| 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 | 46.3 | Very low | 65.4 | Low | 239 Ų | 239 | 129.7 Ų | 129.7 | 100% | 1.177 | 64% | 0.641 | S | S | * | * | 0 | 71.5 | 0 | -161.6 | 172.3 | -177.4 | 0 | 0 | 108.8 | |||||
| 2 | N | 50.3 | Low | 66.8 | Low | 117 Ų | 117 | 132.3 Ų | 132.3 | 63% | 0.626 | 64% | 0.64 | S | S | * | * | trans | -157.2 | 4.3 | 174.3 | -120.1 | -12.5 | 0 | 0 | 0 | 114.3 | Y4 | N2-Y4 PolarHBondContact O-N 3.49Š| ||
| 3 | D | 54.5 | Low | 67.7 | Low | 126 Ų | 126 | 129.2 Ų | 129.2 | 67% | 0.674 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -75 | -22.7 | -173.4 | -56.6 | -64.5 | 0 | 0 | 0 | 114.1 | K5 K6 S7 | D3-K5 VanDerWaalsContact C-N 3.29Å; D3-K5 PolarHBondContact O-N 3.33Å; D3-K6 PolarHBondContact O-N 3.44Å; D3-K6 VanDerWaalsContact O-N 3.15Å; D3-S7 PolarHBondContact O-N 3.15Å |
| 4 | Y | 54.1 | Low | 68.6 | Low | 210 Ų | 210 | 125.9 Ų | 125.9 | 82% | 0.824 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -60.1 | -35.9 | 177.5 | -93.8 | -88 | 0 | 0 | 0 | 113.1 | N2 K6 S7 T8 | N2-Y4 PolarHBondContact O-N 3.49Å; Y4-K6 VanDerWaalsContact C-N 3.3Å; Y4-K6 PolarHBondContact O-N 2.98Å; Y4-S7 PolarHBondContact O-OG 3.03Å; Y4-T8 PolarHBondContact O-N 3.03Å; Y4-T8 PolarHBondContact O-OG1 3.36Å |
| 5 | K | 60.2 | Low | 69.4 | Low | 142 Ų | 142 | 124.7 Ų | 124.7 | 62% | 0.617 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.6 | -30.3 | 179.7 | -68.9 | -176.8 | 179.1 | -178.9 | 0 | 111.8 | D3 I9 | D3-K5 VanDerWaalsContact C-N 3.29Å; D3-K5 PolarHBondContact O-N 3.33Å; K5-I9 WeakPolarHBondContact O-CB 3.13Å; K5-I9 VanDerWaalsContact O-CD1 3.28Å; K5-I9 WeakPolarHBondContact O-CD1 3.28Å; K5-I9 WeakPolarHBondContact O-CG1 3.4Å; K5-I9 PolarHBondContact O-N 3.44Å |
| 6 | K | 64.5 | Low | 69.8 | Low | 163 Ų | 163 | 119.4 Ų | 119.4 | 71% | 0.709 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -75.3 | -39.6 | -175 | -149.2 | 177.3 | -174.9 | -177.3 | 0 | 111.7 | D3 Y4 K10 | D3-K6 PolarHBondContact O-N 3.44Å; D3-K6 VanDerWaalsContact O-N 3.15Å; Y4-K6 VanDerWaalsContact C-N 3.3Å; Y4-K6 PolarHBondContact O-N 2.98Å; K6-K10 WeakPolarHBondContact O-CB 3.21Å; K6-K10 PolarHBondContact O-N 3.34Å; K6-K10 VanDerWaalsContact O-N 3.07Å |
| 7 | S | 73.4 | Confident | 70.2 | Confident | 67 Ų | 67 | 119.6 Ų | 119.6 | 47% | 0.469 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68.9 | -42.1 | 175 | 69.9 | 0 | 0 | 0 | 0 | 111.7 | D3 Y4 I9 K10 S11 | D3-S7 PolarHBondContact O-N 3.15Å; Y4-S7 PolarHBondContact O-OG 3.03Å; S7-I9 PolarHBondContact O-N 3.07Å; S7-K10 WeakPolarHBondContact O-CB 3.22Å; S7-K10 PolarHBondContact O-N 3.14Å; S7-S11 PolarHBondContact O-N 2.81Å; S7-S11 PolarHBondContact O-OG 3.23Å |
| 8 | T | 77.1 | Confident | 70.4 | Confident | 70 Ų | 70 | 120.1 Ų | 120.1 | 43% | 0.429 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -61.6 | -45.9 | 177.4 | -55.7 | 0 | 0 | 0 | 0 | 111.6 | Y4 K10 S11 Y12 | Y4-T8 PolarHBondContact O-N 3.03Å; Y4-T8 PolarHBondContact O-OG1 3.36Å; T8-K10 VanDerWaalsContact C-N 3.32Å; T8-K10 PolarHBondContact O-N 3.45Å; T8-S11 PolarHBondContact O-N 3.32Å; T8-Y12 HydrophobicContact CG2-CD2 3.85Å; T8-Y12 HydrophobicContact CG2-CE2 3.68Å; T8-Y12 VanDerWaalsContact O-CD2 3.22Å; T8-Y12 WeakPolarHBondContact O-CD2 3.29Å; T8-Y12 PolarHBondContact O-N 3.33Å |
| 9 | I | 77.8 | Confident | 70.7 | Confident | 101 Ų | 101 | 121.4 Ų | 121.4 | 52% | 0.518 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61.4 | -41.9 | 176.1 | -69.3 | 164.1 | 0 | 0 | 0 | 110.9 | K5 S7 S11 Y12 I13 | K5-I9 WeakPolarHBondContact O-CB 3.13Å; K5-I9 VanDerWaalsContact O-CD1 3.28Å; K5-I9 WeakPolarHBondContact O-CD1 3.28Å; K5-I9 WeakPolarHBondContact O-CG1 3.4Å; K5-I9 PolarHBondContact O-N 3.44Å; S7-I9 PolarHBondContact O-N 3.07Å; I9-S11 PolarHBondContact O-N 2.81Å; I9-Y12 PolarHBondContact O-N 3.43Å; I9-I13 HydrophobicContact CG2-CD1 3.82Å; I9-I13 HydrophobicContact CG2-CG1 4.43Å; I9-I13 WeakPolarHBondContact O-CG1 3.47Å; I9-I13 PolarHBondContact O-N 2.93Å |
