| 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 | 46.1 | Very low | 51.4 | Low | 237 Ų | 237 | 137.2 Ų | 137.2 | 100% | 1.167 | 70% | 0.696 | S | S | * | * | 0 | 97.1 | 0 | -73.4 | -171.1 | -90.6 | 0 | 0 | 107.2 | |||||
| 2 | T | 49.3 | Very low | 52 | Low | 123 Ų | 123 | 141.8 Ų | 141.8 | 76% | 0.755 | 71% | 0.708 | S | S | * | * | trans | -138 | 40.2 | -172.2 | -8.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 3 | D | 50.7 | Low | 53.1 | Low | 120 Ų | 120 | 133.8 Ų | 133.8 | 64% | 0.642 | 68% | 0.683 | S | S | * | * | trans | -87.7 | -6.7 | 178.9 | -97.5 | -88 | 0 | 0 | 0 | 113.8 | K5 | D3-K5 PolarHBondContact O-N 2.88Š| ||
| 4 | S | 54.3 | Low | 54.4 | Low | 98 Ų | 98 | 130 Ų | 130 | 69% | 0.685 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -6.8 | -173.9 | -51.6 | 0 | 0 | 0 | 0 | 114.7 | ||
| 5 | K | 53.9 | Low | 55.8 | Low | 185 Ų | 185 | 124.3 Ų | 124.3 | 80% | 0.804 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -12.7 | -176.6 | -85.6 | -171.6 | 177.7 | 179.2 | 0 | 115.3 | D3 | D3-K5 PolarHBondContact O-N 2.88Š|
| 6 | Y | 51.8 | Low | 57.2 | Low | 190 Ų | 190 | 126.4 Ų | 126.4 | 75% | 0.745 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -90.4 | -10.1 | 174.6 | -77.5 | -79.2 | 0 | 0 | 0 | 113.4 | ||
| 7 | F | 48.9 | Very low | 58.6 | Low | 91 Ų | 91 | 126.4 Ų | 126.4 | 40% | 0.399 | 63% | 0.633 | S | S | . | * | S | Bend | trans | -113.2 | -2.9 | -166.9 | -73 | -71.1 | 0 | 0 | 0 | 115.9 | T9 V43 K45 | F7-T9 PolarHBondContact O-N 2.89Å; F7-V43 HydrophobicContact CD1-CB 4.01Å; F7-V43 HydrophobicContact CD1-CG1 3.74Å; F7-V43 HydrophobicContact CD1-CG2 3.68Å; F7-V43 HydrophobicContact CE1-CB 4.1Å; F7-V43 HydrophobicContact CE1-CG1 3.41Å; F7-V43 VanDerWaalsContact CE1-CG1 3.41Å; F7-V43 HydrophobicContact CE1-CG2 3.81Å; F7-V43 HydrophobicContact CE2-CG1 4.5Å; F7-V43 HydrophobicContact CG-CG1 4.4Å; F7-V43 HydrophobicContact CZ-CG1 3.83Å; F7-K45 WeakPolarHBondContact O-CE 3.05Å |
| 8 | T | 51.6 | Low | 59.9 | Low | 114 Ų | 114 | 120.9 Ų | 120.9 | 70% | 0.699 | 61% | 0.606 | S | S | * | * | trans | -104 | 63.8 | 177.4 | 62.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 9 | T | 49.5 | Very low | 61.1 | Low | 37 Ų | 37 | 121.6 Ų | 121.6 | 23% | 0.227 | 61% | 0.605 | C | S | . | * | trans | -126.2 | 85.5 | 167.4 | 25.5 | 0 | 0 | 0 | 0 | 108.5 | F7 K11 E14 | F7-T9 PolarHBondContact O-N 2.89Å; T9-K11 HydrophobicContact CG2-CD 3.9Å; T9-K11 HydrophobicContact CG2-CG 4.04Å; T9-K11 PolarHBondContact O-N 3.38Å; T9-E14 VanDerWaalsContact CB-OE1 3.24Å; T9-E14 WeakPolarHBondContact CB-OE1 3.14Å; T9-E14 PolarHBondContact OG1-OE1 3.47Å; T9-E14 PolarHBondContact OG1-OE2 3.17Å; T9-E14 VanDerWaalsContact OG1-OE2 3.14Å | ||
| 10 | N | 53.7 | Low | 62.4 | Low | 167 Ų | 167 | 118.5 Ų | 118.5 | 89% | 0.893 | 60% | 0.599 | S | S | * | * | trans | -75.7 | 45.4 | 158.2 | -152.1 | -48.2 | 0 | 0 | 0 | 109.1 | ||||
| 11 | K | 55.3 | Low | 63.6 | Low | 147 Ų | 147 | 115.4 Ų | 115.4 | 64% | 0.639 | 58% | 0.583 | S | S | * | * | trans | -87.8 | 112.2 | 177 | -80.2 | -174.6 | 179.5 | 179.2 | 0 | 105.8 | T9 G13 E14 | T9-K11 HydrophobicContact CG2-CD 3.9Å; T9-K11 HydrophobicContact CG2-CG 4.04Å; T9-K11 PolarHBondContact O-N 3.38Å; K11-G13 PolarHBondContact O-N 3.01Å; K11-E14 PolarHBondContact O-N 3.25Å | ||
