| 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 | 44.7 | Very low | 39.6 | Very low | 233 Ų | 233 | 122.6 Ų | 122.6 | 100% | 1.148 | 86% | 0.857 | S | S | * | * | 0 | 100.6 | 0 | -166.4 | 176.2 | -83.7 | 0 | 0 | 106.8 | |||||
| 2 | K | 34.8 | Very low | 40 | Very low | 200 Ų | 200 | 129 Ų | 129 | 87% | 0.87 | 86% | 0.863 | S | S | * | * | trans | -90 | 106 | -179.3 | -85.6 | 174.5 | 172.1 | 171.5 | 0 | 107.4 | L4 | K2-L4 PolarHBondContact O-N 3.01Š| ||
| 3 | C | 50.6 | Low | 40.6 | Very low | 112 Ų | 112 | 127.5 Ų | 127.5 | 76% | 0.757 | 85% | 0.854 | S | S | * | * | trans | -83.9 | 102.9 | 167.3 | -65.9 | 0 | 0 | 0 | 0 | 107 | S5 | C3-S5 PolarHBondContact O-N 2.75Å; C3-S5 VanDerWaalsContact O-N 3.12Å | ||
| 4 | L | 44.6 | Very low | 40.9 | Very low | 161 Ų | 161 | 130.9 Ų | 130.9 | 84% | 0.843 | 85% | 0.852 | S | S | * | * | trans | -68.6 | 102.3 | 172.7 | -69.7 | 166.1 | 0 | 0 | 0 | 107.8 | K2 S6 | K2-L4 PolarHBondContact O-N 3.01Å; L4-S6 PolarHBondContact O-N 3.02Å; L4-S6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | S | 43.6 | Very low | 41.4 | Very low | 127 Ų | 127 | 134.8 Ų | 134.8 | 89% | 0.888 | 85% | 0.854 | S | S | * | * | trans | -70.7 | 98.1 | 162 | -62.4 | 0 | 0 | 0 | 0 | 107.7 | C3 | C3-S5 PolarHBondContact O-N 2.75Å; C3-S5 VanDerWaalsContact O-N 3.12Å | ||
| 6 | S | 42.5 | Very low | 42.2 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 83% | 0.832 | 84% | 0.844 | S | S | * | * | trans | -149.6 | 128.1 | 167.6 | -169.5 | 0 | 0 | 0 | 0 | 109.6 | L4 | L4-S6 PolarHBondContact O-N 3.02Å; L4-S6 VanDerWaalsContact O-N 3.15Å | ||
| 7 | G | 35.7 | Very low | 42.9 | Very low | 74 Ų | 74 | 136.9 Ų | 136.9 | 76% | 0.763 | 84% | 0.843 | S | S | * | * | trans | 116.6 | 82.4 | 156.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 8 | G | 32.5 | Very low | 43.9 | Very low | 88 Ų | 88 | 139.9 Ų | 139.9 | 91% | 0.907 | 85% | 0.846 | S | S | * | * | 72.6 | 113.8 | 113.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 9 | G | 34.2 | Very low | 45.1 | Very low | 79 Ų | 79 | 140.7 Ų | 140.7 | 81% | 0.814 | 84% | 0.839 | S | S | * | * | trans | -176.3 | 91.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110 | G11 | G9-G11 PolarHBondContact O-N 2.75Š| ||
| 10 | G | 32.4 | Very low | 46.6 | Very low | 91 Ų | 91 | 142.2 Ų | 142.2 | 94% | 0.938 | 84% | 0.837 | S | S | * | * | trans | -56.6 | 115.1 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 11 | G | 40.1 | Very low | 48.3 | Very low | 65 Ų | 65 | 141.1 Ų | 141.1 | 67% | 0.67 | 83% | 0.826 | S | S | * | * | trans | -120 | 124.5 | 138.7 | 0 | 0 | 0 | 0 | 0 | 104.6 | G9 C13 | G9-G11 PolarHBondContact O-N 2.75Å; G11-C13 PolarHBondContact O-N 2.87Å | ||
| 12 | E | 44.6 | Very low | 50.4 | Low | 199 Ų | 199 | 133.7 Ų | 133.7 | 93% | 0.93 | 79% | 0.792 | S | S | * | * | trans | -63.4 | 78 | 165.4 | -62.8 | 167.3 | 153.9 | 0 | 0 | 106.1 | E14 | E12-E14 PolarHBondContact O-N 2.74Š| ||
| 13 | C | 47 | Very low | 53.1 | Low | 110 Ų | 110 | 128 Ų | 128 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | trans | -62.5 | 102.8 | 157.6 | -124.3 | 0 | 0 | 0 | 0 | 102.4 | G11 E15 | G11-C13 PolarHBondContact O-N 2.87Å; C13-E15 PolarHBondContact O-N 2.95Å | ||
| 14 | E | 45.1 | Very low | 55.1 | Low | 175 Ų | 175 | 127.9 Ų | 127.9 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | -44.6 | 116.3 | 162.1 | -74.1 | -167.9 | 136.8 | 0 | 0 | 105.5 | E12 H16 | E12-E14 PolarHBondContact O-N 2.74Å; E14-H16 VanDerWaalsContact C-N 3.29Å; E14-H16 PolarHBondContact O-N 2.88Å | ||
| 15 | E | 48.7 | Very low | 57.4 | Low | 189 Ų | 189 | 126.3 Ų | 126.3 | 88% | 0.883 | 75% | 0.754 | S | S | * | * | trans | -50.4 | 105.6 | 171.7 | -79.2 | 176 | 150.3 | 0 | 0 | 104.9 | C13 D17 | C13-E15 PolarHBondContact O-N 2.95Å; E15-D17 PolarHBondContact O-N 3.12Å; E15-D17 VanDerWaalsContact O-N 3.1Å | ||
| 16 | H | 54 | Low | 59.8 | Low | 152 Ų | 152 | 124.6 Ų | 124.6 | 70% | 0.704 | 73% | 0.734 | S | S | * | * | trans | -50.6 | 126.3 | 169.4 | -78.7 | -70.6 | 0 | 0 | 0 | 105.1 | E14 E18 | E14-H16 VanDerWaalsContact C-N 3.29Å; E14-H16 PolarHBondContact O-N 2.88Å; H16-E18 PolarHBondContact O-N 2.92Å | ||
| 17 | D | 53.8 | Low | 62.3 | Low | 153 Ų | 153 | 125.9 Ų | 125.9 | 82% | 0.818 | 73% | 0.727 | S | S | * | * | trans | -42.6 | 101.7 | 165.2 | -102.9 | -35.4 | 0 | 0 | 0 | 105.9 | E15 Q19 | E15-D17 PolarHBondContact O-N 3.12Å; E15-D17 VanDerWaalsContact O-N 3.1Å; D17-Q19 PolarHBondContact O-N 2.9Å | ||
| 18 | E | 60.8 | Low | 65.2 | Low | 192 Ų | 192 | 128.3 Ų | 128.3 | 90% | 0.897 | 72% | 0.717 | S | S | * | * | trans | -71.4 | 60.6 | 168.9 | -73.3 | -170.8 | 163.8 | 0 | 0 | 105.5 | H16 E20 | H16-E18 PolarHBondContact O-N 2.92Å; E18-E20 VanDerWaalsContact C-N 3.28Å; E18-E20 PolarHBondContact O-N 3.35Å | ||
| 19 | Q | 66.6 | Low | 68.1 | Low | 155 Ų | 155 | 128.6 Ų | 128.6 | 72% | 0.724 | 69% | 0.693 | S | S | * | * | trans | -67.3 | 100.2 | 173.9 | -170.9 | 162.4 | 66.8 | 0 | 0 | 104.9 | D17 I21 | D17-Q19 PolarHBondContact O-N 2.9Å; Q19-I21 PolarHBondContact O-N 2.92Å; Q19-I21 VanDerWaalsContact O-N 3.16Å | ||
| 20 | E | 76.5 | Confident | 71.1 | Confident | 169 Ų | 169 | 128 Ų | 128 | 79% | 0.79 | 67% | 0.674 | S | S | * | * | trans | -48.2 | 124.6 | 176.8 | -173.6 | 179.9 | -177.7 | 0 | 0 | 108.5 | E18 N22 | E18-E20 VanDerWaalsContact C-N 3.28Å; E18-E20 PolarHBondContact O-N 3.35Å; E20-N22 VanDerWaalsContact C-N 3.34Å; E20-N22 PolarHBondContact O-N 3.05Å | ||
| 21 | I | 80.7 | Confident | 74.1 | Confident | 120 Ų | 120 | 130.4 Ų | 130.4 | 62% | 0.615 | 66% | 0.658 | S | S | * | * | trans | -66 | 98.8 | 177.2 | -61.5 | 176.8 | 0 | 0 | 0 | 107.4 | Q19 Y25 L26 | Q19-I21 PolarHBondContact O-N 2.92Å; Q19-I21 VanDerWaalsContact O-N 3.16Å; I21-Y25 HydrophobicContact CG2-CD1 4.03Å; I21-L26 HydrophobicContact CG2-CD1 4.31Å; I21-L26 HydrophobicContact CG2-CD2 3.77Å; I21-L26 HydrophobicContact CG2-CG 3.81Å | ||
| 22 | N | 88.8 | Confident | 76.8 | Confident | 78 Ų | 78 | 133 Ų | 133 | 42% | 0.417 | 66% | 0.655 | S | S | . | * | trans | -88.3 | 168 | 178.6 | 70.3 | 29.5 | 0 | 0 | 0 | 111.9 | E20 E24 Y25 L26 | E20-N22 VanDerWaalsContact C-N 3.34Å; E20-N22 PolarHBondContact O-N 3.05Å; N22-E24 VanDerWaalsContact C-N 3.27Å; N22-E24 PolarHBondContact O-N 3.44Å; N22-E24 WeakPolarHBondContact OD1-CB 3.28Å; N22-E24 PolarHBondContact OD1-N 3.19Å; N22-Y25 PolarHBondContact O-N 2.91Å; N22-Y25 PolarHBondContact OD1-N 2.87Å; N22-L26 PolarHBondContact O-N 3.11Å | ||
