 131 | P | 90.2 | Very high | 92.4 | Very high | 39 Ų | 39 | 71.6 Ų | 71.6 | 25% | 0.253 | 35% | 0.354 | S | S | . | . | P | Polyproline II helix | trans | -67.4 | 143 | 175.9 | 27 | -33.1 | 0 | 0 | 0 | 110.9 | Y120 R121 C124 H129 | Y120-P131 HydrophobicContact CE1-CB 3.92Å; R121-P131 HydrophobicContact CG-CB 3.91Å; R121-P131 HydrophobicContact CG-CG 4.13Å; C124-P131 HydrophobicContact CB-CB 3.92Å; C124-P131 HydrophobicContact CB-CG 4.46Å; H129-P131 WeakPolarHBondContact O-CD 3.3Å |
| 132 | L | 92.1 | Very high | 92.4 | Very high | 20 Ų | 20 | 73.5 Ų | 73.5 | 11% | 0.105 | 36% | 0.361 | C | S | . | . | P | Polyproline II helix | trans | -66.3 | 155.7 | 169.6 | -66.6 | -175.6 | 0 | 0 | 0 | 111 | D91 T95 Y117 Y120 N136 I140 | D91-L132 HydrophobicContact CB-CD2 3.94Å; T95-L132 HydrophobicContact CG2-CD1 4.13Å; T95-L132 VanDerWaalsContact OG1-CD1 3.26Å; T95-L132 WeakPolarHBondContact OG1-CD1 3.22Å; Y117-L132 WeakPolarHBondContact CE2-O 3.46Å; Y117-L132 PolarHBondContact OH-O 2.73Å; Y120-L132 HydrophobicContact CE1-CB 4.45Å; Y120-L132 PolarHBondContact OH-N 3.28Å; L132-N136 HydrophobicContact CB-CB 4.33Å; L132-I140 HydrophobicContact CD1-CD1 3.44Å; L132-I140 VanDerWaalsContact CD1-CD1 3.44Å |
| 133 | S | 93.8 | Very high | 92.4 | Very high | 56 Ų | 56 | 72.8 Ų | 72.8 | 39% | 0.392 | 37% | 0.367 | S | S | . | . | P | Polyproline II helix | trans | -61.1 | 151.7 | 173.8 | 74.5 | 0 | 0 | 0 | 0 | 111.5 | A135 N136 F137 | S133-A135 PolarHBondContact O-N 3.06Å; S133-A135 VanDerWaalsContact O-N 3.13Å; S133-N136 PolarHBondContact O-N 3.35Å; S133-N136 WeakPolarHBondContact OG-CB 3.18Å; S133-N136 VanDerWaalsContact OG-CG 3.3Å; S133-N136 PolarHBondContact OG-N 3.46Å; S133-N136 PolarHBondContact OG-ND2 2.92Å; S133-F137 WeakPolarHBondContact O-CB 3.26Å; S133-F137 PolarHBondContact O-N 3.19Å |
| 134 | A | 93.3 | Very high | 92.5 | Very high | 58 Ų | 58 | 70.5 Ų | 70.5 | 48% | 0.479 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -56.9 | -31.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | Y117 G138 | Y117-A134 HydrophobicContact CD1-CB 4.37Å; Y117-A134 HydrophobicContact CD2-CB 4.39Å; Y117-A134 HydrophobicContact CE1-CB 4.08Å; Y117-A134 HydrophobicContact CE2-CB 4.09Å; Y117-A134 PolarHBondContact OH-N 3.22Å; A134-G138 PolarHBondContact O-N 2.9Å |
| 135 | A | 93.3 | Very high | 92.6 | Very high | 72 Ų | 72 | 71.2 Ų | 71.2 | 60% | 0.595 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -67.4 | -46.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S133 G138 K139 | S133-A135 PolarHBondContact O-N 3.06Å; S133-A135 VanDerWaalsContact O-N 3.13Å; A135-G138 CarbonylContact O-C 3.59Å; A135-G138 PolarHBondContact O-N 3.2Å; A135-K139 PolarHBondContact O-N 3.48Å |
| 136 | N | 92.9 | Very high | 92.6 | Very high | 46 Ų | 46 | 70.6 Ų | 70.6 | 25% | 0.246 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.3 | -44.6 | 179.9 | -70.6 | -7.7 | 0 | 0 | 0 | 111.5 | L132 S133 G138 K139 I140 | L132-N136 HydrophobicContact CB-CB 4.33Å; S133-N136 PolarHBondContact O-N 3.35Å; S133-N136 WeakPolarHBondContact OG-CB 3.18Å; S133-N136 VanDerWaalsContact OG-CG 3.3Å; S133-N136 PolarHBondContact OG-N 3.46Å; S133-N136 PolarHBondContact OG-ND2 2.92Å; N136-G138 PolarHBondContact O-N 2.93Å; N136-K139 WeakPolarHBondContact O-CB 3.42Å; N136-K139 PolarHBondContact O-N 2.68Å; N136-I140 WeakPolarHBondContact O-CG1 3.5Å; N136-I140 PolarHBondContact O-N 2.98Å |
| 137 | F | 95.5 | Very high | 92.7 | Very high | 2 Ų | 2 | 69 Ų | 69 | 1% | 0.009 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -54.7 | -45.1 | 171 | 177.9 | -89 | 0 | 0 | 0 | 110.9 | T95 W98 I99 V116 Y117 Y120 S133 K139 I140 I141 | T95-F137 HydrophobicContact CG2-CD2 3.74Å; T95-F137 HydrophobicContact CG2-CE2 4.2Å; W98-F137 HydrophobicContact CE3-CE2 4.07Å; W98-F137 HydrophobicContact CE3-CZ 4.48Å; W98-F137 AromaticContact CZ3-CE2 3.85Å; W98-F137 HydrophobicContact CZ3-CE2 3.85Å; W98-F137 AromaticContact CZ3-CZ 3.85Å; W98-F137 HydrophobicContact CZ3-CZ 3.85Å; I99-F137 HydrophobicContact CD1-CD2 4.29Å; I99-F137 HydrophobicContact CD1-CE2 3.83Å; I99-F137 HydrophobicContact CD1-CZ 4.18Å; I99-F137 HydrophobicContact CG1-CE2 3.82Å; I99-F137 HydrophobicContact CG1-CZ 4.1Å; V116-F137 HydrophobicContact CG1-CE1 3.9Å; V116-F137 HydrophobicContact CG1-CZ 3.73Å; Y117-F137 HydrophobicContact CD2-CB 3.97Å; Y117-F137 AromaticContact CD2-CD1 3.97Å; Y117-F137 HydrophobicContact CD2-CD1 3.97Å; Y117-F137 HydrophobicContact CD2-CD2 4.34Å; Y117-F137 AromaticContact CD2-CG 3.82Å; Y117-F137 HydrophobicContact CD2-CG 3.82Å; Y117-F137 HydrophobicContact CE2-CB 4.01Å; Y117-F137 HydrophobicContact CE2-CG 4.31Å; Y120-F137 AromaticContact CD1-CD2 3.72Å; Y120-F137 HydrophobicContact CD1-CD2 3.72Å; Y120-F137 HydrophobicContact CD1-CE2 4.06Å; Y120-F137 HydrophobicContact CD2-CD2 4.26Å; Y120-F137 HydrophobicContact CD2-CE2 4.07Å; Y120-F137 AromaticContact CE1-CD2 3.98Å; Y120-F137 HydrophobicContact CE1-CD2 3.98Å; Y120-F137 HydrophobicContact CE2-CD2 4.48Å; Y120-F137 AromaticContact CG-CD2 3.87Å; Y120-F137 HydrophobicContact CG-CD2 3.87Å; Y120-F137 AromaticContact CG-CE2 3.73Å; Y120-F137 HydrophobicContact CG-CE2 3.73Å; S133-F137 WeakPolarHBondContact O-CB 3.26Å; S133-F137 PolarHBondContact O-N 3.19Å; F137-K139 VanDerWaalsContact C-N 3.26Å; F137-K139 PolarHBondContact O-N 3.28Å; F137-I140 PolarHBondContact O-N 3.47Å; F137-I141 HydrophobicContact CE1-CB 4.49Å; F137-I141 HydrophobicContact CE1-CD1 4.15Å; F137-I141 HydrophobicContact CZ-CD1 4.36Å; F137-I141 WeakPolarHBondContact O-CG2 3.45Å; F137-I141 PolarHBondContact O-N 2.86Å |
| 138 | G | 94.3 | Very high | 93 | Very high | 4 Ų | 4 | 66.4 Ų | 66.4 | 4% | 0.041 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.6 | -27.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | A134 A135 N136 I141 R142 | A134-G138 PolarHBondContact O-N 2.9Å; A135-G138 CarbonylContact O-C 3.59Å; A135-G138 PolarHBondContact O-N 3.2Å; N136-G138 PolarHBondContact O-N 2.93Å; G138-I141 WeakPolarHBondContact O-CG2 3.33Å; G138-R142 WeakPolarHBondContact O-CG 3.4Å; G138-R142 PolarHBondContact O-NE 3.34Å; G138-R142 PolarHBondContact O-NH1 3.1Å; G138-R142 PolarHBondContact O-NH2 3.24Å |
| 139 | K | 94.4 | Very high | 93.3 | Very high | 112 Ų | 112 | 64.1 Ų | 64.1 | 49% | 0.487 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -71.9 | -54.4 | 172.3 | -173.9 | 179.4 | 177.9 | -179.5 | 0 | 109.9 | A135 N136 F137 I141 R142 D143 | A135-K139 PolarHBondContact O-N 3.48Å; N136-K139 WeakPolarHBondContact O-CB 3.42Å; N136-K139 PolarHBondContact O-N 2.68Å; F137-K139 VanDerWaalsContact C-N 3.26Å; F137-K139 PolarHBondContact O-N 3.28Å; K139-I141 VanDerWaalsContact C-N 3.33Å; K139-I141 PolarHBondContact O-N 3.33Å; K139-R142 WeakPolarHBondContact O-CB 3.26Å; K139-R142 PolarHBondContact O-N 3.22Å; K139-D143 PolarHBondContact O-N 3.43Å |
| 140 | I | 95 | Very high | 93.6 | Very high | 8 Ų | 8 | 64.7 Ų | 64.7 | 4% | 0.041 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58.3 | -42.6 | -177.4 | -62.1 | 166.4 | 0 | 0 | 0 | 112 | Q92 T95 C96 I99 L132 N136 F137 R142 D143 I144 | Q92-I140 HydrophobicContact CG-CD1 3.83Å; Q92-I140 HydrophobicContact CG-CG1 4.3Å; T95-I140 HydrophobicContact CG2-CD1 3.88Å; T95-I140 HydrophobicContact CG2-CG2 4.47Å; C96-I140 WeakPolarHBondContact SG-CG2 3.39Å; I99-I140 HydrophobicContact CD1-CB 4.24Å; I99-I140 HydrophobicContact CD1-CG2 3.72Å; L132-I140 HydrophobicContact CD1-CD1 3.44Å; L132-I140 VanDerWaalsContact CD1-CD1 3.44Å; N136-I140 WeakPolarHBondContact O-CG1 3.5Å; N136-I140 PolarHBondContact O-N 2.98Å; F137-I140 PolarHBondContact O-N 3.47Å; I140-R142 VanDerWaalsContact C-N 3.27Å; I140-R142 PolarHBondContact O-N 3.35Å; I140-D143 PolarHBondContact O-N 3.04Å; I140-D143 VanDerWaalsContact O-N 3.15Å; I140-I144 HydrophobicContact CG2-CD1 3.72Å; I140-I144 HydrophobicContact CG2-CG1 4.39Å; I140-I144 WeakPolarHBondContact O-CG1 3.49Å; I140-I144 PolarHBondContact O-N 2.89Å |
| 141 | I | 95.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.4 | -31.5 | 178.9 | -164.8 | 172.4 | 0 | 0 | 0 | 112.6 | I99 L103 V116 F137 G138 K139 F145 I148 Y163 I166 | I99-I141 HydrophobicContact CD1-CB 4.05Å; I99-I141 HydrophobicContact CG2-CG1 4.24Å; L103-I141 HydrophobicContact CD1-CD1 3.82Å; V116-I141 HydrophobicContact CG1-CD1 4.44Å; F137-I141 HydrophobicContact CE1-CB 4.49Å; F137-I141 HydrophobicContact CE1-CD1 4.15Å; F137-I141 HydrophobicContact CZ-CD1 4.36Å; F137-I141 WeakPolarHBondContact O-CG2 3.45Å; F137-I141 PolarHBondContact O-N 2.86Å; G138-I141 WeakPolarHBondContact O-CG2 3.33Å; K139-I141 VanDerWaalsContact C-N 3.33Å; K139-I141 PolarHBondContact O-N 3.33Å; I141-F145 HydrophobicContact CG1-CD2 4.01Å; I141-F145 PolarHBondContact O-N 2.99Å; I141-I148 HydrophobicContact CG1-CD1 4.15Å; I141-I148 HydrophobicContact CG2-CD1 4.24Å; I141-Y163 HydrophobicContact CD1-CD2 4.17Å; I141-Y163 HydrophobicContact CD1-CE2 3.99Å; I141-Y163 HydrophobicContact CG2-CE1 3.93Å; I141-I166 HydrophobicContact CD1-CD1 4.06Å |
| 142 | R | 94.6 | Very high | 94.1 | Very high | 128 Ų | 128 | 67.3 Ų | 67.3 | 48% | 0.483 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -74.3 | -33.6 | 174 | -75.3 | -171 | -67.1 | -90.5 | 4.3 | 111.9 | G138 K139 I140 I144 F145 P146 I148 | G138-R142 WeakPolarHBondContact O-CG 3.4Å; G138-R142 PolarHBondContact O-NE 3.34Å; G138-R142 PolarHBondContact O-NH1 3.1Å; G138-R142 PolarHBondContact O-NH2 3.24Å; K139-R142 WeakPolarHBondContact O-CB 3.26Å; K139-R142 PolarHBondContact O-N 3.22Å; I140-R142 VanDerWaalsContact C-N 3.27Å; I140-R142 PolarHBondContact O-N 3.35Å; R142-I144 VanDerWaalsContact C-N 3.33Å; R142-F145 CarbonylContact O-C 3.36Å; R142-P146 WeakPolarHBondContact O-CA 3.38Å; R142-I148 HydrophobicContact CG-CD1 4.06Å; R142-I148 HydrophobicContact CG-CG1 4.36Å |
| 143 | D | 94.4 | Very high | 94.1 | Very high | 111 Ų | 111 | 69.6 Ų | 69.6 | 59% | 0.594 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -68.6 | -35.6 | 176 | -59.8 | -15.9 | 0 | 0 | 0 | 110.9 | K139 I140 | K139-D143 PolarHBondContact O-N 3.43Å; I140-D143 PolarHBondContact O-N 3.04Å; I140-D143 VanDerWaalsContact O-N 3.15Å |
| 144 | I | 95 | Very high | 94 | Very high | 28 Ų | 28 | 69.7 Ų | 69.7 | 14% | 0.144 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -78.6 | -41.6 | 177.8 | -65.6 | 169 | 0 | 0 | 0 | 112 | C96 I99 R100 I140 R142 P146 | C96-I144 HydrophobicContact CB-CD1 4.09Å; I99-I144 HydrophobicContact CB-CD1 3.79Å; I99-I144 HydrophobicContact CD1-CD1 4.05Å; I99-I144 HydrophobicContact CG2-CB 4.26Å; I99-I144 HydrophobicContact CG2-CD1 3.65Å; I99-I144 HydrophobicContact CG2-CG2 4.05Å; R100-I144 HydrophobicContact CG-CD1 4.39Å; R100-I144 HydrophobicContact CG-CG2 3.95Å; I140-I144 HydrophobicContact CG2-CD1 3.72Å; I140-I144 HydrophobicContact CG2-CG1 4.39Å; I140-I144 WeakPolarHBondContact O-CG1 3.49Å; I140-I144 PolarHBondContact O-N 2.89Å; R142-I144 VanDerWaalsContact C-N 3.33Å; I144-P146 WeakPolarHBondContact O-CD 3.3Å |