| 12 | K | 58.5 | Low | 65.5 | Low | 192 Ų | 192 | 107.1 Ų | 107.1 | 84% | 0.835 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -40.5 | -27.4 | 170.1 | -81.1 | 179.6 | 169.9 | 179.4 | 0 | 114 | F16 | K12-F16 WeakPolarHBondContact O-CB 3.31Å; K12-F16 PolarHBondContact O-N 2.93Å |
| 13 | G | 67.1 | Low | 67.3 | Low | 38 Ų | 38 | 107.2 Ų | 107.2 | 39% | 0.392 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.8 | -36.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | K11 F16 E17 | K11-G13 PolarHBondContact O-N 3.01Å; G13-F16 PolarHBondContact O-N 3.28Å; G13-E17 WeakPolarHBondContact O-CB 3.3Å; G13-E17 WeakPolarHBondContact O-CG 3.37Å; G13-E17 PolarHBondContact O-N 3.22Å |
| 14 | E | 70.9 | Confident | 69.3 | Low | 81 Ų | 81 | 103.8 Ų | 103.8 | 38% | 0.379 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.7 | -45.1 | -178.3 | -88.1 | -177.3 | -166 | 0 | 0 | 111.6 | T9 K11 F16 E17 L18 K45 | T9-E14 VanDerWaalsContact CB-OE1 3.24Å; T9-E14 WeakPolarHBondContact CB-OE1 3.14Å; T9-E14 PolarHBondContact OG1-OE1 3.47Å; T9-E14 PolarHBondContact OG1-OE2 3.17Å; T9-E14 VanDerWaalsContact OG1-OE2 3.14Å; K11-E14 PolarHBondContact O-N 3.25Å; E14-F16 VanDerWaalsContact C-N 3.33Å; E14-E17 PolarHBondContact O-N 3.34Å; E14-L18 WeakPolarHBondContact O-CB 3.26Å; E14-L18 PolarHBondContact O-N 3.34Å; E14-K45 IonicContact OE2-NZ 2.79Å; E14-K45 PolarHBondContact OE2-NZ 3.2Å |
| 15 | I | 74.9 | Confident | 71 | Confident | 45 Ų | 45 | 107.7 Ų | 107.7 | 23% | 0.231 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -67.3 | -38.6 | 177.5 | -61.6 | -179.1 | 0 | 0 | 0 | 110.4 | L18 K19 D46 T49 | I15-L18 PolarHBondContact O-N 3Å; I15-K19 WeakPolarHBondContact O-CB 3.34Å; I15-K19 PolarHBondContact O-N 2.99Å; I15-D46 VanDerWaalsContact CD1-O 3.25Å; I15-D46 WeakPolarHBondContact CD1-O 3.24Å; I15-T49 WeakPolarHBondContact CG2-O 3.45Å |
| 16 | F | 78.1 | Confident | 72.9 | Confident | 157 Ų | 157 | 105.5 Ų | 105.5 | 69% | 0.689 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.5 | -45 | 176.9 | -173.4 | -96.9 | 0 | 0 | 0 | 112.2 | K12 G13 E14 K19 A20 | K12-F16 WeakPolarHBondContact O-CB 3.31Å; K12-F16 PolarHBondContact O-N 2.93Å; G13-F16 PolarHBondContact O-N 3.28Å; E14-F16 VanDerWaalsContact C-N 3.33Å; F16-K19 PolarHBondContact O-N 2.83Å; F16-A20 PolarHBondContact O-N 3.4Å; F16-A20 VanDerWaalsContact O-N 3.08Å |
| 17 | E | 80.8 | Confident | 74.7 | Confident | 126 Ų | 126 | 104.2 Ų | 104.2 | 59% | 0.589 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.9 | -42.8 | 174.2 | -75.8 | -178.8 | -171 | 0 | 0 | 111.6 | G13 E14 K19 A20 E21 | G13-E17 WeakPolarHBondContact O-CB 3.3Å; G13-E17 WeakPolarHBondContact O-CG 3.37Å; G13-E17 PolarHBondContact O-N 3.22Å; E14-E17 PolarHBondContact O-N 3.34Å; E17-K19 VanDerWaalsContact C-N 3.3Å; E17-K19 PolarHBondContact O-N 3.1Å; E17-A20 WeakPolarHBondContact O-CB 3.46Å; E17-A20 PolarHBondContact O-N 3.23Å; E17-A20 VanDerWaalsContact O-N 3.14Å; E17-E21 WeakPolarHBondContact O-CG 3.47Å; E17-E21 PolarHBondContact O-N 3.16Å |