| 23 | A | 92.1 | Very high | 79.1 | Confident | 81 Ų | 81 | 127.9 Ų | 127.9 | 67% | 0.669 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -61 | -34.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L26 E27 | A23-L26 PolarHBondContact O-N 2.95Å; A23-E27 PolarHBondContact O-N 2.89Å |
| 24 | E | 93.7 | Very high | 81.5 | Confident | 108 Ų | 108 | 129.2 Ų | 129.2 | 51% | 0.505 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -65.2 | -41.1 | 178.8 | -169.8 | -167 | 154.5 | 0 | 0 | 111.6 | N22 E27 K28 | N22-E24 VanDerWaalsContact C-N 3.27Å; N22-E24 PolarHBondContact O-N 3.44Å; N22-E24 WeakPolarHBondContact OD1-CB 3.28Å; N22-E24 PolarHBondContact OD1-N 3.19Å; E24-E27 PolarHBondContact O-N 3.32Å; E24-K28 HydrophobicContact CG-CD 4.48Å; E24-K28 WeakPolarHBondContact O-CG 3.09Å; E24-K28 PolarHBondContact O-N 3.48Å; E24-K28 VanDerWaalsContact OE1-CE 3.3Å; E24-K28 WeakPolarHBondContact OE1-CE 3.33Å; E24-K28 IonicContact OE1-NZ 2.63Å; E24-K28 PolarHBondContact OE1-NZ 2.85Å |
| 25 | Y | 93 | Very high | 83.8 | Confident | 129 Ų | 129 | 124.3 Ų | 124.3 | 51% | 0.506 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -62.1 | -45.1 | 174.6 | -178.1 | -90.9 | 0 | 0 | 0 | 111.2 | I21 N22 E27 K28 F29 | I21-Y25 HydrophobicContact CG2-CD1 4.03Å; N22-Y25 PolarHBondContact O-N 2.91Å; N22-Y25 PolarHBondContact OD1-N 2.87Å; Y25-E27 VanDerWaalsContact C-N 3.32Å; Y25-E27 PolarHBondContact O-N 3.24Å; Y25-K28 PolarHBondContact O-N 2.84Å; Y25-F29 WeakPolarHBondContact O-CB 3.37Å; Y25-F29 PolarHBondContact O-N 3.05Å |
| 26 | L | 93.6 | Very high | 85.9 | Confident | 91 Ų | 91 | 117.9 Ų | 117.9 | 48% | 0.476 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63 | -37.7 | 177.4 | -69 | 176.3 | 0 | 0 | 0 | 112.4 | I21 N22 A23 T30 | I21-L26 HydrophobicContact CG2-CD1 4.31Å; I21-L26 HydrophobicContact CG2-CD2 3.77Å; I21-L26 HydrophobicContact CG2-CG 3.81Å; N22-L26 PolarHBondContact O-N 3.11Å; A23-L26 PolarHBondContact O-N 2.95Å; L26-T30 VanDerWaalsContact O-CB 3.31Å; L26-T30 WeakPolarHBondContact O-CB 3.44Å; L26-T30 PolarHBondContact O-N 3.13Å; L26-T30 PolarHBondContact O-OG1 3.18Å |
| 27 | E | 95.5 | Very high | 87.8 | Confident | 145 Ų | 145 | 113.8 Ų | 113.8 | 68% | 0.678 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.3 | -47.2 | 174.8 | -172.8 | -179.8 | -179.4 | 0 | 0 | 111.3 | A23 E24 Y25 F29 T30 K31 | A23-E27 PolarHBondContact O-N 2.89Å; E24-E27 PolarHBondContact O-N 3.32Å; Y25-E27 VanDerWaalsContact C-N 3.32Å; Y25-E27 PolarHBondContact O-N 3.24Å; E27-F29 PolarHBondContact O-N 2.84Å; E27-T30 PolarHBondContact O-N 3.48Å; E27-K31 PolarHBondContact O-N 2.97Å |
| 28 | K | 95.7 | Very high | 89.7 | Confident | 125 Ų | 125 | 111.3 Ų | 111.3 | 54% | 0.543 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -59.3 | -46.8 | 176 | -76 | 169.7 | 172.2 | 168.3 | 0 | 111.6 | E24 Y25 K31 M32 | E24-K28 HydrophobicContact CG-CD 4.48Å; E24-K28 WeakPolarHBondContact O-CG 3.09Å; E24-K28 PolarHBondContact O-N 3.48Å; E24-K28 VanDerWaalsContact OE1-CE 3.3Å; E24-K28 WeakPolarHBondContact OE1-CE 3.33Å; E24-K28 IonicContact OE1-NZ 2.63Å; E24-K28 PolarHBondContact OE1-NZ 2.85Å; Y25-K28 PolarHBondContact O-N 2.84Å; K28-K31 PolarHBondContact O-N 3.32Å; K28-M32 PolarHBondContact O-N 2.98Å |
| 29 | F | 93.7 | Very high | 91.2 | Very high | 95 Ų | 95 | 106.7 Ų | 106.7 | 42% | 0.417 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.1 | -47.7 | 176.4 | 179.8 | -102.6 | 0 | 0 | 0 | 111.3 | Y25 E27 K31 M32 I33 | Y25-F29 WeakPolarHBondContact O-CB 3.37Å; Y25-F29 PolarHBondContact O-N 3.05Å; E27-F29 PolarHBondContact O-N 2.84Å; F29-K31 VanDerWaalsContact C-N 3.31Å; F29-K31 PolarHBondContact O-N 3.01Å; F29-M32 VanDerWaalsContact O-CB 3.3Å; F29-M32 WeakPolarHBondContact O-CB 3.39Å; F29-M32 PolarHBondContact O-N 3.27Å; F29-M32 VanDerWaalsContact O-N 3.09Å; F29-I33 HydrophobicContact CD1-CG1 4.22Å; F29-I33 HydrophobicContact CE1-CD1 4.32Å; F29-I33 HydrophobicContact CE1-CG1 3.81Å; F29-I33 HydrophobicContact CE2-CD1 4.11Å; F29-I33 HydrophobicContact CE2-CG1 4.23Å; F29-I33 HydrophobicContact CZ-CD1 3.81Å; F29-I33 HydrophobicContact CZ-CG1 3.81Å; F29-I33 WeakPolarHBondContact O-CG1 3.47Å; F29-I33 PolarHBondContact O-N 3.26Å |
| 30 | T | 95.8 | Very high | 92.4 | Very high | 66 Ų | 66 | 100.9 Ų | 100.9 | 41% | 0.405 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.8 | -42.6 | 178 | -61.2 | 0 | 0 | 0 | 0 | 111.8 | L26 E27 M32 I33 K34 | L26-T30 VanDerWaalsContact O-CB 3.31Å; L26-T30 WeakPolarHBondContact O-CB 3.44Å; L26-T30 PolarHBondContact O-N 3.13Å; L26-T30 PolarHBondContact O-OG1 3.18Å; E27-T30 PolarHBondContact O-N 3.48Å; T30-M32 VanDerWaalsContact C-N 3.34Å; T30-I33 PolarHBondContact O-N 3.41Å; T30-K34 HydrophobicContact CG2-CD 4.47Å; T30-K34 WeakPolarHBondContact O-CG 3.4Å; T30-K34 PolarHBondContact O-N 3.16Å |
| 31 | K | 96.8 | Very high | 93 | Very high | 142 Ų | 142 | 99.2 Ų | 99.2 | 62% | 0.617 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.7 | -40.6 | 176.2 | -170.9 | 176.1 | -177.1 | 177.9 | 0 | 111.7 | E27 K28 F29 K34 N35 | E27-K31 PolarHBondContact O-N 2.97Å; K28-K31 PolarHBondContact O-N 3.32Å; F29-K31 VanDerWaalsContact C-N 3.31Å; F29-K31 PolarHBondContact O-N 3.01Å; K31-K34 PolarHBondContact O-N 2.87Å; K31-N35 WeakPolarHBondContact O-CB 3.45Å; K31-N35 VanDerWaalsContact O-CG 3.27Å; K31-N35 PolarHBondContact O-N 3.26Å; K31-N35 PolarHBondContact O-ND2 2.98Å |
| 32 | M | 96.1 | Very high | 93.6 | Very high | 120 Ų | 120 | 101.7 Ų | 101.7 | 59% | 0.591 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.6 | -47.2 | 175 | -169.1 | -168 | -50.8 | 0 | 0 | 111.6 | K28 F29 T30 K34 N35 A36 | K28-M32 PolarHBondContact O-N 2.98Å; F29-M32 VanDerWaalsContact O-CB 3.3Å; F29-M32 WeakPolarHBondContact O-CB 3.39Å; F29-M32 PolarHBondContact O-N 3.27Å; F29-M32 VanDerWaalsContact O-N 3.09Å; T30-M32 VanDerWaalsContact C-N 3.34Å; M32-K34 PolarHBondContact O-N 3.41Å; M32-N35 PolarHBondContact O-N 3.42Å; M32-A36 PolarHBondContact O-N 3.28Å |
| 33 | I | 94.1 | Very high | 93.8 | Very high | 91 Ų | 91 | 101.1 Ų | 101.1 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 178.2 | -63.1 | -59.3 | 0 | 0 | 0 | 111.6 | F29 T30 N35 A36 S37 | F29-I33 HydrophobicContact CD1-CG1 4.22Å; F29-I33 HydrophobicContact CE1-CD1 4.32Å; F29-I33 HydrophobicContact CE1-CG1 3.81Å; F29-I33 HydrophobicContact CE2-CD1 4.11Å; F29-I33 HydrophobicContact CE2-CG1 4.23Å; F29-I33 HydrophobicContact CZ-CD1 3.81Å; F29-I33 HydrophobicContact CZ-CG1 3.81Å; F29-I33 WeakPolarHBondContact O-CG1 3.47Å; F29-I33 PolarHBondContact O-N 3.26Å; T30-I33 PolarHBondContact O-N 3.41Å; I33-N35 VanDerWaalsContact C-N 3.34Å; I33-N35 PolarHBondContact O-N 3Å; I33-A36 PolarHBondContact O-N 3.44Å; I33-S37 WeakPolarHBondContact O-CB 3.37Å; I33-S37 PolarHBondContact O-N 3.29Å |