| 145 | F | 95.1 | Very high | 94 | Very high | 20 Ų | 20 | 69.3 Ų | 69.3 | 9% | 0.088 | 38% | 0.378 | C | S | . | . | trans | -120.2 | 81.9 | 179.8 | -55.4 | -69 | 0 | 0 | 0 | 110.3 | I99 L103 E105 I141 R142 N147 I148 I166 | I99-F145 HydrophobicContact CG2-CD2 4.14Å; I99-F145 HydrophobicContact CG2-CE2 3.49Å; I99-F145 VanDerWaalsContact CG2-CE2 3.49Å; I99-F145 HydrophobicContact CG2-CZ 4.32Å; L103-F145 HydrophobicContact CB-CE2 3.86Å; L103-F145 HydrophobicContact CB-CZ 4.06Å; E105-F145 HydrophobicContact CB-CD1 4.4Å; I141-F145 HydrophobicContact CG1-CD2 4.01Å; I141-F145 PolarHBondContact O-N 2.99Å; R142-F145 CarbonylContact O-C 3.36Å; F145-N147 PolarHBondContact O-N 3.49Å; F145-I148 HydrophobicContact CB-CD1 4.43Å; F145-I148 HydrophobicContact CB-CG2 3.36Å; F145-I148 HydrophobicContact CG-CG2 4.31Å; F145-I148 VanDerWaalsContact O-CG1 3.26Å; F145-I148 WeakPolarHBondContact O-CG1 3.32Å; F145-I148 WeakPolarHBondContact O-CG2 3.48Å; F145-I148 PolarHBondContact O-N 3.28Å; F145-I166 HydrophobicContact CB-CG2 4.36Å; F145-I166 HydrophobicContact CD1-CG2 4.44Å; F145-I166 HydrophobicContact CD2-CG2 4.05Å; F145-I166 HydrophobicContact CE2-CG2 4.41Å; F145-I166 HydrophobicContact CG-CG2 4.06Å | ||
| 146 | P | 92.8 | Very high | 93.9 | Very high | 100 Ų | 100 | 78.1 Ų | 78.1 | 65% | 0.649 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -23.1 | -175 | 24.2 | -34 | 0 | 0 | 0 | 113.5 | R142 I144 I148 | R142-P146 WeakPolarHBondContact O-CA 3.38Å; I144-P146 WeakPolarHBondContact O-CD 3.3Å; P146-I148 VanDerWaalsContact C-N 3.31Å; P146-I148 PolarHBondContact O-N 3.26Å |
| 147 | N | 93.3 | Very high | 93.8 | Very high | 104 Ų | 104 | 79.4 Ų | 79.4 | 56% | 0.556 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | -4.9 | -178.3 | -61.6 | -33.5 | 0 | 0 | 0 | 114 | E105 F145 | E105-N147 WeakPolarHBondContact OE1-CB 3.41Å; E105-N147 PolarHBondContact OE1-ND2 3.12Å; F145-N147 PolarHBondContact O-N 3.49Å |
| 148 | I | 94.5 | Very high | 93.5 | Very high | 22 Ų | 22 | 86.3 Ų | 86.3 | 11% | 0.113 | 45% | 0.452 | C | S | . | . | trans | -69.7 | 137.5 | -176.6 | 71.1 | -172.6 | 0 | 0 | 0 | 111.4 | I141 R142 F145 P146 Y163 S164 I166 | I141-I148 HydrophobicContact CG1-CD1 4.15Å; I141-I148 HydrophobicContact CG2-CD1 4.24Å; R142-I148 HydrophobicContact CG-CD1 4.06Å; R142-I148 HydrophobicContact CG-CG1 4.36Å; F145-I148 HydrophobicContact CB-CD1 4.43Å; F145-I148 HydrophobicContact CB-CG2 3.36Å; F145-I148 HydrophobicContact CG-CG2 4.31Å; F145-I148 VanDerWaalsContact O-CG1 3.26Å; F145-I148 WeakPolarHBondContact O-CG1 3.32Å; F145-I148 WeakPolarHBondContact O-CG2 3.48Å; F145-I148 PolarHBondContact O-N 3.28Å; P146-I148 VanDerWaalsContact C-N 3.31Å; P146-I148 PolarHBondContact O-N 3.26Å; I148-Y163 HydrophobicContact CD1-CD1 3.74Å; I148-Y163 HydrophobicContact CD1-CE1 4.05Å; I148-Y163 HydrophobicContact CG1-CD1 4.43Å; I148-S164 WeakPolarHBondContact CA-O 3.36Å; I148-I166 HydrophobicContact CG2-CG2 3.48Å; I148-I166 VanDerWaalsContact CG2-CG2 3.48Å | ||
| 149 | K | 94.2 | Very high | 93.4 | Very high | 138 Ų | 138 | 88.4 Ų | 88.4 | 60% | 0.6 | 47% | 0.466 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.2 | 140.3 | -179.9 | -62.1 | 176 | -175.1 | 172.5 | 0 | 110.5 | R151 S164 | K149-R151 PolarHBondContact O-N 3.04Å; K149-S164 PolarHBondContact N-O 2.89Å; K149-S164 WeakPolarHBondContact O-CB 3.18Å; K149-S164 PolarHBondContact O-N 3.45Å |
| 150 | A | 93.8 | Very high | 93.4 | Very high | 82 Ų | 82 | 88.3 Ų | 88.3 | 68% | 0.678 | 47% | 0.465 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76 | 124.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 151 | R | 94.2 | Very high | 93.4 | Very high | 137 Ų | 137 | 95 Ų | 95 | 52% | 0.517 | 49% | 0.491 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 153.5 | 172 | -72 | -170.7 | -175.8 | -104.3 | 4.2 | 110.4 | K149 L153 C162 S164 | K149-R151 PolarHBondContact O-N 3.04Å; R151-L153 HydrophobicContact CB-CD2 4.5Å; R151-L153 HydrophobicContact CB-CG 4.43Å; R151-C162 PolarHBondContact N-O 3.34Å; R151-C162 PolarHBondContact O-N 3.48Å; R151-S164 PolarHBondContact NE-OG 3.49Å; R151-S164 VanDerWaalsContact NE-OG 3.16Å |
| 152 | R | 94.9 | Very high | 93.4 | Very high | 165 Ų | 165 | 95.3 Ų | 95.3 | 62% | 0.623 | 49% | 0.493 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 120.1 | 169.3 | -168.6 | 174.4 | 74.6 | -164.6 | 0.4 | 107.8 | K160 | R152-K160 WeakPolarHBondContact CA-O 3.42Å |
| 153 | L | 92.1 | Very high | 93.6 | Very high | 68 Ų | 68 | 89.8 Ų | 89.8 | 36% | 0.356 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 141.9 | -172.2 | -61.4 | 178.4 | 0 | 0 | 0 | 110.4 | C110 R151 S159 K160 C162 | C110-L153 HydrophobicContact CB-CD1 4.03Å; C110-L153 WeakPolarHBondContact SG-CD1 3.26Å; R151-L153 HydrophobicContact CB-CD2 4.5Å; R151-L153 HydrophobicContact CB-CG 4.43Å; L153-S159 CarbonylContact O-C 3.49Å; L153-S159 VanDerWaalsContact O-CA 3.31Å; L153-S159 WeakPolarHBondContact O-CA 3.3Å; L153-K160 PolarHBondContact N-O 2.94Å; L153-K160 PolarHBondContact O-N 3.45Å; L153-C162 HydrophobicContact CD1-CB 4.1Å; L153-C162 HydrophobicContact CG-CB 4.43Å |
| 154 | G | 92 | Very high | 93.6 | Very high | 58 Ų | 58 | 85.2 Ų | 85.2 | 60% | 0.598 | 45% | 0.449 | S | S | * | . | S | Bend | trans | 126.8 | 167.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S159 | G154-S159 PolarHBondContact O-OG 2.99Š|
| 155 | G | 92.3 | Very high | 93.6 | Very high | 50 Ų | 50 | 84.3 Ų | 84.3 | 52% | 0.515 | 45% | 0.447 | S | S | . | . | S | Bend | trans | -70.3 | 177 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G157 Q158 S159 | G155-G157 PolarHBondContact O-N 2.93Å; G155-Q158 PolarHBondContact O-N 2.68Å; G155-Q158 VanDerWaalsContact O-N 3.08Å; G155-S159 PolarHBondContact O-N 3.24Å; G155-S159 PolarHBondContact O-OG 3.41Å |
| 156 | R | 90.8 | Very high | 93.6 | Very high | 258 Ų | 258 | 83.4 Ų | 83.4 | 97% | 0.974 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.3 | 122.2 | 174.4 | -173.6 | 177 | 178 | 178.3 | -1.1 | 109.6 | Q158 | R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.43Å |
| 157 | G | 91.3 | Very high | 93.7 | Very high | 73 Ų | 73 | 82.9 Ų | 82.9 | 75% | 0.753 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.5 | -10.5 | -180 | 0 | 0 | 0 | 0 | 0 | 116.4 | G155 | G155-G157 PolarHBondContact O-N 2.93Š|
| 158 | Q | 89 | Confident | 93.7 | Very high | 147 Ų | 147 | 86.2 Ų | 86.2 | 69% | 0.687 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117 | 13 | 179.6 | -63.3 | -60.2 | -34.3 | 0 | 0 | 112.8 | G155 R156 K160 | G155-Q158 PolarHBondContact O-N 2.68Å; G155-Q158 VanDerWaalsContact O-N 3.08Å; R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.43Å; Q158-K160 PolarHBondContact O-N 3.45Å |
| 159 | S | 92.8 | Very high | 93.4 | Very high | 47 Ų | 47 | 88.7 Ų | 88.7 | 33% | 0.329 | 44% | 0.443 | S | S | . | . | trans | -66.9 | 121.1 | -178 | -77.8 | 0 | 0 | 0 | 0 | 112.1 | L153 G154 G155 | L153-S159 CarbonylContact O-C 3.49Å; L153-S159 VanDerWaalsContact O-CA 3.31Å; L153-S159 WeakPolarHBondContact O-CA 3.3Å; G154-S159 PolarHBondContact O-OG 2.99Å; G155-S159 PolarHBondContact O-N 3.24Å; G155-S159 PolarHBondContact O-OG 3.41Å | ||
| 160 | K | 94.2 | Very high | 92.5 | Very high | 110 Ų | 110 | 87.7 Ų | 87.7 | 48% | 0.478 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 148.2 | 175.7 | -64.6 | -174.2 | -179.9 | -177.3 | 0 | 111.7 | R152 L153 Q158 | R152-K160 WeakPolarHBondContact CA-O 3.42Å; L153-K160 PolarHBondContact N-O 2.94Å; L153-K160 PolarHBondContact O-N 3.45Å; Q158-K160 PolarHBondContact O-N 3.45Å |
| 161 | Y | 95.8 | Very high | 90.9 | Very high | 150 Ų | 150 | 88 Ų | 88 | 59% | 0.588 | 44% | 0.442 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 133.8 | 173.2 | -65.8 | -86.1 | 0 | 0 | 0 | 110.5 | K113 | K113-Y161 WeakPolarHBondContact CG-O 3.37Å; K113-Y161 PolarHBondContact N-O 2.92Å |
| 162 | C | 95.4 | Very high | 89.2 | Confident | 5 Ų | 5 | 88.2 Ų | 88.2 | 3% | 0.034 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 151.3 | -177 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | C110 L111 R151 L153 | C110-C162 HydrophobicContact CB-CB 4.36Å; L111-C162 CarbonylContact O-C 3.51Å; L111-C162 WeakPolarHBondContact O-CA 3.39Å; L111-C162 WeakPolarHBondContact O-CB 3.27Å; R151-C162 PolarHBondContact N-O 3.34Å; R151-C162 PolarHBondContact O-N 3.48Å; L153-C162 HydrophobicContact CD1-CB 4.1Å; L153-C162 HydrophobicContact CG-CB 4.43Å |
| 163 | Y | 96.9 | Very high | 87.3 | Confident | 13 Ų | 13 | 86.9 Ų | 86.9 | 5% | 0.051 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.5 | 122.7 | 161.1 | -65.9 | -68.3 | 0 | 0 | 0 | 108.4 | C110 L111 K113 I141 I148 I166 | C110-Y163 CarbonylContact C-O 3.51Å; C110-Y163 WeakPolarHBondContact CA-O 3.19Å; C110-Y163 WeakPolarHBondContact CB-O 3.16Å; L111-Y163 PolarHBondContact N-O 2.94Å; L111-Y163 PolarHBondContact O-N 3.4Å; K113-Y163 HydrophobicContact CB-CD2 4.27Å; K113-Y163 HydrophobicContact CB-CE2 3.85Å; K113-Y163 HydrophobicContact CD-CD2 4.46Å; K113-Y163 HydrophobicContact CD-CE1 4.08Å; K113-Y163 HydrophobicContact CD-CE2 3.98Å; K113-Y163 HydrophobicContact CG-CD1 4.44Å; K113-Y163 HydrophobicContact CG-CD2 3.67Å; K113-Y163 HydrophobicContact CG-CE1 4.31Å; K113-Y163 HydrophobicContact CG-CE2 3.49Å; K113-Y163 VanDerWaalsContact CG-CE2 3.49Å; K113-Y163 HydrophobicContact CG-CG 4.14Å; I141-Y163 HydrophobicContact CD1-CD2 4.17Å; I141-Y163 HydrophobicContact CD1-CE2 3.99Å; I141-Y163 HydrophobicContact CG2-CE1 3.93Å; I148-Y163 HydrophobicContact CD1-CD1 3.74Å; I148-Y163 HydrophobicContact CD1-CE1 4.05Å; I148-Y163 HydrophobicContact CG1-CD1 4.43Å; Y163-I166 HydrophobicContact CD2-CD1 4.25Å; Y163-I166 HydrophobicContact CG-CD1 4.03Å |
| 164 | S | 95.7 | Very high | 85.4 | Confident | 14 Ų | 14 | 91.5 Ų | 91.5 | 10% | 0.098 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 140.1 | 174 | -175.6 | 0 | 0 | 0 | 0 | 108.9 | I148 K149 R151 | I148-S164 WeakPolarHBondContact CA-O 3.36Å; K149-S164 PolarHBondContact N-O 2.89Å; K149-S164 WeakPolarHBondContact O-CB 3.18Å; K149-S164 PolarHBondContact O-N 3.45Å; R151-S164 PolarHBondContact NE-OG 3.49Å; R151-S164 VanDerWaalsContact NE-OG 3.16Å |
| 165 | G | 94.1 | Very high | 83.6 | Confident | 10 Ų | 10 | 93.9 Ų | 93.9 | 10% | 0.103 | 48% | 0.484 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 97 | 9.8 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | H106 T109 | H106-G165 PolarHBondContact N-O 3.42Å; H106-G165 CarbonylContact O-C 3.54Å; H106-G165 WeakPolarHBondContact O-CA 3.29Å; T109-G165 PolarHBondContact O-N 2.88Å |
