| 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 | Very low | 50.4 | Low | 246 Ų | 246 | 146.9 Ų | 146.9 | 100% | 1.212 | 79% | 0.79 | S | S | * | * | 0 | 136.4 | 0 | -68 | 167.4 | 79.7 | 0 | 0 | 107.3 | |||||
| 2 | S | 45 | Very low | 50.5 | Low | 132 Ų | 132 | 150.7 Ų | 150.7 | 92% | 0.923 | 80% | 0.799 | S | S | * | * | trans | -61.1 | 155.8 | -150.2 | -60.8 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 3 | S | 45.5 | Very low | 49.9 | Very low | 94 Ų | 94 | 149.8 Ų | 149.8 | 66% | 0.657 | 79% | 0.794 | S | S | * | * | trans | -98.5 | 142.4 | -176.5 | 100.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 4 | R | 52.5 | Low | 50.1 | Low | 182 Ų | 182 | 145 Ų | 145 | 69% | 0.687 | 79% | 0.787 | S | S | * | * | trans | 88.4 | 130.4 | 137.5 | -67.9 | 175.4 | 176.9 | -87.2 | 7 | 121.3 | ||||
| 5 | R | 54.1 | Low | 50 | Low | 185 Ų | 185 | 144.7 Ų | 144.7 | 70% | 0.698 | 78% | 0.784 | S | S | * | * | trans | 77.5 | 111.7 | 144.9 | -64.1 | 161.5 | -170.2 | 132.9 | -7.8 | 115.5 | ||||
| 6 | D | 50.3 | Low | 50.2 | Low | 145 Ų | 145 | 144.7 Ų | 144.7 | 78% | 0.775 | 78% | 0.784 | S | S | * | * | 69.1 | 124.4 | 64.7 | -67.7 | -56 | 0 | 0 | 0 | 114 | |||||
| 7 | T | 57.6 | Low | 50.5 | Low | 135 Ų | 135 | 141.4 Ų | 141.4 | 83% | 0.828 | 77% | 0.774 | S | S | * | * | trans | 58.7 | 116 | 160.3 | 46.8 | 0 | 0 | 0 | 0 | 118 | ||||
| 8 | D | 41.1 | Very low | 50.5 | Low | 155 Ų | 155 | 137.9 Ų | 137.9 | 83% | 0.829 | 76% | 0.762 | S | S | * | * | trans | -137.5 | 130.2 | 131.9 | -141 | -16.5 | 0 | 0 | 0 | 110.9 | ||||
| 9 | S | 60.2 | Low | 50.4 | Low | 103 Ų | 103 | 137.1 Ų | 137.1 | 72% | 0.72 | 77% | 0.765 | S | S | * | * | trans | -86.4 | 122.3 | 171.4 | -65.1 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 10 | D | 44.4 | Very low | 50.1 | Low | 138 Ų | 138 | 139.2 Ų | 139.2 | 74% | 0.738 | 77% | 0.766 | S | S | * | * | trans | -119.7 | 97.4 | 167.1 | -136.4 | -55.5 | 0 | 0 | 0 | 110.3 | ||||
| 11 | T | 55.3 | Low | 50.3 | Low | 101 Ų | 101 | 137.4 Ų | 137.4 | 62% | 0.62 | 76% | 0.763 | S | S | * | * | trans | 20.7 | 109.9 | 143.1 | -2.5 | 0 | 0 | 0 | 0 | 117.6 | D13 | T11-D13 PolarHBondContact O-N 3.08Å; T11-D13 VanDerWaalsContact O-N 3.08Å | ||
| 12 | Q | 51.5 | Low | 50.5 | Low | 192 Ų | 192 | 131 Ų | 131 | 90% | 0.897 | 74% | 0.742 | S | S | * | * | trans | -69.9 | 93.3 | 158.7 | -176.9 | 170.8 | -57.4 | 0 | 0 | 108.7 | A14 | Q12-A14 PolarHBondContact O-N 3.01Š| ||
