| 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 | 57.3 | Low | 63.4 | Low | 210 Ų | 210 | 134.2 Ų | 134.2 | 100% | 1.034 | 67% | 0.671 | S | S | * | * | 0 | -35.7 | 0 | -147.8 | 161 | 177 | 0 | 0 | 113.2 | H3 K4 | M1-H3 PolarHBondContact O-N 3.42Å; M1-K4 PolarHBondContact O-N 3.37Å | |||
| 2 | M | 58 | Low | 63.3 | Low | 149 Ų | 149 | 130.1 Ų | 130.1 | 73% | 0.734 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -57 | -35.5 | 179.9 | -77.5 | -91.5 | 171.4 | 0 | 0 | 116.3 | K4 I5 V6 | M2-K4 PolarHBondContact O-N 3.29Å; M2-I5 PolarHBondContact O-N 2.83Å; M2-V6 PolarHBondContact O-N 3.4Å |
| 3 | H | 63.4 | Low | 63 | Low | 163 Ų | 163 | 135 Ų | 135 | 76% | 0.755 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -63 | -26.2 | -179.5 | -84.1 | -124.3 | 0 | 0 | 0 | 114.2 | M1 R7 | M1-H3 PolarHBondContact O-N 3.42Å; H3-R7 PolarHBondContact O-N 3.15Å |
| 4 | K | 64.8 | Low | 62.5 | Low | 171 Ų | 171 | 139.6 Ų | 139.6 | 74% | 0.743 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -71.9 | -36.3 | 178.6 | -69.5 | -175.2 | 177.4 | -177.5 | 0 | 111.5 | M1 M2 A8 | M1-K4 PolarHBondContact O-N 3.37Å; M2-K4 PolarHBondContact O-N 3.29Å; K4-A8 WeakPolarHBondContact O-CB 3.47Å; K4-A8 PolarHBondContact O-N 3.44Å |
| 5 | I | 65.8 | Low | 61.8 | Low | 104 Ų | 104 | 137.3 Ų | 137.3 | 53% | 0.533 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -69.4 | -45.1 | 179.3 | -61.2 | 170 | 0 | 0 | 0 | 109.9 | M2 R7 A8 V9 | M2-I5 PolarHBondContact O-N 2.83Å; I5-R7 VanDerWaalsContact C-N 3.34Å; I5-R7 PolarHBondContact O-N 3.43Å; I5-A8 PolarHBondContact O-N 2.9Å; I5-A8 VanDerWaalsContact O-N 3.16Å; I5-V9 HydrophobicContact CG2-CG2 4.27Å; I5-V9 VanDerWaalsContact O-CG2 3.32Å; I5-V9 WeakPolarHBondContact O-CG2 3.34Å; I5-V9 PolarHBondContact O-N 3.28Å |
| 6 | V | 66.4 | Low | 61.1 | Low | 93 Ų | 93 | 135 Ų | 135 | 56% | 0.564 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -61.3 | -42.5 | 179.1 | -179.9 | 0 | 0 | 0 | 0 | 111.5 | M2 V9 L10 | M2-V6 PolarHBondContact O-N 3.4Å; V6-V9 PolarHBondContact O-N 2.86Å; V6-L10 WeakPolarHBondContact O-CB 3.24Å; V6-L10 PolarHBondContact O-N 2.9Å |
| 7 | R | 63.7 | Low | 60.5 | Low | 193 Ų | 193 | 140.2 Ų | 140.2 | 73% | 0.728 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -65.3 | -41.5 | 174.4 | -80.2 | -174.2 | 169.1 | -172.1 | -2.5 | 112.5 | H3 I5 L10 I11 | H3-R7 PolarHBondContact O-N 3.15Å; I5-R7 VanDerWaalsContact C-N 3.34Å; I5-R7 PolarHBondContact O-N 3.43Å; R7-L10 PolarHBondContact O-N 2.94Å; R7-I11 WeakPolarHBondContact O-CB 3.27Å; R7-I11 WeakPolarHBondContact O-CD1 3.38Å; R7-I11 WeakPolarHBondContact O-CG1 3.22Å; R7-I11 PolarHBondContact O-N 3.37Å |