| 166 | I | 95.4 | Very high | 81.7 | Confident | 0 Ų | 0 | 98.8 Ų | 98.8 | 0% | 0 | 50% | 0.498 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 158.3 | 175.2 | 56.5 | 170.7 | 0 | 0 | 0 | 111.4 | L103 E104 H106 T109 L111 I141 F145 I148 Y163 | L103-I166 HydrophobicContact CD1-CD1 4.36Å; E104-I166 CarbonylContact O-C 3.57Å; E104-I166 VanDerWaalsContact O-CA 3.27Å; E104-I166 WeakPolarHBondContact O-CA 3.49Å; H106-I166 PolarHBondContact O-N 3Å; T109-I166 PolarHBondContact OG1-O 3.22Å; L111-I166 HydrophobicContact CD1-CD1 4.38Å; L111-I166 HydrophobicContact CD1-CG1 4.34Å; I141-I166 HydrophobicContact CD1-CD1 4.06Å; F145-I166 HydrophobicContact CB-CG2 4.36Å; F145-I166 HydrophobicContact CD1-CG2 4.44Å; F145-I166 HydrophobicContact CD2-CG2 4.05Å; F145-I166 HydrophobicContact CE2-CG2 4.41Å; F145-I166 HydrophobicContact CG-CG2 4.06Å; I148-I166 HydrophobicContact CG2-CG2 3.48Å; I148-I166 VanDerWaalsContact CG2-CG2 3.48Å; Y163-I166 HydrophobicContact CD2-CD1 4.25Å; Y163-I166 HydrophobicContact CG-CD1 4.03Å |
| 167 | R | 94.2 | Very high | 79.7 | Confident | 90 Ų | 90 | 93.4 Ų | 93.4 | 34% | 0.34 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.8 | 170.2 | 168.6 | 64.5 | -174.8 | -174.5 | -171.1 | 8 | 111.3 | L103 E104 H106 T109 | L103-R167 WeakPolarHBondContact CA-O 3.38Å; E104-R167 HydrophobicContact CG-CG 3.66Å; E104-R167 PolarHBondContact N-O 2.86Å; E104-R167 PolarHBondContact O-N 3.38Å; E104-R167 IonicContact OE1-CZ 3.15Å; E104-R167 IonicContact OE1-NE 2.66Å; E104-R167 PolarHBondContact OE1-NE 3.03Å; E104-R167 IonicContact OE1-NH2 2.77Å; E104-R167 PolarHBondContact OE1-NH2 3.49Å; H106-R167 HydrophobicContact CB-CB 4.23Å; H106-R167 HydrophobicContact CB-CG 3.65Å; H106-R167 PolarHBondContact CD2-NH1 3.2Å; H106-R167 PolarHBondContact NE2-NH1 3.42Å; T109-R167 HydrophobicContact CG2-CB 4.36Å; T109-R167 WeakPolarHBondContact OG1-CB 3.19Å |
| 168 | R | 93.8 | Very high | 77.8 | Confident | 174 Ų | 174 | 95.5 Ų | 95.5 | 66% | 0.657 | 49% | 0.488 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 132.7 | 172 | -72.2 | -175.6 | -78.3 | -164.4 | -3.1 | 108.4 | L111 T170 | L111-R168 HydrophobicContact CD1-CG 4.06Å; L111-R168 HydrophobicContact CD2-CG 4.34Å; R168-T170 PolarHBondContact O-N 3.47Å |
| 169 | K | 89.1 | Confident | 75.8 | Confident | 74 Ų | 74 | 94.6 Ų | 94.6 | 32% | 0.322 | 49% | 0.488 | S | S | . | . | trans | -67.3 | 117.9 | 176.9 | -163.5 | 176.6 | -167.6 | 174 | 0 | 108.6 | S101 H102 E104 V171 | S101-K169 WeakPolarHBondContact O-CD 3.37Å; H102-K169 PolarHBondContact O-N 3.02Å; E104-K169 HydrophobicContact CG-CB 4.48Å; K169-V171 VanDerWaalsContact CE-O 3.3Å; K169-V171 WeakPolarHBondContact CE-O 3.42Å; K169-V171 WeakPolarHBondContact CG-O 3.33Å | ||
| 170 | T | 74.3 | Confident | 73.7 | Confident | 116 Ų | 116 | 100.3 Ų | 100.3 | 71% | 0.712 | 51% | 0.514 | S | S | * | . | trans | -100.9 | -14.1 | -178.6 | 47 | 0 | 0 | 0 | 0 | 112.5 | R168 | R168-T170 PolarHBondContact O-N 3.47Š| ||
| 171 | V | 61.6 | Low | 71.5 | Confident | 90 Ų | 90 | 101.6 Ų | 101.6 | 55% | 0.545 | 53% | 0.526 | S | S | . | . | trans | -110.6 | 103.4 | 176.2 | -172.5 | 0 | 0 | 0 | 0 | 108.1 | K169 N173 | K169-V171 VanDerWaalsContact CE-O 3.3Å; K169-V171 WeakPolarHBondContact CE-O 3.42Å; K169-V171 WeakPolarHBondContact CG-O 3.33Å; V171-N173 PolarHBondContact O-N 3.45Å | ||
| 172 | L | 57.5 | Low | 69.4 | Low | 141 Ų | 141 | 100.6 Ų | 100.6 | 74% | 0.738 | 53% | 0.53 | S | S | * | . | trans | -79.3 | 106.4 | 167.3 | -62.1 | -178 | 0 | 0 | 0 | 106.9 | M174 | L172-M174 PolarHBondContact O-N 2.96Å; L172-M174 VanDerWaalsContact O-N 3.1Å | ||
| 173 | N | 55.1 | Low | 67.1 | Low | 136 Ų | 136 | 109.1 Ų | 109.1 | 73% | 0.727 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 116.4 | 164.7 | -115.1 | 62.3 | 0 | 0 | 0 | 106.4 | V171 P175 | V171-N173 PolarHBondContact O-N 3.45Å; N173-P175 VanDerWaalsContact O-CD 3.26Å; N173-P175 WeakPolarHBondContact O-CD 3.45Å; N173-P175 VanDerWaalsContact O-N 3.11Å |
| 174 | M | 53.2 | Low | 64.5 | Low | 166 Ų | 166 | 115.7 Ų | 115.7 | 82% | 0.818 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 117.5 | 176.1 | -159 | 83.8 | -174 | 0 | 0 | 107.2 | L172 L176 | L172-M174 PolarHBondContact O-N 2.96Å; L172-M174 VanDerWaalsContact O-N 3.1Å; M174-L176 PolarHBondContact O-N 3.13Å; M174-L176 VanDerWaalsContact O-N 3.08Å |
| 175 | P | 54.2 | Low | 62.5 | Low | 107 Ų | 107 | 119.7 Ų | 119.7 | 70% | 0.695 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 117.3 | 170.3 | 24.9 | -29 | 0 | 0 | 0 | 106.4 | N173 L177 | N173-P175 VanDerWaalsContact O-CD 3.26Å; N173-P175 WeakPolarHBondContact O-CD 3.45Å; N173-P175 VanDerWaalsContact O-N 3.11Å; P175-L177 PolarHBondContact O-N 3.35Å |
| 176 | L | 52.3 | Low | 60.6 | Low | 153 Ų | 153 | 123.6 Ų | 123.6 | 80% | 0.801 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 123 | 173.2 | -71.8 | 158 | 0 | 0 | 0 | 106.7 | M174 | M174-L176 PolarHBondContact O-N 3.13Å; M174-L176 VanDerWaalsContact O-N 3.08Å |
| 177 | L | 47.8 | Very low | 58.6 | Low | 145 Ų | 145 | 127.6 Ų | 127.6 | 76% | 0.759 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 138.5 | 175.4 | -68 | 172.4 | 0 | 0 | 0 | 108.1 | P175 N179 | P175-L177 PolarHBondContact O-N 3.35Å; L177-N179 PolarHBondContact O-N 3.26Å |
| 178 | P | 51.3 | Low | 56.6 | Low | 117 Ų | 117 | 129 Ų | 129 | 76% | 0.76 | 69% | 0.685 | S | S | * | * | trans | -59.6 | 113.8 | 166.7 | 24 | -29.2 | 0 | 0 | 0 | 107.2 | L180 | P178-L180 PolarHBondContact O-N 3.48Š| ||
| 179 | N | 47.5 | Very low | 54.6 | Low | 129 Ų | 129 | 126.2 Ų | 126.2 | 69% | 0.69 | 68% | 0.682 | S | S | * | * | trans | -65.5 | 118.6 | 174.6 | -77 | -49.4 | 0 | 0 | 0 | 107.7 | L177 D181 | L177-N179 PolarHBondContact O-N 3.26Å; N179-D181 PolarHBondContact O-N 2.71Å | ||
| 180 | L | 48.9 | Very low | 53.2 | Low | 166 Ų | 166 | 126.3 Ų | 126.3 | 87% | 0.869 | 69% | 0.689 | S | S | * | * | trans | -74.8 | 35.5 | 170.4 | -76 | 165.4 | 0 | 0 | 0 | 110.9 | P178 | P178-L180 PolarHBondContact O-N 3.48Š| ||
| 181 | D | 48.5 | Very low | 52.6 | Low | 138 Ų | 138 | 126.4 Ų | 126.4 | 74% | 0.738 | 68% | 0.681 | S | S | * | * | trans | -96.3 | 125.8 | 172.7 | -154.4 | 10.7 | 0 | 0 | 0 | 109.3 | N179 K183 | N179-D181 PolarHBondContact O-N 2.71Å; D181-K183 PolarHBondContact O-N 2.92Å | ||
| 182 | L | 50.3 | Low | 52.4 | Low | 128 Ų | 128 | 127.1 Ų | 127.1 | 67% | 0.67 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -68.8 | 98.5 | -176.1 | -71.2 | 126.7 | 0 | 0 | 0 | 108.4 | ||
| 183 | K | 47.2 | Very low | 52.6 | Low | 185 Ų | 185 | 124.4 Ų | 124.4 | 80% | 0.804 | 67% | 0.671 | S | S | * | * | trans | 171.3 | 115.7 | 135.7 | -86.9 | 147.4 | -162.2 | -174.6 | 0 | 108.2 | D181 D185 | D181-K183 PolarHBondContact O-N 2.92Å; K183-D185 PolarHBondContact O-N 3.34Å | ||
| 184 | N | 42.4 | Very low | 53.1 | Low | 151 Ų | 151 | 123.8 Ų | 123.8 | 81% | 0.807 | 66% | 0.663 | S | S | * | * | trans | -89.6 | 98.2 | -174.6 | -170.7 | -7.5 | 0 | 0 | 0 | 108.3 | ||||
| 185 | D | 54.8 | Low | 53.9 | Low | 98 Ų | 98 | 118.7 Ų | 118.7 | 52% | 0.524 | 64% | 0.641 | S | S | . | * | trans | -119.8 | 115.7 | 160.1 | -91.4 | -62.3 | 0 | 0 | 0 | 109.2 | K183 S187 E188 | K183-D185 PolarHBondContact O-N 3.34Å; D185-S187 PolarHBondContact O-N 3.13Å; D185-E188 HydrophobicContact CB-CG 4.49Å; D185-E188 PolarHBondContact O-N 2.93Å | ||
| 186 | P | 53.1 | Low | 54.7 | Low | 92 Ų | 92 | 121.2 Ų | 121.2 | 60% | 0.597 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -62.3 | -12.6 | -179.2 | 20.8 | -29.6 | 0 | 0 | 0 | 114 | T190 | P186-T190 PolarHBondContact O-OG1 2.86Å |
| 187 | S | 54 | Low | 55.7 | Low | 83 Ų | 83 | 121 Ų | 121 | 58% | 0.58 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.5 | -39.2 | 172.6 | -57 | 0 | 0 | 0 | 0 | 112.5 | D185 T190 E191 | D185-S187 PolarHBondContact O-N 3.13Å; S187-T190 PolarHBondContact O-N 3.16Å; S187-E191 WeakPolarHBondContact O-CB 3.37Å; S187-E191 PolarHBondContact O-N 3.08Å |
| 188 | E | 52.8 | Low | 57.3 | Low | 120 Ų | 120 | 119.6 Ų | 119.6 | 56% | 0.561 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -73.2 | -31 | -176.1 | -70.7 | -167.6 | 164.4 | 0 | 0 | 112.7 | D185 T190 E191 L192 | D185-E188 HydrophobicContact CB-CG 4.49Å; D185-E188 PolarHBondContact O-N 2.93Å; E188-T190 VanDerWaalsContact C-N 3.33Å; E188-E191 PolarHBondContact O-N 2.9Å; E188-L192 VanDerWaalsContact O-CB 3.29Å; E188-L192 WeakPolarHBondContact O-CB 3.46Å; E188-L192 PolarHBondContact O-N 3.47Å |
| 189 | L | 50.7 | Low | 58.8 | Low | 115 Ų | 115 | 119.6 Ų | 119.6 | 60% | 0.602 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.3 | -36.4 | 172.4 | -80.1 | 178.3 | 0 | 0 | 0 | 112.1 | V193 | L189-V193 WeakPolarHBondContact O-CB 3.44Å; L189-V193 VanDerWaalsContact O-CG2 3.22Å; L189-V193 WeakPolarHBondContact O-CG2 3.44Å; L189-V193 PolarHBondContact O-N 3.28Å; L189-V193 VanDerWaalsContact O-N 3.11Å |
| 190 | T | 60.1 | Low | 60.6 | Low | 76 Ų | 76 | 117 Ų | 117 | 47% | 0.466 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -68.5 | -41.8 | 173.7 | -57.9 | 0 | 0 | 0 | 0 | 109.9 | P186 S187 E188 Q194 | P186-T190 PolarHBondContact O-OG1 2.86Å; S187-T190 PolarHBondContact O-N 3.16Å; E188-T190 VanDerWaalsContact C-N 3.33Å; T190-Q194 HydrophobicContact CG2-CG 4.38Å; T190-Q194 WeakPolarHBondContact O-CB 3.39Å; T190-Q194 WeakPolarHBondContact O-CG 3.44Å; T190-Q194 PolarHBondContact O-N 3.26Å |
| 191 | E | 60.4 | Low | 62.3 | Low | 119 Ų | 119 | 112.3 Ų | 112.3 | 56% | 0.556 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.1 | -40.3 | 178.4 | -166.3 | 170.7 | -174.3 | 0 | 0 | 112.2 | S187 E188 Q194 T195 | S187-E191 WeakPolarHBondContact O-CB 3.37Å; S187-E191 PolarHBondContact O-N 3.08Å; E188-E191 PolarHBondContact O-N 2.9Å; E191-Q194 CarbonylContact O-C 3.55Å; E191-Q194 PolarHBondContact O-N 3.25Å; E191-T195 WeakPolarHBondContact O-CA 3.43Å; E191-T195 WeakPolarHBondContact O-CB 3.44Å; E191-T195 PolarHBondContact O-N 3.1Å; E191-T195 PolarHBondContact O-OG1 3.29Å |
| 192 | L | 57.7 | Low | 64.1 | Low | 105 Ų | 105 | 110.8 Ų | 110.8 | 55% | 0.55 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -72.1 | -40.3 | 178.8 | -171.1 | 66.2 | 0 | 0 | 0 | 112.1 | E188 Q194 T195 Y196 | E188-L192 VanDerWaalsContact O-CB 3.29Å; E188-L192 WeakPolarHBondContact O-CB 3.46Å; E188-L192 PolarHBondContact O-N 3.47Å; L192-Q194 VanDerWaalsContact C-N 3.33Å; L192-T195 PolarHBondContact O-N 3.46Å; L192-Y196 WeakPolarHBondContact O-CB 3.44Å; L192-Y196 PolarHBondContact O-N 3.03Å |
| 193 | V | 62.1 | Low | 65.9 | Low | 84 Ų | 84 | 107 Ų | 107 | 51% | 0.509 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66 | -38.5 | 173.2 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | L189 K197 | L189-V193 WeakPolarHBondContact O-CB 3.44Å; L189-V193 VanDerWaalsContact O-CG2 3.22Å; L189-V193 WeakPolarHBondContact O-CG2 3.44Å; L189-V193 PolarHBondContact O-N 3.28Å; L189-V193 VanDerWaalsContact O-N 3.11Å; V193-K197 VanDerWaalsContact O-CB 3.3Å; V193-K197 WeakPolarHBondContact O-CB 3.43Å; V193-K197 PolarHBondContact O-N 2.98Å |