| 34 | K | 95.6 | Very high | 94 | Very high | 137 Ų | 137 | 100 Ų | 100 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.6 | -43.5 | 175.6 | -74.8 | 179.5 | 177.9 | 178 | 0 | 112 | T30 K31 M32 S37 M38 | T30-K34 HydrophobicContact CG2-CD 4.47Å; T30-K34 WeakPolarHBondContact O-CG 3.4Å; T30-K34 PolarHBondContact O-N 3.16Å; K31-K34 PolarHBondContact O-N 2.87Å; M32-K34 PolarHBondContact O-N 3.41Å; K34-S37 WeakPolarHBondContact O-CB 3.25Å; K34-S37 PolarHBondContact O-N 3.27Å; K34-M38 WeakPolarHBondContact O-CG 3.5Å; K34-M38 PolarHBondContact O-N 3.48Å |
| 35 | N | 94.9 | Very high | 93.9 | Very high | 73 Ų | 73 | 99.7 Ų | 99.7 | 39% | 0.39 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 176.7 | -72.2 | -17 | 0 | 0 | 0 | 111.7 | K31 M32 I33 S37 M38 L39 | K31-N35 WeakPolarHBondContact O-CB 3.45Å; K31-N35 VanDerWaalsContact O-CG 3.27Å; K31-N35 PolarHBondContact O-N 3.26Å; K31-N35 PolarHBondContact O-ND2 2.98Å; M32-N35 PolarHBondContact O-N 3.42Å; I33-N35 VanDerWaalsContact C-N 3.34Å; I33-N35 PolarHBondContact O-N 3Å; N35-S37 VanDerWaalsContact C-N 3.31Å; N35-S37 PolarHBondContact O-N 3.45Å; N35-M38 PolarHBondContact O-N 3.18Å; N35-M38 VanDerWaalsContact OD1-CE 3.25Å; N35-M38 WeakPolarHBondContact OD1-CE 3.45Å; N35-L39 WeakPolarHBondContact O-CG 3.28Å; N35-L39 PolarHBondContact O-N 2.99Å |
| 36 | A | 93 | Very high | 93.9 | Very high | 54 Ų | 54 | 99.5 Ų | 99.5 | 45% | 0.446 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | M32 I33 L39 A40 | M32-A36 PolarHBondContact O-N 3.28Å; I33-A36 PolarHBondContact O-N 3.44Å; A36-L39 PolarHBondContact O-N 3.43Å; A36-A40 WeakPolarHBondContact O-CB 3.38Å; A36-A40 PolarHBondContact O-N 2.93Å |
| 37 | S | 93 | Very high | 93.9 | Very high | 66 Ų | 66 | 99.3 Ų | 99.3 | 46% | 0.462 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 175.3 | -179.1 | 0 | 0 | 0 | 0 | 112.4 | I33 K34 N35 L39 A40 N41 | I33-S37 WeakPolarHBondContact O-CB 3.37Å; I33-S37 PolarHBondContact O-N 3.29Å; K34-S37 WeakPolarHBondContact O-CB 3.25Å; K34-S37 PolarHBondContact O-N 3.27Å; N35-S37 VanDerWaalsContact C-N 3.31Å; N35-S37 PolarHBondContact O-N 3.45Å; S37-L39 VanDerWaalsContact C-N 3.31Å; S37-L39 PolarHBondContact O-N 3.48Å; S37-A40 PolarHBondContact O-N 2.91Å; S37-N41 PolarHBondContact O-N 2.74Å; S37-N41 VanDerWaalsContact O-N 3.16Å; S37-N41 PolarHBondContact O-ND2 3.25Å |
| 38 | M | 93.3 | Very high | 93.8 | Very high | 100 Ų | 100 | 95.2 Ų | 95.2 | 49% | 0.493 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -37.8 | 176 | -71.3 | -170.6 | -66 | 0 | 0 | 112.5 | K34 N35 | K34-M38 WeakPolarHBondContact O-CG 3.5Å; K34-M38 PolarHBondContact O-N 3.48Å; N35-M38 PolarHBondContact O-N 3.18Å; N35-M38 VanDerWaalsContact OD1-CE 3.25Å; N35-M38 WeakPolarHBondContact OD1-CE 3.45Å |
| 39 | L | 92.4 | Very high | 93.7 | Very high | 95 Ų | 95 | 94 Ų | 94 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.1 | -41.4 | 175.6 | -70.1 | 173.1 | 0 | 0 | 0 | 111.6 | N35 A36 S37 N41 R42 L43 | N35-L39 WeakPolarHBondContact O-CG 3.28Å; N35-L39 PolarHBondContact O-N 2.99Å; A36-L39 PolarHBondContact O-N 3.43Å; S37-L39 VanDerWaalsContact C-N 3.31Å; S37-L39 PolarHBondContact O-N 3.48Å; L39-N41 VanDerWaalsContact C-N 3.26Å; L39-N41 PolarHBondContact O-N 3.47Å; L39-R42 WeakPolarHBondContact O-CB 3.41Å; L39-R42 PolarHBondContact O-N 3.32Å; L39-L43 PolarHBondContact O-N 3.31Å |
| 40 | A | 91.5 | Very high | 93.7 | Very high | 34 Ų | 34 | 91.1 Ų | 91.1 | 28% | 0.281 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.9 | -37.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A36 S37 R42 L43 L48 | A36-A40 WeakPolarHBondContact O-CB 3.38Å; A36-A40 PolarHBondContact O-N 2.93Å; S37-A40 PolarHBondContact O-N 2.91Å; A40-R42 PolarHBondContact O-N 2.91Å; A40-L43 WeakPolarHBondContact O-CB 3.18Å; A40-L43 PolarHBondContact O-N 2.93Å; A40-L43 VanDerWaalsContact O-N 3.13Å; A40-L48 HydrophobicContact CB-CD1 4.49Å |
| 41 | N | 90.4 | Very high | 93.5 | Very high | 134 Ų | 134 | 89.6 Ų | 89.6 | 72% | 0.717 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -15.6 | 175.7 | -69.3 | -27 | 0 | 0 | 0 | 114.1 | S37 L39 | S37-N41 PolarHBondContact O-N 2.74Å; S37-N41 VanDerWaalsContact O-N 3.16Å; S37-N41 PolarHBondContact O-ND2 3.25Å; L39-N41 VanDerWaalsContact C-N 3.26Å; L39-N41 PolarHBondContact O-N 3.47Å |
| 42 | R | 93.4 | Very high | 93.3 | Very high | 172 Ų | 172 | 88 Ų | 88 | 65% | 0.649 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.6 | -6.7 | 177.2 | -61.6 | 178.8 | 179.7 | -173.4 | -0.5 | 112.9 | L39 A40 | L39-R42 WeakPolarHBondContact O-CB 3.41Å; L39-R42 PolarHBondContact O-N 3.32Å; A40-R42 PolarHBondContact O-N 2.91Å |
| 43 | L | 92.4 | Very high | 93.2 | Very high | 65 Ų | 65 | 86.8 Ų | 86.8 | 34% | 0.34 | 47% | 0.467 | S | S | . | . | S | Bend | trans | -75 | 142 | 179.6 | -63.6 | -178.8 | 0 | 0 | 0 | 110.3 | L39 A40 Q47 L48 A51 | L39-L43 PolarHBondContact O-N 3.31Å; A40-L43 WeakPolarHBondContact O-CB 3.18Å; A40-L43 PolarHBondContact O-N 2.93Å; A40-L43 VanDerWaalsContact O-N 3.13Å; L43-Q47 HydrophobicContact CB-CB 3.86Å; L43-Q47 HydrophobicContact CD1-CB 4.41Å; L43-Q47 HydrophobicContact CD2-CB 4.06Å; L43-Q47 HydrophobicContact CG-CB 4.32Å; L43-L48 HydrophobicContact CB-CB 4.35Å; L43-A51 HydrophobicContact CD1-CB 4.21Å |
| 44 | S | 95.3 | Very high | 93.2 | Very high | 58 Ų | 58 | 86 Ų | 86 | 41% | 0.406 | 46% | 0.463 | S | S | . | . | trans | -62.1 | 157.6 | 164.3 | 62.9 | 0 | 0 | 0 | 0 | 110.6 | N46 Q47 L48 | S44-N46 PolarHBondContact O-N 3.49Å; S44-N46 VanDerWaalsContact O-N 3.11Å; S44-Q47 PolarHBondContact O-N 2.97Å; S44-Q47 WeakPolarHBondContact OG-CG 3.49Å; S44-Q47 PolarHBondContact OG-N 2.97Å; S44-Q47 PolarHBondContact OG-OE1 3.39Å; S44-L48 WeakPolarHBondContact O-CB 3.3Å; S44-L48 PolarHBondContact O-N 3.45Å | ||
| 45 | S | 93.4 | Very high | 93.1 | Very high | 101 Ų | 101 | 82.3 Ų | 82.3 | 71% | 0.706 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -53.9 | -35.7 | 179.5 | -52.1 | 0 | 0 | 0 | 0 | 113.4 | L48 L49 | S45-L48 PolarHBondContact O-N 3.37Å; S45-L49 WeakPolarHBondContact O-CB 3.44Å; S45-L49 PolarHBondContact O-N 3.27Å |