| 10 | K | 79.4 | Confident | 70.8 | Confident | 125 Ų | 125 | 122.4 Ų | 122.4 | 54% | 0.543 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -61.1 | -44.8 | 177.6 | -164.8 | 177.3 | -172.9 | -81.6 | 0 | 111.9 | K6 S7 T8 Y12 I13 E14 | K6-K10 WeakPolarHBondContact O-CB 3.21Å; K6-K10 PolarHBondContact O-N 3.34Å; K6-K10 VanDerWaalsContact O-N 3.07Å; S7-K10 WeakPolarHBondContact O-CB 3.22Å; S7-K10 PolarHBondContact O-N 3.14Å; T8-K10 VanDerWaalsContact C-N 3.32Å; T8-K10 PolarHBondContact O-N 3.45Å; K10-Y12 VanDerWaalsContact C-N 3.33Å; K10-Y12 PolarHBondContact O-N 3.36Å; K10-I13 PolarHBondContact O-N 3.42Å; K10-E14 IonicContact NZ-OE1 2.66Å; K10-E14 PolarHBondContact NZ-OE1 2.91Å; K10-E14 WeakPolarHBondContact O-CG 3.15Å; K10-E14 PolarHBondContact O-N 2.95Å |
| 11 | S | 82.3 | Confident | 70.9 | Confident | 67 Ų | 67 | 125.7 Ų | 125.7 | 47% | 0.469 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.4 | -36.6 | 176.9 | -63.4 | 0 | 0 | 0 | 0 | 112.7 | S7 T8 I9 Q15 | S7-S11 PolarHBondContact O-N 2.81Å; S7-S11 PolarHBondContact O-OG 3.23Å; T8-S11 PolarHBondContact O-N 3.32Å; I9-S11 PolarHBondContact O-N 2.81Å; S11-Q15 VanDerWaalsContact O-CB 3.23Å; S11-Q15 WeakPolarHBondContact O-CB 3.5Å; S11-Q15 PolarHBondContact O-N 3.2Å |
| 12 | Y | 81.4 | Confident | 71.9 | Confident | 160 Ų | 160 | 119.1 Ų | 119.1 | 63% | 0.627 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66 | -38.3 | 173.3 | -86.8 | -68.5 | 0 | 0 | 0 | 112.6 | T8 I9 K10 A16 | T8-Y12 HydrophobicContact CG2-CD2 3.85Å; T8-Y12 HydrophobicContact CG2-CE2 3.68Å; T8-Y12 VanDerWaalsContact O-CD2 3.22Å; T8-Y12 WeakPolarHBondContact O-CD2 3.29Å; T8-Y12 PolarHBondContact O-N 3.33Å; I9-Y12 PolarHBondContact O-N 3.43Å; K10-Y12 VanDerWaalsContact C-N 3.33Å; K10-Y12 PolarHBondContact O-N 3.36Å; Y12-A16 VanDerWaalsContact O-CB 3.23Å; Y12-A16 WeakPolarHBondContact O-CB 3.23Å; Y12-A16 PolarHBondContact O-N 3.27Å |
| 13 | I | 78.5 | Confident | 72.8 | Confident | 92 Ų | 92 | 116.6 Ų | 116.6 | 47% | 0.472 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.4 | -47.7 | 176.4 | -68 | 167.6 | 0 | 0 | 0 | 110.2 | I9 K10 Q15 A16 E17 | I9-I13 HydrophobicContact CG2-CD1 3.82Å; I9-I13 HydrophobicContact CG2-CG1 4.43Å; I9-I13 WeakPolarHBondContact O-CG1 3.47Å; I9-I13 PolarHBondContact O-N 2.93Å; K10-I13 PolarHBondContact O-N 3.42Å; I13-Q15 VanDerWaalsContact C-N 3.33Å; I13-Q15 PolarHBondContact O-N 2.98Å; I13-A16 PolarHBondContact O-N 3.48Å; I13-E17 WeakPolarHBondContact O-CB 3.46Å; I13-E17 WeakPolarHBondContact O-CG 3.23Å; I13-E17 PolarHBondContact O-N 2.94Å |
| 14 | E | 80.4 | Confident | 73.3 | Confident | 83 Ų | 83 | 118.3 Ų | 118.3 | 39% | 0.388 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -60.5 | -42.9 | 177.9 | -72.8 | 168.8 | 178 | 0 | 0 | 111.5 | K10 E17 D18 | K10-E14 IonicContact NZ-OE1 2.66Å; K10-E14 PolarHBondContact NZ-OE1 2.91Å; K10-E14 WeakPolarHBondContact O-CG 3.15Å; K10-E14 PolarHBondContact O-N 2.95Å; E14-E17 PolarHBondContact O-N 3.21Å; E14-D18 PolarHBondContact O-N 3.39Å |