| 13 | D | 43.6 | Very low | 50.9 | Low | 139 Ų | 139 | 133 Ų | 133 | 74% | 0.743 | 74% | 0.737 | S | S | * | * | trans | -70.2 | 96.1 | 165.7 | -81.6 | -65.1 | 0 | 0 | 0 | 108.9 | T11 N15 | T11-D13 PolarHBondContact O-N 3.08Å; T11-D13 VanDerWaalsContact O-N 3.08Å; D13-N15 PolarHBondContact O-N 2.87Å | ||
| 14 | A | 52.4 | Low | 51.4 | Low | 83 Ų | 83 | 139.6 Ų | 139.6 | 69% | 0.686 | 75% | 0.748 | S | S | * | * | trans | -63.1 | 88.3 | 157.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | Q12 D16 | Q12-A14 PolarHBondContact O-N 3.01Å; A14-D16 PolarHBondContact O-N 2.89Å | ||
| 15 | N | 48.3 | Very low | 51.4 | Low | 140 Ų | 140 | 136.2 Ų | 136.2 | 75% | 0.749 | 75% | 0.752 | S | S | * | * | trans | -73.3 | 81.2 | 167.6 | -171.6 | 12.3 | 0 | 0 | 0 | 108 | D13 S17 | D13-N15 PolarHBondContact O-N 2.87Å; N15-S17 PolarHBondContact O-N 2.74Å | ||
| 16 | D | 53.2 | Low | 51.4 | Low | 145 Ų | 145 | 135.2 Ų | 135.2 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | trans | -64.2 | 81.3 | 161.5 | -135.5 | -46 | 0 | 0 | 0 | 106.2 | A14 S18 | A14-D16 PolarHBondContact O-N 2.89Å; D16-S18 PolarHBondContact O-N 2.87Å | ||
| 17 | S | 56.4 | Low | 51.6 | Low | 88 Ų | 88 | 133.8 Ų | 133.8 | 62% | 0.615 | 76% | 0.758 | S | S | * | * | trans | -71.7 | 70.2 | 169.4 | 67.8 | 0 | 0 | 0 | 0 | 107.5 | N15 C19 | N15-S17 PolarHBondContact O-N 2.74Å; S17-C19 PolarHBondContact O-N 2.86Å | ||
| 18 | S | 49.5 | Very low | 50.9 | Low | 80 Ų | 80 | 134.7 Ų | 134.7 | 56% | 0.559 | 76% | 0.758 | S | S | * | * | trans | -62.7 | 92.8 | 164.5 | -171.5 | 0 | 0 | 0 | 0 | 105.8 | D16 K20 | D16-S18 PolarHBondContact O-N 2.87Å; S18-K20 PolarHBondContact O-N 2.92Å | ||
| 19 | C | 47.8 | Very low | 50.8 | Low | 121 Ų | 121 | 132.9 Ų | 132.9 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | -63.1 | 78.3 | 162.1 | -63.4 | 0 | 0 | 0 | 0 | 106.7 | S17 S21 | S17-C19 PolarHBondContact O-N 2.86Å; C19-S21 VanDerWaalsContact C-N 3.33Å; C19-S21 PolarHBondContact O-N 2.73Å | ||
| 20 | K | 45.2 | Very low | 50.4 | Low | 180 Ų | 180 | 133.4 Ų | 133.4 | 78% | 0.783 | 76% | 0.755 | S | S | * | * | trans | -64.6 | 102.2 | 169.7 | -89.1 | -171.1 | 165.5 | 179 | 0 | 106.4 | S18 S22 | S18-K20 PolarHBondContact O-N 2.92Å; K20-S22 VanDerWaalsContact C-N 3.28Å; K20-S22 PolarHBondContact O-N 3.39Å | ||
| 21 | S | 54.5 | Low | 50.5 | Low | 102 Ų | 102 | 132.9 Ų | 132.9 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | -47.8 | 99.9 | 155.4 | 174 | 0 | 0 | 0 | 0 | 107.2 | C19 E23 | C19-S21 VanDerWaalsContact C-N 3.33Å; C19-S21 PolarHBondContact O-N 2.73Å; S21-E23 VanDerWaalsContact C-N 3.3Å; S21-E23 PolarHBondContact O-N 3.13Å | ||