| 18 | L | 81.8 | Confident | 76.7 | Confident | 28 Ų | 28 | 105.9 Ų | 105.9 | 15% | 0.147 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -57.6 | -44.2 | 175.7 | -128.5 | 80.1 | 0 | 0 | 0 | 111.7 | E14 I15 A20 E21 L22 K36 V37 V47 | E14-L18 WeakPolarHBondContact O-CB 3.26Å; E14-L18 PolarHBondContact O-N 3.34Å; I15-L18 PolarHBondContact O-N 3Å; L18-A20 VanDerWaalsContact C-N 3.32Å; L18-A20 PolarHBondContact O-N 3.2Å; L18-E21 PolarHBondContact O-N 3.33Å; L18-L22 WeakPolarHBondContact O-CB 3.34Å; L18-L22 VanDerWaalsContact O-CG 3.28Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 3.46Å; L18-K36 HydrophobicContact CD1-CB 3.93Å; L18-K36 HydrophobicContact CD1-CD 4.07Å; L18-V37 HydrophobicContact CD2-CB 4.26Å; L18-V37 HydrophobicContact CD2-CG2 3.35Å; L18-V37 HydrophobicContact CG-CG2 4.2Å; L18-V47 HydrophobicContact CD2-CG1 4.42Å |
| 19 | K | 83.8 | Confident | 78.4 | Confident | 135 Ų | 135 | 105 Ų | 105 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.8 | -37.1 | 178.4 | -168.2 | 172.5 | -175.1 | 172.8 | 0 | 111.6 | I15 F16 E17 N23 | I15-K19 WeakPolarHBondContact O-CB 3.34Å; I15-K19 PolarHBondContact O-N 2.99Å; F16-K19 PolarHBondContact O-N 2.83Å; E17-K19 VanDerWaalsContact C-N 3.3Å; E17-K19 PolarHBondContact O-N 3.1Å; K19-N23 PolarHBondContact O-N 2.85Å; K19-N23 PolarHBondContact O-ND2 2.85Å |
| 20 | A | 86.9 | Confident | 80.4 | Confident | 58 Ų | 58 | 108.6 Ų | 108.6 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.9 | -40.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F16 E17 L18 N23 N24 | F16-A20 PolarHBondContact O-N 3.4Å; F16-A20 VanDerWaalsContact O-N 3.08Å; E17-A20 WeakPolarHBondContact O-CB 3.46Å; E17-A20 PolarHBondContact O-N 3.23Å; E17-A20 VanDerWaalsContact O-N 3.14Å; L18-A20 VanDerWaalsContact C-N 3.32Å; L18-A20 PolarHBondContact O-N 3.2Å; A20-N23 PolarHBondContact O-N 3.26Å; A20-N24 PolarHBondContact O-N 3.46Å |
| 21 | E | 86.7 | Confident | 82.2 | Confident | 55 Ų | 55 | 106.4 Ų | 106.4 | 26% | 0.257 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.4 | -38.3 | 176.4 | -70.5 | -175.2 | 179.1 | 0 | 0 | 112.3 | E17 L18 N23 N24 A33 K36 | E17-E21 WeakPolarHBondContact O-CG 3.47Å; E17-E21 PolarHBondContact O-N 3.16Å; L18-E21 PolarHBondContact O-N 3.33Å; E21-N23 VanDerWaalsContact C-N 3.3Å; E21-N23 PolarHBondContact O-N 2.74Å; E21-N24 WeakPolarHBondContact O-CB 3.48Å; E21-N24 PolarHBondContact O-N 3.4Å; E21-N24 VanDerWaalsContact O-N 3.16Å; E21-A33 HydrophobicContact CB-CB 3.69Å; E21-K36 IonicContact OE1-NZ 3.32Å; E21-K36 PolarHBondContact OE1-NZ 3.38Å; E21-K36 VanDerWaalsContact OE1-NZ 3.12Å; E21-K36 IonicContact OE2-NZ 3.12Å; E21-K36 PolarHBondContact OE2-NZ 3.21Å |
| 22 | L | 86.4 | Confident | 83.8 | Confident | 63 Ų | 63 | 105 Ų | 105 | 33% | 0.33 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.6 | -33 | 174.6 | -76.9 | 169.1 | 0 | 0 | 0 | 112.8 | L18 N24 R30 A33 V34 V37 | L18-L22 WeakPolarHBondContact O-CB 3.34Å; L18-L22 VanDerWaalsContact O-CG 3.28Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 3.46Å; L22-N24 VanDerWaalsContact C-N 3.3Å; L22-R30 WeakPolarHBondContact O-CD 3.5Å; L22-R30 VanDerWaalsContact O-CG 3.31Å; L22-R30 WeakPolarHBondContact O-CG 3.41Å; L22-A33 HydrophobicContact CD2-CB 3.81Å; L22-A33 HydrophobicContact CG-CB 3.91Å; L22-V34 HydrophobicContact CD2-CG2 3.72Å; L22-V37 HydrophobicContact CD1-CG2 3.88Å; L22-V37 HydrophobicContact CD2-CG2 4.25Å; L22-V37 HydrophobicContact CG-CG2 4.4Å |