| 15 | Q | 81 | Confident | 73.9 | Confident | 108 Ų | 108 | 111.9 Ų | 111.9 | 51% | 0.505 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.2 | -35.9 | 178 | -166.6 | 177.4 | 16.3 | 0 | 0 | 112.6 | S11 I13 Q19 | S11-Q15 VanDerWaalsContact O-CB 3.23Å; S11-Q15 WeakPolarHBondContact O-CB 3.5Å; S11-Q15 PolarHBondContact O-N 3.2Å; I13-Q15 VanDerWaalsContact C-N 3.33Å; I13-Q15 PolarHBondContact O-N 2.98Å; Q15-Q19 WeakPolarHBondContact O-CB 3.33Å; Q15-Q19 VanDerWaalsContact O-CG 3.29Å; Q15-Q19 WeakPolarHBondContact O-CG 3.42Å; Q15-Q19 PolarHBondContact O-N 3.45Å; Q15-Q19 VanDerWaalsContact O-N 3.14Å |
| 16 | A | 75.8 | Confident | 74.3 | Confident | 41 Ų | 41 | 108.9 Ų | 108.9 | 34% | 0.339 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.2 | -39.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y12 I13 Q19 L20 | Y12-A16 VanDerWaalsContact O-CB 3.23Å; Y12-A16 WeakPolarHBondContact O-CB 3.23Å; Y12-A16 PolarHBondContact O-N 3.27Å; I13-A16 PolarHBondContact O-N 3.48Å; A16-Q19 PolarHBondContact O-N 3.27Å; A16-L20 HydrophobicContact CB-CD1 4.31Å; A16-L20 WeakPolarHBondContact O-CB 3.49Å; A16-L20 WeakPolarHBondContact O-CG 3.41Å; A16-L20 PolarHBondContact O-N 2.78Å |
| 17 | E | 75.9 | Confident | 74.4 | Confident | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.3 | -47.5 | 172.6 | -78.3 | -173.4 | 163.3 | 0 | 0 | 110.7 | I13 E14 Q19 L20 R21 | I13-E17 WeakPolarHBondContact O-CB 3.46Å; I13-E17 WeakPolarHBondContact O-CG 3.23Å; I13-E17 PolarHBondContact O-N 2.94Å; E14-E17 PolarHBondContact O-N 3.21Å; E17-Q19 VanDerWaalsContact C-N 3.27Å; E17-Q19 PolarHBondContact O-N 3.07Å; E17-L20 PolarHBondContact O-N 3.29Å; E17-R21 WeakPolarHBondContact O-CA 3Å; E17-R21 WeakPolarHBondContact O-CB 2.9Å; E17-R21 PolarHBondContact O-N 2.66Å |
| 18 | D | 75.3 | Confident | 73.9 | Confident | 128 Ų | 128 | 105.6 Ų | 105.6 | 68% | 0.684 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.7 | -31.2 | 179 | -81.4 | -16.5 | 0 | 0 | 0 | 113.4 | E14 | E14-D18 PolarHBondContact O-N 3.39Å |
| 19 | Q | 75.8 | Confident | 73.5 | Confident | 146 Ų | 146 | 104.9 Ų | 104.9 | 68% | 0.682 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -84.9 | -34.3 | 179.1 | -72.5 | 179.9 | 20.1 | 0 | 0 | 113.8 | Q15 A16 E17 | Q15-Q19 WeakPolarHBondContact O-CB 3.33Å; Q15-Q19 VanDerWaalsContact O-CG 3.29Å; Q15-Q19 WeakPolarHBondContact O-CG 3.42Å; Q15-Q19 PolarHBondContact O-N 3.45Å; Q15-Q19 VanDerWaalsContact O-N 3.14Å; A16-Q19 PolarHBondContact O-N 3.27Å; E17-Q19 VanDerWaalsContact C-N 3.27Å; E17-Q19 PolarHBondContact O-N 3.07Å |
| 20 | L | 71.3 | Confident | 72.8 | Confident | 140 Ų | 140 | 108.2 Ų | 108.2 | 73% | 0.733 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -92.9 | -18.1 | -177.7 | -64.9 | 170.5 | 0 | 0 | 0 | 112.5 | A16 E17 E22 | A16-L20 HydrophobicContact CB-CD1 4.31Å; A16-L20 WeakPolarHBondContact O-CB 3.49Å; A16-L20 WeakPolarHBondContact O-CG 3.41Å; A16-L20 PolarHBondContact O-N 2.78Å; E17-L20 PolarHBondContact O-N 3.29Å; L20-E22 PolarHBondContact O-N 2.93Å; L20-E22 VanDerWaalsContact O-N 3.07Å |
| 21 | R | 72.8 | Confident | 72 | Confident | 192 Ų | 192 | 107.3 Ų | 107.3 | 73% | 0.725 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -68 | 109.5 | 173.8 | -175.1 | 177.2 | -155.5 | -175 | 7.1 | 107.6 | E17 | E17-R21 WeakPolarHBondContact O-CA 3Å; E17-R21 WeakPolarHBondContact O-CB 2.9Å; E17-R21 PolarHBondContact O-N 2.66Å |
| 22 | E | 68.1 | Low | 71.2 | Confident | 101 Ų | 101 | 108.1 Ų | 108.1 | 47% | 0.472 | 53% | 0.532 | S | S | . | . | trans | -57 | 130.7 | 174 | -67.3 | -149.8 | 167.6 | 0 | 0 | 109.5 | L20 K24 L27 | L20-E22 PolarHBondContact O-N 2.93Å; L20-E22 VanDerWaalsContact O-N 3.07Å; E22-K24 PolarHBondContact O-N 3.22Å; E22-L27 HydrophobicContact CB-CD1 4.05Å; E22-L27 HydrophobicContact CB-CD2 4.31Å; E22-L27 HydrophobicContact CB-CG 3.87Å | ||