| 22 | S | 52.8 | Low | 49.9 | Very low | 111 Ų | 111 | 136.4 Ų | 136.4 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | -73.5 | 93.8 | 171.3 | -168.6 | 0 | 0 | 0 | 0 | 106.3 | K20 R24 | K20-S22 VanDerWaalsContact C-N 3.28Å; K20-S22 PolarHBondContact O-N 3.39Å; S22-R24 VanDerWaalsContact C-N 3.28Å; S22-R24 PolarHBondContact O-N 3.06Å | ||
| 23 | E | 52.7 | Low | 50 | Low | 175 Ų | 175 | 132.6 Ų | 132.6 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | -59 | 93.2 | 168.7 | -70 | -179.3 | 85.8 | 0 | 0 | 108.1 | S21 S25 | S21-E23 VanDerWaalsContact C-N 3.3Å; S21-E23 PolarHBondContact O-N 3.13Å; E23-S25 PolarHBondContact O-N 3.1Å; E23-S25 VanDerWaalsContact O-N 3.08Å | ||
| 24 | R | 56.1 | Low | 49.9 | Very low | 231 Ų | 231 | 133.4 Ų | 133.4 | 87% | 0.872 | 77% | 0.765 | S | S | * | * | trans | -70.5 | 103.9 | 169.1 | 65.6 | -169.6 | -141.2 | -82.7 | -2.1 | 107.7 | S22 L26 | S22-R24 VanDerWaalsContact C-N 3.28Å; S22-R24 PolarHBondContact O-N 3.06Å; R24-L26 PolarHBondContact O-N 3.39Å | ||
| 25 | S | 53.2 | Low | 49.9 | Very low | 112 Ų | 112 | 135 Ų | 135 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -57 | 128.7 | 174.2 | 27 | 0 | 0 | 0 | 0 | 110.5 | E23 | E23-S25 PolarHBondContact O-N 3.1Å; E23-S25 VanDerWaalsContact O-N 3.08Å |
| 26 | L | 52.7 | Low | 50 | Low | 164 Ų | 164 | 135.2 Ų | 135.2 | 86% | 0.859 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -62 | 135.4 | 172.2 | -73.1 | 162.9 | 0 | 0 | 0 | 109.4 | R24 D28 | R24-L26 PolarHBondContact O-N 3.39Å; L26-D28 PolarHBondContact O-N 3.43Å |
| 27 | P | 54.2 | Low | 49.9 | Very low | 114 Ų | 114 | 133.8 Ų | 133.8 | 74% | 0.74 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 121.6 | 170.4 | 27.4 | -30.6 | 0 | 0 | 0 | 109.7 | C29 | P27-C29 PolarHBondContact O-N 3.08Š|
| 28 | D | 43.4 | Very low | 49.8 | Very low | 154 Ų | 154 | 136.4 Ų | 136.4 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | trans | -77.4 | 103.5 | 174.8 | -147.5 | 2.8 | 0 | 0 | 0 | 108.4 | L26 T30 | L26-D28 PolarHBondContact O-N 3.43Å; D28-T30 PolarHBondContact O-N 2.85Å; D28-T30 VanDerWaalsContact O-N 3.16Å | ||
| 29 | C | 39.7 | Very low | 49.6 | Very low | 117 Ų | 117 | 139.5 Ų | 139.5 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | -80.3 | 94.8 | -179.3 | -71.1 | 0 | 0 | 0 | 0 | 110.3 | P27 | P27-C29 PolarHBondContact O-N 3.08Š| ||
