| 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 | 42.7 | Very low | 52.2 | Low | 222 Ų | 222 | 120.6 Ų | 120.6 | 100% | 1.094 | 68% | 0.682 | S | S | * | * | 0 | 94.6 | 0 | -173.3 | 166.6 | 75.1 | 0 | 0 | 106.7 | I3 | M1-I3 PolarHBondContact O-N 3.37Å; M1-I3 VanDerWaalsContact O-N 3.15Å | |||
| 2 | I | 44.8 | Very low | 53.2 | Low | 151 Ų | 151 | 119.4 Ų | 119.4 | 77% | 0.774 | 67% | 0.666 | S | S | * | * | trans | -80.8 | 98.2 | -167.7 | -55.5 | 168.3 | 0 | 0 | 0 | 106.4 | A4 | I2-A4 PolarHBondContact O-N 3.08Š| ||
| 3 | I | 46.8 | Very low | 54 | Low | 98 Ų | 98 | 117.2 Ų | 117.2 | 50% | 0.503 | 66% | 0.657 | S | S | . | * | trans | -72.5 | 121 | 168.7 | 52.6 | 172 | 0 | 0 | 0 | 106.6 | M1 G5 E6 | M1-I3 PolarHBondContact O-N 3.37Å; M1-I3 VanDerWaalsContact O-N 3.15Å; I3-G5 PolarHBondContact O-N 2.95Å; I3-E6 HydrophobicContact CD1-CG 3.62Å; I3-E6 HydrophobicContact CG1-CG 3.82Å; I3-E6 PolarHBondContact O-N 3.47Å | ||
| 4 | A | 54.6 | Low | 55 | Low | 93 Ų | 93 | 115.4 Ų | 115.4 | 77% | 0.769 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 15.3 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | I2 | I2-A4 PolarHBondContact O-N 3.08Š|
| 5 | G | 53.5 | Low | 56.4 | Low | 63 Ų | 63 | 113.7 Ų | 113.7 | 65% | 0.649 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | -11 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | I3 | I3-G5 PolarHBondContact O-N 2.95Š|
| 6 | E | 49.5 | Very low | 57.9 | Low | 116 Ų | 116 | 116.5 Ų | 116.5 | 54% | 0.542 | 65% | 0.65 | S | S | . | * | trans | -99.3 | 22.8 | -173.6 | -61.4 | -92.5 | 110.1 | 0 | 0 | 113.1 | I3 S8 K23 | I3-E6 HydrophobicContact CD1-CG 3.62Å; I3-E6 HydrophobicContact CG1-CG 3.82Å; I3-E6 PolarHBondContact O-N 3.47Å; E6-S8 PolarHBondContact O-N 3.38Å; E6-K23 IonicContact OE2-NZ 3.51Å; E6-K23 PolarHBondContact OE2-NZ 3.29Å | ||
| 7 | Y | 52.2 | Low | 59.3 | Low | 164 Ų | 164 | 114.1 Ų | 114.1 | 64% | 0.643 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 20.8 | 172.3 | -82.8 | -77.2 | 0 | 0 | 0 | 113.7 | E11 | Y7-E11 WeakPolarHBondContact CD1-OE1 3.35Š|
| 8 | S | 54.7 | Low | 60.6 | Low | 119 Ų | 119 | 112.2 Ų | 112.2 | 83% | 0.832 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 9.5 | 176.1 | -168.2 | 0 | 0 | 0 | 0 | 112.9 | E6 | E6-S8 PolarHBondContact O-N 3.38Š|
| 9 | G | 57.8 | Low | 61.7 | Low | 38 Ų | 38 | 111.3 Ų | 111.3 | 39% | 0.392 | 65% | 0.645 | S | S | . | * | S | Bend | trans | -109.9 | 94.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | E11 | G9-E11 PolarHBondContact O-N 3.32Š|
| 10 | I | 58.4 | Low | 62.5 | Low | 158 Ų | 158 | 110.1 Ų | 110.1 | 81% | 0.81 | 63% | 0.632 | S | S | * | * | trans | 27.5 | 70 | 159.4 | -31.8 | 172.6 | 0 | 0 | 0 | 113.5 | H12 | I10-H12 HydrophobicContact CG2-CB 4.44Å; I10-H12 PolarHBondContact O-N 3.35Å | ||
| 11 | E | 59.5 | Low | 63.4 | Low | 105 Ų | 105 | 109.7 Ų | 109.7 | 49% | 0.491 | 64% | 0.637 | S | S | . | * | trans | -67.3 | 82.1 | 171.7 | -62.1 | -84.8 | 156.4 | 0 | 0 | 107.4 | Y7 G9 V13 | Y7-E11 WeakPolarHBondContact CD1-OE1 3.35Å; G9-E11 PolarHBondContact O-N 3.32Å; E11-V13 PolarHBondContact O-N 3.5Å | ||