| 8 | A | 65.9 | Low | 60.2 | Low | 59 Ų | 59 | 137.9 Ų | 137.9 | 49% | 0.488 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -63.7 | -41.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | K4 I5 I11 A12 | K4-A8 WeakPolarHBondContact O-CB 3.47Å; K4-A8 PolarHBondContact O-N 3.44Å; I5-A8 PolarHBondContact O-N 2.9Å; I5-A8 VanDerWaalsContact O-N 3.16Å; A8-I11 PolarHBondContact O-N 3.5Å; A8-A12 VanDerWaalsContact O-CB 3.23Å; A8-A12 WeakPolarHBondContact O-CB 3.25Å; A8-A12 PolarHBondContact O-N 2.68Å |
| 9 | V | 65.6 | Low | 59.9 | Low | 81 Ų | 81 | 136.5 Ų | 136.5 | 49% | 0.491 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -65.2 | -46.9 | 174.6 | 174.6 | 0 | 0 | 0 | 0 | 110.2 | I5 V6 I11 A12 Y13 | I5-V9 HydrophobicContact CG2-CG2 4.27Å; I5-V9 VanDerWaalsContact O-CG2 3.32Å; I5-V9 WeakPolarHBondContact O-CG2 3.34Å; I5-V9 PolarHBondContact O-N 3.28Å; V6-V9 PolarHBondContact O-N 2.86Å; V9-I11 VanDerWaalsContact C-N 3.28Å; V9-I11 PolarHBondContact O-N 3.04Å; V9-A12 CarbonylContact O-C 3.57Å; V9-A12 PolarHBondContact O-N 2.88Å; V9-Y13 VanDerWaalsContact O-CB 3.24Å; V9-Y13 WeakPolarHBondContact O-CB 3.32Å; V9-Y13 PolarHBondContact O-N 2.95Å |
| 10 | L | 64.1 | Low | 59.6 | Low | 128 Ų | 128 | 133.9 Ų | 133.9 | 67% | 0.67 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -64.2 | -31.9 | -179.8 | -145.4 | 106.6 | 0 | 0 | 0 | 113.1 | V6 R7 R14 | V6-L10 WeakPolarHBondContact O-CB 3.24Å; V6-L10 PolarHBondContact O-N 2.9Å; R7-L10 PolarHBondContact O-N 2.94Å; L10-R14 PolarHBondContact O-N 3.42Å |
| 11 | I | 62.2 | Low | 59.2 | Low | 125 Ų | 125 | 133 Ų | 133 | 64% | 0.641 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -75.3 | -41.4 | 174.6 | -67.6 | 165.3 | 0 | 0 | 0 | 110.5 | R7 A8 V9 Y13 R14 | R7-I11 WeakPolarHBondContact O-CB 3.27Å; R7-I11 WeakPolarHBondContact O-CD1 3.38Å; R7-I11 WeakPolarHBondContact O-CG1 3.22Å; R7-I11 PolarHBondContact O-N 3.37Å; A8-I11 PolarHBondContact O-N 3.5Å; V9-I11 VanDerWaalsContact C-N 3.28Å; V9-I11 PolarHBondContact O-N 3.04Å; I11-Y13 VanDerWaalsContact C-N 3.31Å; I11-R14 PolarHBondContact O-N 3.07Å |
| 12 | A | 62.4 | Low | 58.7 | Low | 85 Ų | 85 | 126.3 Ų | 126.3 | 70% | 0.702 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -69.3 | -29.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A8 V9 R14 | A8-A12 VanDerWaalsContact O-CB 3.23Å; A8-A12 WeakPolarHBondContact O-CB 3.25Å; A8-A12 PolarHBondContact O-N 2.68Å; V9-A12 CarbonylContact O-C 3.57Å; V9-A12 PolarHBondContact O-N 2.88Å; A12-R14 VanDerWaalsContact C-N 3.31Å |