| 30 | T | 50.9 | Low | 49.8 | Very low | 115 Ų | 115 | 138.5 Ų | 138.5 | 71% | 0.706 | 79% | 0.788 | S | S | * | * | trans | -79.6 | 129.2 | 167.7 | 28.6 | 0 | 0 | 0 | 0 | 110.7 | D28 H32 | D28-T30 PolarHBondContact O-N 2.85Å; D28-T30 VanDerWaalsContact O-N 3.16Å; T30-H32 PolarHBondContact O-N 3Å | ||
| 31 | P | 46.6 | Very low | 50.3 | Low | 127 Ų | 127 | 132 Ų | 132 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | trans | -85.4 | 115.4 | 179.9 | 30.4 | -28.8 | 0 | 0 | 0 | 110.9 | ||||
| 32 | H | 42.6 | Very low | 50.2 | Low | 174 Ų | 174 | 133.4 Ų | 133.4 | 81% | 0.806 | 78% | 0.779 | S | S | * | * | trans | -90.5 | 136.6 | 164.1 | -100.4 | -75.5 | 0 | 0 | 0 | 110.6 | T30 N34 | T30-H32 PolarHBondContact O-N 3Å; H32-N34 PolarHBondContact O-N 2.86Å | ||
| 33 | P | 54.3 | Low | 50.2 | Low | 112 Ų | 112 | 139.6 Ų | 139.6 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -89.6 | 108.4 | -172.7 | 33.8 | -28.8 | 0 | 0 | 0 | 110 | ||||
| 34 | N | 40.6 | Very low | 50.4 | Low | 157 Ų | 157 | 140.3 Ų | 140.3 | 84% | 0.84 | 79% | 0.789 | S | S | * | * | trans | -114 | 109.2 | 164.4 | -82.3 | -15.7 | 0 | 0 | 0 | 109.8 | H32 I36 | H32-N34 PolarHBondContact O-N 2.86Å; N34-I36 PolarHBondContact O-N 2.86Å | ||
| 35 | S | 53.3 | Low | 50.4 | Low | 117 Ų | 117 | 133.4 Ų | 133.4 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -52.7 | 117.4 | 172.6 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 36 | I | 50 | Low | 50.4 | Low | 143 Ų | 143 | 133.8 Ų | 133.8 | 73% | 0.733 | 78% | 0.781 | S | S | * | * | trans | -129.5 | 103.3 | 155.4 | -66.4 | 168.8 | 0 | 0 | 0 | 105.5 | N34 I38 | N34-I36 PolarHBondContact O-N 2.86Å; I36-I38 HydrophobicContact CG2-CD1 4.44Å; I36-I38 HydrophobicContact CG2-CG1 3.88Å; I36-I38 PolarHBondContact O-N 3.04Å | ||
| 37 | S | 51.8 | Low | 50.5 | Low | 116 Ų | 116 | 135.7 Ų | 135.7 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -63.2 | 111.7 | 169.5 | -173.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 38 | I | 53.8 | Low | 50.7 | Low | 142 Ų | 142 | 137.8 Ų | 137.8 | 73% | 0.728 | 79% | 0.786 | S | S | * | * | trans | -110.5 | 107.6 | 169.1 | -43.2 | 177.1 | 0 | 0 | 0 | 106.3 | I36 A40 | I36-I38 HydrophobicContact CG2-CD1 4.44Å; I36-I38 HydrophobicContact CG2-CG1 3.88Å; I36-I38 PolarHBondContact O-N 3.04Å; I38-A40 PolarHBondContact O-N 2.79Å | ||
| 39 | D | 45.2 | Very low | 51.5 | Low | 146 Ų | 146 | 134.4 Ų | 134.4 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | trans | -41.8 | 120.1 | 172.1 | -177.5 | 57.7 | 0 | 0 | 0 | 111.7 | G41 | D39-G41 VanDerWaalsContact C-N 3.33Å; D39-G41 PolarHBondContact O-N 3.05Å | ||
