| 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 | 48.3 | Very low | 52.1 | Low | 243 Ų | 243 | 164.3 Ų | 164.3 | 100% | 1.197 | 86% | 0.859 | S | S | * | * | 0 | 99.2 | 0 | -71.9 | 167.2 | 68.4 | 0 | 0 | 106.8 | |||||
| 2 | V | 44.9 | Very low | 52.2 | Low | 145 Ų | 145 | 167.1 Ų | 167.1 | 88% | 0.879 | 86% | 0.859 | S | S | * | * | trans | -91.1 | 144 | -169.5 | 177.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | A | 46.8 | Very low | 52.2 | Low | 95 Ų | 95 | 162.3 Ų | 162.3 | 79% | 0.785 | 85% | 0.85 | S | S | * | * | trans | -44.4 | 135 | -173.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 4 | E | 51.5 | Low | 52.6 | Low | 198 Ų | 198 | 160.1 Ų | 160.1 | 93% | 0.925 | 85% | 0.846 | S | S | * | * | trans | -76.1 | 123.6 | 168.5 | -86.6 | 176.7 | 140.5 | 0 | 0 | 111 | ||||
| 5 | A | 54.4 | Low | 52.8 | Low | 90 Ų | 90 | 155.1 Ų | 155.1 | 74% | 0.744 | 84% | 0.837 | S | S | * | * | trans | -76.8 | 125.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q7 | A5-Q7 PolarHBondContact O-N 3.32Š| ||
| 6 | N | 55.3 | Low | 53.1 | Low | 152 Ų | 152 | 150.9 Ų | 150.9 | 81% | 0.813 | 83% | 0.829 | S | S | * | * | trans | -58.8 | 93 | 169.6 | -172.8 | 9.4 | 0 | 0 | 0 | 111.4 | S8 | N6-S8 VanDerWaalsContact C-N 3.28Å; N6-S8 PolarHBondContact O-N 3.3Å; N6-S8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | Q | 55.2 | Low | 53.4 | Low | 183 Ų | 183 | 148.2 Ų | 148.2 | 86% | 0.855 | 82% | 0.824 | S | S | * | * | trans | -85.8 | 73 | 167.3 | -93.3 | 167.5 | 2.1 | 0 | 0 | 110.2 | A5 R9 | A5-Q7 PolarHBondContact O-N 3.32Å; Q7-R9 PolarHBondContact O-N 3.47Å | ||
| 8 | S | 52.6 | Low | 53.8 | Low | 96 Ų | 96 | 146.1 Ų | 146.1 | 67% | 0.671 | 82% | 0.818 | S | S | * | * | trans | -59.2 | 101.1 | 161.1 | -179.5 | 0 | 0 | 0 | 0 | 108.4 | N6 R10 | N6-S8 VanDerWaalsContact C-N 3.28Å; N6-S8 PolarHBondContact O-N 3.3Å; N6-S8 VanDerWaalsContact O-N 3.17Å; S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.25Å | ||
| 9 | R | 55.8 | Low | 54 | Low | 244 Ų | 244 | 142.2 Ų | 142.2 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | trans | -52.5 | 97 | 173.3 | -87.9 | -176.8 | 178.3 | -167 | 0.2 | 109.2 | Q7 T11 | Q7-R9 PolarHBondContact O-N 3.47Å; R9-T11 PolarHBondContact O-N 3.41Å | ||
| 10 | R | 54.7 | Low | 54.2 | Low | 235 Ų | 235 | 138.7 Ų | 138.7 | 89% | 0.887 | 79% | 0.789 | S | S | * | * | trans | -63.8 | 119.3 | 174 | -168.9 | 169.6 | 151 | -170.8 | -5.1 | 108.3 | S8 K12 | S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.25Å; R10-K12 PolarHBondContact O-N 3.26Å | ||
| 11 | T | 53.5 | Low | 54.3 | Low | 126 Ų | 126 | 138.9 Ų | 138.9 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | -48.6 | 122.5 | 173.1 | 48.4 | 0 | 0 | 0 | 0 | 110.9 | R9 | R9-T11 PolarHBondContact O-N 3.41Š| ||
| 12 | K | 53.6 | Low | 54.8 | Low | 198 Ų | 198 | 131.7 Ų | 131.7 | 86% | 0.861 | 75% | 0.749 | S | S | * | * | trans | -110.6 | 83 | 151.8 | -81.5 | -173.4 | 178.5 | -179 | 0 | 106.9 | R10 V14 | R10-K12 PolarHBondContact O-N 3.26Å; K12-V14 VanDerWaalsContact C-N 3.35Å; K12-V14 PolarHBondContact O-N 3.02Å; K12-V14 VanDerWaalsContact O-N 3.09Å | ||
| 13 | S | 52 | Low | 55.6 | Low | 105 Ų | 105 | 129 Ų | 129 | 73% | 0.734 | 73% | 0.733 | S | S | * | * | trans | -58.7 | 105.9 | 153.1 | 167.3 | 0 | 0 | 0 | 0 | 105.9 | A15 | S13-A15 PolarHBondContact O-N 3.45Š| ||
| 14 | V | 57.1 | Low | 56.3 | Low | 131 Ų | 131 | 130 Ų | 130 | 79% | 0.794 | 72% | 0.724 | S | S | * | * | trans | -68.5 | 92.5 | 162.3 | 175.9 | 0 | 0 | 0 | 0 | 104.4 | K12 A16 | K12-V14 VanDerWaalsContact C-N 3.35Å; K12-V14 PolarHBondContact O-N 3.02Å; K12-V14 VanDerWaalsContact O-N 3.09Å; V14-A16 PolarHBondContact O-N 3.43Å | ||
| 15 | A | 55.8 | Low | 57.8 | Low | 86 Ų | 86 | 124.1 Ų | 124.1 | 71% | 0.711 | 70% | 0.699 | S | S | * | * | trans | -61.7 | 96.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 106.4 | S13 S17 | S13-A15 PolarHBondContact O-N 3.45Å; A15-S17 PolarHBondContact O-N 3.11Å | ||
| 16 | A | 58.2 | Low | 59.5 | Low | 87 Ų | 87 | 124.3 Ų | 124.3 | 72% | 0.719 | 69% | 0.687 | S | S | * | * | trans | -59.2 | 107.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 106.1 | V14 | V14-A16 PolarHBondContact O-N 3.43Š| ||
| 17 | S | 58.8 | Low | 61.3 | Low | 106 Ų | 106 | 121.2 Ų | 121.2 | 74% | 0.741 | 67% | 0.67 | S | S | * | * | trans | -53.5 | 132.9 | 170.4 | -146.7 | 0 | 0 | 0 | 0 | 107.6 | A15 | A15-S17 PolarHBondContact O-N 3.11Š| ||
| 18 | P | 59.3 | Low | 63.1 | Low | 109 Ų | 109 | 116.4 Ų | 116.4 | 71% | 0.708 | 65% | 0.651 | S | S | * | * | trans | -57 | 138.6 | 176.3 | -1.3 | 8.1 | 0 | 0 | 0 | 108.3 | A20 | P18-A20 PolarHBondContact O-N 3.19Š| ||
| 19 | P | 57.4 | Low | 65 | Low | 73 Ų | 73 | 117.6 Ų | 117.6 | 47% | 0.474 | 64% | 0.644 | S | S | . | * | trans | -66.5 | 108.4 | -171.8 | 26.7 | -33.2 | 0 | 0 | 0 | 109.2 | H21 N22 | P19-H21 HydrophobicContact CB-CB 4.12Å; P19-H21 PolarHBondContact O-N 3.06Å; P19-N22 HydrophobicContact CG-CB 4.33Å; P19-N22 WeakPolarHBondContact CG-ND2 3.3Å; P19-N22 PolarHBondContact O-N 3.05Å | ||
| 20 | A | 58.3 | Low | 66.9 | Low | 71 Ų | 71 | 110.2 Ų | 110.2 | 59% | 0.587 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -53 | -19.4 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | P18 N22 V23 L24 | P18-A20 PolarHBondContact O-N 3.19Å; A20-N22 VanDerWaalsContact C-N 3.26Å; A20-N22 PolarHBondContact O-N 3.24Å; A20-V23 PolarHBondContact O-N 3.12Å; A20-L24 PolarHBondContact O-N 3.5Å |