| 12 | H | 63.5 | Low | 65.3 | Low | 106 Ų | 106 | 105.8 Ų | 105.8 | 49% | 0.491 | 62% | 0.618 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91 | 102.1 | 176.9 | -174.5 | -140.5 | 0 | 0 | 0 | 107.8 | I10 I14 | I10-H12 HydrophobicContact CG2-CB 4.44Å; I10-H12 PolarHBondContact O-N 3.35Å; H12-I14 PolarHBondContact O-N 3.29Å |
| 13 | V | 64.4 | Low | 67.2 | Low | 90 Ų | 90 | 103.7 Ų | 103.7 | 55% | 0.545 | 60% | 0.604 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -74.9 | 105.6 | 168.8 | -176.1 | 0 | 0 | 0 | 0 | 107.2 | E11 V15 | E11-V13 PolarHBondContact O-N 3.5Å; V13-V15 WeakPolarHBondContact CG1-O 3.39Å |
| 14 | I | 67 | Low | 69.2 | Low | 92 Ų | 92 | 107.3 Ų | 107.3 | 47% | 0.472 | 62% | 0.623 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.2 | -38.1 | -178.7 | -54.7 | 172.5 | 0 | 0 | 0 | 110 | H12 Q20 | H12-I14 PolarHBondContact O-N 3.29Å; I14-Q20 HydrophobicContact CD1-CB 4Å |
| 15 | V | 77.2 | Confident | 70.7 | Confident | 90 Ų | 90 | 106.7 Ų | 106.7 | 55% | 0.545 | 61% | 0.606 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -147.8 | 150.9 | 179.8 | -175.8 | 0 | 0 | 0 | 0 | 107.9 | V13 G17 V18 | V13-V15 WeakPolarHBondContact CG1-O 3.39Å; V15-G17 PolarHBondContact O-N 2.81Å; V15-V18 HydrophobicContact CB-CB 4.39Å; V15-V18 HydrophobicContact CB-CG2 4.38Å; V15-V18 PolarHBondContact O-N 3.28Å |
| 16 | D | 79.3 | Confident | 72.5 | Confident | 159 Ų | 159 | 106.9 Ų | 106.9 | 85% | 0.85 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.1 | 126.9 | 173.9 | -171 | 34.8 | 0 | 0 | 0 | 111 | V18 | D16-V18 PolarHBondContact O-N 3.32Š|
| 17 | G | 82.9 | Confident | 74.4 | Confident | 76 Ų | 76 | 105.4 Ų | 105.4 | 78% | 0.784 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 81.7 | -4.4 | -174.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | V15 | V15-G17 PolarHBondContact O-N 2.81Š|
| 18 | V | 82.7 | Confident | 76.3 | Confident | 79 Ų | 79 | 103.3 Ų | 103.3 | 48% | 0.479 | 59% | 0.585 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.7 | 110.2 | 176.8 | -176.8 | 0 | 0 | 0 | 0 | 110.5 | V15 D16 | V15-V18 HydrophobicContact CB-CB 4.39Å; V15-V18 HydrophobicContact CB-CG2 4.38Å; V15-V18 PolarHBondContact O-N 3.28Å; D16-V18 PolarHBondContact O-N 3.32Å |
| 19 | V | 80.5 | Confident | 78.1 | Confident | 96 Ų | 96 | 101.7 Ų | 101.7 | 58% | 0.582 | 57% | 0.566 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -103.8 | 127.5 | 173.8 | -174.9 | 0 | 0 | 0 | 0 | 109.2 | ||
| 20 | Q | 78.9 | Confident | 79.5 | Confident | 86 Ų | 86 | 104.9 Ų | 104.9 | 40% | 0.402 | 57% | 0.569 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -96.9 | 139.2 | 172.4 | -171.4 | 179.3 | 36 | 0 | 0 | 110.1 | I14 I22 | I14-Q20 HydrophobicContact CD1-CB 4Å; Q20-I22 HydrophobicContact CG-CG1 4.35Å |
| 21 | S | 80.1 | Confident | 81.1 | Confident | 103 Ų | 103 | 104.7 Ų | 104.7 | 72% | 0.72 | 56% | 0.559 | S | S | * | * | trans | -132.6 | 132.3 | 168.1 | -178.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 22 | I | 83.4 | Confident | 82.6 | Confident | 139 Ų | 139 | 102.4 Ų | 102.4 | 71% | 0.713 | 55% | 0.553 | S | S | * | * | trans | -117.9 | 129.3 | 175.9 | -59.5 | 173.4 | 0 | 0 | 0 | 106.9 | Q20 | Q20-I22 HydrophobicContact CG-CG1 4.35Š| ||