| 46 | N | 92.9 | Very high | 93 | Very high | 126 Ų | 126 | 85.2 Ų | 85.2 | 67% | 0.674 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -70.2 | -40.4 | 177.2 | -69.1 | -26.5 | 0 | 0 | 0 | 112.7 | S44 S50 | S44-N46 PolarHBondContact O-N 3.49Å; S44-N46 VanDerWaalsContact O-N 3.11Å; N46-S50 PolarHBondContact O-N 3.09Å; N46-S50 PolarHBondContact O-OG 2.68Å |
| 47 | Q | 93.7 | Very high | 93 | Very high | 87 Ų | 87 | 85.6 Ų | 85.6 | 41% | 0.407 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.7 | -39.4 | 174.6 | -73.8 | 167.2 | -40.1 | 0 | 0 | 111.1 | L43 S44 S50 A51 | L43-Q47 HydrophobicContact CB-CB 3.86Å; L43-Q47 HydrophobicContact CD1-CB 4.41Å; L43-Q47 HydrophobicContact CD2-CB 4.06Å; L43-Q47 HydrophobicContact CG-CB 4.32Å; S44-Q47 PolarHBondContact O-N 2.97Å; S44-Q47 WeakPolarHBondContact OG-CG 3.49Å; S44-Q47 PolarHBondContact OG-N 2.97Å; S44-Q47 PolarHBondContact OG-OE1 3.39Å; Q47-S50 PolarHBondContact O-N 2.94Å; Q47-A51 WeakPolarHBondContact O-CB 3.5Å; Q47-A51 PolarHBondContact O-N 2.98Å |
| 48 | L | 92.7 | Very high | 93 | Very high | 59 Ų | 59 | 87.4 Ų | 87.4 | 31% | 0.309 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.7 | -46 | 176.8 | -176 | 63.3 | 0 | 0 | 0 | 111 | A40 L43 S44 S45 S50 A51 F52 | A40-L48 HydrophobicContact CB-CD1 4.49Å; L43-L48 HydrophobicContact CB-CB 4.35Å; S44-L48 WeakPolarHBondContact O-CB 3.3Å; S44-L48 PolarHBondContact O-N 3.45Å; S45-L48 PolarHBondContact O-N 3.37Å; L48-S50 VanDerWaalsContact C-N 3.33Å; L48-S50 PolarHBondContact O-N 2.63Å; L48-A51 PolarHBondContact O-N 3Å; L48-F52 HydrophobicContact CD1-CD2 4.1Å; L48-F52 HydrophobicContact CD1-CE2 3.62Å; L48-F52 HydrophobicContact CD1-CZ 4.33Å; L48-F52 HydrophobicContact CD2-CE2 4.08Å; L48-F52 HydrophobicContact CG-CD2 3.89Å; L48-F52 HydrophobicContact CG-CE2 3.57Å; L48-F52 WeakPolarHBondContact O-CD2 3.41Å; L48-F52 PolarHBondContact O-N 3.48Å |
| 49 | L | 93.6 | Very high | 93.1 | Very high | 99 Ų | 99 | 87.6 Ų | 87.6 | 52% | 0.518 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57.9 | -45.8 | 173.8 | 178.9 | 62.7 | 0 | 0 | 0 | 111.8 | S45 A51 F52 Q53 | S45-L49 WeakPolarHBondContact O-CB 3.44Å; S45-L49 PolarHBondContact O-N 3.27Å; L49-A51 VanDerWaalsContact C-N 3.35Å; L49-A51 PolarHBondContact O-N 3.01Å; L49-F52 PolarHBondContact O-N 3.32Å; L49-Q53 WeakPolarHBondContact O-CG 3.3Å; L49-Q53 PolarHBondContact O-N 3.3Å |
| 50 | S | 94 | Very high | 93 | Very high | 34 Ų | 34 | 88.1 Ų | 88.1 | 24% | 0.238 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 177.7 | -55.4 | 0 | 0 | 0 | 0 | 111.5 | N46 Q47 L48 F52 Q53 I54 | N46-S50 PolarHBondContact O-N 3.09Å; N46-S50 PolarHBondContact O-OG 2.68Å; Q47-S50 PolarHBondContact O-N 2.94Å; L48-S50 VanDerWaalsContact C-N 3.33Å; L48-S50 PolarHBondContact O-N 2.63Å; S50-F52 PolarHBondContact O-N 2.97Å; S50-Q53 PolarHBondContact O-N 2.89Å; S50-I54 VanDerWaalsContact O-CG1 3.28Å; S50-I54 WeakPolarHBondContact O-CG1 3.46Å; S50-I54 PolarHBondContact O-N 2.91Å |
| 51 | A | 91.4 | Very high | 93.2 | Very high | 35 Ų | 35 | 91.8 Ų | 91.8 | 29% | 0.289 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L43 Q47 L48 L49 I54 S55 | L43-A51 HydrophobicContact CD1-CB 4.21Å; Q47-A51 WeakPolarHBondContact O-CB 3.5Å; Q47-A51 PolarHBondContact O-N 2.98Å; L48-A51 PolarHBondContact O-N 3Å; L49-A51 VanDerWaalsContact C-N 3.35Å; L49-A51 PolarHBondContact O-N 3.01Å; A51-I54 PolarHBondContact O-N 3.13Å; A51-S55 WeakPolarHBondContact O-CB 3.44Å; A51-S55 PolarHBondContact O-N 3.48Å; A51-S55 PolarHBondContact O-OG 3.48Å |
| 52 | F | 92.5 | Very high | 93.2 | Very high | 108 Ų | 108 | 89.5 Ų | 89.5 | 47% | 0.474 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 173.5 | -82.6 | -62.4 | 0 | 0 | 0 | 111.9 | L48 L49 S50 I54 S55 F56 | L48-F52 HydrophobicContact CD1-CD2 4.1Å; L48-F52 HydrophobicContact CD1-CE2 3.62Å; L48-F52 HydrophobicContact CD1-CZ 4.33Å; L48-F52 HydrophobicContact CD2-CE2 4.08Å; L48-F52 HydrophobicContact CG-CD2 3.89Å; L48-F52 HydrophobicContact CG-CE2 3.57Å; L48-F52 WeakPolarHBondContact O-CD2 3.41Å; L48-F52 PolarHBondContact O-N 3.48Å; L49-F52 PolarHBondContact O-N 3.32Å; S50-F52 PolarHBondContact O-N 2.97Å; F52-I54 VanDerWaalsContact C-N 3.33Å; F52-I54 PolarHBondContact O-N 3.33Å; F52-S55 PolarHBondContact O-N 3.24Å; F52-S55 VanDerWaalsContact O-N 3.13Å; F52-F56 HydrophobicContact CD1-CE2 4.44Å; F52-F56 WeakPolarHBondContact O-CD2 3.48Å; F52-F56 PolarHBondContact O-N 3.43Å |
| 53 | Q | 94.3 | Very high | 93.1 | Very high | 95 Ų | 95 | 83.9 Ų | 83.9 | 44% | 0.444 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.1 | -45.3 | 177.7 | -73.1 | 175.5 | -31.6 | 0 | 0 | 111.8 | L49 S50 S55 F56 H57 | L49-Q53 WeakPolarHBondContact O-CG 3.3Å; L49-Q53 PolarHBondContact O-N 3.3Å; S50-Q53 PolarHBondContact O-N 2.89Å; Q53-S55 VanDerWaalsContact C-N 3.33Å; Q53-S55 PolarHBondContact O-N 3.5Å; Q53-F56 PolarHBondContact O-N 3.33Å; Q53-H57 WeakPolarHBondContact O-CB 3.37Å; Q53-H57 PolarHBondContact O-N 2.87Å |
| 54 | I | 93 | Very high | 92.9 | Very high | 74 Ų | 74 | 84.7 Ų | 84.7 | 38% | 0.379 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 175.1 | -66.2 | 164.4 | 0 | 0 | 0 | 110.6 | S50 A51 F52 H57 L58 | S50-I54 VanDerWaalsContact O-CG1 3.28Å; S50-I54 WeakPolarHBondContact O-CG1 3.46Å; S50-I54 PolarHBondContact O-N 2.91Å; A51-I54 PolarHBondContact O-N 3.13Å; F52-I54 VanDerWaalsContact C-N 3.33Å; F52-I54 PolarHBondContact O-N 3.33Å; I54-H57 PolarHBondContact O-N 2.85Å; I54-L58 WeakPolarHBondContact O-CB 3.42Å; I54-L58 PolarHBondContact O-N 2.77Å |
| 55 | S | 93.2 | Very high | 92.6 | Very high | 59 Ų | 59 | 85.9 Ų | 85.9 | 41% | 0.413 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.4 | -45 | -179.6 | -57.9 | 0 | 0 | 0 | 0 | 112.2 | A51 F52 Q53 H57 L58 M59 | A51-S55 WeakPolarHBondContact O-CB 3.44Å; A51-S55 PolarHBondContact O-N 3.48Å; A51-S55 PolarHBondContact O-OG 3.48Å; F52-S55 PolarHBondContact O-N 3.24Å; F52-S55 VanDerWaalsContact O-N 3.13Å; Q53-S55 VanDerWaalsContact C-N 3.33Å; Q53-S55 PolarHBondContact O-N 3.5Å; S55-H57 VanDerWaalsContact C-N 3.34Å; S55-H57 PolarHBondContact O-N 3.28Å; S55-L58 PolarHBondContact O-N 3.3Å; S55-M59 WeakPolarHBondContact O-CG 3.4Å; S55-M59 PolarHBondContact O-N 3.32Å |
| 56 | F | 93 | Very high | 92.4 | Very high | 134 Ų | 134 | 85.5 Ų | 85.5 | 59% | 0.588 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -62.8 | -41.2 | 175 | -80.2 | -67.8 | 0 | 0 | 0 | 112 | F52 Q53 L58 M59 E60 | F52-F56 HydrophobicContact CD1-CE2 4.44Å; F52-F56 WeakPolarHBondContact O-CD2 3.48Å; F52-F56 PolarHBondContact O-N 3.43Å; Q53-F56 PolarHBondContact O-N 3.33Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 2.89Å; F56-M59 HydrophobicContact CB-CE 4.38Å; F56-M59 HydrophobicContact CD1-CE 3.3Å; F56-M59 HydrophobicContact CE1-CE 3.61Å; F56-M59 HydrophobicContact CG-CE 3.91Å; F56-M59 HydrophobicContact CZ-CE 4.45Å; F56-M59 PolarHBondContact O-N 3.49Å; F56-E60 WeakPolarHBondContact O-CB 3.43Å; F56-E60 PolarHBondContact O-N 3.18Å |