| 21 | H | 57.8 | Low | 68.9 | Low | 143 Ų | 143 | 104.6 Ų | 104.6 | 66% | 0.662 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -59.6 | -27.8 | 170.7 | -164.6 | -72 | 0 | 0 | 0 | 114.1 | P19 | P19-H21 HydrophobicContact CB-CB 4.12Å; P19-H21 PolarHBondContact O-N 3.06Å |
| 22 | N | 58.4 | Low | 70.9 | Confident | 92 Ų | 92 | 104.7 Ų | 104.7 | 49% | 0.492 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -80.5 | -32.1 | 179.7 | -77 | -4.3 | 0 | 0 | 0 | 112.7 | P19 A20 N25 I26 | P19-N22 HydrophobicContact CG-CB 4.33Å; P19-N22 WeakPolarHBondContact CG-ND2 3.3Å; P19-N22 PolarHBondContact O-N 3.05Å; A20-N22 VanDerWaalsContact C-N 3.26Å; A20-N22 PolarHBondContact O-N 3.24Å; N22-N25 PolarHBondContact O-N 2.92Å; N22-I26 WeakPolarHBondContact O-CG1 2.92Å; N22-I26 PolarHBondContact O-N 3.43Å |
| 23 | V | 60.8 | Low | 73 | Confident | 89 Ų | 89 | 97.9 Ų | 97.9 | 54% | 0.539 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -72.1 | -45.2 | 179 | -177.9 | 0 | 0 | 0 | 0 | 110.5 | A20 N25 I26 D27 | A20-V23 PolarHBondContact O-N 3.12Å; V23-N25 PolarHBondContact O-N 3.08Å; V23-I26 PolarHBondContact O-N 3.32Å; V23-D27 PolarHBondContact O-N 3.03Å; V23-D27 VanDerWaalsContact O-N 3.17Å |
| 24 | L | 62.6 | Low | 75.1 | Confident | 115 Ų | 115 | 98.6 Ų | 98.6 | 60% | 0.602 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -60.5 | -28.7 | 175.6 | -64.3 | 173 | 0 | 0 | 0 | 113.1 | A20 N28 | A20-L24 PolarHBondContact O-N 3.5Å; L24-N28 PolarHBondContact O-N 3.49Å; L24-N28 PolarHBondContact O-ND2 3.24Å |
| 25 | N | 81.8 | Confident | 77.1 | Confident | 75 Ų | 75 | 95.7 Ų | 95.7 | 40% | 0.401 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -78 | -28.3 | 176.7 | -169.6 | 20.7 | 0 | 0 | 0 | 112.6 | N22 V23 K29 | N22-N25 PolarHBondContact O-N 2.92Å; V23-N25 PolarHBondContact O-N 3.08Å; N25-K29 VanDerWaalsContact O-CG 3.29Å; N25-K29 WeakPolarHBondContact O-CG 3.49Å; N25-K29 PolarHBondContact O-N 3.47Å |
| 26 | I | 90.1 | Very high | 79.1 | Confident | 95 Ų | 95 | 97.5 Ų | 97.5 | 49% | 0.487 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -73.4 | -45.5 | 176.9 | -69.1 | 164.6 | 0 | 0 | 0 | 109.8 | N22 V23 N28 K29 I30 | N22-I26 WeakPolarHBondContact O-CG1 2.92Å; N22-I26 PolarHBondContact O-N 3.43Å; V23-I26 PolarHBondContact O-N 3.32Å; I26-N28 VanDerWaalsContact C-N 3.3Å; I26-N28 PolarHBondContact O-N 3.21Å; I26-K29 WeakPolarHBondContact O-CB 3.36Å; I26-K29 PolarHBondContact O-N 2.91Å; I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.3Å; I26-I30 WeakPolarHBondContact O-CG1 3.43Å; I26-I30 PolarHBondContact O-N 2.75Å |
| 27 | D | 93.2 | Very high | 81 | Confident | 86 Ų | 86 | 97.4 Ų | 97.4 | 46% | 0.46 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 178.5 | -63.8 | -23.2 | 0 | 0 | 0 | 111.1 | V23 K29 I30 E31 | V23-D27 PolarHBondContact O-N 3.03Å; V23-D27 VanDerWaalsContact O-N 3.17Å; D27-K29 VanDerWaalsContact C-N 3.32Å; D27-K29 PolarHBondContact O-N 2.9Å; D27-I30 PolarHBondContact O-N 2.86Å; D27-E31 WeakPolarHBondContact O-CB 3.19Å; D27-E31 PolarHBondContact O-N 3.37Å |
| 28 | N | 92.7 | Very high | 82.9 | Confident | 82 Ų | 82 | 97.7 Ų | 97.7 | 44% | 0.439 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.2 | -35.7 | 174.9 | -71.1 | -12.4 | 0 | 0 | 0 | 113.2 | L24 I26 Q32 | L24-N28 PolarHBondContact O-N 3.49Å; L24-N28 PolarHBondContact O-ND2 3.24Å; I26-N28 VanDerWaalsContact C-N 3.3Å; I26-N28 PolarHBondContact O-N 3.21Å; N28-Q32 WeakPolarHBondContact O-CB 3.17Å; N28-Q32 WeakPolarHBondContact O-CG 3.26Å; N28-Q32 PolarHBondContact O-N 2.8Å; N28-Q32 PolarHBondContact O-NE2 3.17Å |
| 29 | K | 94.1 | Very high | 84.7 | Confident | 122 Ų | 122 | 95.2 Ų | 95.2 | 53% | 0.53 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -73.1 | -36 | 177 | -77.5 | 173.5 | 177.6 | -68.2 | 0 | 111.9 | N25 I26 D27 A33 | N25-K29 VanDerWaalsContact O-CG 3.29Å; N25-K29 WeakPolarHBondContact O-CG 3.49Å; N25-K29 PolarHBondContact O-N 3.47Å; I26-K29 WeakPolarHBondContact O-CB 3.36Å; I26-K29 PolarHBondContact O-N 2.91Å; D27-K29 VanDerWaalsContact C-N 3.32Å; D27-K29 PolarHBondContact O-N 2.9Å; K29-A33 WeakPolarHBondContact O-CB 3.44Å; K29-A33 PolarHBondContact O-N 3.39Å |
| 30 | I | 95.3 | Very high | 86.6 | Confident | 89 Ų | 89 | 98.2 Ų | 98.2 | 46% | 0.456 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.2 | -46.6 | 173.5 | -68.2 | 169.3 | 0 | 0 | 0 | 109.4 | I26 D27 Q32 A33 M34 | I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.3Å; I26-I30 WeakPolarHBondContact O-CG1 3.43Å; I26-I30 PolarHBondContact O-N 2.75Å; D27-I30 PolarHBondContact O-N 2.86Å; I30-Q32 PolarHBondContact O-N 3.07Å; I30-A33 PolarHBondContact O-N 3.23Å; I30-M34 HydrophobicContact CG2-CG 4.35Å; I30-M34 HydrophobicContact CG2-SD 3.97Å; I30-M34 WeakPolarHBondContact O-CB 3.28Å; I30-M34 WeakPolarHBondContact O-CG 3.28Å; I30-M34 PolarHBondContact O-N 3.06Å |
| 31 | E | 95.6 | Very high | 88.6 | Confident | 116 Ų | 116 | 99.5 Ų | 99.5 | 54% | 0.542 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 177.5 | -171.2 | 175.2 | -161.4 | 0 | 0 | 111.4 | D27 A33 M34 D35 | D27-E31 WeakPolarHBondContact O-CB 3.19Å; D27-E31 PolarHBondContact O-N 3.37Å; E31-A33 PolarHBondContact O-N 2.82Å; E31-M34 PolarHBondContact O-N 3.11Å; E31-D35 WeakPolarHBondContact O-CB 3.14Å; E31-D35 PolarHBondContact O-N 3.03Å |