| 23 | K | 83.7 | Confident | 83.9 | Confident | 108 Ų | 108 | 101.7 Ų | 101.7 | 47% | 0.47 | 56% | 0.556 | S | S | . | * | trans | -125.8 | 129.3 | 177 | -172.9 | -179.8 | -77.5 | -88.4 | 0 | 110 | E6 I25 | E6-K23 IonicContact OE2-NZ 3.51Å; E6-K23 PolarHBondContact OE2-NZ 3.29Å; K23-I25 HydrophobicContact CB-CD1 4.32Å; K23-I25 HydrophobicContact CB-CG1 4.09Å; K23-I25 HydrophobicContact CD-CD1 3.85Å; K23-I25 HydrophobicContact CD-CG1 3.64Å; K23-I25 HydrophobicContact CG-CD1 4.16Å; K23-I25 HydrophobicContact CG-CG1 3.6Å | ||
| 24 | L | 88.6 | Confident | 85 | Confident | 174 Ų | 174 | 99.3 Ų | 99.3 | 91% | 0.911 | 55% | 0.546 | S | S | * | . | trans | -76.9 | 119.5 | 164.5 | -176.7 | 64.1 | 0 | 0 | 0 | 108.5 | ||||
| 25 | I | 86.5 | Confident | 86.1 | Confident | 79 Ų | 79 | 102.4 Ų | 102.4 | 41% | 0.405 | 55% | 0.552 | S | S | . | * | trans | -128.1 | 136 | -178.3 | -53.9 | 175.3 | 0 | 0 | 0 | 107.8 | K23 I29 | K23-I25 HydrophobicContact CB-CD1 4.32Å; K23-I25 HydrophobicContact CB-CG1 4.09Å; K23-I25 HydrophobicContact CD-CD1 3.85Å; K23-I25 HydrophobicContact CD-CG1 3.64Å; K23-I25 HydrophobicContact CG-CD1 4.16Å; K23-I25 HydrophobicContact CG-CG1 3.6Å; I25-I29 HydrophobicContact CG2-CB 3.79Å; I25-I29 HydrophobicContact CG2-CG2 3.75Å | ||
| 26 | P | 91.9 | Very high | 86.7 | Confident | 67 Ų | 67 | 105.1 Ų | 105.1 | 44% | 0.435 | 56% | 0.557 | S | S | . | * | trans | -59.5 | 145.5 | 172.3 | -22.7 | 33.3 | 0 | 0 | 0 | 112.3 | E28 I29 K30 | P26-E28 VanDerWaalsContact C-N 3.29Å; P26-E28 HydrophobicContact CB-CG 4.49Å; P26-E28 WeakPolarHBondContact CB-OE1 3.47Å; P26-E28 PolarHBondContact O-N 3.1Å; P26-I29 HydrophobicContact CB-CG1 4.22Å; P26-I29 HydrophobicContact CG-CG1 4.34Å; P26-I29 PolarHBondContact O-N 3.35Å; P26-I29 VanDerWaalsContact O-N 3.08Å; P26-K30 PolarHBondContact O-N 3.41Å | ||
| 27 | E | 89.6 | Confident | 87.2 | Confident | 86 Ų | 86 | 99.9 Ų | 99.9 | 40% | 0.402 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.9 | -35.5 | -176.3 | 176.5 | 59.8 | -162 | 0 | 0 | 112.1 | I29 K30 R31 | E27-I29 VanDerWaalsContact C-N 3.31Å; E27-I29 PolarHBondContact O-N 2.99Å; E27-K30 PolarHBondContact O-N 2.89Å; E27-K30 WeakPolarHBondContact OE2-CD 3.17Å; E27-R31 VanDerWaalsContact CG-NH2 3.29Å; E27-R31 WeakPolarHBondContact O-CG 3.48Å; E27-R31 PolarHBondContact O-N 3.11Å; E27-R31 IonicContact OE1-CZ 3.26Å; E27-R31 IonicContact OE1-NE 2.68Å; E27-R31 PolarHBondContact OE1-NE 3.07Å; E27-R31 IonicContact OE1-NH2 2.94Å; E27-R31 PolarHBondContact OE1-NH2 2.81Å |
| 28 | E | 92 | Very high | 87.4 | Confident | 119 Ų | 119 | 100.7 Ų | 100.7 | 56% | 0.556 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.3 | -36.6 | 175.3 | 66.4 | -82.1 | -179.5 | 0 | 0 | 113 | P26 C32 | P26-E28 VanDerWaalsContact C-N 3.29Å; P26-E28 HydrophobicContact CB-CG 4.49Å; P26-E28 WeakPolarHBondContact CB-OE1 3.47Å; P26-E28 PolarHBondContact O-N 3.1Å; E28-C32 PolarHBondContact O-N 2.96Å; E28-C32 PolarHBondContact O-SG 2.9Å |