| 40 | A | 51.5 | Low | 52.4 | Low | 99 Ų | 99 | 137.2 Ų | 137.2 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -81.9 | 76.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | I38 | I38-A40 PolarHBondContact O-N 2.79Š| ||
| 41 | G | 56 | Low | 52.8 | Low | 45 Ų | 45 | 138.5 Ų | 138.5 | 46% | 0.464 | 78% | 0.782 | S | S | . | * | trans | -78.7 | 138.3 | 162 | 0 | 0 | 0 | 0 | 0 | 111 | D39 R43 | D39-G41 VanDerWaalsContact C-N 3.33Å; D39-G41 PolarHBondContact O-N 3.05Å; G41-R43 PolarHBondContact O-N 3.42Å | ||
| 42 | P | 51.9 | Low | 53.5 | Low | 130 Ų | 130 | 140.3 Ų | 140.3 | 84% | 0.844 | 78% | 0.776 | S | S | * | * | trans | -67.7 | 108 | -179.3 | 27.1 | -31.4 | 0 | 0 | 0 | 109.7 | Q44 | P42-Q44 PolarHBondContact O-N 3.34Š| ||
| 43 | R | 53.8 | Low | 54.3 | Low | 242 Ų | 242 | 142.2 Ų | 142.2 | 91% | 0.913 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 117.3 | 171.5 | -75.3 | -176.9 | -172.4 | -128.6 | 0.4 | 108.9 | G41 A45 | G41-R43 PolarHBondContact O-N 3.42Å; R43-A45 PolarHBondContact O-N 3.49Å |
| 44 | Q | 57.6 | Low | 54.5 | Low | 189 Ų | 189 | 143.6 Ų | 143.6 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 125.6 | 168.7 | -68.2 | -173.6 | 13.3 | 0 | 0 | 109.3 | P42 | P42-Q44 PolarHBondContact O-N 3.34Š|
| 45 | A | 56 | Low | 55.1 | Low | 86 Ų | 86 | 142.1 Ų | 142.1 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 134.8 | 173 | 0 | 0 | 0 | 0 | 0 | 109.9 | R43 K47 | R43-A45 PolarHBondContact O-N 3.49Å; A45-K47 PolarHBondContact O-N 3.16Å |
| 46 | P | 52.9 | Low | 55.3 | Low | 121 Ų | 121 | 142.2 Ų | 142.2 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 126.6 | 175 | 25.5 | -30.5 | 0 | 0 | 0 | 109.4 | I48 | P46-I48 PolarHBondContact O-N 3.01Å; P46-I48 VanDerWaalsContact O-N 3.09Å |
| 47 | K | 54.2 | Low | 55.4 | Low | 204 Ų | 204 | 144.6 Ų | 144.6 | 89% | 0.887 | 77% | 0.771 | S | S | * | * | trans | -69 | 105.5 | 175.5 | -66.6 | 179.4 | -178.4 | 174.5 | 0 | 108.5 | A45 A49 | A45-K47 PolarHBondContact O-N 3.16Å; K47-A49 PolarHBondContact O-N 3.33Å | ||
| 48 | I | 59.5 | Low | 55.2 | Low | 158 Ų | 158 | 142 Ų | 142 | 81% | 0.81 | 76% | 0.762 | S | S | * | * | trans | -63.4 | 108.9 | 167.8 | -61.9 | 173.7 | 0 | 0 | 0 | 106.6 | P46 Q50 | P46-I48 PolarHBondContact O-N 3.01Å; P46-I48 VanDerWaalsContact O-N 3.09Å; I48-Q50 PolarHBondContact O-N 3.33Å; I48-Q50 VanDerWaalsContact O-N 3.12Å | ||
| 49 | A | 58.3 | Low | 55.2 | Low | 82 Ų | 82 | 143 Ų | 143 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | trans | -59.5 | 116.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 108 | K47 I51 | K47-A49 PolarHBondContact O-N 3.33Å; A49-I51 VanDerWaalsContact C-N 3.34Å; A49-I51 PolarHBondContact O-N 3.44Å | ||