| 32 | Q | 95.8 | Very high | 90.5 | Very high | 129 Ų | 129 | 98.1 Ų | 98.1 | 60% | 0.603 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.5 | -43.7 | 174.9 | -75.9 | 168.4 | 42.2 | 0 | 0 | 112.8 | N28 I30 M34 D35 L36 | N28-Q32 WeakPolarHBondContact O-CB 3.17Å; N28-Q32 WeakPolarHBondContact O-CG 3.26Å; N28-Q32 PolarHBondContact O-N 2.8Å; N28-Q32 PolarHBondContact O-NE2 3.17Å; I30-Q32 PolarHBondContact O-N 3.07Å; Q32-M34 VanDerWaalsContact C-N 3.34Å; Q32-D35 PolarHBondContact O-N 3.29Å; Q32-L36 WeakPolarHBondContact O-CB 3.45Å; Q32-L36 PolarHBondContact O-N 3.49Å |
| 33 | A | 97.3 | Very high | 92.4 | Very high | 54 Ų | 54 | 99.6 Ų | 99.6 | 45% | 0.446 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65 | -40.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.3 | K29 I30 E31 L36 V37 | K29-A33 WeakPolarHBondContact O-CB 3.44Å; K29-A33 PolarHBondContact O-N 3.39Å; I30-A33 PolarHBondContact O-N 3.23Å; E31-A33 PolarHBondContact O-N 2.82Å; A33-L36 PolarHBondContact O-N 3.45Å; A33-V37 VanDerWaalsContact O-CG2 3.28Å; A33-V37 WeakPolarHBondContact O-CG2 3.5Å; A33-V37 PolarHBondContact O-N 2.94Å |
| 34 | M | 97.6 | Very high | 94.1 | Very high | 120 Ų | 120 | 97 Ų | 97 | 59% | 0.591 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.8 | -43.2 | 176.2 | -75.4 | -179.2 | 67.2 | 0 | 0 | 112.2 | I30 E31 Q32 L36 V37 K38 | I30-M34 HydrophobicContact CG2-CG 4.35Å; I30-M34 HydrophobicContact CG2-SD 3.97Å; I30-M34 WeakPolarHBondContact O-CB 3.28Å; I30-M34 WeakPolarHBondContact O-CG 3.28Å; I30-M34 PolarHBondContact O-N 3.06Å; E31-M34 PolarHBondContact O-N 3.11Å; Q32-M34 VanDerWaalsContact C-N 3.34Å; M34-L36 VanDerWaalsContact C-N 3.33Å; M34-V37 PolarHBondContact O-N 3.18Å; M34-K38 VanDerWaalsContact O-CB 3.29Å; M34-K38 WeakPolarHBondContact O-CB 3.34Å; M34-K38 PolarHBondContact O-N 2.97Å |
| 35 | D | 97.7 | Very high | 95.9 | Very high | 70 Ų | 70 | 95.8 Ų | 95.8 | 37% | 0.374 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.9 | -35.1 | 178 | -80.5 | -20.3 | 0 | 0 | 0 | 112.3 | E31 Q32 K38 T39 | E31-D35 WeakPolarHBondContact O-CB 3.14Å; E31-D35 PolarHBondContact O-N 3.03Å; Q32-D35 PolarHBondContact O-N 3.29Å; D35-K38 PolarHBondContact O-N 3.12Å; D35-K38 IonicContact OD1-NZ 2.84Å; D35-K38 PolarHBondContact OD1-NZ 3.19Å; D35-T39 VanDerWaalsContact O-CB 3.31Å; D35-T39 WeakPolarHBondContact O-CB 3.48Å; D35-T39 PolarHBondContact O-N 3.06Å; D35-T39 PolarHBondContact O-OG1 3.45Å |
| 36 | L | 97.8 | Very high | 96.6 | Very high | 125 Ų | 125 | 100.1 Ų | 100.1 | 65% | 0.654 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.1 | -47.8 | 171.4 | -177 | 63.6 | 0 | 0 | 0 | 111.3 | Q32 A33 M34 K38 T39 H40 | Q32-L36 WeakPolarHBondContact O-CB 3.45Å; Q32-L36 PolarHBondContact O-N 3.49Å; A33-L36 PolarHBondContact O-N 3.45Å; M34-L36 VanDerWaalsContact C-N 3.33Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 2.88Å; L36-T39 PolarHBondContact O-N 3.35Å; L36-H40 WeakPolarHBondContact O-CB 3.36Å; L36-H40 PolarHBondContact O-N 2.85Å |
| 37 | V | 98.2 | Very high | 97 | Very high | 84 Ų | 84 | 102.5 Ų | 102.5 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 176.5 | 169.1 | 0 | 0 | 0 | 0 | 110.9 | A33 M34 T39 H40 L41 | A33-V37 VanDerWaalsContact O-CG2 3.28Å; A33-V37 WeakPolarHBondContact O-CG2 3.5Å; A33-V37 PolarHBondContact O-N 2.94Å; M34-V37 PolarHBondContact O-N 3.18Å; V37-T39 VanDerWaalsContact C-N 3.33Å; V37-T39 PolarHBondContact O-N 3.49Å; V37-H40 PolarHBondContact O-N 3.48Å; V37-L41 HydrophobicContact CG1-CD1 3.91Å; V37-L41 HydrophobicContact CG1-CG 4.34Å; V37-L41 WeakPolarHBondContact O-CB 3.38Å; V37-L41 WeakPolarHBondContact O-CG 3.49Å; V37-L41 PolarHBondContact O-N 3.15Å |
| 38 | K | 98.3 | Very high | 97.3 | Very high | 112 Ų | 112 | 104.7 Ų | 104.7 | 49% | 0.487 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.5 | -47.3 | 177.3 | -173.2 | -171.7 | -65.7 | 149.5 | 0 | 110.8 | M34 D35 L36 L41 M42 | M34-K38 VanDerWaalsContact O-CB 3.29Å; M34-K38 WeakPolarHBondContact O-CB 3.34Å; M34-K38 PolarHBondContact O-N 2.97Å; D35-K38 PolarHBondContact O-N 3.12Å; D35-K38 IonicContact OD1-NZ 2.84Å; D35-K38 PolarHBondContact OD1-NZ 3.19Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 2.88Å; K38-L41 PolarHBondContact O-N 2.91Å; K38-M42 HydrophobicContact CG-CE 4.24Å; K38-M42 WeakPolarHBondContact O-CB 3.43Å; K38-M42 VanDerWaalsContact O-CG 3.28Å; K38-M42 WeakPolarHBondContact O-CG 3.38Å; K38-M42 PolarHBondContact O-N 3.45Å |
| 39 | T | 97.9 | Very high | 97.6 | Very high | 58 Ų | 58 | 103.5 Ų | 103.5 | 36% | 0.356 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.3 | -46.3 | 178.2 | -60 | 0 | 0 | 0 | 0 | 111.2 | D35 L36 V37 L41 M42 F43 | D35-T39 VanDerWaalsContact O-CB 3.31Å; D35-T39 WeakPolarHBondContact O-CB 3.48Å; D35-T39 PolarHBondContact O-N 3.06Å; D35-T39 PolarHBondContact O-OG1 3.45Å; L36-T39 PolarHBondContact O-N 3.35Å; V37-T39 VanDerWaalsContact C-N 3.33Å; V37-T39 PolarHBondContact O-N 3.49Å; T39-L41 PolarHBondContact O-N 3.44Å; T39-M42 PolarHBondContact O-N 2.92Å; T39-F43 HydrophobicContact CG2-CD2 3.69Å; T39-F43 HydrophobicContact CG2-CE2 3.38Å; T39-F43 WeakPolarHBondContact O-CD2 3.3Å; T39-F43 PolarHBondContact O-N 3.24Å |
| 40 | H | 98.2 | Very high | 97.8 | Very high | 135 Ų | 135 | 101.1 Ų | 101.1 | 63% | 0.625 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.7 | -44.6 | 178.4 | -169.4 | 64.6 | 0 | 0 | 0 | 112.2 | L36 V37 F43 A44 | L36-H40 WeakPolarHBondContact O-CB 3.36Å; L36-H40 PolarHBondContact O-N 2.85Å; V37-H40 PolarHBondContact O-N 3.48Å; H40-F43 PolarHBondContact O-N 3.11Å; H40-A44 WeakPolarHBondContact O-CB 3.5Å; H40-A44 PolarHBondContact O-N 3.46Å |