| 29 | I | 92.1 | Very high | 87.7 | Confident | 86 Ų | 86 | 101.3 Ų | 101.3 | 44% | 0.441 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -72.9 | -42.4 | 177.3 | -57.3 | -57.4 | 0 | 0 | 0 | 109.8 | I25 P26 E27 R31 C32 V33 | I25-I29 HydrophobicContact CG2-CB 3.79Å; I25-I29 HydrophobicContact CG2-CG2 3.75Å; P26-I29 HydrophobicContact CB-CG1 4.22Å; P26-I29 HydrophobicContact CG-CG1 4.34Å; P26-I29 PolarHBondContact O-N 3.35Å; P26-I29 VanDerWaalsContact O-N 3.08Å; E27-I29 VanDerWaalsContact C-N 3.31Å; E27-I29 PolarHBondContact O-N 2.99Å; I29-R31 VanDerWaalsContact C-N 3.28Å; I29-R31 PolarHBondContact O-N 3.35Å; I29-C32 WeakPolarHBondContact O-CB 3.44Å; I29-C32 PolarHBondContact O-N 2.96Å; I29-C32 VanDerWaalsContact O-N 3.07Å; I29-V33 HydrophobicContact CG2-CG2 4.45Å; I29-V33 WeakPolarHBondContact O-CG2 3.31Å; I29-V33 PolarHBondContact O-N 2.93Å |
| 30 | K | 88.2 | Confident | 88.2 | Confident | 104 Ų | 104 | 103.1 Ų | 103.1 | 45% | 0.452 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -55.5 | -43.2 | 175.3 | -174 | -178.2 | 176.4 | -176.3 | 0 | 111.6 | P26 E27 V33 A34 | P26-K30 PolarHBondContact O-N 3.41Å; E27-K30 PolarHBondContact O-N 2.89Å; E27-K30 WeakPolarHBondContact OE2-CD 3.17Å; K30-V33 PolarHBondContact O-N 3.14Å; K30-A34 WeakPolarHBondContact O-CB 3.28Å; K30-A34 PolarHBondContact O-N 2.92Å |
| 31 | R | 90.5 | Very high | 88.7 | Confident | 155 Ų | 155 | 99.1 Ų | 99.1 | 59% | 0.585 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 175.8 | -70.3 | 173 | -167.4 | 163.9 | 1.9 | 112.9 | E27 I29 R35 | E27-R31 VanDerWaalsContact CG-NH2 3.29Å; E27-R31 WeakPolarHBondContact O-CG 3.48Å; E27-R31 PolarHBondContact O-N 3.11Å; E27-R31 IonicContact OE1-CZ 3.26Å; E27-R31 IonicContact OE1-NE 2.68Å; E27-R31 PolarHBondContact OE1-NE 3.07Å; E27-R31 IonicContact OE1-NH2 2.94Å; E27-R31 PolarHBondContact OE1-NH2 2.81Å; I29-R31 VanDerWaalsContact C-N 3.28Å; I29-R31 PolarHBondContact O-N 3.35Å; R31-R35 WeakPolarHBondContact O-CB 3.32Å; R31-R35 PolarHBondContact O-N 3.03Å |
| 32 | C | 91.9 | Very high | 89 | Confident | 56 Ų | 56 | 101.7 Ų | 101.7 | 38% | 0.378 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.8 | -44.8 | 175.6 | -74.2 | 0 | 0 | 0 | 0 | 112 | E28 I29 R35 F36 | E28-C32 PolarHBondContact O-N 2.96Å; E28-C32 PolarHBondContact O-SG 2.9Å; I29-C32 WeakPolarHBondContact O-CB 3.44Å; I29-C32 PolarHBondContact O-N 2.96Å; I29-C32 VanDerWaalsContact O-N 3.07Å; C32-R35 PolarHBondContact O-N 3.45Å; C32-R35 PolarHBondContact SG-NH2 2.94Å; C32-R35 VanDerWaalsContact SG-NH2 3.45Å; C32-F36 PolarHBondContact O-N 3.45Å |
| 33 | V | 89.6 | Confident | 89.3 | Confident | 92 Ų | 92 | 100.3 Ų | 100.3 | 56% | 0.558 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.3 | -45.8 | 176.5 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | I29 K30 R35 F36 A37 | I29-V33 HydrophobicContact CG2-CG2 4.45Å; I29-V33 WeakPolarHBondContact O-CG2 3.31Å; I29-V33 PolarHBondContact O-N 2.93Å; K30-V33 PolarHBondContact O-N 3.14Å; V33-R35 PolarHBondContact O-N 3.32Å; V33-F36 PolarHBondContact O-N 3.49Å; V33-A37 WeakPolarHBondContact O-CB 3.45Å; V33-A37 PolarHBondContact O-N 3.15Å |