| 194 | Q | 65.5 | Low | 67.9 | Low | 123 Ų | 123 | 100.3 Ų | 100.3 | 58% | 0.575 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.4 | -40.5 | 173.2 | -77.1 | 176.1 | 3 | 0 | 0 | 111.7 | T190 E191 L192 K197 Q198 | T190-Q194 HydrophobicContact CG2-CG 4.38Å; T190-Q194 WeakPolarHBondContact O-CB 3.39Å; T190-Q194 WeakPolarHBondContact O-CG 3.44Å; T190-Q194 PolarHBondContact O-N 3.26Å; E191-Q194 CarbonylContact O-C 3.55Å; E191-Q194 PolarHBondContact O-N 3.25Å; L192-Q194 VanDerWaalsContact C-N 3.33Å; Q194-K197 CarbonylContact O-C 3.54Å; Q194-K197 PolarHBondContact O-N 3.4Å; Q194-Q198 WeakPolarHBondContact O-CB 3.34Å; Q194-Q198 PolarHBondContact O-N 2.89Å |
| 195 | T | 70.6 | Confident | 70.1 | Confident | 58 Ų | 58 | 94.8 Ų | 94.8 | 36% | 0.356 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.3 | -47.2 | 178.7 | -60.7 | 0 | 0 | 0 | 0 | 110.4 | E191 L192 K197 Q198 E199 | E191-T195 WeakPolarHBondContact O-CA 3.43Å; E191-T195 WeakPolarHBondContact O-CB 3.44Å; E191-T195 PolarHBondContact O-N 3.1Å; E191-T195 PolarHBondContact O-OG1 3.29Å; L192-T195 PolarHBondContact O-N 3.46Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.17Å; T195-Q198 CarbonylContact O-C 3.58Å; T195-Q198 WeakPolarHBondContact O-CA 3.48Å; T195-Q198 WeakPolarHBondContact O-CB 3.43Å; T195-Q198 PolarHBondContact O-N 2.77Å; T195-E199 HydrophobicContact CG2-CG 4.36Å; T195-E199 WeakPolarHBondContact O-CG 3.28Å; T195-E199 PolarHBondContact O-N 3.01Å |
| 196 | Y | 70.1 | Confident | 72 | Confident | 160 Ų | 160 | 96.1 Ų | 96.1 | 63% | 0.627 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59 | -44.8 | 173.8 | 175.4 | -100.1 | 0 | 0 | 0 | 111.9 | L192 Q198 V200 | L192-Y196 WeakPolarHBondContact O-CB 3.44Å; L192-Y196 PolarHBondContact O-N 3.03Å; Y196-Q198 VanDerWaalsContact C-N 3.26Å; Y196-Q198 PolarHBondContact O-N 2.66Å; Y196-V200 HydrophobicContact CD2-CG2 4.5Å; Y196-V200 HydrophobicContact CE1-CG2 4.18Å; Y196-V200 HydrophobicContact CE2-CG2 4.09Å; Y196-V200 VanDerWaalsContact O-CG2 3.28Å; Y196-V200 WeakPolarHBondContact O-CG2 3.47Å; Y196-V200 PolarHBondContact O-N 2.72Å; Y196-V200 VanDerWaalsContact O-N 3.08Å |
| 197 | K | 74.8 | Confident | 73.9 | Confident | 150 Ų | 150 | 97.6 Ų | 97.6 | 65% | 0.652 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.1 | -34.9 | 175.9 | -169.6 | -178.1 | 175.9 | -175.2 | 0 | 111.5 | V193 Q194 T195 T201 | V193-K197 VanDerWaalsContact O-CB 3.3Å; V193-K197 WeakPolarHBondContact O-CB 3.43Å; V193-K197 PolarHBondContact O-N 2.98Å; Q194-K197 CarbonylContact O-C 3.54Å; Q194-K197 PolarHBondContact O-N 3.4Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.17Å; K197-T201 VanDerWaalsContact O-CB 3.3Å; K197-T201 WeakPolarHBondContact O-CB 3.41Å; K197-T201 PolarHBondContact O-N 3.5Å; K197-T201 PolarHBondContact O-OG1 3.1Å |
| 198 | Q | 80.2 | Confident | 75.7 | Confident | 115 Ų | 115 | 97.5 Ų | 97.5 | 54% | 0.537 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -70.2 | -48 | 178.6 | -176 | 59.8 | 42.5 | 0 | 0 | 111.1 | Q194 T195 Y196 V200 T201 E202 | Q194-Q198 WeakPolarHBondContact O-CB 3.34Å; Q194-Q198 PolarHBondContact O-N 2.89Å; T195-Q198 CarbonylContact O-C 3.58Å; T195-Q198 WeakPolarHBondContact O-CA 3.48Å; T195-Q198 WeakPolarHBondContact O-CB 3.43Å; T195-Q198 PolarHBondContact O-N 2.77Å; Y196-Q198 VanDerWaalsContact C-N 3.26Å; Y196-Q198 PolarHBondContact O-N 2.66Å; Q198-V200 PolarHBondContact O-N 2.86Å; Q198-T201 CarbonylContact O-C 3.55Å; Q198-T201 WeakPolarHBondContact O-CA 3.47Å; Q198-T201 WeakPolarHBondContact O-CB 3.48Å; Q198-T201 PolarHBondContact O-N 2.99Å; Q198-T201 VanDerWaalsContact O-N 3.1Å; Q198-E202 WeakPolarHBondContact O-CB 3.47Å; Q198-E202 PolarHBondContact O-N 2.98Å |
| 199 | E | 83.3 | Confident | 77.5 | Confident | 117 Ų | 117 | 92.3 Ų | 92.3 | 55% | 0.547 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.6 | -44.7 | 176.8 | -73.1 | -178.1 | 172.3 | 0 | 0 | 111.7 | T195 T201 E202 A203 | T195-E199 HydrophobicContact CG2-CG 4.36Å; T195-E199 WeakPolarHBondContact O-CG 3.28Å; T195-E199 PolarHBondContact O-N 3.01Å; E199-T201 VanDerWaalsContact C-N 3.31Å; E199-T201 PolarHBondContact O-N 3.36Å; E199-E202 PolarHBondContact O-N 2.94Å; E199-A203 WeakPolarHBondContact O-CB 3.26Å; E199-A203 PolarHBondContact O-N 3.03Å |
| 200 | V | 86.1 | Confident | 79.4 | Confident | 75 Ų | 75 | 90.9 Ų | 90.9 | 46% | 0.455 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.4 | -38.7 | 175.4 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | Y196 Q198 A204 | Y196-V200 HydrophobicContact CD2-CG2 4.5Å; Y196-V200 HydrophobicContact CE1-CG2 4.18Å; Y196-V200 HydrophobicContact CE2-CG2 4.09Å; Y196-V200 VanDerWaalsContact O-CG2 3.28Å; Y196-V200 WeakPolarHBondContact O-CG2 3.47Å; Y196-V200 PolarHBondContact O-N 2.72Å; Y196-V200 VanDerWaalsContact O-N 3.08Å; Q198-V200 PolarHBondContact O-N 2.86Å; V200-A204 WeakPolarHBondContact O-CB 3.49Å; V200-A204 PolarHBondContact O-N 3.21Å |
| 201 | T | 84.4 | Confident | 81.1 | Confident | 66 Ų | 66 | 94.6 Ų | 94.6 | 41% | 0.405 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.4 | -39.7 | 177.1 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | K197 Q198 E199 A204 C205 | K197-T201 VanDerWaalsContact O-CB 3.3Å; K197-T201 WeakPolarHBondContact O-CB 3.41Å; K197-T201 PolarHBondContact O-N 3.5Å; K197-T201 PolarHBondContact O-OG1 3.1Å; Q198-T201 CarbonylContact O-C 3.55Å; Q198-T201 WeakPolarHBondContact O-CA 3.47Å; Q198-T201 WeakPolarHBondContact O-CB 3.48Å; Q198-T201 PolarHBondContact O-N 2.99Å; Q198-T201 VanDerWaalsContact O-N 3.1Å; E199-T201 VanDerWaalsContact C-N 3.31Å; E199-T201 PolarHBondContact O-N 3.36Å; T201-A204 PolarHBondContact O-N 3.25Å; T201-C205 PolarHBondContact O-N 3.1Å; T201-C205 PolarHBondContact O-SG 2.94Å |
| 202 | E | 85.4 | Confident | 82.5 | Confident | 106 Ų | 106 | 88.9 Ų | 88.9 | 50% | 0.495 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -66.2 | -49.2 | 178.5 | -174.6 | 168.1 | -168 | 0 | 0 | 111.3 | Q198 E199 A204 C205 E206 | Q198-E202 WeakPolarHBondContact O-CB 3.47Å; Q198-E202 PolarHBondContact O-N 2.98Å; E199-E202 PolarHBondContact O-N 2.94Å; E202-A204 VanDerWaalsContact C-N 3.27Å; E202-A204 PolarHBondContact O-N 3.36Å; E202-C205 WeakPolarHBondContact O-CA 3.42Å; E202-C205 WeakPolarHBondContact O-CB 3.3Å; E202-C205 PolarHBondContact O-N 3.03Å; E202-E206 PolarHBondContact O-N 2.84Å |
| 203 | A | 88.4 | Confident | 84.2 | Confident | 50 Ų | 50 | 88.2 Ų | 88.2 | 41% | 0.413 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -58.2 | -39 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | E199 E206 L207 | E199-A203 WeakPolarHBondContact O-CB 3.26Å; E199-A203 PolarHBondContact O-N 3.03Å; A203-E206 PolarHBondContact O-N 3.36Å; A203-L207 WeakPolarHBondContact O-CG 3.22Å; A203-L207 PolarHBondContact O-N 3.34Å |
| 204 | A | 89.4 | Confident | 85.6 | Confident | 43 Ų | 43 | 92 Ų | 92 | 36% | 0.355 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V200 T201 E202 L207 I208 | V200-A204 WeakPolarHBondContact O-CB 3.49Å; V200-A204 PolarHBondContact O-N 3.21Å; T201-A204 PolarHBondContact O-N 3.25Å; E202-A204 VanDerWaalsContact C-N 3.27Å; E202-A204 PolarHBondContact O-N 3.36Å; A204-L207 PolarHBondContact O-N 2.86Å; A204-I208 WeakPolarHBondContact O-CD1 3.4Å; A204-I208 WeakPolarHBondContact O-CG1 3.15Å; A204-I208 PolarHBondContact O-N 2.74Å |
| 205 | C | 89.2 | Confident | 86.7 | Confident | 36 Ų | 36 | 90.8 Ų | 90.8 | 24% | 0.243 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 176.3 | -71.1 | 0 | 0 | 0 | 0 | 111.7 | T201 E202 I208 C209 V223 | T201-C205 PolarHBondContact O-N 3.1Å; T201-C205 PolarHBondContact O-SG 2.94Å; E202-C205 WeakPolarHBondContact O-CA 3.42Å; E202-C205 WeakPolarHBondContact O-CB 3.3Å; E202-C205 PolarHBondContact O-N 3.03Å; C205-I208 PolarHBondContact O-N 3.05Å; C205-C209 PolarHBondContact O-N 3.21Å; C205-C209 PolarHBondContact O-SG 2.98Å; C205-V223 HydrophobicContact CB-CG1 3.9Å |
| 206 | E | 92.9 | Very high | 87.6 | Confident | 125 Ų | 125 | 90 Ų | 90 | 58% | 0.584 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -59.7 | -48.5 | 176.1 | -68.8 | -173.9 | 168.3 | 0 | 0 | 111.7 | E202 A203 I208 C209 D210 | E202-E206 PolarHBondContact O-N 2.84Å; A203-E206 PolarHBondContact O-N 3.36Å; E206-I208 VanDerWaalsContact C-N 3.28Å; E206-I208 PolarHBondContact O-N 2.71Å; E206-C209 WeakPolarHBondContact O-CB 3.08Å; E206-C209 PolarHBondContact O-N 2.96Å; E206-C209 VanDerWaalsContact O-N 3.1Å; E206-D210 PolarHBondContact O-N 3.2Å |
| 207 | L | 93.1 | Very high | 88.5 | Confident | 124 Ų | 124 | 91.6 Ų | 91.6 | 65% | 0.649 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -59.6 | -38.7 | 177.9 | -70.4 | 174.8 | 0 | 0 | 0 | 112.6 | A203 A204 W211 | A203-L207 WeakPolarHBondContact O-CG 3.22Å; A203-L207 PolarHBondContact O-N 3.34Å; A204-L207 PolarHBondContact O-N 2.86Å; L207-W211 WeakPolarHBondContact O-CB 3.39Å; L207-W211 PolarHBondContact O-N 3.02Å |
| 208 | I | 93.6 | Very high | 89 | Confident | 80 Ų | 80 | 91.7 Ų | 91.7 | 41% | 0.41 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -68.3 | -39.4 | 176.6 | -67.6 | 164 | 0 | 0 | 0 | 110.8 | A204 C205 E206 W211 A212 V223 I226 | A204-I208 WeakPolarHBondContact O-CD1 3.4Å; A204-I208 WeakPolarHBondContact O-CG1 3.15Å; A204-I208 PolarHBondContact O-N 2.74Å; C205-I208 PolarHBondContact O-N 3.05Å; E206-I208 VanDerWaalsContact C-N 3.28Å; E206-I208 PolarHBondContact O-N 2.71Å; I208-W211 PolarHBondContact O-N 3.48Å; I208-A212 WeakPolarHBondContact O-CB 3.25Å; I208-A212 PolarHBondContact O-N 3.32Å; I208-V223 HydrophobicContact CB-CG1 4.08Å; I208-V223 HydrophobicContact CD1-CG1 4.49Å; I208-V223 HydrophobicContact CG2-CG1 3.9Å; I208-I226 HydrophobicContact CG2-CD1 3.89Å |
| 209 | C | 90.2 | Very high | 89.4 | Confident | 11 Ų | 11 | 89.8 Ų | 89.8 | 7% | 0.074 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 175.2 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | C205 E206 W211 A212 Q213 F220 I226 | C205-C209 PolarHBondContact O-N 3.21Å; C205-C209 PolarHBondContact O-SG 2.98Å; E206-C209 WeakPolarHBondContact O-CB 3.08Å; E206-C209 PolarHBondContact O-N 2.96Å; E206-C209 VanDerWaalsContact O-N 3.1Å; C209-W211 VanDerWaalsContact C-N 3.34Å; C209-W211 PolarHBondContact O-N 3.48Å; C209-A212 PolarHBondContact O-N 3.2Å; C209-Q213 WeakPolarHBondContact O-CB 3.27Å; C209-Q213 PolarHBondContact O-N 2.91Å; C209-F220 WeakPolarHBondContact CB-O 3.5Å; C209-I226 HydrophobicContact CB-CD1 4.34Å |
| 210 | D | 90.9 | Very high | 89.7 | Confident | 86 Ų | 86 | 84.9 Ų | 84.9 | 46% | 0.46 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.3 | -43.4 | 175.3 | -101.4 | 18 | 0 | 0 | 0 | 112.6 | E206 K214 | E206-D210 PolarHBondContact O-N 3.2Å; D210-K214 WeakPolarHBondContact O-CG 3.39Å; D210-K214 PolarHBondContact O-N 2.95Å |