| 41 | L | 98.4 | Very high | 97.9 | Very high | 98 Ų | 98 | 99 Ų | 99 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -42.2 | 176.2 | -73 | 174.4 | 0 | 0 | 0 | 112 | V37 K38 T39 F43 A44 V45 | V37-L41 HydrophobicContact CG1-CD1 3.91Å; V37-L41 HydrophobicContact CG1-CG 4.34Å; V37-L41 WeakPolarHBondContact O-CB 3.38Å; V37-L41 WeakPolarHBondContact O-CG 3.49Å; V37-L41 PolarHBondContact O-N 3.15Å; K38-L41 PolarHBondContact O-N 2.91Å; T39-L41 PolarHBondContact O-N 3.44Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 3.44Å; L41-A44 PolarHBondContact O-N 3Å; L41-V45 VanDerWaalsContact O-CB 3.27Å; L41-V45 WeakPolarHBondContact O-CB 3.45Å; L41-V45 WeakPolarHBondContact O-CG2 3.28Å; L41-V45 PolarHBondContact O-N 3.31Å |
| 42 | M | 97.8 | Very high | 98.1 | Very high | 114 Ų | 114 | 98.6 Ų | 98.6 | 56% | 0.562 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.7 | -42.8 | 176.4 | -75.7 | -171.3 | -60.7 | 0 | 0 | 111.7 | K38 T39 R46 | K38-M42 HydrophobicContact CG-CE 4.24Å; K38-M42 WeakPolarHBondContact O-CB 3.43Å; K38-M42 VanDerWaalsContact O-CG 3.28Å; K38-M42 WeakPolarHBondContact O-CG 3.38Å; K38-M42 PolarHBondContact O-N 3.45Å; T39-M42 PolarHBondContact O-N 2.92Å; M42-R46 WeakPolarHBondContact O-CB 3.48Å; M42-R46 PolarHBondContact O-N 3.39Å |
| 43 | F | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 100 Ų | 100 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.4 | -51.6 | 176.1 | -76.7 | -61.8 | 0 | 0 | 0 | 111.9 | T39 H40 L41 V45 R46 E47 | T39-F43 HydrophobicContact CG2-CD2 3.69Å; T39-F43 HydrophobicContact CG2-CE2 3.38Å; T39-F43 WeakPolarHBondContact O-CD2 3.3Å; T39-F43 PolarHBondContact O-N 3.24Å; H40-F43 PolarHBondContact O-N 3.11Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 3.44Å; F43-V45 VanDerWaalsContact C-N 3.35Å; F43-V45 PolarHBondContact O-N 3.33Å; F43-R46 WeakPolarHBondContact O-CB 3.49Å; F43-R46 PolarHBondContact O-N 2.91Å; F43-R46 VanDerWaalsContact O-N 3.11Å; F43-E47 WeakPolarHBondContact O-CG 3.37Å; F43-E47 PolarHBondContact O-N 3.38Å |
| 44 | A | 98.3 | Very high | 98.3 | Very high | 36 Ų | 36 | 99 Ų | 99 | 30% | 0.298 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.3 | -46.4 | -179 | 0 | 0 | 0 | 0 | 0 | 111.8 | H40 L41 R46 E47 E48 | H40-A44 WeakPolarHBondContact O-CB 3.5Å; H40-A44 PolarHBondContact O-N 3.46Å; L41-A44 PolarHBondContact O-N 3Å; A44-R46 VanDerWaalsContact C-N 3.33Å; A44-R46 PolarHBondContact O-N 2.94Å; A44-E47 PolarHBondContact O-N 3.36Å; A44-E48 WeakPolarHBondContact O-CB 3.39Å; A44-E48 VanDerWaalsContact O-CG 3.3Å; A44-E48 WeakPolarHBondContact O-CG 3.31Å; A44-E48 PolarHBondContact O-N 2.91Å |
| 45 | V | 98.4 | Very high | 98.3 | Very high | 89 Ų | 89 | 99.1 Ų | 99.1 | 54% | 0.539 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 177.6 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | L41 F43 V49 | L41-V45 VanDerWaalsContact O-CB 3.27Å; L41-V45 WeakPolarHBondContact O-CB 3.45Å; L41-V45 WeakPolarHBondContact O-CG2 3.28Å; L41-V45 PolarHBondContact O-N 3.31Å; F43-V45 VanDerWaalsContact C-N 3.35Å; F43-V45 PolarHBondContact O-N 3.33Å; V45-V49 HydrophobicContact CG1-CG2 4.4Å; V45-V49 WeakPolarHBondContact O-CB 3.39Å; V45-V49 VanDerWaalsContact O-CG2 3.24Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.75Å |
| 46 | R | 98.2 | Very high | 98.3 | Very high | 166 Ų | 166 | 100.3 Ų | 100.3 | 63% | 0.626 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.6 | -46.7 | 177.5 | -178.9 | 175.9 | -179.2 | 169.5 | 1 | 111.6 | M42 F43 A44 V49 D50 | M42-R46 WeakPolarHBondContact O-CB 3.48Å; M42-R46 PolarHBondContact O-N 3.39Å; F43-R46 WeakPolarHBondContact O-CB 3.49Å; F43-R46 PolarHBondContact O-N 2.91Å; F43-R46 VanDerWaalsContact O-N 3.11Å; A44-R46 VanDerWaalsContact C-N 3.33Å; A44-R46 PolarHBondContact O-N 2.94Å; R46-V49 PolarHBondContact O-N 3.49Å; R46-D50 IonicContact NE-OD2 3.81Å; R46-D50 WeakPolarHBondContact O-CB 3.24Å; R46-D50 PolarHBondContact O-N 3.49Å |
| 47 | E | 98.4 | Very high | 98.4 | Very high | 145 Ų | 145 | 100 Ų | 100 | 68% | 0.678 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.5 | -44.4 | 178.1 | -72.6 | -173.7 | 127.6 | 0 | 0 | 111.7 | F43 A44 V49 D50 G51 | F43-E47 WeakPolarHBondContact O-CG 3.37Å; F43-E47 PolarHBondContact O-N 3.38Å; A44-E47 PolarHBondContact O-N 3.36Å; E47-V49 PolarHBondContact O-N 3.22Å; E47-D50 PolarHBondContact O-N 3.31Å; E47-G51 PolarHBondContact O-N 3Å |
| 48 | E | 98.4 | Very high | 98.4 | Very high | 132 Ų | 132 | 100.8 Ų | 100.8 | 62% | 0.617 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60 | -45.1 | 175.2 | -73.6 | -67.9 | 162.8 | 0 | 0 | 111.7 | A44 G51 L52 | A44-E48 WeakPolarHBondContact O-CB 3.39Å; A44-E48 VanDerWaalsContact O-CG 3.3Å; A44-E48 WeakPolarHBondContact O-CG 3.31Å; A44-E48 PolarHBondContact O-N 2.91Å; E48-G51 PolarHBondContact O-N 3.42Å; E48-L52 WeakPolarHBondContact O-CB 3.29Å; E48-L52 VanDerWaalsContact O-CG 3.29Å; E48-L52 WeakPolarHBondContact O-CG 3.47Å; E48-L52 PolarHBondContact O-N 2.99Å |
| 49 | V | 98.6 | Very high | 98.4 | Very high | 57 Ų | 57 | 99.6 Ų | 99.6 | 35% | 0.345 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64 | -45 | 178 | 168 | 0 | 0 | 0 | 0 | 111.6 | V45 R46 E47 G51 L52 R53 | V45-V49 HydrophobicContact CG1-CG2 4.4Å; V45-V49 WeakPolarHBondContact O-CB 3.39Å; V45-V49 VanDerWaalsContact O-CG2 3.24Å; V45-V49 WeakPolarHBondContact O-CG2 3.43Å; V45-V49 PolarHBondContact O-N 2.75Å; R46-V49 PolarHBondContact O-N 3.49Å; E47-V49 PolarHBondContact O-N 3.22Å; V49-G51 VanDerWaalsContact C-N 3.33Å; V49-L52 PolarHBondContact O-N 3.49Å; V49-R53 WeakPolarHBondContact O-CB 3.46Å; V49-R53 VanDerWaalsContact O-CG 3.29Å; V49-R53 WeakPolarHBondContact O-CG 3.48Å; V49-R53 PolarHBondContact O-N 2.97Å |