| 23 | P | 69 | Low | 70.5 | Confident | 64 Ų | 64 | 104.1 Ų | 104.1 | 42% | 0.416 | 53% | 0.526 | S | S | . | . | trans | -61.9 | 137.2 | 179.5 | 27 | -33.6 | 0 | 0 | 0 | 108 | S25 D26 L27 | P23-S25 PolarHBondContact O-N 3.28Å; P23-D26 HydrophobicContact CG-CB 3.86Å; P23-D26 WeakPolarHBondContact CG-OD2 3.4Å; P23-D26 PolarHBondContact O-N 3.39Å; P23-L27 PolarHBondContact O-N 3.12Å | ||
| 24 | K | 64.6 | Low | 69.8 | Low | 163 Ų | 163 | 104.6 Ų | 104.6 | 71% | 0.709 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -53.6 | -29.9 | -177.3 | -174.4 | 178.6 | 177.2 | -179.5 | 0 | 112.4 | E22 D26 L28 | E22-K24 PolarHBondContact O-N 3.22Å; K24-D26 VanDerWaalsContact C-N 3.34Å; K24-L28 HydrophobicContact CG-CD1 3.91Å; K24-L28 HydrophobicContact CG-CG 4.27Å; K24-L28 VanDerWaalsContact O-CB 3.28Å; K24-L28 WeakPolarHBondContact O-CB 3.5Å; K24-L28 WeakPolarHBondContact O-CD1 3.41Å; K24-L28 WeakPolarHBondContact O-CG 3.21Å; K24-L28 PolarHBondContact O-N 2.94Å |
| 25 | S | 66.8 | Low | 69 | Low | 75 Ų | 75 | 102.5 Ų | 102.5 | 52% | 0.524 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.4 | -41.3 | 173.7 | 51.7 | 0 | 0 | 0 | 0 | 112.9 | P23 A29 | P23-S25 PolarHBondContact O-N 3.28Å; S25-A29 WeakPolarHBondContact O-CB 3.37Å; S25-A29 PolarHBondContact O-N 3.25Å |
| 26 | D | 69.6 | Low | 68.2 | Low | 79 Ų | 79 | 101.3 Ų | 101.3 | 42% | 0.422 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -78.2 | -42.3 | -174.2 | -64.7 | 7.7 | 0 | 0 | 0 | 109.4 | P23 K24 L28 A29 Y30 | P23-D26 HydrophobicContact CG-CB 3.86Å; P23-D26 WeakPolarHBondContact CG-OD2 3.4Å; P23-D26 PolarHBondContact O-N 3.39Å; K24-D26 VanDerWaalsContact C-N 3.34Å; D26-L28 VanDerWaalsContact C-N 3.35Å; D26-L28 PolarHBondContact O-N 3.31Å; D26-A29 WeakPolarHBondContact O-CB 3.19Å; D26-A29 PolarHBondContact O-N 3.42Å; D26-A29 VanDerWaalsContact O-N 3.12Å; D26-Y30 WeakPolarHBondContact O-CD2 3.49Å; D26-Y30 PolarHBondContact O-N 3.22Å |
| 27 | L | 65.7 | Low | 67.6 | Low | 81 Ų | 81 | 105 Ų | 105 | 42% | 0.424 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -55.6 | -48.5 | 170 | -75.9 | 166.5 | 0 | 0 | 0 | 111.8 | E22 P23 A29 Y30 E31 | E22-L27 HydrophobicContact CB-CD1 4.05Å; E22-L27 HydrophobicContact CB-CD2 4.31Å; E22-L27 HydrophobicContact CB-CG 3.87Å; P23-L27 PolarHBondContact O-N 3.12Å; L27-A29 VanDerWaalsContact C-N 3.29Å; L27-A29 PolarHBondContact O-N 2.99Å; L27-Y30 PolarHBondContact O-N 2.83Å; L27-E31 PolarHBondContact O-N 3.36Å |
| 28 | L | 63.6 | Low | 67.3 | Low | 80 Ų | 80 | 104.2 Ų | 104.2 | 42% | 0.419 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67 | -29.4 | 178 | -71.5 | 173.9 | 0 | 0 | 0 | 112.6 | K24 D26 Y30 E31 L32 | K24-L28 HydrophobicContact CG-CD1 3.91Å; K24-L28 HydrophobicContact CG-CG 4.27Å; K24-L28 VanDerWaalsContact O-CB 3.28Å; K24-L28 WeakPolarHBondContact O-CB 3.5Å; K24-L28 WeakPolarHBondContact O-CD1 3.41Å; K24-L28 WeakPolarHBondContact O-CG 3.21Å; K24-L28 PolarHBondContact O-N 2.94Å; D26-L28 VanDerWaalsContact C-N 3.35Å; D26-L28 PolarHBondContact O-N 3.31Å; L28-Y30 VanDerWaalsContact C-N 3.33Å; L28-E31 PolarHBondContact O-N 3Å; L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 WeakPolarHBondContact O-CD1 3.41Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 2.94Å |
| 29 | A | 69.1 | Low | 66.9 | Low | 55 Ų | 55 | 106.7 Ų | 106.7 | 46% | 0.455 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66 | -34.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S25 D26 L27 P33 | S25-A29 WeakPolarHBondContact O-CB 3.37Å; S25-A29 PolarHBondContact O-N 3.25Å; D26-A29 WeakPolarHBondContact O-CB 3.19Å; D26-A29 PolarHBondContact O-N 3.42Å; D26-A29 VanDerWaalsContact O-N 3.12Å; L27-A29 VanDerWaalsContact C-N 3.29Å; L27-A29 PolarHBondContact O-N 2.99Å; A29-P33 WeakPolarHBondContact O-CD 3.31Å |