| 57 | H | 93 | Very high | 92.1 | Very high | 63 Ų | 63 | 84.7 Ų | 84.7 | 29% | 0.292 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 175.7 | -172.3 | 61.8 | 0 | 0 | 0 | 112 | Q53 I54 S55 E60 K61 | Q53-H57 WeakPolarHBondContact O-CB 3.37Å; Q53-H57 PolarHBondContact O-N 2.87Å; I54-H57 PolarHBondContact O-N 2.85Å; S55-H57 VanDerWaalsContact C-N 3.34Å; S55-H57 PolarHBondContact O-N 3.28Å; H57-E60 IonicContact ND1-OE2 3.71Å; H57-E60 PolarHBondContact O-N 3.27Å; H57-K61 VanDerWaalsContact CE1-CE 3.46Å; H57-K61 WeakPolarHBondContact CE1-CE 3.2Å; H57-K61 WeakPolarHBondContact O-CG 3.39Å; H57-K61 PolarHBondContact O-N 3.01Å |
| 58 | L | 94.3 | Very high | 91.8 | Very high | 104 Ų | 104 | 82.8 Ų | 82.8 | 55% | 0.545 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 175.5 | -177.3 | 62.5 | 0 | 0 | 0 | 111.4 | I54 S55 F56 E60 K61 I62 | I54-L58 WeakPolarHBondContact O-CB 3.42Å; I54-L58 PolarHBondContact O-N 2.77Å; S55-L58 PolarHBondContact O-N 3.3Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 2.89Å; L58-E60 VanDerWaalsContact C-N 3.32Å; L58-E60 PolarHBondContact O-N 3.36Å; L58-K61 PolarHBondContact O-N 3.12Å; L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.37Å; L58-I62 HydrophobicContact CD2-CD1 4.48Å; L58-I62 HydrophobicContact CG-CD1 3.85Å; L58-I62 HydrophobicContact CG-CG1 4.47Å; L58-I62 WeakPolarHBondContact O-CG1 3.39Å; L58-I62 PolarHBondContact O-N 2.89Å |
| 59 | M | 94.2 | Very high | 91.4 | Very high | 103 Ų | 103 | 86.8 Ų | 86.8 | 51% | 0.507 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 176.2 | -74 | -172.4 | -65.3 | 0 | 0 | 112.2 | S55 F56 I62 S63 | S55-M59 WeakPolarHBondContact O-CG 3.4Å; S55-M59 PolarHBondContact O-N 3.32Å; F56-M59 HydrophobicContact CB-CE 4.38Å; F56-M59 HydrophobicContact CD1-CE 3.3Å; F56-M59 HydrophobicContact CE1-CE 3.61Å; F56-M59 HydrophobicContact CG-CE 3.91Å; F56-M59 HydrophobicContact CZ-CE 4.45Å; F56-M59 PolarHBondContact O-N 3.49Å; M59-I62 PolarHBondContact O-N 3.2Å; M59-S63 WeakPolarHBondContact O-CB 3.31Å; M59-S63 PolarHBondContact O-N 3Å; M59-S63 PolarHBondContact O-OG 2.85Å |
| 60 | E | 91.7 | Very high | 90.8 | Very high | 107 Ų | 107 | 86.5 Ų | 86.5 | 50% | 0.5 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.9 | -42 | 174.4 | -177.1 | -174.4 | -158.1 | 0 | 0 | 112 | F56 H57 L58 S63 F64 | F56-E60 WeakPolarHBondContact O-CB 3.43Å; F56-E60 PolarHBondContact O-N 3.18Å; H57-E60 IonicContact ND1-OE2 3.71Å; H57-E60 PolarHBondContact O-N 3.27Å; L58-E60 VanDerWaalsContact C-N 3.32Å; L58-E60 PolarHBondContact O-N 3.36Å; E60-S63 PolarHBondContact O-N 3.32Å; E60-S63 PolarHBondContact O-OG 2.95Å; E60-F64 WeakPolarHBondContact O-CB 3.48Å; E60-F64 PolarHBondContact O-N 3Å |
| 61 | K | 93.9 | Very high | 90 | Very high | 110 Ų | 110 | 90.4 Ų | 90.4 | 48% | 0.478 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.6 | -40.4 | 176.7 | -67 | -62.1 | 177.7 | -169.2 | 0 | 112.4 | H57 L58 F64 V65 | H57-K61 VanDerWaalsContact CE1-CE 3.46Å; H57-K61 WeakPolarHBondContact CE1-CE 3.2Å; H57-K61 WeakPolarHBondContact O-CG 3.39Å; H57-K61 PolarHBondContact O-N 3.01Å; L58-K61 PolarHBondContact O-N 3.12Å; K61-F64 WeakPolarHBondContact O-CB 3.43Å; K61-F64 PolarHBondContact O-N 3.39Å; K61-V65 WeakPolarHBondContact O-CG2 3.42Å; K61-V65 PolarHBondContact O-N 3.44Å; K61-V65 VanDerWaalsContact O-N 3.12Å |
| 62 | I | 91.9 | Very high | 88.5 | Confident | 87 Ų | 87 | 93.4 Ų | 93.4 | 45% | 0.446 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65 | -43.8 | 175.9 | -68.1 | 167.6 | 0 | 0 | 0 | 110.3 | L58 M59 F64 V65 I66 | L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.37Å; L58-I62 HydrophobicContact CD2-CD1 4.48Å; L58-I62 HydrophobicContact CG-CD1 3.85Å; L58-I62 HydrophobicContact CG-CG1 4.47Å; L58-I62 WeakPolarHBondContact O-CG1 3.39Å; L58-I62 PolarHBondContact O-N 2.89Å; M59-I62 PolarHBondContact O-N 3.2Å; I62-F64 VanDerWaalsContact C-N 3.28Å; I62-F64 PolarHBondContact O-N 2.88Å; I62-V65 PolarHBondContact O-N 3.36Å; I62-V65 VanDerWaalsContact O-N 3.17Å; I62-I66 HydrophobicContact CG2-CD1 3.75Å; I62-I66 HydrophobicContact CG2-CG1 4.33Å; I62-I66 WeakPolarHBondContact O-CG1 3.32Å; I62-I66 PolarHBondContact O-N 3.47Å |
| 63 | S | 90.9 | Very high | 86.9 | Confident | 54 Ų | 54 | 94.2 Ų | 94.2 | 38% | 0.378 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62 | -38.4 | 178.1 | 74.4 | 0 | 0 | 0 | 0 | 111.7 | M59 E60 I66 L67 | M59-S63 WeakPolarHBondContact O-CB 3.31Å; M59-S63 PolarHBondContact O-N 3Å; M59-S63 PolarHBondContact O-OG 2.85Å; E60-S63 PolarHBondContact O-N 3.32Å; E60-S63 PolarHBondContact O-OG 2.95Å; S63-I66 PolarHBondContact O-N 3.02Å; S63-L67 WeakPolarHBondContact O-CB 3.48Å; S63-L67 VanDerWaalsContact O-CG 3.27Å; S63-L67 WeakPolarHBondContact O-CG 3.49Å; S63-L67 PolarHBondContact O-N 3.04Å |
| 64 | F | 88.1 | Confident | 85 | Confident | 81 Ų | 81 | 99 Ų | 99 | 36% | 0.355 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.9 | -44.3 | 174.1 | -179.6 | -89.7 | 0 | 0 | 0 | 112.6 | E60 K61 I62 L67 S68 L80 | E60-F64 WeakPolarHBondContact O-CB 3.48Å; E60-F64 PolarHBondContact O-N 3Å; K61-F64 WeakPolarHBondContact O-CB 3.43Å; K61-F64 PolarHBondContact O-N 3.39Å; I62-F64 VanDerWaalsContact C-N 3.28Å; I62-F64 PolarHBondContact O-N 2.88Å; F64-L67 PolarHBondContact O-N 3.46Å; F64-S68 WeakPolarHBondContact O-CB 3.32Å; F64-S68 PolarHBondContact O-N 3.43Å; F64-S68 PolarHBondContact O-OG 3.35Å; F64-L80 HydrophobicContact CE2-CD2 3.59Å; F64-L80 HydrophobicContact CZ-CB 4.39Å; F64-L80 HydrophobicContact CZ-CD1 4.26Å; F64-L80 HydrophobicContact CZ-CD2 3.63Å; F64-L80 HydrophobicContact CZ-CG 4.3Å |
| 65 | V | 89.3 | Confident | 83.2 | Confident | 84 Ų | 84 | 98.9 Ų | 98.9 | 51% | 0.509 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.1 | -48.3 | 176.3 | 172.4 | 0 | 0 | 0 | 0 | 110.1 | K61 I62 L67 S68 M69 | K61-V65 WeakPolarHBondContact O-CG2 3.42Å; K61-V65 PolarHBondContact O-N 3.44Å; K61-V65 VanDerWaalsContact O-N 3.12Å; I62-V65 PolarHBondContact O-N 3.36Å; I62-V65 VanDerWaalsContact O-N 3.17Å; V65-L67 PolarHBondContact O-N 2.88Å; V65-S68 WeakPolarHBondContact O-CB 3.47Å; V65-S68 PolarHBondContact O-N 2.72Å; V65-S68 VanDerWaalsContact O-N 3.16Å; V65-M69 HydrophobicContact CG1-SD 4.21Å; V65-M69 WeakPolarHBondContact O-CG 3.27Å; V65-M69 PolarHBondContact O-N 2.92Å |