| 50 | Q | 59.2 | Low | 55.8 | Low | 177 Ų | 177 | 142.2 Ų | 142.2 | 83% | 0.827 | 77% | 0.765 | S | S | * | * | trans | -66.7 | 95.8 | 174.9 | -67.1 | -171.4 | -53.9 | 0 | 0 | 108.4 | I48 K52 | I48-Q50 PolarHBondContact O-N 3.33Å; I48-Q50 VanDerWaalsContact O-N 3.12Å; Q50-K52 VanDerWaalsContact C-N 3.33Å; Q50-K52 PolarHBondContact O-N 3.07Å | ||
| 51 | I | 59.8 | Low | 56.2 | Low | 141 Ų | 141 | 142.2 Ų | 142.2 | 72% | 0.723 | 76% | 0.759 | S | S | * | * | trans | -66 | 99 | 166.7 | -64.4 | 164.8 | 0 | 0 | 0 | 106.1 | A49 R53 | A49-I51 VanDerWaalsContact C-N 3.34Å; A49-I51 PolarHBondContact O-N 3.44Å; I51-R53 VanDerWaalsContact C-N 3.33Å; I51-R53 HydrophobicContact CG2-CG 4.45Å; I51-R53 PolarHBondContact O-N 2.94Å | ||
| 52 | K | 61.9 | Low | 56.2 | Low | 165 Ų | 165 | 143.4 Ų | 143.4 | 72% | 0.717 | 76% | 0.755 | S | S | * | * | trans | -65.5 | 94.9 | 168.6 | -68.1 | -169.4 | -179.9 | -165.9 | 0 | 107.7 | Q50 N54 | Q50-K52 VanDerWaalsContact C-N 3.33Å; Q50-K52 PolarHBondContact O-N 3.07Å; K52-N54 PolarHBondContact O-N 3.33Å | ||
| 53 | R | 57.7 | Low | 56.5 | Low | 214 Ų | 214 | 141.9 Ų | 141.9 | 81% | 0.808 | 75% | 0.745 | S | S | * | * | trans | -69.9 | 85.6 | 162.2 | -79.1 | -170.6 | 174.2 | 95.1 | -2.6 | 107.7 | I51 L55 | I51-R53 VanDerWaalsContact C-N 3.33Å; I51-R53 HydrophobicContact CG2-CG 4.45Å; I51-R53 PolarHBondContact O-N 2.94Å; R53-L55 PolarHBondContact O-N 3.21Å | ||
| 54 | N | 59.5 | Low | 56.6 | Low | 141 Ų | 141 | 133.2 Ų | 133.2 | 75% | 0.754 | 73% | 0.725 | S | S | * | * | trans | -77.7 | 77.6 | 163.2 | -65.3 | -63.7 | 0 | 0 | 0 | 107.6 | K52 | K52-N54 PolarHBondContact O-N 3.33Š| ||
| 55 | L | 53.8 | Low | 56.6 | Low | 127 Ų | 127 | 131 Ų | 131 | 67% | 0.665 | 72% | 0.718 | S | S | * | * | trans | -98.1 | 81.1 | 167.5 | -147.3 | 65 | 0 | 0 | 0 | 106.3 | R53 Y57 | R53-L55 PolarHBondContact O-N 3.21Å; L55-Y57 HydrophobicContact CD2-CD2 3.91Å; L55-Y57 HydrophobicContact CD2-CE2 3.34Å; L55-Y57 HydrophobicContact CG-CD2 3.89Å; L55-Y57 HydrophobicContact CG-CE2 3.76Å; L55-Y57 PolarHBondContact O-N 3Å | ||
| 56 | S | 56.9 | Low | 56.9 | Low | 118 Ų | 118 | 132.1 Ų | 132.1 | 83% | 0.825 | 71% | 0.709 | S | S | * | * | trans | -70.9 | 86.3 | 166.5 | -176.2 | 0 | 0 | 0 | 0 | 106.5 | G58 | S56-G58 PolarHBondContact O-N 3.34Å; S56-G58 VanDerWaalsContact O-N 3.1Å | ||