| 211 | W | 94 | Very high | 89.6 | Confident | 153 Ų | 153 | 87.9 Ų | 87.9 | 58% | 0.58 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -63.2 | -47.7 | 175.1 | 168.8 | 82.7 | 0 | 0 | 0 | 111.5 | L207 I208 C209 Q213 K214 I215 | L207-W211 WeakPolarHBondContact O-CB 3.39Å; L207-W211 PolarHBondContact O-N 3.02Å; I208-W211 PolarHBondContact O-N 3.48Å; C209-W211 VanDerWaalsContact C-N 3.34Å; C209-W211 PolarHBondContact O-N 3.48Å; W211-Q213 VanDerWaalsContact C-N 3.3Å; W211-Q213 PolarHBondContact O-N 2.89Å; W211-K214 PolarHBondContact O-N 2.9Å; W211-I215 HydrophobicContact CD2-CD1 4.08Å; W211-I215 HydrophobicContact CH2-CD1 4.2Å; W211-I215 HydrophobicContact CZ2-CD1 3.35Å; W211-I215 VanDerWaalsContact NE1-CD1 3.28Å; W211-I215 PolarHBondContact O-N 3.23Å |
| 212 | A | 91.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 87.7 Ų | 87.7 | 0% | 0 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -63.3 | -37.7 | 180 | 0 | 0 | 0 | 0 | 0 | 111.8 | I208 C209 K214 I215 L216 F220 I226 | I208-A212 WeakPolarHBondContact O-CB 3.25Å; I208-A212 PolarHBondContact O-N 3.32Å; C209-A212 PolarHBondContact O-N 3.2Å; A212-K214 VanDerWaalsContact C-N 3.31Å; A212-K214 PolarHBondContact O-N 3.34Å; A212-I215 PolarHBondContact O-N 2.87Å; A212-L216 HydrophobicContact CB-CD1 4.38Å; A212-L216 WeakPolarHBondContact O-CB 3.39Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.15Å; A212-F220 HydrophobicContact CB-CD2 3.98Å; A212-F220 HydrophobicContact CB-CE2 4.19Å; A212-I226 HydrophobicContact CB-CD1 3.66Å; A212-I226 HydrophobicContact CB-CG1 3.91Å; A212-I226 HydrophobicContact CB-CG2 3.9Å |
| 213 | Q | 92.1 | Very high | 90 | Very high | 90 Ų | 90 | 85 Ų | 85 | 42% | 0.421 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 176.9 | 177.6 | 169.9 | -18.9 | 0 | 0 | 112.7 | C209 W211 K217 R218 | C209-Q213 WeakPolarHBondContact O-CB 3.27Å; C209-Q213 PolarHBondContact O-N 2.91Å; W211-Q213 VanDerWaalsContact C-N 3.3Å; W211-Q213 PolarHBondContact O-N 2.89Å; Q213-K217 VanDerWaalsContact O-CA 3.29Å; Q213-K217 WeakPolarHBondContact O-CA 3.45Å; Q213-K217 PolarHBondContact O-N 2.95Å; Q213-R218 WeakPolarHBondContact CA-O 3.45Å; Q213-R218 WeakPolarHBondContact CB-O 3.45Å |
| 214 | K | 91 | Very high | 90.2 | Very high | 164 Ų | 164 | 86 Ų | 86 | 71% | 0.713 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -66.3 | -38.2 | 177.1 | -71.3 | 167.3 | -175.4 | 163.8 | 0 | 112.3 | D210 W211 A212 | D210-K214 WeakPolarHBondContact O-CG 3.39Å; D210-K214 PolarHBondContact O-N 2.95Å; W211-K214 PolarHBondContact O-N 2.9Å; A212-K214 VanDerWaalsContact C-N 3.31Å; A212-K214 PolarHBondContact O-N 3.34Å |
| 215 | I | 89.9 | Confident | 90.2 | Very high | 98 Ų | 98 | 86.6 Ų | 86.6 | 50% | 0.503 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -83.3 | -47.1 | -176.1 | -64.9 | -176.7 | 0 | 0 | 0 | 111.8 | W211 A212 K217 | W211-I215 HydrophobicContact CD2-CD1 4.08Å; W211-I215 HydrophobicContact CH2-CD1 4.2Å; W211-I215 HydrophobicContact CZ2-CD1 3.35Å; W211-I215 VanDerWaalsContact NE1-CD1 3.28Å; W211-I215 PolarHBondContact O-N 3.23Å; A212-I215 PolarHBondContact O-N 2.87Å; I215-K217 VanDerWaalsContact C-N 3.33Å |
| 216 | L | 88.1 | Confident | 90.3 | Very high | 41 Ų | 41 | 85.3 Ų | 85.3 | 22% | 0.215 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -90.5 | -1.8 | -172.7 | -55.4 | 174.8 | 0 | 0 | 0 | 112.4 | A212 R218 F220 Y229 L230 I235 | A212-L216 HydrophobicContact CB-CD1 4.38Å; A212-L216 WeakPolarHBondContact O-CB 3.39Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.15Å; L216-R218 PolarHBondContact O-N 3.23Å; L216-R218 VanDerWaalsContact O-N 3.15Å; L216-F220 HydrophobicContact CB-CE2 3.96Å; L216-F220 HydrophobicContact CB-CZ 4.15Å; L216-F220 HydrophobicContact CD1-CE2 3.74Å; L216-F220 HydrophobicContact CD1-CZ 3.72Å; L216-F220 HydrophobicContact CG-CE2 4.43Å; L216-Y229 HydrophobicContact CB-CE1 4.27Å; L216-Y229 HydrophobicContact CD1-CD1 3.8Å; L216-Y229 HydrophobicContact CD1-CE1 3.98Å; L216-Y229 HydrophobicContact CD2-CE1 4.13Å; L216-Y229 HydrophobicContact CG-CE1 4.35Å; L216-L230 HydrophobicContact CD1-CD2 4.18Å; L216-I235 HydrophobicContact CD2-CD1 4.33Å |
| 217 | K | 89.2 | Confident | 90.1 | Very high | 194 Ų | 194 | 80.8 Ų | 80.8 | 84% | 0.843 | 40% | 0.402 | S | S | * | . | S | Bend | trans | 52.5 | 34.2 | 178.8 | -57.9 | -175.3 | 178.8 | -178 | 0 | 113 | Q213 I215 | Q213-K217 VanDerWaalsContact O-CA 3.29Å; Q213-K217 WeakPolarHBondContact O-CA 3.45Å; Q213-K217 PolarHBondContact O-N 2.95Å; I215-K217 VanDerWaalsContact C-N 3.33Å |
| 218 | R | 86.6 | Confident | 89.8 | Confident | 151 Ų | 151 | 79.5 Ų | 79.5 | 57% | 0.57 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -143.8 | 139 | -176.8 | -164.2 | -179.5 | -171 | 91.7 | 3.7 | 108.7 | Q213 L216 F220 | Q213-R218 WeakPolarHBondContact CA-O 3.45Å; Q213-R218 WeakPolarHBondContact CB-O 3.45Å; L216-R218 PolarHBondContact O-N 3.23Å; L216-R218 VanDerWaalsContact O-N 3.15Å; R218-F220 HydrophobicContact CB-CE2 4.11Å; R218-F220 HydrophobicContact CB-CZ 3.98Å; R218-F220 HydrophobicContact CG-CZ 4.39Å; R218-F220 VanDerWaalsContact O-CD2 3.26Å; R218-F220 WeakPolarHBondContact O-CD2 3.37Å; R218-F220 WeakPolarHBondContact O-CE2 3.5Å |
| 219 | S | 87 | Confident | 89.6 | Confident | 75 Ų | 75 | 78.1 Ų | 78.1 | 52% | 0.524 | 38% | 0.378 | S | S | . | . | trans | -76.6 | 144.6 | 176 | 55.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 220 | F | 89.7 | Confident | 89.5 | Confident | 14 Ų | 14 | 79.4 Ų | 79.4 | 6% | 0.061 | 38% | 0.384 | C | S | . | . | trans | -134.9 | 130.8 | 174.6 | -56.3 | -82.5 | 0 | 0 | 0 | 107.9 | C209 A212 L216 R218 E225 I226 Y229 | C209-F220 WeakPolarHBondContact CB-O 3.5Å; A212-F220 HydrophobicContact CB-CD2 3.98Å; A212-F220 HydrophobicContact CB-CE2 4.19Å; L216-F220 HydrophobicContact CB-CE2 3.96Å; L216-F220 HydrophobicContact CB-CZ 4.15Å; L216-F220 HydrophobicContact CD1-CE2 3.74Å; L216-F220 HydrophobicContact CD1-CZ 3.72Å; L216-F220 HydrophobicContact CG-CE2 4.43Å; R218-F220 HydrophobicContact CB-CE2 4.11Å; R218-F220 HydrophobicContact CB-CZ 3.98Å; R218-F220 HydrophobicContact CG-CZ 4.39Å; R218-F220 VanDerWaalsContact O-CD2 3.26Å; R218-F220 WeakPolarHBondContact O-CD2 3.37Å; R218-F220 WeakPolarHBondContact O-CE2 3.5Å; F220-E225 HydrophobicContact CB-CB 4.33Å; F220-E225 HydrophobicContact CD1-CB 4Å; F220-I226 HydrophobicContact CB-CD1 4.42Å; F220-I226 HydrophobicContact CB-CG1 3.61Å; F220-I226 HydrophobicContact CD1-CG1 4.11Å; F220-I226 HydrophobicContact CD2-CG1 3.97Å; F220-I226 HydrophobicContact CG-CG1 3.63Å; F220-Y229 HydrophobicContact CE1-CD1 4.34Å; F220-Y229 HydrophobicContact CE1-CD2 4.34Å; F220-Y229 AromaticContact CE1-CG 3.87Å; F220-Y229 HydrophobicContact CE1-CG 3.87Å; F220-Y229 AromaticContact CZ-CD1 3.99Å; F220-Y229 HydrophobicContact CZ-CD1 3.99Å; F220-Y229 HydrophobicContact CZ-CD2 4.49Å; F220-Y229 AromaticContact CZ-CG 3.96Å; F220-Y229 HydrophobicContact CZ-CG 3.96Å | ||
| 221 | D | 83.9 | Confident | 89.5 | Confident | 139 Ų | 139 | 76.2 Ų | 76.2 | 74% | 0.743 | 37% | 0.367 | S | S | * | . | S | Bend | trans | -91.8 | -16 | -178.1 | -60.5 | -48.2 | 0 | 0 | 0 | 111.3 | E225 | D221-E225 PolarHBondContact N-OE2 3.19Š|
| 222 | T | 89.9 | Confident | 89.1 | Confident | 61 Ų | 61 | 75.7 Ų | 75.7 | 37% | 0.374 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -143.9 | 152.3 | 178.1 | 62.7 | 0 | 0 | 0 | 0 | 112.6 | V224 E225 I226 | T222-V224 PolarHBondContact O-N 3.38Å; T222-V224 VanDerWaalsContact O-N 3.13Å; T222-E225 WeakPolarHBondContact O-CB 3.37Å; T222-E225 PolarHBondContact O-N 3.08Å; T222-E225 WeakPolarHBondContact OG1-CG 3.24Å; T222-E225 PolarHBondContact OG1-N 3.26Å; T222-I226 PolarHBondContact O-N 2.98Å |
| 223 | V | 90.2 | Very high | 88.8 | Confident | 51 Ų | 51 | 80.6 Ų | 80.6 | 31% | 0.309 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.1 | -24.5 | 171.8 | -70.9 | 0 | 0 | 0 | 0 | 113.2 | C205 I208 I226 A227 | C205-V223 HydrophobicContact CB-CG1 3.9Å; I208-V223 HydrophobicContact CB-CG1 4.08Å; I208-V223 HydrophobicContact CD1-CG1 4.49Å; I208-V223 HydrophobicContact CG2-CG1 3.9Å; V223-I226 HydrophobicContact CG1-CD1 4.36Å; V223-I226 PolarHBondContact O-N 3.28Å; V223-A227 PolarHBondContact O-N 3.32Å |
| 224 | V | 91.3 | Very high | 88.4 | Confident | 70 Ų | 70 | 83.2 Ų | 83.2 | 42% | 0.424 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -69.9 | -36.7 | 174.9 | -176.8 | 0 | 0 | 0 | 0 | 111.2 | T222 A227 R228 V246 | T222-V224 PolarHBondContact O-N 3.38Å; T222-V224 VanDerWaalsContact O-N 3.13Å; V224-A227 PolarHBondContact O-N 2.82Å; V224-R228 WeakPolarHBondContact O-CG 3.14Å; V224-R228 PolarHBondContact O-N 3.27Å; V224-V246 HydrophobicContact CG1-CG1 4.32Å |
| 225 | E | 89.2 | Confident | 88.1 | Confident | 55 Ų | 55 | 80 Ų | 80 | 26% | 0.257 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 174.5 | -78.5 | 174.6 | 176.8 | 0 | 0 | 112.5 | F220 D221 T222 R228 Y229 | F220-E225 HydrophobicContact CB-CB 4.33Å; F220-E225 HydrophobicContact CD1-CB 4Å; D221-E225 PolarHBondContact N-OE2 3.19Å; T222-E225 WeakPolarHBondContact O-CB 3.37Å; T222-E225 PolarHBondContact O-N 3.08Å; T222-E225 WeakPolarHBondContact OG1-CG 3.24Å; T222-E225 PolarHBondContact OG1-N 3.26Å; E225-R228 PolarHBondContact O-N 2.89Å; E225-R228 IonicContact OE1-NH2 3.74Å; E225-Y229 WeakPolarHBondContact O-CB 3.32Å; E225-Y229 PolarHBondContact O-N 3.13Å |
| 226 | I | 91.1 | Very high | 87.9 | Confident | 9 Ų | 9 | 78.2 Ų | 78.2 | 5% | 0.046 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -58.7 | -51.4 | 173.5 | -54.3 | 168.4 | 0 | 0 | 0 | 109.1 | I208 C209 A212 F220 T222 V223 R228 Y229 L230 | I208-I226 HydrophobicContact CG2-CD1 3.89Å; C209-I226 HydrophobicContact CB-CD1 4.34Å; A212-I226 HydrophobicContact CB-CD1 3.66Å; A212-I226 HydrophobicContact CB-CG1 3.91Å; A212-I226 HydrophobicContact CB-CG2 3.9Å; F220-I226 HydrophobicContact CB-CD1 4.42Å; F220-I226 HydrophobicContact CB-CG1 3.61Å; F220-I226 HydrophobicContact CD1-CG1 4.11Å; F220-I226 HydrophobicContact CD2-CG1 3.97Å; F220-I226 HydrophobicContact CG-CG1 3.63Å; T222-I226 PolarHBondContact O-N 2.98Å; V223-I226 HydrophobicContact CG1-CD1 4.36Å; V223-I226 PolarHBondContact O-N 3.28Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.29Å; I226-Y229 PolarHBondContact O-N 2.78Å; I226-L230 HydrophobicContact CG2-CD1 4Å; I226-L230 HydrophobicContact CG2-CG 4.32Å; I226-L230 VanDerWaalsContact O-CG 3.26Å; I226-L230 WeakPolarHBondContact O-CG 3.47Å; I226-L230 PolarHBondContact O-N 3.04Å |
| 227 | A | 90.1 | Very high | 87.7 | Confident | 31 Ų | 31 | 81.2 Ų | 81.2 | 26% | 0.256 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.6 | -42.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V223 V224 L230 I231 V246 | V223-A227 PolarHBondContact O-N 3.32Å; V224-A227 PolarHBondContact O-N 2.82Å; A227-L230 PolarHBondContact O-N 2.63Å; A227-I231 VanDerWaalsContact O-CD1 3.27Å; A227-I231 WeakPolarHBondContact O-CD1 3.35Å; A227-I231 WeakPolarHBondContact O-CG1 3.41Å; A227-I231 PolarHBondContact O-N 2.81Å; A227-I231 VanDerWaalsContact O-N 3.1Å; A227-V246 HydrophobicContact CB-CG1 4.04Å; A227-V246 HydrophobicContact CB-CG2 4.47Å |