| 34 | A | 88.9 | Confident | 89.5 | Confident | 40 Ų | 40 | 100 Ų | 100 | 33% | 0.331 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.5 | -50.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | K30 F36 A37 F38 | K30-A34 WeakPolarHBondContact O-CB 3.28Å; K30-A34 PolarHBondContact O-N 2.92Å; A34-F36 VanDerWaalsContact C-N 3.31Å; A34-F36 PolarHBondContact O-N 3.33Å; A34-A37 PolarHBondContact O-N 2.89Å; A34-A37 VanDerWaalsContact O-N 3.14Å; A34-F38 HydrophobicContact CB-CD2 4.49Å; A34-F38 HydrophobicContact CB-CE2 4.49Å; A34-F38 WeakPolarHBondContact O-CD2 3.13Å; A34-F38 PolarHBondContact O-N 3.36Å |
| 35 | R | 89.9 | Confident | 89.3 | Confident | 156 Ų | 156 | 94.4 Ų | 94.4 | 59% | 0.589 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -56.6 | -44.8 | 178.5 | -176.6 | 178.9 | 65 | -101.6 | -0.3 | 112 | R31 C32 V33 Q39 | R31-R35 WeakPolarHBondContact O-CB 3.32Å; R31-R35 PolarHBondContact O-N 3.03Å; C32-R35 PolarHBondContact O-N 3.45Å; C32-R35 PolarHBondContact SG-NH2 2.94Å; C32-R35 VanDerWaalsContact SG-NH2 3.45Å; V33-R35 PolarHBondContact O-N 3.32Å; R35-Q39 WeakPolarHBondContact O-CB 3.36Å; R35-Q39 PolarHBondContact O-N 2.95Å |
| 36 | F | 90.3 | Very high | 89 | Confident | 148 Ų | 148 | 96.4 Ų | 96.4 | 65% | 0.649 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.1 | -44.6 | 177.4 | -178.4 | -97.9 | 0 | 0 | 0 | 111.8 | C32 V33 A34 Q39 Y40 | C32-F36 PolarHBondContact O-N 3.45Å; V33-F36 PolarHBondContact O-N 3.49Å; A34-F36 VanDerWaalsContact C-N 3.31Å; A34-F36 PolarHBondContact O-N 3.33Å; F36-Q39 PolarHBondContact O-N 3.07Å; F36-Y40 VanDerWaalsContact O-CB 3.28Å; F36-Y40 WeakPolarHBondContact O-CB 3.25Å; F36-Y40 PolarHBondContact O-N 3.32Å |
| 37 | A | 88.6 | Confident | 88.2 | Confident | 48 Ų | 48 | 105.3 Ų | 105.3 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.2 | -44.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V33 A34 A41 | V33-A37 WeakPolarHBondContact O-CB 3.45Å; V33-A37 PolarHBondContact O-N 3.15Å; A34-A37 PolarHBondContact O-N 2.89Å; A34-A37 VanDerWaalsContact O-N 3.14Å; A37-A41 VanDerWaalsContact O-CB 3.31Å; A37-A41 WeakPolarHBondContact O-CB 3.44Å; A37-A41 PolarHBondContact O-N 3.44Å |
| 38 | F | 88.2 | Confident | 87.5 | Confident | 94 Ų | 94 | 105.1 Ų | 105.1 | 41% | 0.412 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 176.1 | -80.5 | -73.2 | 0 | 0 | 0 | 112.5 | A34 A41 K42 V49 A51 | A34-F38 HydrophobicContact CB-CD2 4.49Å; A34-F38 HydrophobicContact CB-CE2 4.49Å; A34-F38 WeakPolarHBondContact O-CD2 3.13Å; A34-F38 PolarHBondContact O-N 3.36Å; F38-A41 PolarHBondContact O-N 3.49Å; F38-K42 WeakPolarHBondContact O-CB 3.45Å; F38-K42 PolarHBondContact O-N 3.23Å; F38-V49 HydrophobicContact CD1-CB 3.63Å; F38-V49 HydrophobicContact CD1-CG1 3.79Å; F38-V49 HydrophobicContact CD1-CG2 4.12Å; F38-V49 HydrophobicContact CE1-CB 3.49Å; F38-V49 VanDerWaalsContact CE1-CB 3.49Å; F38-V49 HydrophobicContact CE1-CG1 3.54Å; F38-V49 HydrophobicContact CE1-CG2 4.46Å; F38-V49 HydrophobicContact CG-CG1 4.49Å; F38-V49 HydrophobicContact CZ-CB 4.43Å; F38-V49 HydrophobicContact CZ-CG1 4.03Å; F38-A51 HydrophobicContact CE2-CB 4.2Å; F38-A51 HydrophobicContact CZ-CB 3.79Å |