| 66 | I | 89.4 | Confident | 81.1 | Confident | 93 Ų | 93 | 103.6 Ų | 103.6 | 48% | 0.477 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -57.8 | -48.6 | 177.7 | -67.2 | 168.8 | 0 | 0 | 0 | 110.8 | I62 S63 S68 M69 C70 | I62-I66 HydrophobicContact CG2-CD1 3.75Å; I62-I66 HydrophobicContact CG2-CG1 4.33Å; I62-I66 WeakPolarHBondContact O-CG1 3.32Å; I62-I66 PolarHBondContact O-N 3.47Å; S63-I66 PolarHBondContact O-N 3.02Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.16Å; I66-M69 WeakPolarHBondContact O-CB 3.35Å; I66-M69 PolarHBondContact O-N 3.41Å; I66-M69 VanDerWaalsContact O-N 3.16Å; I66-C70 PolarHBondContact O-N 3.37Å; I66-C70 PolarHBondContact O-SG 3.38Å |
| 67 | L | 86.4 | Confident | 79.2 | Confident | 108 Ų | 108 | 103.9 Ų | 103.9 | 57% | 0.565 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.1 | -38.3 | 178.5 | -73.5 | 173.4 | 0 | 0 | 0 | 112 | S63 F64 V65 M69 C70 K71 | S63-L67 WeakPolarHBondContact O-CB 3.48Å; S63-L67 VanDerWaalsContact O-CG 3.27Å; S63-L67 WeakPolarHBondContact O-CG 3.49Å; S63-L67 PolarHBondContact O-N 3.04Å; F64-L67 PolarHBondContact O-N 3.46Å; V65-L67 PolarHBondContact O-N 2.88Å; L67-M69 VanDerWaalsContact C-N 3.31Å; L67-M69 PolarHBondContact O-N 3.29Å; L67-C70 PolarHBondContact O-N 3.1Å; L67-K71 WeakPolarHBondContact O-CG 3.37Å; L67-K71 PolarHBondContact O-N 2.85Å |
| 68 | S | 86.5 | Confident | 77.4 | Confident | 47 Ų | 47 | 106.7 Ų | 106.7 | 33% | 0.329 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.6 | -35.7 | 176.6 | -58.9 | 0 | 0 | 0 | 0 | 111.8 | F64 V65 I66 K71 | F64-S68 WeakPolarHBondContact O-CB 3.32Å; F64-S68 PolarHBondContact O-N 3.43Å; F64-S68 PolarHBondContact O-OG 3.35Å; V65-S68 WeakPolarHBondContact O-CB 3.47Å; V65-S68 PolarHBondContact O-N 2.72Å; V65-S68 VanDerWaalsContact O-N 3.16Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.16Å; S68-K71 PolarHBondContact O-N 2.84Å |
| 69 | M | 84.2 | Confident | 75.5 | Confident | 143 Ų | 143 | 106.7 Ų | 106.7 | 70% | 0.704 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70.3 | -33.9 | 172.7 | -64.7 | 176.7 | 78.9 | 0 | 0 | 112.3 | V65 I66 L67 | V65-M69 HydrophobicContact CG1-SD 4.21Å; V65-M69 WeakPolarHBondContact O-CG 3.27Å; V65-M69 PolarHBondContact O-N 2.92Å; I66-M69 WeakPolarHBondContact O-CB 3.35Å; I66-M69 PolarHBondContact O-N 3.41Å; I66-M69 VanDerWaalsContact O-N 3.16Å; L67-M69 VanDerWaalsContact C-N 3.31Å; L67-M69 PolarHBondContact O-N 3.29Å |
| 70 | C | 80.7 | Confident | 73.6 | Confident | 94 Ų | 94 | 106.1 Ų | 106.1 | 64% | 0.635 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -74.9 | -25.1 | 175.5 | -64.6 | 0 | 0 | 0 | 0 | 113.5 | I66 L67 S72 | I66-C70 PolarHBondContact O-N 3.37Å; I66-C70 PolarHBondContact O-SG 3.38Å; L67-C70 PolarHBondContact O-N 3.1Å; C70-S72 PolarHBondContact O-N 2.76Å |
| 71 | K | 77.1 | Confident | 72 | Confident | 116 Ų | 116 | 108.7 Ų | 108.7 | 50% | 0.504 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -70 | 75.2 | 171.7 | -76 | -171.9 | 175.4 | -164.7 | 0 | 109.2 | L67 S68 S73 E79 | L67-K71 WeakPolarHBondContact O-CG 3.37Å; L67-K71 PolarHBondContact O-N 2.85Å; S68-K71 PolarHBondContact O-N 2.84Å; K71-S73 PolarHBondContact O-N 3.17Å; K71-S73 VanDerWaalsContact O-N 3.17Å; K71-E79 IonicContact NZ-OE2 3.14Å; K71-E79 PolarHBondContact NZ-OE2 2.85Å; K71-E79 VanDerWaalsContact NZ-OE2 3.14Å |
| 72 | S | 60.4 | Low | 70.2 | Confident | 98 Ų | 98 | 107.3 Ų | 107.3 | 69% | 0.685 | 60% | 0.596 | S | S | * | * | trans | -55.5 | 114.1 | 172 | 173 | 0 | 0 | 0 | 0 | 110.8 | C70 K74 | C70-S72 PolarHBondContact O-N 2.76Å; S72-K74 PolarHBondContact O-N 2.91Å | ||
| 73 | S | 59.5 | Low | 68.3 | Low | 124 Ų | 124 | 109.7 Ų | 109.7 | 87% | 0.867 | 60% | 0.603 | S | S | * | * | S | Bend | trans | 37.1 | 24.1 | 141.1 | -171.8 | 0 | 0 | 0 | 0 | 120.3 | K71 | K71-S73 PolarHBondContact O-N 3.17Å; K71-S73 VanDerWaalsContact O-N 3.17Å |
| 74 | K | 54.7 | Low | 66.4 | Low | 196 Ų | 196 | 114.9 Ų | 114.9 | 85% | 0.852 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -136.1 | 112.9 | 173.7 | -148.9 | 168.3 | -178.3 | 178.3 | 0 | 109.2 | S72 E76 | S72-K74 PolarHBondContact O-N 2.91Å; K74-E76 PolarHBondContact O-N 3.46Å |
| 75 | G | 54.7 | Low | 64.8 | Low | 71 Ų | 71 | 115 Ų | 115 | 73% | 0.732 | 63% | 0.629 | S | S | * | * | trans | -47.2 | 126.6 | -161.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 76 | E | 49.1 | Very low | 63.1 | Low | 159 Ų | 159 | 115.7 Ų | 115.7 | 74% | 0.743 | 64% | 0.644 | S | S | * | * | trans | -152.1 | 82.2 | 150 | -110 | 174.7 | -167.8 | 0 | 0 | 107.5 | K74 D78 | K74-E76 PolarHBondContact O-N 3.46Å; E76-D78 PolarHBondContact O-N 3.37Å | ||
| 77 | T | 53.7 | Low | 61.5 | Low | 139 Ų | 139 | 120.8 Ų | 120.8 | 85% | 0.853 | 66% | 0.657 | S | S | * | * | trans | -88.5 | 76.1 | 177.1 | -41.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 78 | D | 54.4 | Low | 60.2 | Low | 122 Ų | 122 | 124.9 Ų | 124.9 | 65% | 0.652 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -160.6 | -18.9 | 160.3 | -126 | -10 | 0 | 0 | 0 | 117 | E76 L80 | E76-D78 PolarHBondContact O-N 3.37Å; D78-L80 VanDerWaalsContact C-N 3.26Å; D78-L80 PolarHBondContact O-N 3.35Å |
| 79 | E | 55.3 | Low | 58.6 | Low | 104 Ų | 104 | 129 Ų | 129 | 49% | 0.486 | 68% | 0.68 | S | S | . | * | G | 310 helix | trans | -70.8 | -19.7 | -178.4 | -64.7 | -174.8 | 146.6 | 0 | 0 | 113.9 | K71 K81 S82 F83 | K71-E79 IonicContact NZ-OE2 3.14Å; K71-E79 PolarHBondContact NZ-OE2 2.85Å; K71-E79 VanDerWaalsContact NZ-OE2 3.14Å; E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.94Å; E79-S82 PolarHBondContact O-N 3.01Å; E79-S82 PolarHBondContact O-OG 2.72Å; E79-F83 WeakPolarHBondContact O-CD2 3.36Å |
| 80 | L | 54.6 | Low | 57.4 | Low | 91 Ų | 91 | 125.8 Ų | 125.8 | 48% | 0.476 | 67% | 0.67 | S | S | . | * | G | 310 helix | trans | -73.7 | -22.2 | -174.2 | -53.8 | -175.3 | 0 | 0 | 0 | 113.3 | F64 D78 | F64-L80 HydrophobicContact CE2-CD2 3.59Å; F64-L80 HydrophobicContact CZ-CB 4.39Å; F64-L80 HydrophobicContact CZ-CD1 4.26Å; F64-L80 HydrophobicContact CZ-CD2 3.63Å; F64-L80 HydrophobicContact CZ-CG 4.3Å; D78-L80 VanDerWaalsContact C-N 3.26Å; D78-L80 PolarHBondContact O-N 3.35Å |
| 81 | K | 57.2 | Low | 56.5 | Low | 161 Ų | 161 | 127.4 Ų | 127.4 | 70% | 0.7 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -74.4 | -27.3 | 176 | -80.1 | -179.1 | 180 | 171.1 | 0 | 112.8 | E79 Q84 | E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.94Å; K81-Q84 WeakPolarHBondContact O-CB 3.38Å; K81-Q84 PolarHBondContact O-N 2.96Å |