| 30 | Y | 63.1 | Low | 66.6 | Low | 170 Ų | 170 | 106.3 Ų | 106.3 | 67% | 0.667 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -72.9 | -33.8 | 173.3 | -67.3 | -68.9 | 0 | 0 | 0 | 112.8 | D26 L27 L28 P33 | D26-Y30 WeakPolarHBondContact O-CD2 3.49Å; D26-Y30 PolarHBondContact O-N 3.22Å; L27-Y30 PolarHBondContact O-N 2.83Å; L28-Y30 VanDerWaalsContact C-N 3.33Å; Y30-P33 WeakPolarHBondContact O-CD 3.36Å |
| 31 | E | 62.6 | Low | 66.3 | Low | 106 Ų | 106 | 107.4 Ų | 107.4 | 50% | 0.495 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -84.3 | -25.6 | -178.1 | -67 | -174.9 | 171.9 | 0 | 0 | 113.4 | L27 L28 I34 C35 | L27-E31 PolarHBondContact O-N 3.36Å; L28-E31 PolarHBondContact O-N 3Å; E31-I34 WeakPolarHBondContact O-CB 3.17Å; E31-I34 PolarHBondContact O-N 3.32Å; E31-C35 WeakPolarHBondContact O-CB 3.49Å; E31-C35 PolarHBondContact O-N 2.98Å; E31-C35 PolarHBondContact O-SG 3.4Å; E31-C35 VanDerWaalsContact O-SG 3.34Å |
| 32 | L | 64.8 | Low | 65.9 | Low | 85 Ų | 85 | 103.7 Ų | 103.7 | 45% | 0.445 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -53.9 | -46.1 | -179.4 | -95.2 | 160.3 | 0 | 0 | 0 | 114.2 | L28 I34 C35 S36 L42 | L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 WeakPolarHBondContact O-CD1 3.41Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 2.94Å; L32-I34 VanDerWaalsContact C-N 3.33Å; L32-I34 PolarHBondContact O-N 3.2Å; L32-C35 PolarHBondContact O-N 2.91Å; L32-S36 WeakPolarHBondContact O-CB 3.5Å; L32-S36 PolarHBondContact O-N 2.94Å; L32-L42 HydrophobicContact CD2-CD2 3.56Å |
| 33 | P | 66.4 | Low | 65.9 | Low | 76 Ų | 76 | 107.3 Ų | 107.3 | 49% | 0.494 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.1 | -40.1 | 174.8 | -23.2 | 32.9 | 0 | 0 | 0 | 112.6 | A29 Y30 S36 V37 | A29-P33 WeakPolarHBondContact O-CD 3.31Å; Y30-P33 WeakPolarHBondContact O-CD 3.36Å; P33-S36 PolarHBondContact O-N 3.06Å; P33-V37 VanDerWaalsContact O-CG2 3.27Å; P33-V37 WeakPolarHBondContact O-CG2 3.14Å; P33-V37 PolarHBondContact O-N 3.45Å |
| 34 | I | 65.3 | Low | 66.1 | Low | 102 Ų | 102 | 107 Ų | 107 | 52% | 0.523 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -69.1 | -45.4 | 180 | -64.8 | 171.3 | 0 | 0 | 0 | 110 | E31 L32 S36 V37 L38 | E31-I34 WeakPolarHBondContact O-CB 3.17Å; E31-I34 PolarHBondContact O-N 3.32Å; L32-I34 VanDerWaalsContact C-N 3.33Å; L32-I34 PolarHBondContact O-N 3.2Å; I34-S36 VanDerWaalsContact C-N 3.28Å; I34-S36 PolarHBondContact O-N 3.45Å; I34-V37 PolarHBondContact O-N 2.83Å; I34-L38 HydrophobicContact CG2-CD1 3.62Å; I34-L38 HydrophobicContact CG2-CG 4.26Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.31Å; I34-L38 WeakPolarHBondContact O-CG 3.37Å; I34-L38 PolarHBondContact O-N 3.34Å |
| 35 | C | 62.1 | Low | 67.1 | Low | 38 Ų | 38 | 102.5 Ų | 102.5 | 26% | 0.257 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -58.9 | -39.6 | 174.9 | -70.3 | 0 | 0 | 0 | 0 | 111.8 | E31 L32 Q39 F40 L42 | E31-C35 WeakPolarHBondContact O-CB 3.49Å; E31-C35 PolarHBondContact O-N 2.98Å; E31-C35 PolarHBondContact O-SG 3.4Å; E31-C35 VanDerWaalsContact O-SG 3.34Å; L32-C35 PolarHBondContact O-N 2.91Å; C35-Q39 PolarHBondContact O-N 3Å; C35-F40 HydrophobicContact CB-CB 4.28Å; C35-F40 PolarHBondContact O-N 3.37Å; C35-L42 HydrophobicContact CB-CD2 4.4Å |
| 36 | S | 64 | Low | 67.7 | Low | 83 Ų | 83 | 105 Ų | 105 | 58% | 0.58 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -67.1 | -40.7 | 175.4 | -173.4 | 0 | 0 | 0 | 0 | 112.9 | L32 P33 I34 Q39 | L32-S36 WeakPolarHBondContact O-CB 3.5Å; L32-S36 PolarHBondContact O-N 2.94Å; P33-S36 PolarHBondContact O-N 3.06Å; I34-S36 VanDerWaalsContact C-N 3.28Å; I34-S36 PolarHBondContact O-N 3.45Å; S36-Q39 PolarHBondContact O-N 3.29Å |