| 50 | D | 98.5 | Very high | 98.4 | Very high | 71 Ų | 71 | 101.7 Ų | 101.7 | 38% | 0.38 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.3 | -36.6 | 179.5 | -71.2 | -19.6 | 0 | 0 | 0 | 110.9 | R46 E47 R53 G54 | R46-D50 IonicContact NE-OD2 3.81Å; R46-D50 WeakPolarHBondContact O-CB 3.24Å; R46-D50 PolarHBondContact O-N 3.49Å; E47-D50 PolarHBondContact O-N 3.31Å; D50-R53 PolarHBondContact O-N 3.44Å; D50-R53 IonicContact OD1-NH1 3.21Å; D50-R53 PolarHBondContact OD1-NH1 3.24Å; D50-G54 PolarHBondContact O-N 3.21Å |
| 51 | G | 98.5 | Very high | 98.4 | Very high | 46 Ų | 46 | 96.9 Ų | 96.9 | 47% | 0.474 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | E47 E48 V49 R53 G54 K55 | E47-G51 PolarHBondContact O-N 3Å; E48-G51 PolarHBondContact O-N 3.42Å; V49-G51 VanDerWaalsContact C-N 3.33Å; G51-R53 PolarHBondContact O-N 2.99Å; G51-G54 PolarHBondContact O-N 2.88Å; G51-K55 PolarHBondContact O-N 3.42Å |
| 52 | L | 98.7 | Very high | 98.4 | Very high | 107 Ų | 107 | 96.3 Ų | 96.3 | 56% | 0.56 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63 | -41.6 | 176.3 | -71.6 | 174.1 | 0 | 0 | 0 | 112 | E48 V49 G54 K55 I56 | E48-L52 WeakPolarHBondContact O-CB 3.29Å; E48-L52 VanDerWaalsContact O-CG 3.29Å; E48-L52 WeakPolarHBondContact O-CG 3.47Å; E48-L52 PolarHBondContact O-N 2.99Å; V49-L52 PolarHBondContact O-N 3.49Å; L52-G54 PolarHBondContact O-N 3.38Å; L52-K55 PolarHBondContact O-N 3.42Å; L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.34Å; L52-I56 PolarHBondContact O-N 2.88Å |
| 53 | R | 98.6 | Very high | 98.4 | Very high | 158 Ų | 158 | 94.2 Ų | 94.2 | 60% | 0.596 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60 | -44.7 | 175 | -77 | 170.7 | 172.8 | 162 | -2.2 | 111.9 | V49 D50 G51 K55 I56 F57 | V49-R53 WeakPolarHBondContact O-CB 3.46Å; V49-R53 VanDerWaalsContact O-CG 3.29Å; V49-R53 WeakPolarHBondContact O-CG 3.48Å; V49-R53 PolarHBondContact O-N 2.97Å; D50-R53 PolarHBondContact O-N 3.44Å; D50-R53 IonicContact OD1-NH1 3.21Å; D50-R53 PolarHBondContact OD1-NH1 3.24Å; G51-R53 PolarHBondContact O-N 2.99Å; R53-K55 VanDerWaalsContact C-N 3.33Å; R53-K55 PolarHBondContact O-N 2.96Å; R53-I56 PolarHBondContact O-N 3.44Å; R53-F57 WeakPolarHBondContact O-CB 3.29Å; R53-F57 PolarHBondContact O-N 3.1Å |
| 54 | G | 98.6 | Very high | 98.4 | Very high | 33 Ų | 33 | 95 Ų | 95 | 34% | 0.34 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | D50 G51 L52 I56 F57 D58 | D50-G54 PolarHBondContact O-N 3.21Å; G51-G54 PolarHBondContact O-N 2.88Å; L52-G54 PolarHBondContact O-N 3.38Å; G54-I56 PolarHBondContact O-N 3.11Å; G54-F57 WeakPolarHBondContact O-CB 3.46Å; G54-F57 PolarHBondContact O-N 2.97Å; G54-D58 PolarHBondContact O-N 3.37Å |
| 55 | K | 98.4 | Very high | 98.4 | Very high | 123 Ų | 123 | 99.6 Ų | 99.6 | 54% | 0.535 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 178.4 | -173.8 | 59 | 176.5 | -179 | 0 | 112.8 | G51 L52 R53 D58 L59 | G51-K55 PolarHBondContact O-N 3.42Å; L52-K55 PolarHBondContact O-N 3.42Å; R53-K55 VanDerWaalsContact C-N 3.33Å; R53-K55 PolarHBondContact O-N 2.96Å; K55-D58 PolarHBondContact O-N 3.37Å; K55-L59 HydrophobicContact CD-CD1 4.41Å; K55-L59 HydrophobicContact CD-CG 4.45Å; K55-L59 HydrophobicContact CG-CD1 4.12Å; K55-L59 WeakPolarHBondContact O-CB 3.36Å; K55-L59 VanDerWaalsContact O-CG 3.28Å; K55-L59 WeakPolarHBondContact O-CG 3.5Å; K55-L59 PolarHBondContact O-N 2.89Å |
| 56 | I | 98.6 | Very high | 98.4 | Very high | 94 Ų | 94 | 99.2 Ų | 99.2 | 48% | 0.482 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.6 | -49.7 | 175.4 | -70.4 | 164.7 | 0 | 0 | 0 | 109.7 | L52 R53 G54 D58 L59 E60 | L52-I56 VanDerWaalsContact O-CG1 3.31Å; L52-I56 WeakPolarHBondContact O-CG1 3.34Å; L52-I56 PolarHBondContact O-N 2.88Å; R53-I56 PolarHBondContact O-N 3.44Å; G54-I56 PolarHBondContact O-N 3.11Å; I56-D58 VanDerWaalsContact C-N 3.33Å; I56-D58 PolarHBondContact O-N 3.06Å; I56-L59 PolarHBondContact O-N 3.47Å; I56-E60 HydrophobicContact CG2-CG 4.26Å; I56-E60 WeakPolarHBondContact O-CG 3.18Å; I56-E60 PolarHBondContact O-N 3.3Å |
| 57 | F | 98.5 | Very high | 98.3 | Very high | 120 Ų | 120 | 97.2 Ų | 97.2 | 53% | 0.526 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -57.1 | -44.9 | 179.7 | 178.8 | -101.8 | 0 | 0 | 0 | 112.5 | R53 G54 E60 N61 | R53-F57 WeakPolarHBondContact O-CB 3.29Å; R53-F57 PolarHBondContact O-N 3.1Å; G54-F57 WeakPolarHBondContact O-CB 3.46Å; G54-F57 PolarHBondContact O-N 2.97Å; F57-E60 PolarHBondContact O-N 2.84Å; F57-N61 VanDerWaalsContact CD1-ND2 3.34Å; F57-N61 WeakPolarHBondContact CD1-ND2 3Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.27Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.43Å; F57-N61 WeakPolarHBondContact O-CB 3.5Å; F57-N61 VanDerWaalsContact O-CG 3.25Å; F57-N61 PolarHBondContact O-N 3.46Å; F57-N61 PolarHBondContact O-ND2 2.84Å; F57-N61 VanDerWaalsContact O-ND2 3.1Å |
| 58 | D | 98.5 | Very high | 98.1 | Very high | 99 Ų | 99 | 92.9 Ų | 92.9 | 53% | 0.529 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.8 | -41.6 | 178.3 | -72.7 | -20.5 | 0 | 0 | 0 | 112.5 | G54 K55 I56 N61 H62 | G54-D58 PolarHBondContact O-N 3.37Å; K55-D58 PolarHBondContact O-N 3.37Å; I56-D58 VanDerWaalsContact C-N 3.33Å; I56-D58 PolarHBondContact O-N 3.06Å; D58-N61 PolarHBondContact O-N 2.84Å; D58-H62 WeakPolarHBondContact O-CB 3.17Å; D58-H62 PolarHBondContact O-N 2.81Å |