| 39 | Q | 89.4 | Confident | 86.9 | Confident | 92 Ų | 92 | 101.9 Ų | 101.9 | 43% | 0.43 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -48.2 | 178 | -175.5 | 58.1 | 56.4 | 0 | 0 | 110.8 | R35 F36 A41 K42 D43 | R35-Q39 WeakPolarHBondContact O-CB 3.36Å; R35-Q39 PolarHBondContact O-N 2.95Å; F36-Q39 PolarHBondContact O-N 3.07Å; Q39-A41 VanDerWaalsContact C-N 3.3Å; Q39-A41 PolarHBondContact O-N 2.77Å; Q39-K42 WeakPolarHBondContact O-CB 3.35Å; Q39-K42 PolarHBondContact O-N 3.23Å; Q39-K42 VanDerWaalsContact O-N 3.11Å; Q39-D43 VanDerWaalsContact NE2-CG 3.25Å; Q39-D43 PolarHBondContact NE2-OD1 2.95Å; Q39-D43 PolarHBondContact NE2-OD2 3.33Å; Q39-D43 VanDerWaalsContact O-CG 3.24Å; Q39-D43 PolarHBondContact O-N 3.19Å |
| 40 | Y | 90.4 | Very high | 86.3 | Confident | 133 Ų | 133 | 105 Ų | 105 | 52% | 0.522 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -56.5 | -44.1 | 176 | 179.7 | -98.3 | 0 | 0 | 0 | 112.2 | F36 K42 D43 N44 | F36-Y40 VanDerWaalsContact O-CB 3.28Å; F36-Y40 WeakPolarHBondContact O-CB 3.25Å; F36-Y40 PolarHBondContact O-N 3.32Å; Y40-K42 PolarHBondContact O-N 3.01Å; Y40-D43 PolarHBondContact O-N 3.44Å; Y40-N44 WeakPolarHBondContact CE1-ND2 3.15Å; Y40-N44 WeakPolarHBondContact O-CB 3.14Å; Y40-N44 PolarHBondContact O-N 2.99Å; Y40-N44 PolarHBondContact O-OD1 3.26Å; Y40-N44 PolarHBondContact OH-ND2 3.31Å; Y40-N44 VanDerWaalsContact OH-ND2 3.08Å |
| 41 | A | 88.8 | Confident | 86 | Confident | 3 Ų | 3 | 103.1 Ų | 103.1 | 3% | 0.025 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -63 | -41.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A37 F38 Q39 N44 G45 Q46 V49 | A37-A41 VanDerWaalsContact O-CB 3.31Å; A37-A41 WeakPolarHBondContact O-CB 3.44Å; A37-A41 PolarHBondContact O-N 3.44Å; F38-A41 PolarHBondContact O-N 3.49Å; Q39-A41 VanDerWaalsContact C-N 3.3Å; Q39-A41 PolarHBondContact O-N 2.77Å; A41-N44 PolarHBondContact O-N 3.41Å; A41-G45 PolarHBondContact O-N 2.94Å; A41-Q46 HydrophobicContact CB-CB 3.96Å; A41-Q46 VanDerWaalsContact CB-OE1 3.22Å; A41-Q46 WeakPolarHBondContact O-CA 3.5Å; A41-Q46 WeakPolarHBondContact O-CB 3.38Å; A41-Q46 PolarHBondContact O-N 2.94Å; A41-V49 HydrophobicContact CB-CG2 3.08Å |
| 42 | K | 86.2 | Confident | 85.5 | Confident | 157 Ų | 157 | 100.1 Ų | 100.1 | 68% | 0.683 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.1 | -44.3 | 175.6 | -174.9 | -179.2 | 177.9 | -177.3 | 0 | 111.4 | F38 Q39 Y40 N44 G45 | F38-K42 WeakPolarHBondContact O-CB 3.45Å; F38-K42 PolarHBondContact O-N 3.23Å; Q39-K42 WeakPolarHBondContact O-CB 3.35Å; Q39-K42 PolarHBondContact O-N 3.23Å; Q39-K42 VanDerWaalsContact O-N 3.11Å; Y40-K42 PolarHBondContact O-N 3.01Å; K42-N44 VanDerWaalsContact C-N 3.3Å; K42-N44 PolarHBondContact O-N 3.08Å; K42-G45 PolarHBondContact O-N 3.26Å; K42-G45 VanDerWaalsContact O-N 3.1Å |