| 228 | R | 87.1 | Confident | 87.4 | Confident | 96 Ų | 96 | 74.3 Ų | 74.3 | 36% | 0.362 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 175.7 | -78.9 | -171 | -78.2 | 116.8 | -14.7 | 112.3 | V224 E225 I226 L230 I231 Q232 V246 | V224-R228 WeakPolarHBondContact O-CG 3.14Å; V224-R228 PolarHBondContact O-N 3.27Å; E225-R228 PolarHBondContact O-N 2.89Å; E225-R228 IonicContact OE1-NH2 3.74Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.29Å; R228-L230 VanDerWaalsContact C-N 3.34Å; R228-L230 PolarHBondContact O-N 3.05Å; R228-I231 PolarHBondContact O-N 3.45Å; R228-Q232 WeakPolarHBondContact O-CB 3.26Å; R228-Q232 PolarHBondContact O-N 3.01Å; R228-V246 HydrophobicContact CG-CG1 3.68Å |
| 229 | Y | 87.8 | Confident | 87.2 | Confident | 52 Ų | 52 | 77 Ų | 77 | 20% | 0.204 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.6 | -44 | 179 | -179.8 | -93.8 | 0 | 0 | 0 | 111.6 | L216 F220 E225 I226 I231 Q232 E233 I235 | L216-Y229 HydrophobicContact CB-CE1 4.27Å; L216-Y229 HydrophobicContact CD1-CD1 3.8Å; L216-Y229 HydrophobicContact CD1-CE1 3.98Å; L216-Y229 HydrophobicContact CD2-CE1 4.13Å; L216-Y229 HydrophobicContact CG-CE1 4.35Å; F220-Y229 HydrophobicContact CE1-CD1 4.34Å; F220-Y229 HydrophobicContact CE1-CD2 4.34Å; F220-Y229 AromaticContact CE1-CG 3.87Å; F220-Y229 HydrophobicContact CE1-CG 3.87Å; F220-Y229 AromaticContact CZ-CD1 3.99Å; F220-Y229 HydrophobicContact CZ-CD1 3.99Å; F220-Y229 HydrophobicContact CZ-CD2 4.49Å; F220-Y229 AromaticContact CZ-CG 3.96Å; F220-Y229 HydrophobicContact CZ-CG 3.96Å; E225-Y229 WeakPolarHBondContact O-CB 3.32Å; E225-Y229 PolarHBondContact O-N 3.13Å; I226-Y229 PolarHBondContact O-N 2.78Å; Y229-I231 VanDerWaalsContact C-N 3.28Å; Y229-I231 PolarHBondContact O-N 2.9Å; Y229-Q232 PolarHBondContact O-N 2.94Å; Y229-E233 HydrophobicContact CD1-CG 4.21Å; Y229-E233 HydrophobicContact CD2-CG 4.18Å; Y229-E233 HydrophobicContact CE1-CB 4.47Å; Y229-E233 HydrophobicContact CE1-CG 3.74Å; Y229-E233 HydrophobicContact CE2-CG 3.72Å; Y229-E233 HydrophobicContact CG-CG 4.42Å; Y229-E233 VanDerWaalsContact CZ-CG 3.49Å; Y229-E233 WeakPolarHBondContact O-CB 3.48Å; Y229-E233 PolarHBondContact O-N 3.24Å; Y229-I235 HydrophobicContact CE1-CD1 4.28Å |
| 230 | L | 89.8 | Confident | 87.2 | Confident | 37 Ų | 37 | 75.3 Ų | 75.3 | 19% | 0.194 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.8 | -35.9 | 177.5 | -66.5 | 175.6 | 0 | 0 | 0 | 112.6 | L216 I226 A227 R228 H234 I235 V236 | L216-L230 HydrophobicContact CD1-CD2 4.18Å; I226-L230 HydrophobicContact CG2-CD1 4Å; I226-L230 HydrophobicContact CG2-CG 4.32Å; I226-L230 VanDerWaalsContact O-CG 3.26Å; I226-L230 WeakPolarHBondContact O-CG 3.47Å; I226-L230 PolarHBondContact O-N 3.04Å; A227-L230 PolarHBondContact O-N 2.63Å; R228-L230 VanDerWaalsContact C-N 3.34Å; R228-L230 PolarHBondContact O-N 3.05Å; L230-H234 PolarHBondContact O-N 2.85Å; L230-I235 HydrophobicContact CB-CB 4.44Å; L230-I235 HydrophobicContact CD2-CB 3.92Å; L230-I235 HydrophobicContact CD2-CD1 3.75Å; L230-I235 HydrophobicContact CD2-CG1 4.43Å; L230-I235 HydrophobicContact CD2-CG2 3.77Å; L230-I235 PolarHBondContact O-N 3.38Å; L230-V236 HydrophobicContact CB-CG1 4.12Å; L230-V236 HydrophobicContact CB-CG2 3.9Å; L230-V236 HydrophobicContact CD1-CG1 4.42Å; L230-V236 PolarHBondContact O-N 3.31Å |
| 231 | I | 89.4 | Confident | 87 | Confident | 19 Ų | 19 | 80.4 Ų | 80.4 | 10% | 0.097 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -70.3 | -43.3 | 175.8 | -65.7 | 159.3 | 0 | 0 | 0 | 110.5 | A227 R228 Y229 H234 V236 P238 A243 V246 | A227-I231 VanDerWaalsContact O-CD1 3.27Å; A227-I231 WeakPolarHBondContact O-CD1 3.35Å; A227-I231 WeakPolarHBondContact O-CG1 3.41Å; A227-I231 PolarHBondContact O-N 2.81Å; A227-I231 VanDerWaalsContact O-N 3.1Å; R228-I231 PolarHBondContact O-N 3.45Å; Y229-I231 VanDerWaalsContact C-N 3.28Å; Y229-I231 PolarHBondContact O-N 2.9Å; I231-H234 PolarHBondContact O-N 2.82Å; I231-V236 HydrophobicContact CB-CG2 4.43Å; I231-V236 HydrophobicContact CG1-CG2 3.69Å; I231-P238 HydrophobicContact CG2-CB 3.99Å; I231-A243 HydrophobicContact CD1-CB 3.71Å; I231-A243 HydrophobicContact CG1-CB 3.86Å; I231-A243 HydrophobicContact CG2-CB 4.32Å; I231-V246 HydrophobicContact CD1-CB 4.14Å; I231-V246 HydrophobicContact CD1-CG1 4.05Å |
| 232 | Q | 85.8 | Confident | 87.2 | Confident | 143 Ų | 143 | 80 Ų | 80 | 67% | 0.668 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -67.6 | -41.6 | -177.7 | -177.1 | 167 | 11.1 | 0 | 0 | 112.6 | R228 Y229 H234 | R228-Q232 WeakPolarHBondContact O-CB 3.26Å; R228-Q232 PolarHBondContact O-N 3.01Å; Y229-Q232 PolarHBondContact O-N 2.94Å; Q232-H234 PolarHBondContact O-N 3.45Å |
| 233 | E | 86.3 | Confident | 87 | Confident | 103 Ų | 103 | 77.3 Ų | 77.3 | 48% | 0.481 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | 8 | 176.3 | -66.7 | -60.7 | 128.9 | 0 | 0 | 112.9 | Y229 I235 | Y229-E233 HydrophobicContact CD1-CG 4.21Å; Y229-E233 HydrophobicContact CD2-CG 4.18Å; Y229-E233 HydrophobicContact CE1-CB 4.47Å; Y229-E233 HydrophobicContact CE1-CG 3.74Å; Y229-E233 HydrophobicContact CE2-CG 3.72Å; Y229-E233 HydrophobicContact CG-CG 4.42Å; Y229-E233 VanDerWaalsContact CZ-CG 3.49Å; Y229-E233 WeakPolarHBondContact O-CB 3.48Å; Y229-E233 PolarHBondContact O-N 3.24Å; E233-I235 HydrophobicContact CB-CD1 3.75Å; E233-I235 HydrophobicContact CB-CG1 3.84Å; E233-I235 PolarHBondContact O-N 3.19Å; E233-I235 VanDerWaalsContact O-N 3.08Å |
| 234 | H | 83.5 | Confident | 86.8 | Confident | 144 Ų | 144 | 80.7 Ų | 80.7 | 67% | 0.667 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.1 | 24.9 | -178.1 | -67.6 | -72.6 | 0 | 0 | 0 | 114.6 | L230 I231 Q232 V236 | L230-H234 PolarHBondContact O-N 2.85Å; I231-H234 PolarHBondContact O-N 2.82Å; Q232-H234 PolarHBondContact O-N 3.45Å; H234-V236 VanDerWaalsContact C-N 3.29Å |
| 235 | I | 83.9 | Confident | 86.6 | Confident | 97 Ų | 97 | 83.1 Ų | 83.1 | 50% | 0.497 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -72.3 | -29 | 177 | -59.9 | 167.9 | 0 | 0 | 0 | 110.3 | L216 Y229 L230 E233 | L216-I235 HydrophobicContact CD2-CD1 4.33Å; Y229-I235 HydrophobicContact CE1-CD1 4.28Å; L230-I235 HydrophobicContact CB-CB 4.44Å; L230-I235 HydrophobicContact CD2-CB 3.92Å; L230-I235 HydrophobicContact CD2-CD1 3.75Å; L230-I235 HydrophobicContact CD2-CG1 4.43Å; L230-I235 HydrophobicContact CD2-CG2 3.77Å; L230-I235 PolarHBondContact O-N 3.38Å; E233-I235 HydrophobicContact CB-CD1 3.75Å; E233-I235 HydrophobicContact CB-CG1 3.84Å; E233-I235 PolarHBondContact O-N 3.19Å; E233-I235 VanDerWaalsContact O-N 3.08Å |
| 236 | V | 85.9 | Confident | 86.4 | Confident | 61 Ų | 61 | 82.2 Ų | 82.2 | 37% | 0.37 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -121.1 | 159.2 | 173.1 | -60.9 | 0 | 0 | 0 | 0 | 111.1 | L230 I231 H234 P238 | L230-V236 HydrophobicContact CB-CG1 4.12Å; L230-V236 HydrophobicContact CB-CG2 3.9Å; L230-V236 HydrophobicContact CD1-CG1 4.42Å; L230-V236 PolarHBondContact O-N 3.31Å; I231-V236 HydrophobicContact CB-CG2 4.43Å; I231-V236 HydrophobicContact CG1-CG2 3.69Å; H234-V236 VanDerWaalsContact C-N 3.29Å; V236-P238 WeakPolarHBondContact O-CD 3.22Å; V236-P238 VanDerWaalsContact O-N 3.11Å |
| 237 | N | 84.5 | Confident | 86.1 | Confident | 103 Ų | 103 | 85.3 Ų | 85.3 | 55% | 0.551 | 42% | 0.421 | S | S | * | . | trans | -64.3 | 110.8 | -177.4 | -177 | -9.5 | 0 | 0 | 0 | 111.5 | R239 C240 | N237-R239 PolarHBondContact O-N 3.04Å; N237-R239 WeakPolarHBondContact OD1-CB 3.5Å; N237-R239 PolarHBondContact OD1-N 2.85Å; N237-C240 PolarHBondContact O-N 3Å; N237-C240 PolarHBondContact O-SG 3Å | ||
| 238 | P | 82.2 | Confident | 85.6 | Confident | 49 Ų | 49 | 86.9 Ų | 86.9 | 32% | 0.318 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.7 | -11 | -174.9 | 32 | -37.3 | 0 | 0 | 0 | 113.2 | I231 V236 | I231-P238 HydrophobicContact CG2-CB 3.99Å; V236-P238 WeakPolarHBondContact O-CD 3.22Å; V236-P238 VanDerWaalsContact O-N 3.11Å |
| 239 | R | 83.3 | Confident | 84.9 | Confident | 207 Ų | 207 | 85.3 Ų | 85.3 | 78% | 0.781 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.3 | -5.8 | -178.6 | -63.7 | -177.3 | 177.3 | 161.7 | 0.1 | 113.4 | N237 K244 | N237-R239 PolarHBondContact O-N 3.04Å; N237-R239 WeakPolarHBondContact OD1-CB 3.5Å; N237-R239 PolarHBondContact OD1-N 2.85Å; R239-K244 WeakPolarHBondContact O-CE 3.49Å |
| 240 | C | 87.6 | Confident | 83.5 | Confident | 41 Ų | 41 | 85.4 Ų | 85.4 | 28% | 0.277 | 45% | 0.449 | S | S | . | . | S | Bend | trans | -70 | 155.8 | 179.4 | 75 | 0 | 0 | 0 | 0 | 111.6 | N237 Q242 A243 K244 | N237-C240 PolarHBondContact O-N 3Å; N237-C240 PolarHBondContact O-SG 3Å; C240-Q242 PolarHBondContact O-N 3.44Å; C240-A243 PolarHBondContact O-N 3.24Å; C240-A243 WeakPolarHBondContact SG-CB 3.45Å; C240-A243 PolarHBondContact SG-N 3.03Å; C240-K244 PolarHBondContact O-N 3.34Å; C240-K244 VanDerWaalsContact O-N 3.1Å |
| 241 | N | 85.2 | Confident | 82 | Confident | 120 Ų | 120 | 91.3 Ų | 91.3 | 64% | 0.642 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63 | -32.3 | -177 | -65.8 | -26.2 | 0 | 0 | 0 | 111.9 | K244 L245 | N241-K244 PolarHBondContact O-N 2.96Å; N241-L245 WeakPolarHBondContact O-CB 3.38Å; N241-L245 PolarHBondContact O-N 3.27Å |
| 242 | Q | 88.4 | Confident | 80.3 | Confident | 132 Ų | 132 | 94.9 Ų | 94.9 | 62% | 0.617 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.6 | -42.8 | 175.6 | -64.7 | 77.5 | 3.3 | 0 | 0 | 111.6 | C240 K244 L245 V246 | C240-Q242 PolarHBondContact O-N 3.44Å; Q242-K244 VanDerWaalsContact C-N 3.34Å; Q242-K244 PolarHBondContact O-N 3.03Å; Q242-L245 PolarHBondContact O-N 3.41Å; Q242-V246 WeakPolarHBondContact O-CG2 3.38Å; Q242-V246 PolarHBondContact O-N 3.08Å |
| 243 | A | 84.2 | Confident | 78 | Confident | 3 Ų | 3 | 91 Ų | 91 | 3% | 0.025 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | I231 C240 T247 | I231-A243 HydrophobicContact CD1-CB 3.71Å; I231-A243 HydrophobicContact CG1-CB 3.86Å; I231-A243 HydrophobicContact CG2-CB 4.32Å; C240-A243 PolarHBondContact O-N 3.24Å; C240-A243 WeakPolarHBondContact SG-CB 3.45Å; C240-A243 PolarHBondContact SG-N 3.03Å; A243-T247 VanDerWaalsContact O-CB 3.3Å; A243-T247 WeakPolarHBondContact O-CB 3.42Å; A243-T247 PolarHBondContact O-N 3.16Å; A243-T247 PolarHBondContact O-OG1 2.79Å |
| 244 | K | 86.1 | Confident | 75.5 | Confident | 122 Ų | 122 | 89.5 Ų | 89.5 | 53% | 0.53 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.5 | -45.7 | 173.8 | -67.3 | 175.1 | -175.3 | 171.3 | 0 | 111.6 | R239 C240 N241 Q242 T247 S248 | R239-K244 WeakPolarHBondContact O-CE 3.49Å; C240-K244 PolarHBondContact O-N 3.34Å; C240-K244 VanDerWaalsContact O-N 3.1Å; N241-K244 PolarHBondContact O-N 2.96Å; Q242-K244 VanDerWaalsContact C-N 3.34Å; Q242-K244 PolarHBondContact O-N 3.03Å; K244-T247 PolarHBondContact O-N 2.92Å; K244-S248 WeakPolarHBondContact O-CB 3.38Å; K244-S248 PolarHBondContact O-N 3.5Å; K244-S248 PolarHBondContact O-OG 2.77Å; K244-S248 VanDerWaalsContact O-OG 3.04Å |