| 13 | Y | 59 | Low | 58.3 | Low | 194 Ų | 194 | 124.3 Ų | 124.3 | 76% | 0.761 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 8.8 | 175.4 | -126.5 | -89.9 | 0 | 0 | 0 | 113 | V9 I11 P15 | V9-Y13 VanDerWaalsContact O-CB 3.24Å; V9-Y13 WeakPolarHBondContact O-CB 3.32Å; V9-Y13 PolarHBondContact O-N 2.95Å; I11-Y13 VanDerWaalsContact C-N 3.31Å; Y13-P15 WeakPolarHBondContact O-CD 3.19Å; Y13-P15 VanDerWaalsContact O-N 3.15Å |
| 14 | R | 56.6 | Low | 57.6 | Low | 200 Ų | 200 | 125.7 Ų | 125.7 | 76% | 0.755 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -68.7 | 105 | 153.3 | -77.1 | -161.6 | 168.2 | -160.2 | -3.2 | 104.8 | L10 I11 A12 C16 | L10-R14 PolarHBondContact O-N 3.42Å; I11-R14 PolarHBondContact O-N 3.07Å; A12-R14 VanDerWaalsContact C-N 3.31Å; R14-C16 PolarHBondContact O-N 2.83Å |
| 15 | P | 51.8 | Low | 57 | Low | 105 Ų | 105 | 120.8 Ų | 120.8 | 68% | 0.682 | 66% | 0.656 | S | S | * | * | trans | -55.7 | 128 | 160.2 | 30 | -31.4 | 0 | 0 | 0 | 102.6 | Y13 Y17 | Y13-P15 WeakPolarHBondContact O-CD 3.19Å; Y13-P15 VanDerWaalsContact O-N 3.15Å; P15-Y17 VanDerWaalsContact C-N 3.33Å; P15-Y17 PolarHBondContact O-N 3.38Å | ||
| 16 | C | 51 | Low | 56.4 | Low | 100 Ų | 100 | 127.6 Ų | 127.6 | 68% | 0.676 | 67% | 0.674 | S | S | * | * | trans | -39 | 115.1 | 161.8 | -64.6 | 0 | 0 | 0 | 0 | 104.4 | R14 T18 | R14-C16 PolarHBondContact O-N 2.83Å; C16-T18 HydrophobicContact CB-CG2 3.95Å; C16-T18 PolarHBondContact O-N 2.95Å; C16-T18 PolarHBondContact O-OG1 2.84Å | ||
| 17 | Y | 51.1 | Low | 55.6 | Low | 224 Ų | 224 | 128.1 Ų | 128.1 | 88% | 0.878 | 68% | 0.678 | S | S | * | * | trans | -68.1 | 71.8 | 170 | -143.2 | -86.1 | 0 | 0 | 0 | 102.4 | P15 P19 | P15-Y17 VanDerWaalsContact C-N 3.33Å; P15-Y17 PolarHBondContact O-N 3.38Å; Y17-P19 WeakPolarHBondContact O-CD 3.36Å; Y17-P19 VanDerWaalsContact O-N 3.16Å | ||
| 18 | T | 54.8 | Low | 54.8 | Low | 98 Ų | 98 | 126.5 Ų | 126.5 | 60% | 0.601 | 68% | 0.679 | S | S | * | * | trans | -64.1 | 110.6 | 166.9 | 36.2 | 0 | 0 | 0 | 0 | 100.6 | C16 S20 | C16-T18 HydrophobicContact CB-CG2 3.95Å; C16-T18 PolarHBondContact O-N 2.95Å; C16-T18 PolarHBondContact O-OG1 2.84Å; T18-S20 PolarHBondContact O-N 2.96Å | ||
| 19 | P | 54.4 | Low | 54.4 | Low | 111 Ų | 111 | 128.4 Ų | 128.4 | 72% | 0.721 | 68% | 0.68 | S | S | * | * | trans | -55 | 108.2 | 158.7 | 25.1 | -29.3 | 0 | 0 | 0 | 103.1 | Y17 P21 | Y17-P19 WeakPolarHBondContact O-CD 3.36Å; Y17-P19 VanDerWaalsContact O-N 3.16Å; P19-P21 VanDerWaalsContact O-CD 3.31Å; P19-P21 WeakPolarHBondContact O-CD 3.47Å | ||
| 20 | S | 54 | Low | 53.7 | Low | 85 Ų | 85 | 129.7 Ų | 129.7 | 59% | 0.594 | 68% | 0.681 | S | S | * | * | trans | -46.9 | 112.7 | -178 | -169.6 | 0 | 0 | 0 | 0 | 105.4 | T18 A22 | T18-S20 PolarHBondContact O-N 2.96Å; S20-A22 VanDerWaalsContact C-N 3.34Å; S20-A22 PolarHBondContact O-N 3.42Å | ||