| 23 | N | 87.8 | Confident | 85.2 | Confident | 125 Ų | 125 | 95.9 Ų | 95.9 | 67% | 0.668 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | 8.3 | 175.9 | -70.8 | -61.3 | 0 | 0 | 0 | 113.1 | K19 A20 E21 | K19-N23 PolarHBondContact O-N 2.85Å; K19-N23 PolarHBondContact O-ND2 2.85Å; A20-N23 PolarHBondContact O-N 3.26Å; E21-N23 VanDerWaalsContact C-N 3.3Å; E21-N23 PolarHBondContact O-N 2.74Å |
| 24 | N | 92.4 | Very high | 86.2 | Confident | 47 Ų | 47 | 97.3 Ų | 97.3 | 25% | 0.251 | 46% | 0.461 | S | S | . | . | trans | -71.1 | 139.6 | -179 | -160.6 | -80.4 | 0 | 0 | 0 | 111.9 | A20 E21 L22 K26 K29 R30 | A20-N24 PolarHBondContact O-N 3.46Å; E21-N24 WeakPolarHBondContact O-CB 3.48Å; E21-N24 PolarHBondContact O-N 3.4Å; E21-N24 VanDerWaalsContact O-N 3.16Å; L22-N24 VanDerWaalsContact C-N 3.3Å; N24-K26 PolarHBondContact O-N 2.99Å; N24-K26 WeakPolarHBondContact OD1-CB 3.32Å; N24-K26 PolarHBondContact OD1-N 3.32Å; N24-K29 HydrophobicContact CB-CB 4.05Å; N24-K29 HydrophobicContact CB-CD 4.46Å; N24-R30 WeakPolarHBondContact O-CD 3.28Å; N24-R30 VanDerWaalsContact O-CG 3.26Å; N24-R30 WeakPolarHBondContact O-CG 3.49Å; N24-R30 PolarHBondContact O-NE 3.13Å | ||
| 25 | E | 90.7 | Very high | 87.1 | Confident | 181 Ų | 181 | 100 Ų | 100 | 85% | 0.846 | 47% | 0.471 | S | S | * | . | S | Bend | trans | -61.9 | -33.3 | 178.5 | -61.2 | -177.6 | 128.2 | 0 | 0 | 112.2 | K27 R30 | E25-K27 PolarHBondContact O-N 2.95Å; E25-R30 PolarHBondContact O-NH2 3.39Å |
| 26 | K | 92.8 | Very high | 87.6 | Confident | 138 Ų | 138 | 102.2 Ų | 102.2 | 60% | 0.6 | 48% | 0.48 | S | S | * | . | trans | -70.8 | 120.8 | -179.7 | -61.7 | -174.6 | -179.5 | -175.2 | 0 | 111 | N24 E28 K29 R30 | N24-K26 PolarHBondContact O-N 2.99Å; N24-K26 WeakPolarHBondContact OD1-CB 3.32Å; N24-K26 PolarHBondContact OD1-N 3.32Å; K26-E28 VanDerWaalsContact C-N 3.31Å; K26-E28 PolarHBondContact O-N 2.88Å; K26-K29 HydrophobicContact CB-CB 4.22Å; K26-K29 HydrophobicContact CB-CD 4.45Å; K26-K29 HydrophobicContact CB-CG 4.16Å; K26-K29 HydrophobicContact CD-CD 4.4Å; K26-K29 PolarHBondContact O-N 3.49Å; K26-R30 PolarHBondContact O-N 3.43Å | ||
| 27 | K | 90.8 | Very high | 87.9 | Confident | 164 Ų | 164 | 95.8 Ų | 95.8 | 71% | 0.713 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -58.1 | -39.9 | 179.2 | -171.4 | 178.9 | 179.5 | -179.3 | 0 | 113.1 | E25 R30 K31 | E25-K27 PolarHBondContact O-N 2.95Å; K27-R30 PolarHBondContact O-N 3.32Å; K27-K31 PolarHBondContact O-N 2.92Å |
| 28 | E | 90.1 | Very high | 88.2 | Confident | 125 Ų | 125 | 94.5 Ų | 94.5 | 58% | 0.584 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.1 | -41.7 | 178.8 | -66.1 | -50.7 | 129 | 0 | 0 | 112.3 | K26 R30 K31 E32 | K26-E28 VanDerWaalsContact C-N 3.31Å; K26-E28 PolarHBondContact O-N 2.88Å; E28-R30 VanDerWaalsContact C-N 3.34Å; E28-R30 PolarHBondContact O-N 3.16Å; E28-K31 WeakPolarHBondContact O-CB 3.41Å; E28-K31 PolarHBondContact O-N 3.44Å; E28-E32 PolarHBondContact O-N 2.82Å |
| 29 | K | 88.3 | Confident | 88.4 | Confident | 97 Ų | 97 | 95.5 Ų | 95.5 | 42% | 0.422 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.2 | -41 | 176.6 | -73.6 | -165.6 | 167.3 | -164.2 | 0 | 111.9 | N24 K26 K31 E32 A33 | N24-K29 HydrophobicContact CB-CB 4.05Å; N24-K29 HydrophobicContact CB-CD 4.46Å; K26-K29 HydrophobicContact CB-CB 4.22Å; K26-K29 HydrophobicContact CB-CD 4.45Å; K26-K29 HydrophobicContact CB-CG 4.16Å; K26-K29 HydrophobicContact CD-CD 4.4Å; K26-K29 PolarHBondContact O-N 3.49Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 2.68Å; K29-E32 PolarHBondContact O-N 3.4Å; K29-A33 WeakPolarHBondContact O-CB 3.49Å; K29-A33 PolarHBondContact O-N 3.04Å |