| 59 | L | 98.6 | Very high | 97.9 | Very high | 87 Ų | 87 | 91.7 Ų | 91.7 | 46% | 0.455 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.2 | -44.6 | 177 | -74.3 | 171.7 | 0 | 0 | 0 | 111.5 | K55 I56 N61 H62 V63 | K55-L59 HydrophobicContact CD-CD1 4.41Å; K55-L59 HydrophobicContact CD-CG 4.45Å; K55-L59 HydrophobicContact CG-CD1 4.12Å; K55-L59 WeakPolarHBondContact O-CB 3.36Å; K55-L59 VanDerWaalsContact O-CG 3.28Å; K55-L59 WeakPolarHBondContact O-CG 3.5Å; K55-L59 PolarHBondContact O-N 2.89Å; I56-L59 PolarHBondContact O-N 3.47Å; L59-N61 VanDerWaalsContact C-N 3.33Å; L59-N61 PolarHBondContact O-N 3.32Å; L59-H62 WeakPolarHBondContact O-CB 3.45Å; L59-H62 PolarHBondContact O-N 3.19Å; L59-H62 VanDerWaalsContact O-N 3.15Å; L59-V63 WeakPolarHBondContact O-CG2 3.29Å; L59-V63 PolarHBondContact O-N 2.88Å |
| 60 | E | 98.4 | Very high | 97.6 | Very high | 103 Ų | 103 | 92.5 Ų | 92.5 | 48% | 0.481 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 175.8 | -73.5 | -179.2 | 160.7 | 0 | 0 | 111.6 | I56 F57 H62 V63 R64 | I56-E60 HydrophobicContact CG2-CG 4.26Å; I56-E60 WeakPolarHBondContact O-CG 3.18Å; I56-E60 PolarHBondContact O-N 3.3Å; F57-E60 PolarHBondContact O-N 2.84Å; E60-H62 VanDerWaalsContact C-N 3.32Å; E60-H62 PolarHBondContact O-N 3.44Å; E60-V63 PolarHBondContact O-N 3.48Å; E60-R64 WeakPolarHBondContact O-CB 3.28Å; E60-R64 PolarHBondContact O-N 3.21Å |
| 61 | N | 98.3 | Very high | 97.2 | Very high | 34 Ų | 34 | 91.3 Ų | 91.3 | 18% | 0.182 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -64.6 | -38.4 | 175.5 | -72.4 | -33.2 | 0 | 0 | 0 | 111.9 | F57 D58 L59 R64 R65 | F57-N61 VanDerWaalsContact CD1-ND2 3.34Å; F57-N61 WeakPolarHBondContact CD1-ND2 3Å; F57-N61 WeakPolarHBondContact CE1-ND2 3.27Å; F57-N61 WeakPolarHBondContact CZ-ND2 3.43Å; F57-N61 WeakPolarHBondContact O-CB 3.5Å; F57-N61 VanDerWaalsContact O-CG 3.25Å; F57-N61 PolarHBondContact O-N 3.46Å; F57-N61 PolarHBondContact O-ND2 2.84Å; F57-N61 VanDerWaalsContact O-ND2 3.1Å; D58-N61 PolarHBondContact O-N 2.84Å; L59-N61 VanDerWaalsContact C-N 3.33Å; L59-N61 PolarHBondContact O-N 3.32Å; N61-R64 PolarHBondContact OD1-NH1 3.44Å; N61-R65 WeakPolarHBondContact O-CG 3.38Å; N61-R65 PolarHBondContact O-N 3.31Å; N61-R65 VanDerWaalsContact O-N 3.11Å; N61-R65 PolarHBondContact O-NH1 2.97Å |
| 62 | H | 98.3 | Very high | 96.9 | Very high | 85 Ų | 85 | 94.1 Ų | 94.1 | 39% | 0.394 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.6 | -47.3 | 176.5 | -174.8 | 47.5 | 0 | 0 | 0 | 111.8 | D58 L59 E60 R64 R65 L66 | D58-H62 WeakPolarHBondContact O-CB 3.17Å; D58-H62 PolarHBondContact O-N 2.81Å; L59-H62 WeakPolarHBondContact O-CB 3.45Å; L59-H62 PolarHBondContact O-N 3.19Å; L59-H62 VanDerWaalsContact O-N 3.15Å; E60-H62 VanDerWaalsContact C-N 3.32Å; E60-H62 PolarHBondContact O-N 3.44Å; H62-R64 VanDerWaalsContact C-N 3.35Å; H62-R64 PolarHBondContact O-N 2.88Å; H62-R65 PolarHBondContact ND1-NH2 3.43Å; H62-R65 PolarHBondContact O-N 2.9Å; H62-L66 WeakPolarHBondContact NE2-CD1 3.43Å; H62-L66 WeakPolarHBondContact O-CG 3.3Å; H62-L66 PolarHBondContact O-N 2.93Å |
| 63 | V | 98.2 | Very high | 96.4 | Very high | 71 Ų | 71 | 93.8 Ų | 93.8 | 43% | 0.43 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -57.5 | -48.3 | 175.4 | 169.8 | 0 | 0 | 0 | 0 | 110.3 | L59 E60 R65 L66 E67 | L59-V63 WeakPolarHBondContact O-CG2 3.29Å; L59-V63 PolarHBondContact O-N 2.88Å; E60-V63 PolarHBondContact O-N 3.48Å; V63-R65 VanDerWaalsContact C-N 3.3Å; V63-R65 PolarHBondContact O-N 3.29Å; V63-L66 PolarHBondContact O-N 3.48Å; V63-L66 VanDerWaalsContact O-N 3.11Å; V63-E67 HydrophobicContact CG1-CG 4.13Å; V63-E67 WeakPolarHBondContact O-CB 3.33Å; V63-E67 WeakPolarHBondContact O-CG 3.45Å; V63-E67 PolarHBondContact O-N 3.32Å |
| 64 | R | 98.1 | Very high | 95.8 | Very high | 139 Ų | 139 | 91.7 Ų | 91.7 | 53% | 0.525 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.2 | -39.5 | 179.5 | -164.8 | -175.9 | -57.3 | 113.6 | 5.5 | 112.7 | E60 N61 H62 A68 | E60-R64 WeakPolarHBondContact O-CB 3.28Å; E60-R64 PolarHBondContact O-N 3.21Å; N61-R64 PolarHBondContact OD1-NH1 3.44Å; H62-R64 VanDerWaalsContact C-N 3.35Å; H62-R64 PolarHBondContact O-N 2.88Å; R64-A68 PolarHBondContact O-N 3.3Å; R64-A68 VanDerWaalsContact O-N 3.12Å |
| 65 | R | 97.8 | Very high | 95.1 | Very high | 133 Ų | 133 | 100 Ų | 100 | 50% | 0.502 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.3 | -48.9 | 174.2 | -72.6 | -168.1 | -50.5 | -86.3 | 6.3 | 111.3 | N61 H62 V63 E67 A68 E69 | N61-R65 WeakPolarHBondContact O-CG 3.38Å; N61-R65 PolarHBondContact O-N 3.31Å; N61-R65 VanDerWaalsContact O-N 3.11Å; N61-R65 PolarHBondContact O-NH1 2.97Å; H62-R65 PolarHBondContact ND1-NH2 3.43Å; H62-R65 PolarHBondContact O-N 2.9Å; V63-R65 VanDerWaalsContact C-N 3.3Å; V63-R65 PolarHBondContact O-N 3.29Å; R65-E67 VanDerWaalsContact C-N 3.31Å; R65-E67 PolarHBondContact O-N 3.03Å; R65-A68 WeakPolarHBondContact O-CB 3.28Å; R65-A68 PolarHBondContact O-N 3.41Å; R65-E69 WeakPolarHBondContact O-CG 3.48Å; R65-E69 PolarHBondContact O-N 3.36Å |
| 66 | L | 97.3 | Very high | 94.4 | Very high | 80 Ų | 80 | 99.3 Ų | 99.3 | 42% | 0.419 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.2 | -39.1 | 178.8 | -71.3 | 177 | 0 | 0 | 0 | 112.1 | H62 V63 E69 N70 | H62-L66 WeakPolarHBondContact NE2-CD1 3.43Å; H62-L66 WeakPolarHBondContact O-CG 3.3Å; H62-L66 PolarHBondContact O-N 2.93Å; V63-L66 PolarHBondContact O-N 3.48Å; V63-L66 VanDerWaalsContact O-N 3.11Å; L66-E69 PolarHBondContact O-N 3.46Å; L66-N70 WeakPolarHBondContact O-CB 3.12Å; L66-N70 PolarHBondContact O-N 2.89Å |