| 21 | P | 52.1 | Low | 53.4 | Low | 116 Ų | 116 | 128.7 Ų | 128.7 | 75% | 0.753 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 104.4 | -168.3 | 24.5 | -30.6 | 0 | 0 | 0 | 105.3 | P19 | P19-P21 VanDerWaalsContact O-CD 3.31Å; P19-P21 WeakPolarHBondContact O-CD 3.47Å |
| 22 | A | 46.7 | Very low | 53 | Low | 69 Ų | 69 | 132 Ų | 132 | 57% | 0.57 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 48.4 | 75.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | S20 K24 | S20-A22 VanDerWaalsContact C-N 3.34Å; S20-A22 PolarHBondContact O-N 3.42Å; A22-K24 HydrophobicContact CB-CD 4.22Å; A22-K24 HydrophobicContact CB-CG 3.95Å; A22-K24 PolarHBondContact O-N 3.02Å |
| 23 | V | 48.6 | Very low | 52.7 | Low | 107 Ų | 107 | 134.5 Ų | 134.5 | 65% | 0.648 | 68% | 0.683 | S | S | * | * | trans | -71.7 | 75.9 | 135.8 | -164 | 0 | 0 | 0 | 0 | 105.8 | S25 | V23-S25 WeakPolarHBondContact CG1-OG 3.36Å; V23-S25 PolarHBondContact O-N 3.21Å | ||
| 24 | K | 48.2 | Very low | 52.5 | Low | 192 Ų | 192 | 131.8 Ų | 131.8 | 84% | 0.835 | 67% | 0.672 | S | S | * | * | trans | -64.4 | 51.4 | 151.1 | -78.1 | 171.8 | 178.1 | -179.3 | 0 | 107.5 | A22 R26 | A22-K24 HydrophobicContact CB-CD 4.22Å; A22-K24 HydrophobicContact CB-CG 3.95Å; A22-K24 PolarHBondContact O-N 3.02Å; K24-R26 VanDerWaalsContact C-N 3.29Å; K24-R26 PolarHBondContact O-N 2.98Å; K24-R26 VanDerWaalsContact O-N 3.15Å | ||
| 25 | S | 53.6 | Low | 52.6 | Low | 68 Ų | 68 | 127.7 Ų | 127.7 | 48% | 0.476 | 66% | 0.662 | S | S | . | * | trans | -76.7 | 102.5 | 155.7 | 55.4 | 0 | 0 | 0 | 0 | 103.3 | V23 T27 | V23-S25 WeakPolarHBondContact CG1-OG 3.36Å; V23-S25 PolarHBondContact O-N 3.21Å; S25-T27 PolarHBondContact O-N 2.87Å | ||
| 26 | R | 51.4 | Low | 53.2 | Low | 246 Ų | 246 | 126 Ų | 126 | 93% | 0.928 | 65% | 0.653 | S | S | * | * | trans | -60.5 | 56.4 | 162.7 | -164.4 | -179.7 | -175.4 | 178.6 | 0.5 | 110 | K24 | K24-R26 VanDerWaalsContact C-N 3.29Å; K24-R26 PolarHBondContact O-N 2.98Å; K24-R26 VanDerWaalsContact O-N 3.15Å | ||
| 27 | T | 50.2 | Low | 53.9 | Low | 105 Ų | 105 | 126.2 Ų | 126.2 | 64% | 0.644 | 65% | 0.647 | S | S | * | * | trans | -116.8 | 61.8 | 156.4 | -5.4 | 0 | 0 | 0 | 0 | 103.7 | S25 I29 | S25-T27 PolarHBondContact O-N 2.87Å; T27-I29 PolarHBondContact O-N 3.43Å | ||
| 28 | Q | 48.3 | Very low | 54.9 | Low | 159 Ų | 159 | 122 Ų | 122 | 74% | 0.743 | 63% | 0.633 | S | S | * | * | trans | -54.3 | 94 | 148.7 | -174.4 | 175.8 | 20.7 | 0 | 0 | 103.8 | Q30 | Q28-Q30 PolarHBondContact O-N 3.38Š| ||