| 82 | S | 55.3 | Low | 55.7 | Low | 81 Ų | 81 | 125.7 Ų | 125.7 | 57% | 0.566 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | -28 | -174.8 | 70.2 | 0 | 0 | 0 | 0 | 113.1 | E79 Q84 | E79-S82 PolarHBondContact O-N 3.01Å; E79-S82 PolarHBondContact O-OG 2.72Å; S82-Q84 VanDerWaalsContact C-N 3.25Å; S82-Q84 PolarHBondContact O-N 2.93Å |
| 83 | F | 53.5 | Low | 55.8 | Low | 137 Ų | 137 | 126.7 Ų | 126.7 | 60% | 0.601 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | 1.2 | 176.8 | -63.7 | -78 | 0 | 0 | 0 | 113.9 | E79 T85 | E79-F83 WeakPolarHBondContact O-CD2 3.36Å; F83-T85 PolarHBondContact O-N 2.79Å |
| 84 | Q | 50 | Low | 55.6 | Low | 164 Ų | 164 | 132.1 Ų | 132.1 | 77% | 0.766 | 68% | 0.679 | S | S | * | * | trans | -75.3 | 24.5 | 170.6 | -147.4 | -179.3 | 70.4 | 0 | 0 | 111.8 | K81 S82 A86 | K81-Q84 WeakPolarHBondContact O-CB 3.38Å; K81-Q84 PolarHBondContact O-N 2.96Å; S82-Q84 VanDerWaalsContact C-N 3.25Å; S82-Q84 PolarHBondContact O-N 2.93Å; Q84-A86 PolarHBondContact O-N 2.69Å | ||
| 85 | T | 53.9 | Low | 55.5 | Low | 82 Ų | 82 | 127.1 Ų | 127.1 | 50% | 0.503 | 67% | 0.667 | S | S | . | * | trans | -46.1 | 120.1 | 168 | 4.1 | 0 | 0 | 0 | 0 | 107.1 | F83 W87 | F83-T85 PolarHBondContact O-N 2.79Å; T85-W87 PolarHBondContact O-N 2.91Å | ||
| 86 | A | 55.5 | Low | 55 | Low | 100 Ų | 100 | 131.2 Ų | 131.2 | 83% | 0.826 | 67% | 0.669 | S | S | * | * | trans | -65.1 | 77.3 | -170.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q84 K88 | Q84-A86 PolarHBondContact O-N 2.69Å; A86-K88 VanDerWaalsContact C-N 3.31Å; A86-K88 PolarHBondContact O-N 3.25Å | ||
| 87 | W | 55.4 | Low | 54.9 | Low | 200 Ų | 200 | 129.8 Ų | 129.8 | 76% | 0.758 | 67% | 0.666 | S | S | * | * | trans | -77.7 | 90.6 | 173.8 | -65.4 | 112.5 | 0 | 0 | 0 | 107.7 | T85 Y89 | T85-W87 PolarHBondContact O-N 2.91Å; W87-Y89 PolarHBondContact O-N 3.33Å | ||
| 88 | K | 58.6 | Low | 54.5 | Low | 194 Ų | 194 | 129.3 Ų | 129.3 | 84% | 0.843 | 66% | 0.658 | S | S | * | * | trans | -64 | 113.5 | 167.8 | -165.2 | 175 | -177.2 | 179.9 | 0 | 106.9 | A86 | A86-K88 VanDerWaalsContact C-N 3.31Å; A86-K88 PolarHBondContact O-N 3.25Å | ||
| 89 | Y | 52.1 | Low | 54 | Low | 132 Ų | 132 | 130.9 Ų | 130.9 | 52% | 0.518 | 67% | 0.666 | S | S | . | * | trans | -48.2 | 129.5 | 171.8 | -131.2 | -101.7 | 0 | 0 | 0 | 108.2 | W87 S91 Y92 | W87-Y89 PolarHBondContact O-N 3.33Å; Y89-S91 PolarHBondContact O-N 3.49Å; Y89-Y92 AromaticContact CD1-CD2 3.71Å; Y89-Y92 HydrophobicContact CD1-CD2 3.71Å; Y89-Y92 AromaticContact CD1-CE2 3.49Å; Y89-Y92 HydrophobicContact CD1-CE2 3.49Å; Y89-Y92 VanDerWaalsContact CD1-CE2 3.49Å; Y89-Y92 AromaticContact CE1-CD2 3.73Å; Y89-Y92 HydrophobicContact CE1-CD2 3.73Å; Y89-Y92 AromaticContact CE1-CE2 3.42Å; Y89-Y92 HydrophobicContact CE1-CE2 3.42Å; Y89-Y92 VanDerWaalsContact CE1-CE2 3.42Å | ||
| 90 | P | 60 | Low | 53.5 | Low | 76 Ų | 76 | 130.1 Ų | 130.1 | 49% | 0.494 | 67% | 0.673 | S | S | . | * | trans | -53.3 | 132.1 | 165.4 | -22.1 | 32.7 | 0 | 0 | 0 | 107.7 | Y92 | P90-Y92 VanDerWaalsContact C-N 3.35Å; P90-Y92 HydrophobicContact CB-CE1 4.35Å; P90-Y92 HydrophobicContact CB-CE2 4.09Å; P90-Y92 HydrophobicContact CG-CE2 4.32Å; P90-Y92 WeakPolarHBondContact O-CD2 3.35Å; P90-Y92 WeakPolarHBondContact O-CE2 3.45Å; P90-Y92 PolarHBondContact O-N 3.38Å | ||
| 91 | S | 62.4 | Low | 53.1 | Low | 129 Ų | 129 | 130.8 Ų | 130.8 | 90% | 0.902 | 68% | 0.682 | S | S | * | * | trans | -66.4 | 100.6 | 172.4 | -117.5 | 0 | 0 | 0 | 0 | 107.3 | Y89 | Y89-S91 PolarHBondContact O-N 3.49Š| ||
| 92 | Y | 59.8 | Low | 52.7 | Low | 80 Ų | 80 | 129.3 Ų | 129.3 | 31% | 0.314 | 68% | 0.68 | S | S | . | * | trans | -78.7 | 131.8 | 173.8 | -63.7 | -78.5 | 0 | 0 | 0 | 108.2 | Y89 P90 R94 | Y89-Y92 AromaticContact CD1-CD2 3.71Å; Y89-Y92 HydrophobicContact CD1-CD2 3.71Å; Y89-Y92 AromaticContact CD1-CE2 3.49Å; Y89-Y92 HydrophobicContact CD1-CE2 3.49Å; Y89-Y92 VanDerWaalsContact CD1-CE2 3.49Å; Y89-Y92 AromaticContact CE1-CD2 3.73Å; Y89-Y92 HydrophobicContact CE1-CD2 3.73Å; Y89-Y92 AromaticContact CE1-CE2 3.42Å; Y89-Y92 HydrophobicContact CE1-CE2 3.42Å; Y89-Y92 VanDerWaalsContact CE1-CE2 3.42Å; P90-Y92 VanDerWaalsContact C-N 3.35Å; P90-Y92 HydrophobicContact CB-CE1 4.35Å; P90-Y92 HydrophobicContact CB-CE2 4.09Å; P90-Y92 HydrophobicContact CG-CE2 4.32Å; P90-Y92 WeakPolarHBondContact O-CD2 3.35Å; P90-Y92 WeakPolarHBondContact O-CE2 3.45Å; P90-Y92 PolarHBondContact O-N 3.38Å; Y92-R94 PolarHBondContact O-N 3.21Å | ||
| 93 | P | 62.5 | Low | 51.9 | Low | 119 Ų | 119 | 131.9 Ų | 131.9 | 77% | 0.773 | 69% | 0.687 | S | S | * | * | trans | -57.7 | 127.8 | 167.3 | 25 | -30.7 | 0 | 0 | 0 | 106.9 | C95 | P93-C95 PolarHBondContact O-N 3.16Š| ||
| 94 | R | 55.7 | Low | 51.6 | Low | 237 Ų | 237 | 133.5 Ų | 133.5 | 89% | 0.894 | 69% | 0.694 | S | S | * | * | trans | -53.1 | 112.3 | 169.4 | -80.5 | -165.9 | -175.6 | 166.4 | 2 | 106.3 | Y92 M96 | Y92-R94 PolarHBondContact O-N 3.21Å; R94-M96 PolarHBondContact O-N 2.91Å | ||
| 95 | C | 51.4 | Low | 51.6 | Low | 91 Ų | 91 | 130.4 Ų | 130.4 | 62% | 0.615 | 69% | 0.69 | S | S | * | * | trans | -58.3 | 111.5 | 162.6 | -171.6 | 0 | 0 | 0 | 0 | 104.1 | P93 I97 | P93-C95 PolarHBondContact O-N 3.16Å; C95-I97 PolarHBondContact O-N 3.42Å | ||
| 96 | M | 43.8 | Very low | 51.1 | Low | 157 Ų | 157 | 131.6 Ų | 131.6 | 77% | 0.773 | 70% | 0.702 | S | S | * | * | trans | -65.5 | 85.8 | 166.9 | -61.8 | -137.1 | -61.5 | 0 | 0 | 105 | R94 N98 | R94-M96 PolarHBondContact O-N 2.91Å; M96-N98 PolarHBondContact O-N 3.49Å | ||
| 97 | I | 47.1 | Very low | 50.3 | Low | 130 Ų | 130 | 133.7 Ų | 133.7 | 67% | 0.667 | 70% | 0.696 | S | S | * | * | trans | -63.1 | 96.7 | 158.1 | -65.2 | 170.8 | 0 | 0 | 0 | 102 | C95 D99 | C95-I97 PolarHBondContact O-N 3.42Å; I97-D99 PolarHBondContact O-N 3.16Å | ||
| 98 | N | 45.7 | Very low | 49.6 | Very low | 129 Ų | 129 | 135 Ų | 135 | 69% | 0.69 | 70% | 0.701 | S | S | * | * | trans | -56.3 | 112.8 | 163.2 | -74.2 | -29 | 0 | 0 | 0 | 104.6 | M96 S100 | M96-N98 PolarHBondContact O-N 3.49Å; N98-S100 PolarHBondContact O-N 3.21Å | ||
| 99 | D | 44.4 | Very low | 49.1 | Very low | 154 Ų | 154 | 132 Ų | 132 | 82% | 0.824 | 70% | 0.699 | S | S | * | * | trans | -67.9 | 48.3 | 169.6 | -69.7 | -38.4 | 0 | 0 | 0 | 110.2 | I97 | I97-D99 PolarHBondContact O-N 3.16Š| ||