| 67 | E | 96.4 | Very high | 93.7 | Very high | 124 Ų | 124 | 97.1 Ų | 97.1 | 58% | 0.579 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.5 | -41.7 | 175.6 | -74.4 | 176.8 | 159.9 | 0 | 0 | 111.9 | V63 R65 S71 | V63-E67 HydrophobicContact CG1-CG 4.13Å; V63-E67 WeakPolarHBondContact O-CB 3.33Å; V63-E67 WeakPolarHBondContact O-CG 3.45Å; V63-E67 PolarHBondContact O-N 3.32Å; R65-E67 VanDerWaalsContact C-N 3.31Å; R65-E67 PolarHBondContact O-N 3.03Å; E67-S71 VanDerWaalsContact O-CB 3.28Å; E67-S71 WeakPolarHBondContact O-CB 3.49Å; E67-S71 PolarHBondContact O-N 3.28Å |
| 68 | A | 95.1 | Very high | 92.9 | Very high | 54 Ų | 54 | 95.6 Ų | 95.6 | 45% | 0.446 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.2 | -47.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | R64 R65 N70 S71 I72 | R64-A68 PolarHBondContact O-N 3.3Å; R64-A68 VanDerWaalsContact O-N 3.12Å; R65-A68 WeakPolarHBondContact O-CB 3.28Å; R65-A68 PolarHBondContact O-N 3.41Å; A68-N70 PolarHBondContact O-N 3.22Å; A68-S71 WeakPolarHBondContact O-CB 3.49Å; A68-S71 PolarHBondContact O-N 3.19Å; A68-I72 WeakPolarHBondContact O-CG1 3.43Å; A68-I72 PolarHBondContact O-N 2.88Å |
| 69 | E | 94.6 | Very high | 91.9 | Very high | 107 Ų | 107 | 96.8 Ų | 96.8 | 50% | 0.5 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.4 | -46.7 | 175.8 | -71.8 | 172.8 | -158.8 | 0 | 0 | 111.4 | R65 L66 S71 I72 L73 | R65-E69 WeakPolarHBondContact O-CG 3.48Å; R65-E69 PolarHBondContact O-N 3.36Å; L66-E69 PolarHBondContact O-N 3.46Å; E69-S71 VanDerWaalsContact C-N 3.33Å; E69-S71 PolarHBondContact O-N 3.17Å; E69-I72 PolarHBondContact O-N 3.03Å; E69-L73 WeakPolarHBondContact O-CB 3.22Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.02Å |
| 70 | N | 92.2 | Very high | 90.9 | Very high | 75 Ų | 75 | 98 Ų | 98 | 40% | 0.401 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -40.4 | 179.3 | -163.8 | -64.3 | 0 | 0 | 0 | 111.4 | L66 A68 I72 L73 K74 | L66-N70 WeakPolarHBondContact O-CB 3.12Å; L66-N70 PolarHBondContact O-N 2.89Å; A68-N70 PolarHBondContact O-N 3.22Å; N70-I72 PolarHBondContact O-N 3.36Å; N70-L73 PolarHBondContact O-N 2.85Å; N70-K74 WeakPolarHBondContact O-CB 3.5Å; N70-K74 VanDerWaalsContact O-CG 3.26Å; N70-K74 WeakPolarHBondContact O-CG 3.33Å; N70-K74 PolarHBondContact O-N 3.01Å; N70-K74 WeakPolarHBondContact OD1-CD 3.49Å; N70-K74 WeakPolarHBondContact OD1-CE 3.43Å; N70-K74 PolarHBondContact OD1-NZ 2.82Å |
| 71 | S | 90.6 | Very high | 89.9 | Confident | 46 Ų | 46 | 96.3 Ų | 96.3 | 32% | 0.322 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 175.2 | -174 | 0 | 0 | 0 | 0 | 112.1 | E67 A68 E69 R75 | E67-S71 VanDerWaalsContact O-CB 3.28Å; E67-S71 WeakPolarHBondContact O-CB 3.49Å; E67-S71 PolarHBondContact O-N 3.28Å; A68-S71 WeakPolarHBondContact O-CB 3.49Å; A68-S71 PolarHBondContact O-N 3.19Å; E69-S71 VanDerWaalsContact C-N 3.33Å; E69-S71 PolarHBondContact O-N 3.17Å; S71-R75 VanDerWaalsContact O-CG 3.28Å; S71-R75 WeakPolarHBondContact O-CG 3.44Å; S71-R75 PolarHBondContact O-N 3.33Å |
| 72 | I | 90.5 | Very high | 88.8 | Confident | 105 Ų | 105 | 96.3 Ų | 96.3 | 54% | 0.538 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.8 | -47.3 | 176.4 | -67.3 | 165.4 | 0 | 0 | 0 | 110.6 | A68 E69 N70 K74 R75 T76 | A68-I72 WeakPolarHBondContact O-CG1 3.43Å; A68-I72 PolarHBondContact O-N 2.88Å; E69-I72 PolarHBondContact O-N 3.03Å; N70-I72 PolarHBondContact O-N 3.36Å; I72-K74 PolarHBondContact O-N 3Å; I72-R75 PolarHBondContact O-N 2.98Å; I72-T76 WeakPolarHBondContact O-CB 3.42Å; I72-T76 PolarHBondContact O-N 3.23Å; I72-T76 VanDerWaalsContact O-N 3.07Å; I72-T76 PolarHBondContact O-OG1 3.41Å |
| 73 | L | 88.4 | Confident | 87.8 | Confident | 99 Ų | 99 | 98.4 Ų | 98.4 | 52% | 0.518 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.7 | -48.4 | 177.9 | -71.5 | 171.3 | 0 | 0 | 0 | 111.2 | E69 N70 R75 T76 I77 | E69-L73 WeakPolarHBondContact O-CB 3.22Å; E69-L73 VanDerWaalsContact O-CG 3.3Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.02Å; N70-L73 PolarHBondContact O-N 2.85Å; L73-R75 PolarHBondContact O-N 3.46Å; L73-T76 PolarHBondContact O-N 2.78Å; L73-I77 HydrophobicContact CB-CD1 4.09Å; L73-I77 WeakPolarHBondContact O-CB 3.2Å; L73-I77 WeakPolarHBondContact O-CD1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.37Å; L73-I77 PolarHBondContact O-N 3Å |
| 74 | K | 85.8 | Confident | 86.7 | Confident | 114 Ų | 114 | 101 Ų | 101 | 50% | 0.496 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.8 | -33.1 | 177.9 | -75.8 | 178.2 | 168.2 | 158.6 | 0 | 113.4 | N70 I72 L82 | N70-K74 WeakPolarHBondContact O-CB 3.5Å; N70-K74 VanDerWaalsContact O-CG 3.26Å; N70-K74 WeakPolarHBondContact O-CG 3.33Å; N70-K74 PolarHBondContact O-N 3.01Å; N70-K74 WeakPolarHBondContact OD1-CD 3.49Å; N70-K74 WeakPolarHBondContact OD1-CE 3.43Å; N70-K74 PolarHBondContact OD1-NZ 2.82Å; I72-K74 PolarHBondContact O-N 3Å; K74-L82 HydrophobicContact CB-CD1 4.24Å; K74-L82 HydrophobicContact CG-CD1 4.03Å |
| 75 | R | 84.4 | Confident | 85.5 | Confident | 209 Ų | 209 | 98.6 Ų | 98.6 | 79% | 0.789 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -76.8 | -26.9 | 176.3 | -70.2 | 171.4 | -172.9 | -163 | 0.2 | 113.3 | S71 I72 L73 | S71-R75 VanDerWaalsContact O-CG 3.28Å; S71-R75 WeakPolarHBondContact O-CG 3.44Å; S71-R75 PolarHBondContact O-N 3.33Å; I72-R75 PolarHBondContact O-N 2.98Å; L73-R75 PolarHBondContact O-N 3.46Å |
| 76 | T | 84.4 | Confident | 84.1 | Confident | 107 Ų | 107 | 98 Ų | 98 | 66% | 0.656 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -94.8 | -26.9 | -172.5 | -49.8 | 0 | 0 | 0 | 0 | 112 | I72 L73 | I72-T76 WeakPolarHBondContact O-CB 3.42Å; I72-T76 PolarHBondContact O-N 3.23Å; I72-T76 VanDerWaalsContact O-N 3.07Å; I72-T76 PolarHBondContact O-OG1 3.41Å; L73-T76 PolarHBondContact O-N 2.78Å |