| 29 | I | 56.6 | Low | 55.9 | Low | 99 Ų | 99 | 121.7 Ų | 121.7 | 51% | 0.508 | 63% | 0.631 | S | S | . | * | trans | -57.2 | 97 | 166.9 | -75.4 | 168.3 | 0 | 0 | 0 | 103.5 | T27 P31 Y34 | T27-I29 PolarHBondContact O-N 3.43Å; I29-P31 WeakPolarHBondContact O-CD 3.15Å; I29-Y34 HydrophobicContact CB-CE2 4.16Å; I29-Y34 HydrophobicContact CD1-CE2 4.27Å; I29-Y34 HydrophobicContact CG1-CE2 4.1Å; I29-Y34 HydrophobicContact CG2-CD2 3.32Å; I29-Y34 HydrophobicContact CG2-CE2 3.08Å; I29-Y34 HydrophobicContact CG2-CG 4.44Å | ||
| 30 | Q | 51.5 | Low | 56.8 | Low | 108 Ų | 108 | 121.8 Ų | 121.8 | 51% | 0.505 | 63% | 0.626 | S | S | . | * | trans | -62.7 | 123.1 | 175.9 | -68 | -139.7 | 79.1 | 0 | 0 | 105.2 | Q28 R32 Q33 | Q28-Q30 PolarHBondContact O-N 3.38Å; Q30-R32 PolarHBondContact O-N 2.93Å; Q30-Q33 PolarHBondContact O-N 3.28Å | ||
| 31 | P | 56 | Low | 57.9 | Low | 106 Ų | 106 | 121.9 Ų | 121.9 | 69% | 0.688 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -57.9 | -13.4 | 179.8 | 20.2 | -30.4 | 0 | 0 | 0 | 112.5 | I29 | I29-P31 WeakPolarHBondContact O-CD 3.15Å |
| 32 | R | 54.2 | Low | 59 | Low | 194 Ų | 194 | 120.7 Ų | 120.7 | 73% | 0.732 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -78.2 | -25.8 | 174.8 | -67.9 | -67.3 | -174.1 | 174.3 | 3 | 115.7 | Q30 E35 | Q30-R32 PolarHBondContact O-N 2.93Å; R32-E35 IonicContact NH1-OE2 3.6Å |
| 33 | Q | 56.1 | Low | 60.4 | Low | 138 Ų | 138 | 119.1 Ų | 119.1 | 65% | 0.645 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -78.6 | -27.1 | 178.7 | -90.1 | -176.2 | -62.7 | 0 | 0 | 112.6 | Q30 | Q30-Q33 PolarHBondContact O-N 3.28Å |
| 34 | Y | 55.9 | Low | 61.8 | Low | 137 Ų | 137 | 120 Ų | 120 | 54% | 0.537 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -73 | -29.6 | 177.1 | -86.8 | -102 | 0 | 0 | 0 | 112.6 | I29 S36 L37 F38 | I29-Y34 HydrophobicContact CB-CE2 4.16Å; I29-Y34 HydrophobicContact CD1-CE2 4.27Å; I29-Y34 HydrophobicContact CG1-CE2 4.1Å; I29-Y34 HydrophobicContact CG2-CD2 3.32Å; I29-Y34 HydrophobicContact CG2-CE2 3.08Å; I29-Y34 HydrophobicContact CG2-CG 4.44Å; Y34-S36 VanDerWaalsContact C-N 3.34Å; Y34-S36 PolarHBondContact O-N 3.47Å; Y34-L37 PolarHBondContact O-N 3.34Å; Y34-F38 VanDerWaalsContact O-CB 3.22Å; Y34-F38 WeakPolarHBondContact O-CB 3.38Å; Y34-F38 PolarHBondContact O-N 3.2Å |
| 35 | E | 59.1 | Low | 62.8 | Low | 114 Ų | 114 | 118.1 Ų | 118.1 | 53% | 0.533 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63.9 | -38.9 | 177.5 | -66.9 | -144 | 103.5 | 0 | 0 | 112.4 | R32 T39 | R32-E35 IonicContact NH1-OE2 3.6Å; E35-T39 VanDerWaalsContact O-CB 3.27Å; E35-T39 WeakPolarHBondContact O-CB 3.39Å; E35-T39 PolarHBondContact O-N 3.39Å; E35-T39 PolarHBondContact O-OG1 3.34Å |