| 30 | R | 90.6 | Very high | 88.3 | Confident | 111 Ų | 111 | 89.8 Ų | 89.8 | 42% | 0.419 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62 | -41.4 | 174 | -73.8 | -175 | -84.6 | 168.5 | -7.6 | 112.3 | L22 N24 E25 K26 K27 E28 A33 V34 | L22-R30 WeakPolarHBondContact O-CD 3.5Å; L22-R30 VanDerWaalsContact O-CG 3.31Å; L22-R30 WeakPolarHBondContact O-CG 3.41Å; N24-R30 WeakPolarHBondContact O-CD 3.28Å; N24-R30 VanDerWaalsContact O-CG 3.26Å; N24-R30 WeakPolarHBondContact O-CG 3.49Å; N24-R30 PolarHBondContact O-NE 3.13Å; E25-R30 PolarHBondContact O-NH2 3.39Å; K26-R30 PolarHBondContact O-N 3.43Å; K27-R30 PolarHBondContact O-N 3.32Å; E28-R30 VanDerWaalsContact C-N 3.34Å; E28-R30 PolarHBondContact O-N 3.16Å; R30-A33 PolarHBondContact O-N 3.01Å; R30-V34 VanDerWaalsContact O-CG2 3.3Å; R30-V34 WeakPolarHBondContact O-CG2 3.15Å; R30-V34 PolarHBondContact O-N 3.41Å |
| 31 | K | 90.7 | Very high | 88.1 | Confident | 121 Ų | 121 | 92.6 Ų | 92.6 | 53% | 0.526 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.9 | -41.3 | 178.8 | -169.5 | 179.7 | -178.6 | -176.6 | 0 | 111.8 | K27 E28 K29 K35 | K27-K31 PolarHBondContact O-N 2.92Å; E28-K31 WeakPolarHBondContact O-CB 3.41Å; E28-K31 PolarHBondContact O-N 3.44Å; K29-K31 VanDerWaalsContact C-N 3.34Å; K29-K31 PolarHBondContact O-N 2.68Å; K31-K35 WeakPolarHBondContact O-CG 3.45Å; K31-K35 PolarHBondContact O-N 3.09Å |
| 32 | E | 88.9 | Confident | 87.8 | Confident | 118 Ų | 118 | 95.4 Ų | 95.4 | 55% | 0.551 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -64.9 | -44.4 | 172.4 | -78.4 | -167.6 | 132.8 | 0 | 0 | 112.1 | E28 K29 V34 K35 K36 | E28-E32 PolarHBondContact O-N 2.82Å; K29-E32 PolarHBondContact O-N 3.4Å; E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 PolarHBondContact O-N 3.31Å; E32-K35 WeakPolarHBondContact O-CB 3.48Å; E32-K35 PolarHBondContact O-N 3.06Å; E32-K35 VanDerWaalsContact O-N 3.13Å; E32-K36 WeakPolarHBondContact O-CG 3.38Å; E32-K36 PolarHBondContact O-N 3.4Å |
| 33 | A | 87.8 | Confident | 87.5 | Confident | 0 Ų | 0 | 95.7 Ų | 95.7 | 0% | 0 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -58.6 | -44.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | E21 L22 K29 R30 K35 K36 V37 | E21-A33 HydrophobicContact CB-CB 3.69Å; L22-A33 HydrophobicContact CD2-CB 3.81Å; L22-A33 HydrophobicContact CG-CB 3.91Å; K29-A33 WeakPolarHBondContact O-CB 3.49Å; K29-A33 PolarHBondContact O-N 3.04Å; R30-A33 PolarHBondContact O-N 3.01Å; A33-K35 VanDerWaalsContact C-N 3.34Å; A33-K35 PolarHBondContact O-N 2.89Å; A33-K36 WeakPolarHBondContact O-CB 3.46Å; A33-K36 PolarHBondContact O-N 3.37Å; A33-K36 VanDerWaalsContact O-N 3.16Å; A33-V37 WeakPolarHBondContact O-CG2 3.49Å; A33-V37 PolarHBondContact O-N 3.48Å |