| 43 | D | 89.8 | Confident | 84.8 | Confident | 110 Ų | 110 | 100.9 Ų | 100.9 | 59% | 0.588 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66.9 | -33.9 | -179.8 | -64.5 | -24.5 | 0 | 0 | 0 | 111.7 | Q39 Y40 G45 | Q39-D43 VanDerWaalsContact NE2-CG 3.25Å; Q39-D43 PolarHBondContact NE2-OD1 2.95Å; Q39-D43 PolarHBondContact NE2-OD2 3.33Å; Q39-D43 VanDerWaalsContact O-CG 3.24Å; Q39-D43 PolarHBondContact O-N 3.19Å; Y40-D43 PolarHBondContact O-N 3.44Å; D43-G45 PolarHBondContact O-N 2.71Å |
| 44 | N | 89 | Confident | 84.1 | Confident | 100 Ų | 100 | 104.8 Ų | 104.8 | 54% | 0.535 | 55% | 0.548 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.6 | 7.5 | 174.6 | -72.7 | 23.9 | 0 | 0 | 0 | 113.7 | Y40 A41 K42 Q46 | Y40-N44 WeakPolarHBondContact CE1-ND2 3.15Å; Y40-N44 WeakPolarHBondContact O-CB 3.14Å; Y40-N44 PolarHBondContact O-N 2.99Å; Y40-N44 PolarHBondContact O-OD1 3.26Å; Y40-N44 PolarHBondContact OH-ND2 3.31Å; Y40-N44 VanDerWaalsContact OH-ND2 3.08Å; A41-N44 PolarHBondContact O-N 3.41Å; K42-N44 VanDerWaalsContact C-N 3.3Å; K42-N44 PolarHBondContact O-N 3.08Å; N44-Q46 PolarHBondContact O-N 2.86Å |
| 45 | G | 84 | Confident | 83.2 | Confident | 58 Ų | 58 | 109.2 Ų | 109.2 | 60% | 0.598 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.3 | 19.8 | 179 | 0 | 0 | 0 | 0 | 0 | 114.1 | A41 K42 D43 R47 | A41-G45 PolarHBondContact O-N 2.94Å; K42-G45 PolarHBondContact O-N 3.26Å; K42-G45 VanDerWaalsContact O-N 3.1Å; D43-G45 PolarHBondContact O-N 2.71Å; G45-R47 PolarHBondContact O-N 3.5Å |
| 46 | Q | 80.3 | Confident | 81.9 | Confident | 121 Ų | 121 | 105.1 Ų | 105.1 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | trans | -71 | 118.8 | 176.8 | -154.6 | 175 | 15.2 | 0 | 0 | 109.3 | A41 N44 S48 | A41-Q46 HydrophobicContact CB-CB 3.96Å; A41-Q46 VanDerWaalsContact CB-OE1 3.22Å; A41-Q46 WeakPolarHBondContact O-CA 3.5Å; A41-Q46 WeakPolarHBondContact O-CB 3.38Å; A41-Q46 PolarHBondContact O-N 2.94Å; N44-Q46 PolarHBondContact O-N 2.86Å; Q46-S48 PolarHBondContact O-N 2.68Å | ||
| 47 | R | 73.8 | Confident | 80.9 | Confident | 254 Ų | 254 | 103 Ų | 103 | 96% | 0.958 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -68 | -22.3 | -173.7 | -71.1 | 179.2 | -80.3 | -161.7 | -4.6 | 114.1 | G45 | G45-R47 PolarHBondContact O-N 3.5Š|
| 48 | S | 76.3 | Confident | 79.8 | Confident | 82 Ų | 82 | 109 Ų | 109 | 57% | 0.573 | 59% | 0.585 | S | S | * | * | trans | -155 | 140.4 | -177.9 | -177.4 | 0 | 0 | 0 | 0 | 110.3 | Q46 | Q46-S48 PolarHBondContact O-N 2.68Š| ||
| 49 | V | 78.6 | Confident | 78.6 | Confident | 51 Ų | 51 | 116.4 Ų | 116.4 | 31% | 0.309 | 62% | 0.621 | S | S | . | * | trans | -123.9 | 130.2 | 168.1 | 176.5 | 0 | 0 | 0 | 0 | 106.4 | F38 A41 | F38-V49 HydrophobicContact CD1-CB 3.63Å; F38-V49 HydrophobicContact CD1-CG1 3.79Å; F38-V49 HydrophobicContact CD1-CG2 4.12Å; F38-V49 HydrophobicContact CE1-CB 3.49Å; F38-V49 VanDerWaalsContact CE1-CB 3.49Å; F38-V49 HydrophobicContact CE1-CG1 3.54Å; F38-V49 HydrophobicContact CE1-CG2 4.46Å; F38-V49 HydrophobicContact CG-CG1 4.49Å; F38-V49 HydrophobicContact CZ-CB 4.43Å; F38-V49 HydrophobicContact CZ-CG1 4.03Å; A41-V49 HydrophobicContact CB-CG2 3.08Å | ||