| 36 | S | 64.1 | Low | 63.6 | Low | 71 Ų | 71 | 119 Ų | 119 | 50% | 0.497 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -69.1 | -40.9 | 177.8 | -179.9 | 0 | 0 | 0 | 0 | 112.2 | Y34 N40 | Y34-S36 VanDerWaalsContact C-N 3.34Å; Y34-S36 PolarHBondContact O-N 3.47Å; S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.35Å; S36-N40 PolarHBondContact O-ND2 2.8Å |
| 37 | L | 65.6 | Low | 64.2 | Low | 104 Ų | 104 | 112.3 Ų | 112.3 | 55% | 0.545 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.3 | -46 | 174.7 | -93.9 | 156.3 | 0 | 0 | 0 | 111.2 | Y34 N40 I41 | Y34-L37 PolarHBondContact O-N 3.34Å; L37-N40 PolarHBondContact O-N 3.19Å; L37-I41 WeakPolarHBondContact O-CB 3.38Å; L37-I41 WeakPolarHBondContact O-CD1 2.97Å; L37-I41 WeakPolarHBondContact O-CG1 3.37Å; L37-I41 PolarHBondContact O-N 3.19Å |
| 38 | F | 71.7 | Confident | 64.6 | Low | 135 Ų | 135 | 112.5 Ų | 112.5 | 59% | 0.592 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.9 | -43.3 | 179.4 | -172.8 | -98.4 | 0 | 0 | 0 | 111.7 | Y34 I41 L42 | Y34-F38 VanDerWaalsContact O-CB 3.22Å; Y34-F38 WeakPolarHBondContact O-CB 3.38Å; Y34-F38 PolarHBondContact O-N 3.2Å; F38-I41 PolarHBondContact O-N 2.88Å; F38-L42 HydrophobicContact CE1-CD2 4.14Å; F38-L42 VanDerWaalsContact O-CB 3.25Å; F38-L42 WeakPolarHBondContact O-CB 3.23Å; F38-L42 PolarHBondContact O-N 3.28Å |
| 39 | T | 74.7 | Confident | 65.2 | Low | 92 Ų | 92 | 109.8 Ų | 109.8 | 56% | 0.564 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.6 | -40.2 | 178.7 | -52.5 | 0 | 0 | 0 | 0 | 111.8 | E35 G43 | E35-T39 VanDerWaalsContact O-CB 3.27Å; E35-T39 WeakPolarHBondContact O-CB 3.39Å; E35-T39 PolarHBondContact O-N 3.39Å; E35-T39 PolarHBondContact O-OG1 3.34Å; T39-G43 PolarHBondContact O-N 3.38Å |
| 40 | N | 73.4 | Confident | 65.3 | Low | 112 Ų | 112 | 112.2 Ų | 112.2 | 60% | 0.599 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -64.7 | -43.3 | 175.1 | -87.2 | -61.1 | 0 | 0 | 0 | 112.2 | S36 L37 F44 | S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.35Å; S36-N40 PolarHBondContact O-ND2 2.8Å; L37-N40 PolarHBondContact O-N 3.19Å; N40-F44 WeakPolarHBondContact O-CB 3.38Å; N40-F44 PolarHBondContact O-N 2.75Å |
| 41 | I | 77.2 | Confident | 65.4 | Low | 87 Ų | 87 | 117.3 Ų | 117.3 | 45% | 0.446 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.3 | -49.4 | 178.5 | -68.1 | 165.8 | 0 | 0 | 0 | 109.9 | L37 F38 G43 F44 Y45 | L37-I41 WeakPolarHBondContact O-CB 3.38Å; L37-I41 WeakPolarHBondContact O-CD1 2.97Å; L37-I41 WeakPolarHBondContact O-CG1 3.37Å; L37-I41 PolarHBondContact O-N 3.19Å; F38-I41 PolarHBondContact O-N 2.88Å; I41-G43 VanDerWaalsContact C-N 3.33Å; I41-G43 PolarHBondContact O-N 2.91Å; I41-F44 WeakPolarHBondContact O-CB 3.24Å; I41-F44 PolarHBondContact O-N 3.16Å; I41-Y45 HydrophobicContact CG2-CD2 3.68Å; I41-Y45 HydrophobicContact CG2-CE2 3.55Å; I41-Y45 WeakPolarHBondContact O-CD2 3.22Å; I41-Y45 PolarHBondContact O-N 2.71Å |