| 100 | S | 43.9 | Very low | 48.6 | Very low | 89 Ų | 89 | 134.8 Ų | 134.8 | 62% | 0.622 | 72% | 0.717 | S | S | * | * | trans | -71.2 | 125.3 | 159.2 | -178.4 | 0 | 0 | 0 | 0 | 105.7 | N98 M102 | N98-S100 PolarHBondContact O-N 3.21Å; S100-M102 PolarHBondContact O-N 3.28Å | ||
| 101 | P | 48 | Very low | 47.8 | Very low | 105 Ų | 105 | 135.4 Ų | 135.4 | 68% | 0.682 | 72% | 0.723 | S | S | * | * | trans | -51.4 | 123 | 173.7 | 20.1 | -28.9 | 0 | 0 | 0 | 107.4 | D103 | P101-D103 PolarHBondContact O-N 3.14Š| ||
| 102 | M | 47 | Very low | 46.8 | Very low | 130 Ų | 130 | 134.4 Ų | 134.4 | 64% | 0.64 | 72% | 0.716 | S | S | * | * | trans | -58.6 | 91.1 | 169.6 | -90.7 | -86 | -154.2 | 0 | 0 | 106.8 | S100 F104 | S100-M102 PolarHBondContact O-N 3.28Å; M102-F104 VanDerWaalsContact C-N 3.27Å; M102-F104 HydrophobicContact CB-CD2 4.11Å; M102-F104 HydrophobicContact CB-CE2 3.86Å; M102-F104 VanDerWaalsContact O-CD2 3.28Å; M102-F104 WeakPolarHBondContact O-CD2 3.49Å; M102-F104 PolarHBondContact O-N 2.94Å | ||
| 103 | D | 38.6 | Very low | 45.8 | Very low | 134 Ų | 134 | 137.5 Ų | 137.5 | 72% | 0.717 | 74% | 0.738 | S | S | * | * | trans | -65 | 96.7 | 164.2 | -108.5 | -34.3 | 0 | 0 | 0 | 106 | P101 S105 | P101-D103 PolarHBondContact O-N 3.14Å; D103-S105 PolarHBondContact O-N 3.46Å | ||
| 104 | F | 47.7 | Very low | 44.6 | Very low | 172 Ų | 172 | 140.8 Ų | 140.8 | 75% | 0.754 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -65 | 15.3 | 174.7 | -83.2 | -86 | 0 | 0 | 0 | 112.9 | M102 | M102-F104 VanDerWaalsContact C-N 3.27Å; M102-F104 HydrophobicContact CB-CD2 4.11Å; M102-F104 HydrophobicContact CB-CE2 3.86Å; M102-F104 VanDerWaalsContact O-CD2 3.28Å; M102-F104 WeakPolarHBondContact O-CD2 3.49Å; M102-F104 PolarHBondContact O-N 2.94Å |
| 105 | S | 49.7 | Very low | 43.8 | Very low | 98 Ų | 98 | 136.3 Ų | 136.3 | 69% | 0.685 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -90.1 | 4.7 | -173 | 65.7 | 0 | 0 | 0 | 0 | 115.3 | D103 | D103-S105 PolarHBondContact O-N 3.46Š|
| 106 | S | 42.9 | Very low | 43 | Very low | 108 Ų | 108 | 143.5 Ų | 143.5 | 76% | 0.755 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -125.3 | 47 | 172.9 | -110.8 | 0 | 0 | 0 | 0 | 114.2 | R108 | S106-R108 PolarHBondContact O-N 2.68Å; S106-R108 VanDerWaalsContact O-N 3.12Å |
| 107 | M | 40.6 | Very low | 42.7 | Very low | 143 Ų | 143 | 141.2 Ų | 141.2 | 70% | 0.704 | 76% | 0.756 | S | S | * | * | trans | -79.3 | 67.2 | 152 | -73 | -167.9 | 74 | 0 | 0 | 109.3 | T109 | M107-T109 PolarHBondContact O-N 3.17Š| ||
| 108 | R | 40.5 | Very low | 42.4 | Very low | 227 Ų | 227 | 141.3 Ų | 141.3 | 86% | 0.857 | 76% | 0.762 | S | S | * | * | trans | -83.8 | 102.3 | 163.5 | -142.2 | 178.4 | -169.5 | -178.1 | 3.1 | 106.9 | S106 Q110 | S106-R108 PolarHBondContact O-N 2.68Å; S106-R108 VanDerWaalsContact O-N 3.12Å; R108-Q110 PolarHBondContact O-N 2.79Å | ||
| 109 | T | 46.6 | Very low | 42.1 | Very low | 131 Ų | 131 | 143.3 Ų | 143.3 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -51.2 | 96.6 | 167.9 | 34.7 | 0 | 0 | 0 | 0 | 110 | M107 S111 | M107-T109 PolarHBondContact O-N 3.17Å; T109-S111 VanDerWaalsContact C-N 3.26Å; T109-S111 PolarHBondContact O-N 3.12Å | ||
| 110 | Q | 43.5 | Very low | 41.9 | Very low | 192 Ų | 192 | 141.3 Ų | 141.3 | 90% | 0.897 | 77% | 0.769 | S | S | * | * | trans | -75.9 | 93.3 | 159 | -81.2 | -172.3 | -9.5 | 0 | 0 | 107.5 | R108 S112 | R108-Q110 PolarHBondContact O-N 2.79Å; Q110-S112 PolarHBondContact O-N 3.15Å | ||
| 111 | S | 42.8 | Very low | 41.7 | Very low | 88 Ų | 88 | 142.6 Ų | 142.6 | 62% | 0.615 | 78% | 0.778 | S | S | * | * | trans | -25.1 | 117.2 | 157.7 | 169.5 | 0 | 0 | 0 | 0 | 112.6 | T109 N113 | T109-S111 VanDerWaalsContact C-N 3.26Å; T109-S111 PolarHBondContact O-N 3.12Å; S111-N113 VanDerWaalsContact C-N 3.34Å; S111-N113 PolarHBondContact O-N 3.37Å | ||
| 112 | S | 40.6 | Very low | 41.3 | Very low | 109 Ų | 109 | 140.6 Ų | 140.6 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | trans | -57.7 | 93 | 163 | 160.2 | 0 | 0 | 0 | 0 | 109.4 | Q110 | Q110-S112 PolarHBondContact O-N 3.15Š| ||
| 113 | N | 38.6 | Very low | 41.6 | Very low | 145 Ų | 145 | 144.4 Ų | 144.4 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | -138.2 | 67 | 168 | -93.3 | -10.6 | 0 | 0 | 0 | 109.4 | S111 | S111-N113 VanDerWaalsContact C-N 3.34Å; S111-N113 PolarHBondContact O-N 3.37Å | ||
| 114 | E | 38.4 | Very low | 41.8 | Very low | 188 Ų | 188 | 145 Ų | 145 | 88% | 0.879 | 82% | 0.816 | S | S | * | * | trans | -155.2 | 55.1 | 160.2 | -138.9 | 167.4 | 177.1 | 0 | 0 | 111.9 | ||||
| 115 | V | 37.2 | Very low | 41.5 | Very low | 143 Ų | 143 | 143.5 Ų | 143.5 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | trans | -130.5 | 63.3 | 162.1 | -169.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 116 | R | 34.6 | Very low | 41 | Very low | 241 Ų | 241 | 146.1 Ų | 146.1 | 91% | 0.909 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -161.6 | 131.2 | 154.7 | -156.5 | 170.9 | -129 | -168.4 | 0.3 | 109.8 | ||
| 117 | S | 38.2 | Very low | 40.9 | Very low | 109 Ų | 109 | 148.3 Ų | 148.3 | 76% | 0.762 | 83% | 0.831 | S | S | * | * | trans | 97.7 | 60.6 | 164.9 | -159.4 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 118 | V | 40.9 | Very low | 40.9 | Very low | 132 Ų | 132 | 148.6 Ų | 148.6 | 80% | 0.8 | 84% | 0.839 | S | S | * | * | trans | -134.3 | 65.8 | 137.7 | -158.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 119 | I | 40.2 | Very low | 40.9 | Very low | 172 Ų | 172 | 143.4 Ų | 143.4 | 88% | 0.882 | 84% | 0.837 | S | S | * | * | trans | -127.7 | 73.1 | 156.9 | -44 | 173.8 | 0 | 0 | 0 | 105.8 | ||||
| 120 | S | 39.6 | Very low | 40.5 | Very low | 111 Ų | 111 | 144.3 Ų | 144.3 | 78% | 0.776 | 84% | 0.84 | S | S | * | * | trans | -170.8 | 87.2 | 156.3 | -162.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 121 | S | 40.3 | Very low | 40.3 | Very low | 117 Ų | 117 | 140.6 Ų | 140.6 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | trans | -149.8 | 71.1 | 165.4 | -44 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 122 | G | 39.2 | Very low | 40.1 | Very low | 63 Ų | 63 | 145 Ų | 145 | 65% | 0.649 | 85% | 0.854 | S | S | * | * | trans | -131.6 | 126.9 | 165.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 123 | P | 53.2 | Low | 40 | Very low | 210 Ų | 210 | 148.3 Ų | 148.3 | 100% | 1.364 | 86% | 0.862 | S | S | * | * | trans | -65.1 | 0 | -169.3 | 29.1 | -36.2 | 0 | 0 | 0 | 113.9 |
Retrieved 123 of 123 residues in 20 ms
(Link to these results)