| 50 | I | 80.3 | Confident | 78 | Confident | 152 Ų | 152 | 117.7 Ų | 117.7 | 78% | 0.779 | 63% | 0.63 | S | S | * | * | trans | -97.6 | 116 | 177.7 | -59.3 | 170 | 0 | 0 | 0 | 107.2 | ||||
| 51 | A | 80.5 | Confident | 77.4 | Confident | 64 Ų | 64 | 116.8 Ų | 116.8 | 53% | 0.529 | 64% | 0.636 | S | S | . | * | trans | -96.1 | 124.7 | 162 | 0 | 0 | 0 | 0 | 0 | 107.9 | F38 P53 | F38-A51 HydrophobicContact CE2-CB 4.2Å; F38-A51 HydrophobicContact CZ-CB 3.79Å; A51-P53 VanDerWaalsContact O-CD 3.25Å; A51-P53 WeakPolarHBondContact O-CD 3.49Å | ||
| 52 | A | 81.3 | Confident | 76.7 | Confident | 92 Ų | 92 | 123.2 Ų | 123.2 | 76% | 0.76 | 67% | 0.67 | S | S | * | * | trans | -91.8 | 110.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 53 | P | 77.1 | Confident | 76.2 | Confident | 71 Ų | 71 | 121.2 Ų | 121.2 | 46% | 0.461 | 67% | 0.669 | S | S | . | * | trans | -73.9 | 145.9 | 173.2 | 23 | -23.5 | 0 | 0 | 0 | 110.9 | A51 N55 S56 | A51-P53 VanDerWaalsContact O-CD 3.25Å; A51-P53 WeakPolarHBondContact O-CD 3.49Å; P53-N55 WeakPolarHBondContact CB-OD1 3.42Å; P53-N55 PolarHBondContact O-N 3.47Å; P53-S56 WeakPolarHBondContact CD-OG 3.49Å; P53-S56 WeakPolarHBondContact CG-OG 3.17Å; P53-S56 PolarHBondContact O-N 3.09Å; P53-S56 PolarHBondContact O-OG 3.05Å | ||
| 54 | E | 74.4 | Confident | 75.3 | Confident | 175 Ų | 175 | 121.9 Ų | 121.9 | 82% | 0.818 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | -32.7 | -179.4 | -175.9 | -179.8 | 158.4 | 0 | 0 | 112.2 | S56 | E54-S56 PolarHBondContact O-N 3.47Š|
| 55 | N | 70.2 | Confident | 74.4 | Confident | 133 Ų | 133 | 123.3 Ų | 123.3 | 71% | 0.711 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | 21.7 | -178.5 | 69.5 | -15.5 | 0 | 0 | 0 | 114.2 | P53 T57 | P53-N55 WeakPolarHBondContact CB-OD1 3.42Å; P53-N55 PolarHBondContact O-N 3.47Å; N55-T57 PolarHBondContact O-N 2.75Å; N55-T57 VanDerWaalsContact O-N 3.09Å |
| 56 | S | 63 | Low | 73.7 | Confident | 70 Ų | 70 | 128 Ų | 128 | 49% | 0.49 | 69% | 0.69 | S | S | . | * | trans | -68 | -4.1 | 177.9 | -53.7 | 0 | 0 | 0 | 0 | 113.8 | P53 E54 L58 | P53-S56 WeakPolarHBondContact CD-OG 3.49Å; P53-S56 WeakPolarHBondContact CG-OG 3.17Å; P53-S56 PolarHBondContact O-N 3.09Å; P53-S56 PolarHBondContact O-OG 3.05Å; E54-S56 PolarHBondContact O-N 3.47Å; S56-L58 PolarHBondContact O-N 3.24Å | ||
| 57 | T | 67.8 | Low | 73.2 | Confident | 104 Ų | 104 | 128.5 Ų | 128.5 | 64% | 0.638 | 70% | 0.699 | S | S | * | * | trans | -69.2 | 95.5 | 174.1 | -10.9 | 0 | 0 | 0 | 0 | 108.7 | N55 H59 | N55-T57 PolarHBondContact O-N 2.75Å; N55-T57 VanDerWaalsContact O-N 3.09Å; T57-H59 PolarHBondContact O-N 3.03Å | ||
| 58 | L | 67.3 | Low | 73.2 | Confident | 173 Ų | 173 | 118.1 Ų | 118.1 | 91% | 0.906 | 68% | 0.678 | S | S | * | * | trans | -53.2 | 109.8 | 165.7 | -63.5 | 166.6 | 0 | 0 | 0 | 107.7 | S56 | S56-L58 PolarHBondContact O-N 3.24Š| ||
| 59 | H | 61.4 | Low | 72.9 | Confident | 250 Ų | 250 | 121.4 Ų | 121.4 | 100% | 1.157 | 69% | 0.687 | S | S | * | * | trans | -81.1 | 0 | 165.2 | -75.3 | -77.5 | 0 | 0 | 0 | 109.9 | T57 | T57-H59 PolarHBondContact O-N 3.03Š|
Retrieved 59 of 59 residues in 62.7 ms
(Link to these results)