| 37 | V | 63.1 | Low | 68.4 | Low | 119 Ų | 119 | 107.7 Ų | 107.7 | 72% | 0.721 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -69.3 | -38.6 | 178.8 | 168 | 0 | 0 | 0 | 0 | 111.4 | P33 I34 Q39 | P33-V37 VanDerWaalsContact O-CG2 3.27Å; P33-V37 WeakPolarHBondContact O-CG2 3.14Å; P33-V37 PolarHBondContact O-N 3.45Å; I34-V37 PolarHBondContact O-N 2.83Å; V37-Q39 PolarHBondContact O-N 2.84Å |
| 38 | L | 69.8 | Low | 69.1 | Low | 106 Ų | 106 | 108 Ų | 108 | 56% | 0.555 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | 5.7 | -179.9 | -65.3 | 177.3 | 0 | 0 | 0 | 113.4 | I34 F40 | I34-L38 HydrophobicContact CG2-CD1 3.62Å; I34-L38 HydrophobicContact CG2-CG 4.26Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.31Å; I34-L38 WeakPolarHBondContact O-CG 3.37Å; I34-L38 PolarHBondContact O-N 3.34Å; L38-F40 HydrophobicContact CB-CD2 3.57Å; L38-F40 HydrophobicContact CB-CE2 3.84Å; L38-F40 HydrophobicContact CD1-CD2 4.19Å; L38-F40 HydrophobicContact CD1-CE2 3.88Å; L38-F40 PolarHBondContact O-N 3.08Å; L38-F40 VanDerWaalsContact O-N 3.13Å |
| 39 | Q | 68.2 | Low | 69.9 | Low | 179 Ų | 179 | 107.2 Ų | 107.2 | 84% | 0.836 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53.9 | 27.2 | -176.6 | -57.3 | -174.3 | -11.4 | 0 | 0 | 113.7 | C35 S36 V37 R41 | C35-Q39 PolarHBondContact O-N 3Å; S36-Q39 PolarHBondContact O-N 3.29Å; V37-Q39 PolarHBondContact O-N 2.84Å; Q39-R41 PolarHBondContact O-N 2.93Å |
| 40 | F | 68.3 | Low | 70.4 | Confident | 138 Ų | 138 | 108.6 Ų | 108.6 | 61% | 0.605 | 55% | 0.549 | S | S | * | . | trans | -63.2 | 135.3 | 171.5 | -85.8 | -76.2 | 0 | 0 | 0 | 108.9 | C35 L38 L42 | C35-F40 HydrophobicContact CB-CB 4.28Å; C35-F40 PolarHBondContact O-N 3.37Å; L38-F40 HydrophobicContact CB-CD2 3.57Å; L38-F40 HydrophobicContact CB-CE2 3.84Å; L38-F40 HydrophobicContact CD1-CD2 4.19Å; L38-F40 HydrophobicContact CD1-CE2 3.88Å; L38-F40 PolarHBondContact O-N 3.08Å; L38-F40 VanDerWaalsContact O-N 3.13Å; F40-L42 PolarHBondContact O-N 3.26Å; F40-L42 VanDerWaalsContact O-N 3.08Å | ||
| 41 | R | 65.3 | Low | 71.3 | Confident | 163 Ų | 163 | 103.7 Ų | 103.7 | 62% | 0.615 | 54% | 0.537 | S | S | * | . | trans | -62 | 117.1 | 169.1 | -81.7 | -173.8 | 177.3 | 161.4 | -0.7 | 108.1 | Q39 Q43 P44 E48 | Q39-R41 PolarHBondContact O-N 2.93Å; R41-Q43 PolarHBondContact O-N 3.46Å; R41-Q43 VanDerWaalsContact O-N 3.15Å; R41-P44 WeakPolarHBondContact O-CD 3.28Å; R41-E48 IonicContact NH1-OE1 2.86Å; R41-E48 PolarHBondContact NH1-OE1 3.15Å; R41-E48 IonicContact NH1-OE2 3.51Å | ||
| 42 | L | 64.1 | Low | 72.1 | Confident | 115 Ų | 115 | 103.9 Ų | 103.9 | 60% | 0.602 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -60.3 | -21.4 | 173.7 | -69.6 | 169.9 | 0 | 0 | 0 | 112.4 | L32 C35 F40 | L32-L42 HydrophobicContact CD2-CD2 3.56Å; C35-L42 HydrophobicContact CB-CD2 4.4Å; F40-L42 PolarHBondContact O-N 3.26Å; F40-L42 VanDerWaalsContact O-N 3.08Å |
| 43 | Q | 68.8 | Low | 72.6 | Confident | 177 Ų | 177 | 102.5 Ų | 102.5 | 83% | 0.827 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -135.5 | 80.2 | 178.5 | -64.7 | 170.3 | 8.9 | 0 | 0 | 108.7 | R41 | R41-Q43 PolarHBondContact O-N 3.46Å; R41-Q43 VanDerWaalsContact O-N 3.15Å |
| 44 | P | 74.1 | Confident | 73.2 | Confident | 58 Ų | 58 | 102.8 Ų | 102.8 | 38% | 0.377 | 53% | 0.531 | S | S | . | . | trans | -71.7 | 157.7 | 172.9 | 7.6 | 6.8 | 0 | 0 | 0 | 110.2 | R41 E48 I49 | R41-P44 WeakPolarHBondContact O-CD 3.28Å; P44-E48 HydrophobicContact CB-CB 4.37Å; P44-I49 HydrophobicContact CB-CD1 3.9Å; P44-I49 HydrophobicContact CB-CG1 3.82Å; P44-I49 HydrophobicContact CG-CD1 3.76Å; P44-I49 HydrophobicContact CG-CG1 3.91Å | ||