| 34 | V | 88.5 | Confident | 86.9 | Confident | 68 Ų | 68 | 93 Ų | 93 | 41% | 0.412 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.8 | -39.4 | 176.3 | 172.6 | 0 | 0 | 0 | 0 | 111.9 | L22 R30 E32 K36 V37 I38 | L22-V34 HydrophobicContact CD2-CG2 3.72Å; R30-V34 VanDerWaalsContact O-CG2 3.3Å; R30-V34 WeakPolarHBondContact O-CG2 3.15Å; R30-V34 PolarHBondContact O-N 3.41Å; E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 PolarHBondContact O-N 3.31Å; V34-K36 VanDerWaalsContact C-N 3.34Å; V34-K36 PolarHBondContact O-N 3.27Å; V34-V37 WeakPolarHBondContact O-CB 3.28Å; V34-V37 PolarHBondContact O-N 2.85Å; V34-I38 HydrophobicContact CG1-CD1 3.95Å; V34-I38 HydrophobicContact CG1-CG1 4.5Å; V34-I38 WeakPolarHBondContact O-CG1 3.05Å; V34-I38 PolarHBondContact O-N 3.36Å |
| 35 | K | 90 | Very high | 86.2 | Confident | 138 Ų | 138 | 93.4 Ų | 93.4 | 60% | 0.6 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.8 | -41.8 | 174.6 | -72 | 176.9 | 179.2 | -177.5 | 0 | 111.8 | K31 E32 A33 I38 A39 | K31-K35 WeakPolarHBondContact O-CG 3.45Å; K31-K35 PolarHBondContact O-N 3.09Å; E32-K35 WeakPolarHBondContact O-CB 3.48Å; E32-K35 PolarHBondContact O-N 3.06Å; E32-K35 VanDerWaalsContact O-N 3.13Å; A33-K35 VanDerWaalsContact C-N 3.34Å; A33-K35 PolarHBondContact O-N 2.89Å; K35-I38 PolarHBondContact O-N 2.9Å; K35-A39 WeakPolarHBondContact O-CB 3.46Å; K35-A39 PolarHBondContact O-N 2.91Å |
| 36 | K | 85.5 | Confident | 85.5 | Confident | 92 Ų | 92 | 89.3 Ų | 89.3 | 40% | 0.4 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 175.9 | -65.6 | 175.9 | -174.1 | 171 | 0 | 111.6 | L18 E21 E32 A33 V34 A39 A40 | L18-K36 HydrophobicContact CD1-CB 3.93Å; L18-K36 HydrophobicContact CD1-CD 4.07Å; E21-K36 IonicContact OE1-NZ 3.32Å; E21-K36 PolarHBondContact OE1-NZ 3.38Å; E21-K36 VanDerWaalsContact OE1-NZ 3.12Å; E21-K36 IonicContact OE2-NZ 3.12Å; E21-K36 PolarHBondContact OE2-NZ 3.21Å; E32-K36 WeakPolarHBondContact O-CG 3.38Å; E32-K36 PolarHBondContact O-N 3.4Å; A33-K36 WeakPolarHBondContact O-CB 3.46Å; A33-K36 PolarHBondContact O-N 3.37Å; A33-K36 VanDerWaalsContact O-N 3.16Å; V34-K36 VanDerWaalsContact C-N 3.34Å; V34-K36 PolarHBondContact O-N 3.27Å; K36-A39 PolarHBondContact O-N 3.12Å; K36-A40 WeakPolarHBondContact O-CB 3.4Å; K36-A40 PolarHBondContact O-N 2.89Å |
| 37 | V | 85.2 | Confident | 84.4 | Confident | 22 Ų | 22 | 84.7 Ų | 84.7 | 13% | 0.133 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -58.6 | -51.6 | 174.1 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | L18 L22 A33 V34 A39 A40 M41 V47 | L18-V37 HydrophobicContact CD2-CB 4.26Å; L18-V37 HydrophobicContact CD2-CG2 3.35Å; L18-V37 HydrophobicContact CG-CG2 4.2Å; L22-V37 HydrophobicContact CD1-CG2 3.88Å; L22-V37 HydrophobicContact CD2-CG2 4.25Å; L22-V37 HydrophobicContact CG-CG2 4.4Å; A33-V37 WeakPolarHBondContact O-CG2 3.49Å; A33-V37 PolarHBondContact O-N 3.48Å; V34-V37 WeakPolarHBondContact O-CB 3.28Å; V34-V37 PolarHBondContact O-N 2.85Å; V37-A39 VanDerWaalsContact C-N 3.32Å; V37-A39 PolarHBondContact O-N 3.08Å; V37-A40 CarbonylContact O-C 3.58Å; V37-A40 WeakPolarHBondContact O-CA 3.38Å; V37-A40 WeakPolarHBondContact O-CB 3.39Å; V37-A40 PolarHBondContact O-N 3.14Å; V37-A40 VanDerWaalsContact O-N 3.1Å; V37-M41 HydrophobicContact CG1-CG 4.24Å; V37-M41 HydrophobicContact CG1-SD 3.87Å; V37-M41 WeakPolarHBondContact O-CG 3.38Å; V37-M41 PolarHBondContact O-N 3.42Å; V37-V47 HydrophobicContact CG1-CG2 4.2Å |