| 42 | L | 75.9 | Confident | 65.8 | Low | 92 Ų | 92 | 117.9 Ų | 117.9 | 48% | 0.482 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -60.9 | -44.1 | 179.3 | -167.8 | 69.9 | 0 | 0 | 0 | 111.1 | F38 F44 Y45 T46 | F38-L42 HydrophobicContact CE1-CD2 4.14Å; F38-L42 VanDerWaalsContact O-CB 3.25Å; F38-L42 WeakPolarHBondContact O-CB 3.23Å; F38-L42 PolarHBondContact O-N 3.28Å; L42-F44 VanDerWaalsContact C-N 3.35Å; L42-F44 PolarHBondContact O-N 3.31Å; L42-Y45 PolarHBondContact O-N 3.48Å; L42-T46 WeakPolarHBondContact O-CG2 3.06Å; L42-T46 PolarHBondContact O-N 2.95Å; L42-T46 PolarHBondContact O-OG1 3.31Å |
| 43 | G | 76.4 | Confident | 66.5 | Low | 36 Ų | 36 | 113.9 Ų | 113.9 | 37% | 0.371 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -57.1 | -44.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T39 I41 T46 N47 | T39-G43 PolarHBondContact O-N 3.38Å; I41-G43 VanDerWaalsContact C-N 3.33Å; I41-G43 PolarHBondContact O-N 2.91Å; G43-T46 VanDerWaalsContact CA-OG1 3.32Å; G43-T46 WeakPolarHBondContact CA-OG1 3.31Å; G43-T46 PolarHBondContact O-N 2.74Å; G43-T46 PolarHBondContact O-OG1 2.77Å; G43-N47 WeakPolarHBondContact O-CB 3.37Å; G43-N47 PolarHBondContact O-N 3.01Å |
| 44 | F | 78.2 | Confident | 67 | Low | 126 Ų | 126 | 112.6 Ų | 112.6 | 55% | 0.553 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61 | -46.6 | 176.5 | -177.1 | -96.1 | 0 | 0 | 0 | 112.3 | N40 I41 L42 N47 Q48 | N40-F44 WeakPolarHBondContact O-CB 3.38Å; N40-F44 PolarHBondContact O-N 2.75Å; I41-F44 WeakPolarHBondContact O-CB 3.24Å; I41-F44 PolarHBondContact O-N 3.16Å; L42-F44 VanDerWaalsContact C-N 3.35Å; L42-F44 PolarHBondContact O-N 3.31Å; F44-N47 PolarHBondContact O-N 2.62Å; F44-Q48 HydrophobicContact CD1-CG 4.36Å; F44-Q48 HydrophobicContact CE1-CG 4.1Å; F44-Q48 HydrophobicContact CZ-CG 4.32Å; F44-Q48 VanDerWaalsContact CZ-NE2 3.33Å; F44-Q48 VanDerWaalsContact O-CG 3.24Å; F44-Q48 WeakPolarHBondContact O-CG 3.32Å; F44-Q48 PolarHBondContact O-N 2.84Å; F44-Q48 VanDerWaalsContact O-N 3.07Å |
| 45 | Y | 67.8 | Low | 67.7 | Low | 152 Ų | 152 | 111.1 Ų | 111.1 | 60% | 0.596 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -68 | -37.9 | 178.3 | -78.9 | -72.2 | 0 | 0 | 0 | 113 | I41 L42 N47 Q48 S49 | I41-Y45 HydrophobicContact CG2-CD2 3.68Å; I41-Y45 HydrophobicContact CG2-CE2 3.55Å; I41-Y45 WeakPolarHBondContact O-CD2 3.22Å; I41-Y45 PolarHBondContact O-N 2.71Å; L42-Y45 PolarHBondContact O-N 3.48Å; Y45-N47 VanDerWaalsContact C-N 3.34Å; Y45-Q48 PolarHBondContact O-N 2.85Å; Y45-S49 PolarHBondContact O-N 2.79Å; Y45-S49 VanDerWaalsContact O-N 3.15Å; Y45-S49 PolarHBondContact O-OG 2.86Å |