| 45 | T | 83.8 | Confident | 73.6 | Confident | 68 Ų | 68 | 107.6 Ų | 107.6 | 42% | 0.417 | 54% | 0.542 | S | S | . | . | trans | -76.3 | 159.1 | 175.4 | 62.4 | 0 | 0 | 0 | 0 | 110.9 | D47 E48 I49 | T45-D47 PolarHBondContact O-N 3.32Å; T45-E48 PolarHBondContact N-OE2 3.08Å; T45-E48 VanDerWaalsContact N-OE2 3.14Å; T45-E48 WeakPolarHBondContact O-CB 3.42Å; T45-E48 PolarHBondContact O-N 3.4Å; T45-E48 VanDerWaalsContact O-N 3.1Å; T45-E48 WeakPolarHBondContact OG1-CG 3.44Å; T45-I49 WeakPolarHBondContact O-CG1 3.3Å; T45-I49 PolarHBondContact O-N 3.33Å | ||
| 46 | I | 80.8 | Confident | 74 | Confident | 126 Ų | 126 | 111.9 Ų | 111.9 | 65% | 0.646 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -57.4 | -40.1 | 177.4 | -68.2 | 172.4 | 0 | 0 | 0 | 110.7 | E48 I49 Q50 | I46-E48 VanDerWaalsContact C-N 3.25Å; I46-E48 PolarHBondContact O-N 3.13Å; I46-I49 PolarHBondContact O-N 3.16Å; I46-Q50 WeakPolarHBondContact O-CB 3.35Å; I46-Q50 PolarHBondContact O-N 2.96Å |
| 47 | D | 84.7 | Confident | 74.2 | Confident | 137 Ų | 137 | 114.2 Ų | 114.2 | 73% | 0.733 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -61.4 | -32.9 | 178.9 | -56.7 | -38 | 0 | 0 | 0 | 113 | T45 P51 | T45-D47 PolarHBondContact O-N 3.32Å; D47-P51 WeakPolarHBondContact O-CD 3.5Å |
| 48 | E | 79.1 | Confident | 73.9 | Confident | 86 Ų | 86 | 117.3 Ų | 117.3 | 40% | 0.402 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -75.4 | -30.3 | 176 | -69 | 170.4 | 165.3 | 0 | 0 | 111.7 | R41 P44 T45 I46 H52 | R41-E48 IonicContact NH1-OE1 2.86Å; R41-E48 PolarHBondContact NH1-OE1 3.15Å; R41-E48 IonicContact NH1-OE2 3.51Å; P44-E48 HydrophobicContact CB-CB 4.37Å; T45-E48 PolarHBondContact N-OE2 3.08Å; T45-E48 VanDerWaalsContact N-OE2 3.14Å; T45-E48 WeakPolarHBondContact O-CB 3.42Å; T45-E48 PolarHBondContact O-N 3.4Å; T45-E48 VanDerWaalsContact O-N 3.1Å; T45-E48 WeakPolarHBondContact OG1-CG 3.44Å; I46-E48 VanDerWaalsContact C-N 3.25Å; I46-E48 PolarHBondContact O-N 3.13Å; E48-H52 PolarHBondContact O-CD2 3.16Å |
| 49 | I | 80 | Confident | 73.2 | Confident | 65 Ų | 65 | 121.8 Ų | 121.8 | 33% | 0.333 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -89.7 | -34.7 | -174.8 | -62.4 | 166.4 | 0 | 0 | 0 | 112.1 | P44 T45 I46 P51 H52 V53 | P44-I49 HydrophobicContact CB-CD1 3.9Å; P44-I49 HydrophobicContact CB-CG1 3.82Å; P44-I49 HydrophobicContact CG-CD1 3.76Å; P44-I49 HydrophobicContact CG-CG1 3.91Å; T45-I49 WeakPolarHBondContact O-CG1 3.3Å; T45-I49 PolarHBondContact O-N 3.33Å; I46-I49 PolarHBondContact O-N 3.16Å; I49-P51 VanDerWaalsContact C-CD 3.46Å; I49-H52 WeakPolarHBondContact O-CB 3.35Å; I49-H52 PolarHBondContact O-N 2.92Å; I49-V53 HydrophobicContact CG2-CG2 3.59Å; I49-V53 PolarHBondContact O-N 3.09Å; I49-V53 VanDerWaalsContact O-N 3.09Å |
| 50 | Q | 79.4 | Confident | 72 | Confident | 84 Ų | 84 | 125.3 Ų | 125.3 | 39% | 0.393 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -52.7 | -46.3 | -170.8 | -167.2 | 64.3 | 50.2 | 0 | 0 | 113.7 | I46 H52 V53 D54 | I46-Q50 WeakPolarHBondContact O-CB 3.35Å; I46-Q50 PolarHBondContact O-N 2.96Å; Q50-H52 PolarHBondContact O-N 3.04Å; Q50-H52 VanDerWaalsContact O-N 3.16Å; Q50-V53 PolarHBondContact O-N 3.14Å; Q50-V53 VanDerWaalsContact O-N 3.16Å; Q50-D54 PolarHBondContact NE2-OD1 2.99Å; Q50-D54 PolarHBondContact O-N 3.04Å |
| 51 | P | 82.8 | Confident | 72.2 | Confident | 66 Ų | 66 | 124.7 Ų | 124.7 | 43% | 0.429 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64 | -25.3 | -179.9 | -20.2 | 33.1 | 0 | 0 | 0 | 113.8 | D47 I49 R55 | D47-P51 WeakPolarHBondContact O-CD 3.5Å; I49-P51 VanDerWaalsContact C-CD 3.46Å; P51-R55 VanDerWaalsContact O-CG 3.3Å; P51-R55 WeakPolarHBondContact O-CG 3.33Å; P51-R55 PolarHBondContact O-N 3.45Å |