| 38 | I | 87.1 | Confident | 83.4 | Confident | 99 Ų | 99 | 81.9 Ų | 81.9 | 51% | 0.508 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59 | -47.9 | -179.5 | -68 | 166.3 | 0 | 0 | 0 | 109.5 | V34 K35 A40 M41 T42 | V34-I38 HydrophobicContact CG1-CD1 3.95Å; V34-I38 HydrophobicContact CG1-CG1 4.5Å; V34-I38 WeakPolarHBondContact O-CG1 3.05Å; V34-I38 PolarHBondContact O-N 3.36Å; K35-I38 PolarHBondContact O-N 2.9Å; I38-A40 VanDerWaalsContact C-N 3.28Å; I38-A40 PolarHBondContact O-N 2.79Å; I38-M41 CarbonylContact O-C 3.59Å; I38-M41 WeakPolarHBondContact O-CB 3.42Å; I38-M41 PolarHBondContact O-N 2.94Å; I38-T42 PolarHBondContact O-N 2.87Å; I38-T42 PolarHBondContact O-OG1 3.34Å |
| 39 | A | 84.6 | Confident | 82 | Confident | 48 Ų | 48 | 82.8 Ų | 82.8 | 40% | 0.397 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.6 | -39.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K35 K36 V37 T42 V43 | K35-A39 WeakPolarHBondContact O-CB 3.46Å; K35-A39 PolarHBondContact O-N 2.91Å; K36-A39 PolarHBondContact O-N 3.12Å; V37-A39 VanDerWaalsContact C-N 3.32Å; V37-A39 PolarHBondContact O-N 3.08Å; A39-T42 PolarHBondContact O-N 3.27Å; A39-V43 WeakPolarHBondContact O-CG2 3.38Å; A39-V43 PolarHBondContact O-N 3.32Å |
| 40 | A | 82.2 | Confident | 81.7 | Confident | 16 Ų | 16 | 82.1 Ų | 82.1 | 13% | 0.132 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -65.9 | -39.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | K36 V37 I38 V43 G44 K45 V47 | K36-A40 WeakPolarHBondContact O-CB 3.4Å; K36-A40 PolarHBondContact O-N 2.89Å; V37-A40 CarbonylContact O-C 3.58Å; V37-A40 WeakPolarHBondContact O-CA 3.38Å; V37-A40 WeakPolarHBondContact O-CB 3.39Å; V37-A40 PolarHBondContact O-N 3.14Å; V37-A40 VanDerWaalsContact O-N 3.1Å; I38-A40 VanDerWaalsContact C-N 3.28Å; I38-A40 PolarHBondContact O-N 2.79Å; A40-V43 WeakPolarHBondContact O-CG2 3.25Å; A40-V43 PolarHBondContact O-N 3.5Å; A40-G44 PolarHBondContact O-N 3.32Å; A40-K45 HydrophobicContact CB-CB 4.23Å; A40-K45 HydrophobicContact CB-CD 4.42Å; A40-K45 WeakPolarHBondContact O-CB 3.36Å; A40-K45 PolarHBondContact O-N 2.66Å; A40-V47 HydrophobicContact CB-CG1 3.86Å |
| 41 | M | 82.9 | Confident | 81.2 | Confident | 116 Ų | 116 | 80.6 Ų | 80.6 | 57% | 0.571 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -68.1 | -37.4 | 175.6 | -67.2 | 180 | 79.1 | 0 | 0 | 112 | V37 I38 V43 G44 V47 | V37-M41 HydrophobicContact CG1-CG 4.24Å; V37-M41 HydrophobicContact CG1-SD 3.87Å; V37-M41 WeakPolarHBondContact O-CG 3.38Å; V37-M41 PolarHBondContact O-N 3.42Å; I38-M41 CarbonylContact O-C 3.59Å; I38-M41 WeakPolarHBondContact O-CB 3.42Å; I38-M41 PolarHBondContact O-N 2.94Å; M41-V43 PolarHBondContact O-N 3.46Å; M41-G44 PolarHBondContact O-N 3.14Å; M41-V47 HydrophobicContact CG-CG2 3.69Å; M41-V47 HydrophobicContact SD-CG2 4.16Å |
| 42 | T | 80.9 | Confident | 80.7 | Confident | 115 Ų | 115 | 78.3 Ų | 78.3 | 71% | 0.706 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -63.9 | -30.5 | 178 | -24.7 | 0 | 0 | 0 | 0 | 112.4 | I38 A39 G44 | I38-T42 PolarHBondContact O-N 2.87Å; I38-T42 PolarHBondContact O-OG1 3.34Å; A39-T42 PolarHBondContact O-N 3.27Å; T42-G44 VanDerWaalsContact C-N 3.32Å |