| 46 | T | 71.6 | Confident | 68.2 | Low | 86 Ų | 86 | 110.9 Ų | 110.9 | 53% | 0.528 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.3 | -33.4 | 175.3 | 49 | 0 | 0 | 0 | 0 | 112.7 | L42 G43 S49 | L42-T46 WeakPolarHBondContact O-CG2 3.06Å; L42-T46 PolarHBondContact O-N 2.95Å; L42-T46 PolarHBondContact O-OG1 3.31Å; G43-T46 VanDerWaalsContact CA-OG1 3.32Å; G43-T46 WeakPolarHBondContact CA-OG1 3.31Å; G43-T46 PolarHBondContact O-N 2.74Å; G43-T46 PolarHBondContact O-OG1 2.77Å; T46-S49 PolarHBondContact O-N 3.25Å |
| 47 | N | 64.4 | Low | 68.5 | Low | 106 Ų | 106 | 113.6 Ų | 113.6 | 57% | 0.567 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71 | -39.9 | 176.8 | -166.6 | -82.5 | 0 | 0 | 0 | 111.6 | G43 F44 Y45 S49 N50 | G43-N47 WeakPolarHBondContact O-CB 3.37Å; G43-N47 PolarHBondContact O-N 3.01Å; F44-N47 PolarHBondContact O-N 2.62Å; Y45-N47 VanDerWaalsContact C-N 3.34Å; N47-S49 VanDerWaalsContact C-N 3.25Å; N47-S49 PolarHBondContact O-N 3.04Å; N47-N50 PolarHBondContact O-N 2.79Å |
| 48 | Q | 58.6 | Low | 68.7 | Low | 109 Ų | 109 | 114.3 Ų | 114.3 | 51% | 0.509 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.7 | -27.3 | 174.2 | -70.8 | -97.3 | 32.6 | 0 | 0 | 113.2 | F44 Y45 N50 | F44-Q48 HydrophobicContact CD1-CG 4.36Å; F44-Q48 HydrophobicContact CE1-CG 4.1Å; F44-Q48 HydrophobicContact CZ-CG 4.32Å; F44-Q48 VanDerWaalsContact CZ-NE2 3.33Å; F44-Q48 VanDerWaalsContact O-CG 3.24Å; F44-Q48 WeakPolarHBondContact O-CG 3.32Å; F44-Q48 PolarHBondContact O-N 2.84Å; F44-Q48 VanDerWaalsContact O-N 3.07Å; Y45-Q48 PolarHBondContact O-N 2.85Å; Q48-N50 PolarHBondContact O-N 3.15Å |
| 49 | S | 61 | Low | 68.5 | Low | 102 Ų | 102 | 112.7 Ų | 112.7 | 71% | 0.713 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -4.2 | -179.7 | -56.6 | 0 | 0 | 0 | 0 | 113.6 | Y45 T46 N47 | Y45-S49 PolarHBondContact O-N 2.79Å; Y45-S49 VanDerWaalsContact O-N 3.15Å; Y45-S49 PolarHBondContact O-OG 2.86Å; T46-S49 PolarHBondContact O-N 3.25Å; N47-S49 VanDerWaalsContact C-N 3.25Å; N47-S49 PolarHBondContact O-N 3.04Å |
| 50 | N | 59 | Low | 68 | Low | 149 Ų | 149 | 114.4 Ų | 114.4 | 80% | 0.797 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.6 | 15.4 | -175.3 | -145.2 | 8.9 | 0 | 0 | 0 | 113 | N47 Q48 | N47-N50 PolarHBondContact O-N 2.79Å; Q48-N50 PolarHBondContact O-N 3.15Å |
| 51 | Q | 52.1 | Low | 67.5 | Low | 216 Ų | 216 | 114.6 Ų | 114.6 | 100% | 1.009 | 60% | 0.597 | S | S | * | * | trans | -110.4 | 0 | 164.8 | -73.9 | -170.7 | 30.2 | 0 | 0 | 109.4 |
Retrieved 51 of 51 residues in 66.7 ms
(Link to these results)