| 52 | H | 79.7 | Confident | 72.5 | Confident | 111 Ų | 111 | 122.7 Ų | 122.7 | 51% | 0.514 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -83.1 | -37.6 | 177.4 | -60.6 | -75.2 | 0 | 0 | 0 | 111.4 | E48 I49 Q50 R55 L56 | E48-H52 PolarHBondContact O-CD2 3.16Å; I49-H52 WeakPolarHBondContact O-CB 3.35Å; I49-H52 PolarHBondContact O-N 2.92Å; Q50-H52 PolarHBondContact O-N 3.04Å; Q50-H52 VanDerWaalsContact O-N 3.16Å; H52-R55 PolarHBondContact O-N 3.27Å; H52-L56 WeakPolarHBondContact O-CG 3.35Å; H52-L56 PolarHBondContact O-N 3.17Å; H52-L56 VanDerWaalsContact O-N 3.08Å |
| 53 | V | 75.8 | Confident | 73 | Confident | 56 Ų | 56 | 123.1 Ų | 123.1 | 34% | 0.339 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63 | -44.5 | 173.2 | 172 | 0 | 0 | 0 | 0 | 110.5 | I49 Q50 R55 L56 Q57 | I49-V53 HydrophobicContact CG2-CG2 3.59Å; I49-V53 PolarHBondContact O-N 3.09Å; I49-V53 VanDerWaalsContact O-N 3.09Å; Q50-V53 PolarHBondContact O-N 3.14Å; Q50-V53 VanDerWaalsContact O-N 3.16Å; V53-R55 PolarHBondContact O-N 3.29Å; V53-L56 PolarHBondContact O-N 2.82Å; V53-Q57 PolarHBondContact O-N 3.1Å |
| 54 | D | 78.5 | Confident | 73.3 | Confident | 82 Ų | 82 | 119.9 Ų | 119.9 | 44% | 0.439 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62 | -30.7 | 177.8 | -62.2 | -19.3 | 0 | 0 | 0 | 112 | Q50 | Q50-D54 PolarHBondContact NE2-OD1 2.99Å; Q50-D54 PolarHBondContact O-N 3.04Å |
| 55 | R | 73.9 | Confident | 73.2 | Confident | 202 Ų | 202 | 123.8 Ų | 123.8 | 76% | 0.762 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -76.3 | -26.6 | 173.2 | -76.3 | 175.7 | 179.6 | -176 | 2.7 | 113.9 | P51 H52 V53 | P51-R55 VanDerWaalsContact O-CG 3.3Å; P51-R55 WeakPolarHBondContact O-CG 3.33Å; P51-R55 PolarHBondContact O-N 3.45Å; H52-R55 PolarHBondContact O-N 3.27Å; V53-R55 PolarHBondContact O-N 3.29Å |
| 56 | L | 71.1 | Confident | 72.5 | Confident | 128 Ų | 128 | 127.5 Ų | 127.5 | 67% | 0.67 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -83.3 | -19.6 | 178.4 | -74.3 | 168.1 | 0 | 0 | 0 | 112.3 | H52 V53 F58 | H52-L56 WeakPolarHBondContact O-CG 3.35Å; H52-L56 PolarHBondContact O-N 3.17Å; H52-L56 VanDerWaalsContact O-N 3.08Å; V53-L56 PolarHBondContact O-N 2.82Å; L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 WeakPolarHBondContact O-CD2 3.44Å; L56-F58 PolarHBondContact O-N 2.79Å |
| 57 | Q | 66.6 | Low | 71.9 | Confident | 133 Ų | 133 | 127.6 Ų | 127.6 | 62% | 0.621 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -67.9 | 93 | 164.4 | -68 | -173.4 | -0.4 | 0 | 0 | 107.6 | V53 E59 | V53-Q57 PolarHBondContact O-N 3.1Å; Q57-E59 PolarHBondContact O-N 3.3Å |
| 58 | F | 57.1 | Low | 70.9 | Confident | 183 Ų | 183 | 126.9 Ų | 126.9 | 80% | 0.803 | 61% | 0.607 | S | S | * | * | trans | -54.4 | 126.6 | 165 | -72.1 | -87.3 | 0 | 0 | 0 | 107.6 | L56 M60 | L56-F58 VanDerWaalsContact C-N 3.27Å; L56-F58 WeakPolarHBondContact O-CD2 3.44Å; L56-F58 PolarHBondContact O-N 2.79Å; F58-M60 PolarHBondContact O-N 2.86Å | ||
| 59 | E | 55.3 | Low | 70.3 | Confident | 200 Ų | 200 | 130.3 Ų | 130.3 | 94% | 0.935 | 62% | 0.624 | S | S | * | * | trans | -49.9 | 111.4 | 169.3 | -72 | -175.9 | 156.4 | 0 | 0 | 107.8 | Q57 | Q57-E59 PolarHBondContact O-N 3.3Š| ||
| 60 | M | 43 | Very low | 69.4 | Low | 254 Ų | 254 | 136.3 Ų | 136.3 | 100% | 1.251 | 65% | 0.65 | S | S | * | * | trans | -75.5 | 0 | 171 | -96.4 | -178.5 | 33 | 0 | 0 | 110.5 | F58 | F58-M60 PolarHBondContact O-N 2.86Š|
Retrieved 60 of 60 residues in 66.9 ms
(Link to these results)