| 245 | L | 87.6 | Confident | 73.4 | Confident | 121 Ų | 121 | 88.8 Ų | 88.8 | 63% | 0.634 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.8 | -46.7 | -179.9 | -172.1 | 71.6 | 0 | 0 | 0 | 112.4 | N241 Q242 T247 S248 A249 | N241-L245 WeakPolarHBondContact O-CB 3.38Å; N241-L245 PolarHBondContact O-N 3.27Å; Q242-L245 PolarHBondContact O-N 3.41Å; L245-T247 VanDerWaalsContact C-N 3.32Å; L245-T247 PolarHBondContact O-N 3.07Å; L245-S248 WeakPolarHBondContact CA-OG 3.38Å; L245-S248 PolarHBondContact O-N 3.39Å; L245-S248 PolarHBondContact O-OG 3.31Å; L245-A249 WeakPolarHBondContact O-CB 3.31Å; L245-A249 PolarHBondContact O-N 3.35Å |
| 246 | V | 85.8 | Confident | 71.4 | Confident | 36 Ų | 36 | 88.5 Ų | 88.5 | 22% | 0.218 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -63.6 | -39.4 | 177.6 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | V224 A227 R228 I231 Q242 | V224-V246 HydrophobicContact CG1-CG1 4.32Å; A227-V246 HydrophobicContact CB-CG1 4.04Å; A227-V246 HydrophobicContact CB-CG2 4.47Å; R228-V246 HydrophobicContact CG-CG1 3.68Å; I231-V246 HydrophobicContact CD1-CB 4.14Å; I231-V246 HydrophobicContact CD1-CG1 4.05Å; Q242-V246 WeakPolarHBondContact O-CG2 3.38Å; Q242-V246 PolarHBondContact O-N 3.08Å |
| 247 | T | 83.1 | Confident | 69.1 | Low | 74 Ų | 74 | 95.6 Ų | 95.6 | 45% | 0.454 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.7 | -37.1 | 178 | -52.1 | 0 | 0 | 0 | 0 | 111.6 | A243 K244 L245 | A243-T247 VanDerWaalsContact O-CB 3.3Å; A243-T247 WeakPolarHBondContact O-CB 3.42Å; A243-T247 PolarHBondContact O-N 3.16Å; A243-T247 PolarHBondContact O-OG1 2.79Å; K244-T247 PolarHBondContact O-N 2.92Å; L245-T247 VanDerWaalsContact C-N 3.32Å; L245-T247 PolarHBondContact O-N 3.07Å |
| 248 | S | 80 | Confident | 66.9 | Low | 65 Ų | 65 | 96.5 Ų | 96.5 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -73.6 | -34.3 | 178.1 | 57.9 | 0 | 0 | 0 | 0 | 113.4 | K244 L245 A250 L251 | K244-S248 WeakPolarHBondContact O-CB 3.38Å; K244-S248 PolarHBondContact O-N 3.5Å; K244-S248 PolarHBondContact O-OG 2.77Å; K244-S248 VanDerWaalsContact O-OG 3.04Å; L245-S248 WeakPolarHBondContact CA-OG 3.38Å; L245-S248 PolarHBondContact O-N 3.39Å; L245-S248 PolarHBondContact O-OG 3.31Å; S248-A250 PolarHBondContact O-N 3.16Å; S248-L251 PolarHBondContact O-N 3.37Å; S248-L251 VanDerWaalsContact O-N 3.16Å |
| 249 | A | 71.9 | Confident | 64.6 | Low | 63 Ų | 63 | 103.6 Ų | 103.6 | 52% | 0.521 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -63.2 | -26 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L245 L251 A252 | L245-A249 WeakPolarHBondContact O-CB 3.31Å; L245-A249 PolarHBondContact O-N 3.35Å; A249-L251 VanDerWaalsContact C-N 3.3Å; A249-L251 PolarHBondContact O-N 3.08Å; A249-A252 PolarHBondContact O-N 3.2Å |
| 250 | A | 60.1 | Low | 62.4 | Low | 53 Ų | 53 | 102.7 Ų | 102.7 | 44% | 0.438 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.2 | -20.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114 | S248 A252 | S248-A250 PolarHBondContact O-N 3.16Å; A250-A252 VanDerWaalsContact C-N 3.34Å |
| 251 | L | 56.8 | Low | 59.6 | Low | 161 Ų | 161 | 106 Ų | 106 | 84% | 0.843 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -10.9 | 179.1 | -68.7 | 168.6 | 0 | 0 | 0 | 112.9 | S248 A249 | S248-L251 PolarHBondContact O-N 3.37Å; S248-L251 VanDerWaalsContact O-N 3.16Å; A249-L251 VanDerWaalsContact C-N 3.3Å; A249-L251 PolarHBondContact O-N 3.08Å |
| 252 | A | 53.4 | Low | 57 | Low | 95 Ų | 95 | 108.2 Ų | 108.2 | 79% | 0.785 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -95 | -5.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | A249 A250 | A249-A252 PolarHBondContact O-N 3.2Å; A250-A252 VanDerWaalsContact C-N 3.34Å |
| 253 | G | 38.9 | Very low | 54.3 | Low | 61 Ų | 61 | 110.8 Ų | 110.8 | 63% | 0.629 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -131.5 | 108.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 254 | G | 32.6 | Very low | 51.7 | Low | 72 Ų | 72 | 120.5 Ų | 120.5 | 74% | 0.742 | 69% | 0.689 | S | S | * | * | trans | -120.7 | 159.7 | 164 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 255 | P | 39.7 | Very low | 49.2 | Very low | 129 Ų | 129 | 120.9 Ų | 120.9 | 84% | 0.838 | 70% | 0.702 | S | S | * | * | cis | -122.4 | 162.1 | 30.2 | 37.9 | -24.8 | 0 | 0 | 0 | 116 | ||||
| 256 | A | 43.1 | Very low | 46.6 | Very low | 91 Ų | 91 | 120.7 Ų | 120.7 | 75% | 0.752 | 71% | 0.708 | S | S | * | * | trans | -52.6 | 144.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 257 | K | 36.2 | Very low | 43.8 | Very low | 210 Ų | 210 | 123 Ų | 123 | 91% | 0.913 | 73% | 0.73 | S | S | * | * | trans | -121.6 | 113.4 | 150.5 | -77.5 | -176 | 179.1 | 174.5 | 0 | 109.9 | ||||
| 258 | T | 39.4 | Very low | 41.1 | Very low | 121 Ų | 121 | 128.3 Ų | 128.3 | 74% | 0.742 | 75% | 0.752 | S | S | * | * | trans | -64.8 | 142.9 | 166.3 | 49.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 259 | H | 33.1 | Very low | 38.6 | Very low | 199 Ų | 199 | 130.6 Ų | 130.6 | 92% | 0.921 | 77% | 0.768 | S | S | * | * | trans | -137.8 | 128.8 | 147.1 | -113.5 | -91 | 0 | 0 | 0 | 110.7 | ||||
| 260 | K | 37.6 | Very low | 37.3 | Very low | 187 Ų | 187 | 133.5 Ų | 133.5 | 81% | 0.813 | 78% | 0.782 | S | S | * | * | trans | -98.4 | 138.8 | -177.4 | -89.3 | -168 | 176.1 | -176.6 | 0 | 111 | ||||
| 261 | V | 28.2 | Very low | 35.8 | Very low | 110 Ų | 110 | 135 Ų | 135 | 67% | 0.667 | 79% | 0.794 | S | S | * | * | 70.3 | 127.9 | 129.3 | -179.5 | 0 | 0 | 0 | 0 | 120.7 | K263 | V261-K263 HydrophobicContact CG1-CB 4.23Š| |||
| 262 | I | 31.6 | Very low | 34.5 | Very low | 167 Ų | 167 | 135.2 Ų | 135.2 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | -155.6 | 96.7 | 120.7 | -78.9 | 127.8 | 0 | 0 | 0 | 105.8 | |||||
| 263 | K | 30.5 | Very low | 33.3 | Very low | 186 Ų | 186 | 134.5 Ų | 134.5 | 81% | 0.809 | 80% | 0.797 | S | S | * | * | 59.2 | 103.6 | 87.9 | -156.7 | 178.7 | -172.1 | 177.8 | 0 | 115.1 | V261 | V261-K263 HydrophobicContact CG1-CB 4.23Š| |||
| 264 | K | 29.5 | Very low | 32.8 | Very low | 207 Ų | 207 | 140.1 Ų | 140.1 | 90% | 0.9 | 81% | 0.813 | S | S | * | * | trans | -164.5 | 110.7 | 133.8 | -119.8 | 170.5 | 179.7 | 173.8 | 0 | 112 | ||||
| 265 | T | 33.5 | Very low | 32.6 | Very low | 131 Ų | 131 | 140.3 Ų | 140.3 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -129.9 | 152.7 | 149.3 | 0.7 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 266 | P | 33.5 | Very low | 32.1 | Very low | 117 Ų | 117 | 139 Ų | 139 | 76% | 0.76 | 82% | 0.815 | S | S | * | * | -128.6 | 129.8 | 130 | 26.2 | -9.7 | 0 | 0 | 0 | 109.8 | |||||
| 267 | A | 27.1 | Very low | 31.5 | Very low | 83 Ų | 83 | 139.2 Ų | 139.2 | 69% | 0.686 | 82% | 0.817 | S | S | * | * | 88.2 | 137.7 | 99 | 0 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 268 | M | 25.8 | Very low | 31.2 | Very low | 187 Ų | 187 | 135.9 Ų | 135.9 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | cis | -162 | 157 | 14.2 | -103.7 | 148.2 | 77.7 | 0 | 0 | 108.2 | ||||
| 269 | S | 27.2 | Very low | 30.8 | Very low | 113 Ų | 113 | 136 Ų | 136 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -71.8 | -165.2 | 176.2 | -23.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 270 | P | 46.3 | Very low | 30.6 | Very low | 124 Ų | 124 | 134.8 Ų | 134.8 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | cis | -141.9 | -160.6 | -13 | 32.7 | -7.9 | 0 | 0 | 0 | 114.2 | ||||
| 271 | A | 28.3 | Very low | 30.2 | Very low | 84 Ų | 84 | 134 Ų | 134 | 69% | 0.694 | 79% | 0.794 | S | S | * | * | trans | 95.5 | 139.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 272 | D | 28.4 | Very low | 30.1 | Very low | 166 Ų | 166 | 137.5 Ų | 137.5 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | cis | -171.7 | 161.5 | -6.1 | -104.9 | -42 | 0 | 0 | 0 | 105.8 | ||||
| 273 | G | 29 | Very low | 30 | Very low | 79 Ų | 79 | 137.1 Ų | 137.1 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | trans | 121.5 | 113.1 | 146.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 274 | D | 27.5 | Very low | 29.9 | Very low | 179 Ų | 179 | 132 Ų | 132 | 96% | 0.957 | 80% | 0.797 | S | S | * | * | trans | -46 | 163.5 | 164.5 | -85.5 | -60.6 | 0 | 0 | 0 | 117.8 | ||||
| 275 | G | 28.9 | Very low | 29.8 | Very low | 77 Ų | 77 | 128.4 Ų | 128.4 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | 155.3 | 118.3 | 148.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 276 | A | 28.8 | Very low | 29.7 | Very low | 101 Ų | 101 | 129.6 Ų | 129.6 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -90.1 | 167.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 277 | A | 31.3 | Very low | 29.7 | Very low | 95 Ų | 95 | 129 Ų | 129 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | 81.8 | 112.4 | 140.6 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 278 | D | 30.7 | Very low | 29.8 | Very low | 141 Ų | 141 | 130.4 Ų | 130.4 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | 94 | 133.3 | 110.4 | -143.4 | -136.9 | 0 | 0 | 0 | 123.1 | |||||
| 279 | L | 30.5 | Very low | 30 | Very low | 124 Ų | 124 | 126.9 Ų | 126.9 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | trans | 75.1 | 121.4 | 151.5 | -71.9 | 165.7 | 0 | 0 | 0 | 125.8 | ||||
| 280 | K | 29.4 | Very low | 30.2 | Very low | 172 Ų | 172 | 126.8 Ų | 126.8 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | 77.3 | 116.6 | 126.8 | -89.9 | 177.2 | 174 | 166.5 | 0 | 123.3 | |||||
| 281 | K | 28 | Very low | 30 | Very low | 172 Ų | 172 | 126.7 Ų | 126.7 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | 78.9 | 121.3 | 110.1 | -155.8 | -174.7 | -170.1 | -166.1 | 0 | 120.1 | |||||
| 282 | E | 26.6 | Very low | 30.2 | Very low | 182 Ų | 182 | 131 Ų | 131 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | trans | 172 | 111.6 | 134.3 | -81.8 | -124.8 | 98.9 | 0 | 0 | 105.9 | ||||
| 283 | Q | 29.9 | Very low | 30.4 | Very low | 159 Ų | 159 | 129.8 Ų | 129.8 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | 51.1 | 113.8 | 67.6 | -153.8 | 104.9 | 41.1 | 0 | 0 | 115.1 | |||||
| 284 | G | 27 | Very low | 30.3 | Very low | 78 Ų | 78 | 132 Ų | 132 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -175 | 96.5 | 169 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 285 | D | 27.8 | Very low | 30.5 | Very low | 132 Ų | 132 | 128.4 Ų | 128.4 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | -62.9 | 159.7 | 176.7 | -88.4 | -69.9 | 0 | 0 | 0 | 114.5 | ||||
| 286 | L | 30.5 | Very low | 30.5 | Very low | 156 Ų | 156 | 127.7 Ų | 127.7 | 82% | 0.817 | 76% | 0.762 | S | S | * | * | 172.9 | 117.3 | 115.3 | -85 | 171.6 | 0 | 0 | 0 | 112.4 | |||||