| 77 | I | 84.4 | Confident | 82.9 | Confident | 49 Ų | 49 | 101.2 Ų | 101.2 | 25% | 0.251 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -80.5 | 132.3 | -177.3 | -65.1 | 165.4 | 0 | 0 | 0 | 110.3 | L73 T81 L82 | L73-I77 HydrophobicContact CB-CD1 4.09Å; L73-I77 WeakPolarHBondContact O-CB 3.2Å; L73-I77 WeakPolarHBondContact O-CD1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.37Å; L73-I77 PolarHBondContact O-N 3Å; I77-T81 HydrophobicContact CG2-CG2 3.85Å; I77-L82 HydrophobicContact CG2-CB 4.4Å |
| 78 | P | 80.3 | Confident | 81.2 | Confident | 88 Ų | 88 | 103.9 Ų | 103.9 | 57% | 0.571 | 53% | 0.527 | S | S | * | . | trans | -56.4 | 142.1 | 173.2 | -24.9 | 33.8 | 0 | 0 | 0 | 112.6 | D80 T81 L82 | P78-D80 PolarHBondContact O-N 3.41Å; P78-D80 VanDerWaalsContact O-N 3.08Å; P78-T81 PolarHBondContact O-N 2.93Å; P78-L82 PolarHBondContact O-N 3.27Å | ||
| 79 | N | 76.9 | Confident | 79.2 | Confident | 123 Ų | 123 | 111.3 Ų | 111.3 | 66% | 0.658 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -53.6 | -34.3 | -175.5 | -76.7 | -59 | 0 | 0 | 0 | 114.1 | L82 K83 | N79-L82 PolarHBondContact O-N 3.41Å; N79-K83 VanDerWaalsContact O-CG 3.3Å; N79-K83 WeakPolarHBondContact O-CG 3.29Å; N79-K83 PolarHBondContact O-N 3.36Å |
| 80 | D | 77.8 | Confident | 78.4 | Confident | 113 Ų | 113 | 111.5 Ų | 111.5 | 60% | 0.604 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71 | -38.9 | -179.4 | -65.3 | -27 | 0 | 0 | 0 | 112.2 | P78 K83 Q84 | P78-D80 PolarHBondContact O-N 3.41Å; P78-D80 VanDerWaalsContact O-N 3.08Å; D80-K83 IonicContact OD1-NZ 3.94Å; D80-Q84 WeakPolarHBondContact O-CG 3.47Å; D80-Q84 PolarHBondContact O-N 3.26Å |
| 81 | T | 77.8 | Confident | 77.7 | Confident | 68 Ų | 68 | 113.4 Ų | 113.4 | 42% | 0.417 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.8 | -38.8 | 173.2 | -51.3 | 0 | 0 | 0 | 0 | 111.1 | I77 P78 K83 Q84 L85 | I77-T81 HydrophobicContact CG2-CG2 3.85Å; P78-T81 PolarHBondContact O-N 2.93Å; T81-K83 PolarHBondContact O-N 2.91Å; T81-Q84 PolarHBondContact O-N 3.35Å; T81-L85 PolarHBondContact O-N 2.87Å; T81-L85 VanDerWaalsContact O-N 3.12Å |
| 82 | L | 76.4 | Confident | 77 | Confident | 34 Ų | 34 | 117.2 Ų | 117.2 | 18% | 0.178 | 58% | 0.583 | C | S | . | * | H | α-helix | trans | -62.4 | -42.6 | 177.2 | -164.4 | 109.5 | 0 | 0 | 0 | 112 | K74 I77 P78 N79 Q84 L85 H86 | K74-L82 HydrophobicContact CB-CD1 4.24Å; K74-L82 HydrophobicContact CG-CD1 4.03Å; I77-L82 HydrophobicContact CG2-CB 4.4Å; P78-L82 PolarHBondContact O-N 3.27Å; N79-L82 PolarHBondContact O-N 3.41Å; L82-Q84 VanDerWaalsContact C-N 3.33Å; L82-Q84 PolarHBondContact O-N 2.95Å; L82-L85 PolarHBondContact O-N 3.09Å; L82-H86 PolarHBondContact O-N 3.17Å; L82-H86 VanDerWaalsContact O-N 3.11Å |
| 83 | K | 76.4 | Confident | 76.2 | Confident | 128 Ų | 128 | 117.9 Ų | 117.9 | 56% | 0.557 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.1 | -39.6 | 174.8 | -74 | 170.3 | -174.2 | 170.6 | 0 | 112.3 | N79 D80 T81 L85 H86 L87 | N79-K83 VanDerWaalsContact O-CG 3.3Å; N79-K83 WeakPolarHBondContact O-CG 3.29Å; N79-K83 PolarHBondContact O-N 3.36Å; D80-K83 IonicContact OD1-NZ 3.94Å; T81-K83 PolarHBondContact O-N 2.91Å; K83-L85 VanDerWaalsContact C-N 3.34Å; K83-H86 PolarHBondContact O-N 3.49Å; K83-L87 PolarHBondContact O-N 2.98Å |
| 84 | Q | 74.9 | Confident | 75.4 | Confident | 126 Ų | 126 | 119.1 Ų | 119.1 | 59% | 0.589 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66.5 | -34.3 | 176.6 | -70.7 | -177.2 | 15.7 | 0 | 0 | 112.8 | D80 T81 L82 L87 | D80-Q84 WeakPolarHBondContact O-CG 3.47Å; D80-Q84 PolarHBondContact O-N 3.26Å; T81-Q84 PolarHBondContact O-N 3.35Å; L82-Q84 VanDerWaalsContact C-N 3.33Å; L82-Q84 PolarHBondContact O-N 2.95Å; Q84-L87 PolarHBondContact O-N 2.81Å |
| 85 | L | 72.9 | Confident | 74.7 | Confident | 89 Ų | 89 | 119.4 Ų | 119.4 | 47% | 0.466 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.8 | -40.5 | 175.3 | -70.5 | 172.4 | 0 | 0 | 0 | 112 | T81 L82 K83 L87 K88 | T81-L85 PolarHBondContact O-N 2.87Å; T81-L85 VanDerWaalsContact O-N 3.12Å; L82-L85 PolarHBondContact O-N 3.09Å; K83-L85 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.96Å; L85-K88 PolarHBondContact O-N 3Å |
| 86 | H | 69.5 | Low | 74 | Confident | 119 Ų | 119 | 113 Ų | 113 | 55% | 0.551 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.6 | -21.5 | 176.3 | -75.2 | 175.7 | 0 | 0 | 0 | 114.2 | L82 K83 K88 | L82-H86 PolarHBondContact O-N 3.17Å; L82-H86 VanDerWaalsContact O-N 3.11Å; K83-H86 PolarHBondContact O-N 3.49Å; H86-K88 VanDerWaalsContact C-N 3.35Å |
| 87 | L | 71.5 | Confident | 73.2 | Confident | 149 Ų | 149 | 113.5 Ų | 113.5 | 78% | 0.78 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -10.3 | 176.7 | -77.3 | 160.5 | 0 | 0 | 0 | 113.4 | K83 Q84 L85 | K83-L87 PolarHBondContact O-N 2.98Å; Q84-L87 PolarHBondContact O-N 2.81Å; L85-L87 PolarHBondContact O-N 2.96Å |
| 88 | K | 60 | Low | 72.3 | Confident | 179 Ų | 179 | 118.8 Ų | 118.8 | 78% | 0.778 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.4 | -9.3 | -175.1 | -80.1 | -176.2 | 175.2 | -179.5 | 0 | 114.6 | L85 H86 | L85-K88 PolarHBondContact O-N 3Å; H86-K88 VanDerWaalsContact C-N 3.35Å |
| 89 | L | 52.9 | Low | 71.5 | Confident | 210 Ų | 210 | 121.6 Ų | 121.6 | 100% | 1.099 | 61% | 0.607 | S | S | * | * | trans | -104.1 | 0 | 174.3 | -84.6 | 152.2 | 0 | 0 | 0 | 109.2 |
Retrieved 89 of 89 residues in 24.3 ms
(Link to these results)