| 43 | V | 79.6 | Confident | 80.2 | Confident | 68 Ų | 68 | 76 Ų | 76 | 41% | 0.412 | 45% | 0.447 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | 3.2 | 176.5 | -60.7 | 0 | 0 | 0 | 0 | 113.5 | F7 A39 A40 M41 K45 | F7-V43 HydrophobicContact CD1-CB 4.01Å; F7-V43 HydrophobicContact CD1-CG1 3.74Å; F7-V43 HydrophobicContact CD1-CG2 3.68Å; F7-V43 HydrophobicContact CE1-CB 4.1Å; F7-V43 HydrophobicContact CE1-CG1 3.41Å; F7-V43 VanDerWaalsContact CE1-CG1 3.41Å; F7-V43 HydrophobicContact CE1-CG2 3.81Å; F7-V43 HydrophobicContact CE2-CG1 4.5Å; F7-V43 HydrophobicContact CG-CG1 4.4Å; F7-V43 HydrophobicContact CZ-CG1 3.83Å; A39-V43 WeakPolarHBondContact O-CG2 3.38Å; A39-V43 PolarHBondContact O-N 3.32Å; A40-V43 WeakPolarHBondContact O-CG2 3.25Å; A40-V43 PolarHBondContact O-N 3.5Å; M41-V43 PolarHBondContact O-N 3.46Å; V43-K45 HydrophobicContact CG2-CB 4.39Å; V43-K45 HydrophobicContact CG2-CD 4.24Å; V43-K45 HydrophobicContact CG2-CG 3.95Å |
| 44 | G | 76.1 | Confident | 79.7 | Confident | 70 Ų | 70 | 80.8 Ų | 80.8 | 72% | 0.722 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.3 | 19.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | A40 M41 T42 | A40-G44 PolarHBondContact O-N 3.32Å; M41-G44 PolarHBondContact O-N 3.14Å; T42-G44 VanDerWaalsContact C-N 3.32Å |
| 45 | K | 76.9 | Confident | 79.1 | Confident | 55 Ų | 55 | 81.6 Ų | 81.6 | 24% | 0.239 | 48% | 0.48 | C | S | . | . | trans | -75.9 | 131.5 | 170.1 | -73.7 | -178.8 | 175 | -171.2 | 0 | 109.4 | F7 E14 A40 V43 | F7-K45 WeakPolarHBondContact O-CE 3.05Å; E14-K45 IonicContact OE2-NZ 2.79Å; E14-K45 PolarHBondContact OE2-NZ 3.2Å; A40-K45 HydrophobicContact CB-CB 4.23Å; A40-K45 HydrophobicContact CB-CD 4.42Å; A40-K45 WeakPolarHBondContact O-CB 3.36Å; A40-K45 PolarHBondContact O-N 2.66Å; V43-K45 HydrophobicContact CG2-CB 4.39Å; V43-K45 HydrophobicContact CG2-CD 4.24Å; V43-K45 HydrophobicContact CG2-CG 3.95Å | ||
| 46 | D | 75.5 | Confident | 78.4 | Confident | 95 Ų | 95 | 77.6 Ų | 77.6 | 51% | 0.508 | 47% | 0.471 | S | S | . | . | trans | -73.9 | 125.3 | 169.4 | -175.1 | 25.4 | 0 | 0 | 0 | 109.7 | I15 S48 T49 | I15-D46 VanDerWaalsContact CD1-O 3.25Å; I15-D46 WeakPolarHBondContact CD1-O 3.24Å; D46-S48 VanDerWaalsContact OD1-CB 3.28Å; D46-S48 WeakPolarHBondContact OD1-CB 3.43Å; D46-S48 PolarHBondContact OD1-N 2.87Å; D46-S48 VanDerWaalsContact OD1-N 3.09Å; D46-S48 PolarHBondContact OD1-OG 2.82Å; D46-T49 PolarHBondContact OD2-OG1 2.99Å | ||
| 47 | V | 70.8 | Confident | 77.8 | Confident | 40 Ų | 40 | 76.5 Ų | 76.5 | 24% | 0.242 | 48% | 0.477 | C | S | . | . | trans | -109.1 | 3.7 | -178.3 | -80.4 | 0 | 0 | 0 | 0 | 111.9 | L18 V37 A40 M41 | L18-V47 HydrophobicContact CD2-CG1 4.42Å; V37-V47 HydrophobicContact CG1-CG2 4.2Å; A40-V47 HydrophobicContact CB-CG1 3.86Å; M41-V47 HydrophobicContact CG-CG2 3.69Å; M41-V47 HydrophobicContact SD-CG2 4.16Å | ||
| 48 | S | 69.9 | Low | 77.2 | Confident | 106 Ų | 106 | 81 Ų | 81 | 74% | 0.741 | 51% | 0.505 | S | S | * | . | trans | -92.5 | -8.3 | -174 | -29.7 | 0 | 0 | 0 | 0 | 113.4 | D46 | D46-S48 VanDerWaalsContact OD1-CB 3.28Å; D46-S48 WeakPolarHBondContact OD1-CB 3.43Å; D46-S48 PolarHBondContact OD1-N 2.87Å; D46-S48 VanDerWaalsContact OD1-N 3.09Å; D46-S48 PolarHBondContact OD1-OG 2.82Å | ||
| 49 | T | 59.8 | Low | 76.3 | Confident | 144 Ų | 144 | 79.4 Ų | 79.4 | 88% | 0.883 | 51% | 0.505 | S | S | * | . | trans | -86.6 | 0 | -170.2 | -21.4 | 0 | 0 | 0 | 0 | 114.6 | I15 D46 | I15-T49 WeakPolarHBondContact CG2-O 3.45Å; D46-T49 PolarHBondContact OD2-OG1 2.99Å |
Retrieved 49 of 49 residues in 14.7 ms
(Link to these results)