| 287 | S | 33.9 | Very low | 30.7 | Very low | 106 Ų | 106 | 130.9 Ų | 130.9 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | 37.7 | 146.1 | 130.1 | -48.7 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 288 | S | 30.1 | Very low | 30.7 | Very low | 112 Ų | 112 | 135.6 Ų | 135.6 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | cis | -176.8 | 156.2 | 10.2 | 47.4 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 289 | S | 29.3 | Very low | 30.9 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 78% | 0.783 | 76% | 0.763 | S | S | * | * | 172.8 | 137.1 | 69.2 | 51.3 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 290 | S | 31.8 | Very low | 30.8 | Very low | 111 Ų | 111 | 133.5 Ų | 133.5 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | trans | -89.7 | 171.6 | 155.5 | -53.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 291 | P | 42.4 | Very low | 30.9 | Very low | 123 Ų | 123 | 130.6 Ų | 130.6 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | -142.5 | 151.5 | 81.5 | 30.4 | -10.1 | 0 | 0 | 0 | 112.6 | |||||
| 292 | K | 31.3 | Very low | 30.9 | Very low | 173 Ų | 173 | 126.7 Ų | 126.7 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | cis | 80.2 | 96.1 | 47.6 | -152.6 | 176.2 | -175.6 | -179.9 | 0 | 116.4 | ||||
| 293 | M | 33.6 | Very low | 31.1 | Very low | 142 Ų | 142 | 124 Ų | 124 | 70% | 0.7 | 77% | 0.767 | S | S | * | * | 62.1 | 148.8 | 127.6 | -60.8 | 178.5 | 44.7 | 0 | 0 | 123.1 | |||||
| 294 | S | 26.4 | Very low | 31.1 | Very low | 125 Ų | 125 | 122.6 Ų | 122.6 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | -157.3 | 151.1 | 124.6 | 58.7 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 295 | S | 32.3 | Very low | 31.5 | Very low | 103 Ų | 103 | 128 Ų | 128 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -131.2 | 172.1 | -162.8 | 48.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 296 | G | 29.1 | Very low | 31.9 | Very low | 62 Ų | 62 | 127.8 Ų | 127.8 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | trans | 120.1 | 111.8 | 152.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 297 | D | 33.3 | Very low | 32 | Very low | 169 Ų | 169 | 125 Ų | 125 | 90% | 0.904 | 77% | 0.77 | S | S | * | * | 89.6 | 128.3 | 62.7 | -87.2 | -49.9 | 0 | 0 | 0 | 114 | |||||
| 298 | K | 31.6 | Very low | 32.1 | Very low | 194 Ų | 194 | 125 Ų | 125 | 84% | 0.843 | 77% | 0.77 | S | S | * | * | 155.3 | 117.5 | 116.4 | -166.7 | 165.4 | -179.7 | -175.3 | 0 | 115.7 | |||||
| 299 | S | 33.3 | Very low | 32.4 | Very low | 93 Ų | 93 | 124.1 Ų | 124.1 | 65% | 0.65 | 77% | 0.769 | S | S | * | * | trans | 42.9 | 135.7 | 133.7 | -50.9 | 0 | 0 | 0 | 0 | 127.2 | ||||
| 300 | T | 30 | Very low | 32.5 | Very low | 127 Ų | 127 | 126.7 Ų | 126.7 | 78% | 0.779 | 77% | 0.774 | S | S | * | * | 86.6 | 127.9 | 128.8 | 49.3 | 0 | 0 | 0 | 0 | 125.1 | |||||
| 301 | S | 30 | Very low | 32.8 | Very low | 111 Ų | 111 | 125.6 Ų | 125.6 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | 83.2 | 118.1 | 136.3 | 68 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 302 | A | 29.2 | Very low | 33.1 | Very low | 90 Ų | 90 | 125.4 Ų | 125.4 | 74% | 0.744 | 77% | 0.771 | S | S | * | * | 75.3 | 125.2 | 122.7 | 0 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 303 | V | 29.5 | Very low | 34.4 | Very low | 127 Ų | 127 | 122.7 Ų | 122.7 | 77% | 0.77 | 77% | 0.771 | S | S | * | * | trans | 89.9 | 142.7 | 134.9 | 172.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 304 | T | 30.5 | Very low | 35.3 | Very low | 129 Ų | 129 | 122.1 Ų | 122.1 | 79% | 0.791 | 78% | 0.778 | S | S | * | * | trans | 87.6 | 108 | 159.8 | 34.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 305 | K | 35.9 | Very low | 36.3 | Very low | 191 Ų | 191 | 122 Ų | 122 | 83% | 0.83 | 78% | 0.777 | S | S | * | * | trans | -58.4 | 152.1 | 143 | -143.2 | 176.4 | -173 | 179.5 | 0 | 109.3 | ||||
| 306 | P | 36.3 | Very low | 37.4 | Very low | 127 Ų | 127 | 125.1 Ų | 125.1 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | -140.2 | 171.8 | 103.3 | 34.8 | -19.2 | 0 | 0 | 0 | 114.2 | |||||
| 307 | S | 31.9 | Very low | 39.1 | Very low | 99 Ų | 99 | 127.5 Ų | 127.5 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | trans | -90.6 | 154.9 | -175.8 | -178.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 308 | S | 36.1 | Very low | 40.6 | Very low | 106 Ų | 106 | 125.1 Ų | 125.1 | 74% | 0.741 | 78% | 0.782 | S | S | * | * | 125 | 119.9 | 130 | -47.2 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 309 | A | 36.9 | Very low | 42.1 | Very low | 93 Ų | 93 | 121.3 Ų | 121.3 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | 73.8 | 123.5 | 133.2 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 310 | D | 31.9 | Very low | 43.4 | Very low | 165 Ų | 165 | 122.3 Ų | 122.3 | 88% | 0.882 | 78% | 0.782 | S | S | * | * | 116.6 | 141.9 | 128.3 | -124.5 | -55.7 | 0 | 0 | 0 | 119 | |||||
| 311 | A | 36.9 | Very low | 44.7 | Very low | 88 Ų | 88 | 122.3 Ų | 122.3 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | 98 | 142.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 312 | P | 50.1 | Low | 45.2 | Very low | 120 Ų | 120 | 126.1 Ų | 126.1 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -111.4 | 177 | -130 | 19.5 | 2.3 | 0 | 0 | 0 | 115.9 | ||||
| 313 | P | 57.1 | Low | 45.8 | Very low | 116 Ų | 116 | 127.6 Ų | 127.6 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 153.9 | -175.7 | 32.8 | -35.2 | 0 | 0 | 0 | 113.8 | ||
| 314 | P | 53.4 | Low | 46.2 | Very low | 130 Ų | 130 | 126.5 Ų | 126.5 | 84% | 0.844 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 142.4 | 177.1 | 30.4 | -32.6 | 0 | 0 | 0 | 112.9 | ||
| 315 | S | 46.8 | Very low | 46.7 | Very low | 121 Ų | 121 | 125.2 Ų | 125.2 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 140.4 | -172 | -24.4 | 0 | 0 | 0 | 0 | 114.5 | ||
| 316 | L | 55.2 | Low | 46.6 | Very low | 169 Ų | 169 | 122.7 Ų | 122.7 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 147.6 | 167.3 | -75.6 | 160.2 | 0 | 0 | 0 | 111.2 | ||
| 317 | P | 64.4 | Low | 46.7 | Very low | 112 Ų | 112 | 121.2 Ų | 121.2 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 156.8 | 171.9 | 31.6 | -32.3 | 0 | 0 | 0 | 112.4 | ||
| 318 | P | 65.2 | Low | 47 | Very low | 119 Ų | 119 | 122.4 Ų | 122.4 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 155.5 | -170.2 | 31 | -35.1 | 0 | 0 | 0 | 113.9 | ||
| 319 | P | 63.1 | Low | 47 | Very low | 115 Ų | 115 | 121.6 Ų | 121.6 | 75% | 0.747 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -81 | 152.7 | 175.1 | 32.8 | -33.6 | 0 | 0 | 0 | 112.6 | ||
| 320 | P | 61.9 | Low | 46.9 | Very low | 114 Ų | 114 | 122.4 Ų | 122.4 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 154.8 | 172.6 | 30.7 | -33.2 | 0 | 0 | 0 | 112.1 | ||
| 321 | P | 57.2 | Low | 47.1 | Very low | 127 Ų | 127 | 122 Ų | 122 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 146.7 | -167.4 | 29.9 | -34.3 | 0 | 0 | 0 | 113.9 | ||
| 322 | H | 39.1 | Very low | 47.2 | Very low | 190 Ų | 190 | 125.9 Ų | 125.9 | 88% | 0.88 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 134.2 | 167.9 | -68.8 | -98.7 | 0 | 0 | 0 | 111.1 | ||
| 323 | S | 42.2 | Very low | 47.1 | Very low | 122 Ų | 122 | 125.7 Ų | 125.7 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | -110.5 | 107.6 | 158.5 | 56.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 324 | S | 37 | Very low | 46.4 | Very low | 104 Ų | 104 | 124.8 Ų | 124.8 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -89.8 | 116.7 | 171.3 | 47.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 325 | S | 41.2 | Very low | 45.7 | Very low | 102 Ų | 102 | 124.9 Ų | 124.9 | 71% | 0.713 | 79% | 0.787 | S | S | * | * | trans | 31.8 | 134.2 | 133.1 | 58.2 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 326 | T | 35.5 | Very low | 45.3 | Very low | 138 Ų | 138 | 124 Ų | 124 | 85% | 0.847 | 78% | 0.78 | S | S | * | * | trans | 177.1 | 138.8 | 136.7 | 22.6 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 327 | S | 37.9 | Very low | 44.6 | Very low | 96 Ų | 96 | 124.7 Ų | 124.7 | 67% | 0.671 | 78% | 0.779 | S | S | * | * | cis | -170.1 | 152.9 | 13.9 | -67.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 328 | S | 37.6 | Very low | 43.7 | Very low | 123 Ų | 123 | 128.7 Ų | 128.7 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 60.5 | 150 | 141.7 | -51.8 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 329 | A | 36.5 | Very low | 43.2 | Very low | 90 Ų | 90 | 128.3 Ų | 128.3 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | cis | -159.3 | 156.1 | 14.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 330 | S | 35 | Very low | 42.2 | Very low | 110 Ų | 110 | 133.6 Ų | 133.6 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | 59.5 | 117.9 | 136 | -66 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 331 | M | 35.6 | Very low | 41.9 | Very low | 155 Ų | 155 | 137.3 Ų | 137.3 | 76% | 0.764 | 81% | 0.813 | S | S | * | * | 63 | 106 | 118.9 | -59.5 | -92.2 | 98.2 | 0 | 0 | 122.5 | |||||
| 332 | Q | 39 | Very low | 41.1 | Very low | 171 Ų | 171 | 137.9 Ų | 137.9 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | trans | 56.6 | 171.3 | 133.6 | -59 | -147.8 | -19.4 | 0 | 0 | 122 | ||||
| 333 | P | 48 | Very low | 41.2 | Very low | 116 Ų | 116 | 135.1 Ų | 135.1 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | -125.9 | 172.7 | -59.4 | 36.6 | -20.9 | 0 | 0 | 0 | 112.7 | |||||
| 334 | A | 42 | Very low | 41.2 | Very low | 96 Ų | 96 | 135.8 Ų | 135.8 | 79% | 0.793 | 81% | 0.806 | S | S | * | * | trans | -87.5 | 134 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 335 | V | 39.3 | Very low | 41.4 | Very low | 133 Ų | 133 | 137.7 Ų | 137.7 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | trans | -153.3 | 124.7 | 151.6 | -175 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 336 | S | 39.4 | Very low | 41.4 | Very low | 102 Ų | 102 | 139.9 Ų | 139.9 | 71% | 0.713 | 82% | 0.817 | S | S | * | * | trans | 50.3 | 122 | 149.2 | -56.7 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 337 | Q | 39.4 | Very low | 41.8 | Very low | 183 Ų | 183 | 140.1 Ų | 140.1 | 86% | 0.855 | 82% | 0.815 | S | S | * | * | -179.5 | 117.2 | 111.1 | -99.9 | 174.5 | 54.6 | 0 | 0 | 109.7 | |||||
| 338 | Q | 45.1 | Very low | 42.1 | Very low | 197 Ų | 197 | 143.2 Ų | 143.2 | 92% | 0.921 | 83% | 0.825 | S | S | * | * | trans | -151.4 | 117.2 | 138.1 | -155.3 | 131.9 | 8.1 | 0 | 0 | 110.5 | ||||
| 339 | V | 54.6 | Low | 42.5 | Very low | 111 Ų | 111 | 144.8 Ų | 144.8 | 67% | 0.673 | 82% | 0.822 | S | S | * | * | trans | -100.6 | 152.8 | 176.5 | 155.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 340 | R | 41.8 | Very low | 43 | Very low | 226 Ų | 226 | 149.3 Ų | 149.3 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | 86.7 | 159 | 158.3 | -85.4 | 159.1 | -166 | -127.3 | 5.4 | 117.9 | ||||
| 341 | P | 56.3 | Low | 43.7 | Very low | 192 Ų | 192 | 152.9 Ų | 152.9 | 100% | 1.247 | 83% | 0.834 | S | S | * | * | cis | -122.5 | 0 | -44.5 | 26.3 | -8.8 | 0 | 0 | 0 | 112.4 |
Retrieved 341 of 341 residues in 267 ms
(Link to these results)