| 57 | Y | 51 | Low | 57.4 | Low | 194 Ų | 194 | 130.5 Ų | 130.5 | 76% | 0.761 | 71% | 0.706 | S | S | * | * | trans | -62.4 | 113.9 | 164.2 | -96 | -84.6 | 0 | 0 | 0 | 106.2 | L55 D59 | L55-Y57 HydrophobicContact CD2-CD2 3.91Å; L55-Y57 HydrophobicContact CD2-CE2 3.34Å; L55-Y57 HydrophobicContact CG-CD2 3.89Å; L55-Y57 HydrophobicContact CG-CE2 3.76Å; L55-Y57 PolarHBondContact O-N 3Å; Y57-D59 PolarHBondContact O-N 3.23Å; Y57-D59 VanDerWaalsContact O-N 3.16Å | ||
| 58 | G | 48.5 | Very low | 57.8 | Low | 60 Ų | 60 | 126.3 Ų | 126.3 | 62% | 0.619 | 70% | 0.702 | S | S | * | * | trans | -51.6 | 123.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | S56 N60 | S56-G58 PolarHBondContact O-N 3.34Å; S56-G58 VanDerWaalsContact O-N 3.1Å; G58-N60 PolarHBondContact O-N 3.49Å | ||
| 59 | D | 54.3 | Low | 57.9 | Low | 163 Ų | 163 | 122.3 Ų | 122.3 | 87% | 0.872 | 69% | 0.688 | S | S | * | * | trans | -54.1 | 95.9 | 155.4 | -177.3 | 51.2 | 0 | 0 | 0 | 107.1 | Y57 | Y57-D59 PolarHBondContact O-N 3.23Å; Y57-D59 VanDerWaalsContact O-N 3.16Å | ||
| 60 | N | 57.3 | Low | 58.2 | Low | 130 Ų | 130 | 124.3 Ų | 124.3 | 70% | 0.695 | 69% | 0.687 | S | S | * | * | trans | -145.8 | 103.5 | 164.4 | -156.5 | -77.8 | 0 | 0 | 0 | 106.9 | G58 D62 | G58-N60 PolarHBondContact O-N 3.49Å; N60-D62 PolarHBondContact O-N 2.9Å | ||
| 61 | S | 59.1 | Low | 58.8 | Low | 100 Ų | 100 | 120.9 Ų | 120.9 | 70% | 0.699 | 68% | 0.68 | S | S | * | * | trans | -53.1 | 77.8 | 166.6 | 37.9 | 0 | 0 | 0 | 0 | 110.9 | P63 | S61-P63 VanDerWaalsContact O-CD 3.32Å; S61-P63 WeakPolarHBondContact O-CD 3.41Å | ||
| 62 | D | 56.4 | Low | 59.3 | Low | 70 Ų | 70 | 119.6 Ų | 119.6 | 37% | 0.374 | 68% | 0.68 | S | S | . | * | trans | -79 | 111.6 | 162.8 | -177.6 | -1.8 | 0 | 0 | 0 | 107.7 | N60 A64 L65 | N60-D62 PolarHBondContact O-N 2.9Å; D62-A64 PolarHBondContact O-N 2.97Å; D62-A64 VanDerWaalsContact OD1-CB 3.29Å; D62-A64 WeakPolarHBondContact OD1-CB 3.49Å; D62-A64 PolarHBondContact OD1-N 2.98Å; D62-L65 HydrophobicContact CB-CB 4.4Å; D62-L65 HydrophobicContact CB-CD1 4.09Å; D62-L65 HydrophobicContact CB-CG 3.9Å; D62-L65 PolarHBondContact O-N 3.43Å | ||
| 63 | P | 58.8 | Low | 59.5 | Low | 97 Ų | 97 | 115.7 Ų | 115.7 | 63% | 0.63 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.2 | -15.4 | 178.6 | 25.6 | -34.1 | 0 | 0 | 0 | 113.1 | S61 L65 S69 | S61-P63 VanDerWaalsContact O-CD 3.32Å; S61-P63 WeakPolarHBondContact O-CD 3.41Å; P63-L65 VanDerWaalsContact C-N 3.31Å; P63-S69 PolarHBondContact O-OG 3.45Å; P63-S69 VanDerWaalsContact O-OG 3.08Å |
| 64 | A | 56.7 | Low | 60 | Low | 61 Ų | 61 | 109.3 Ų | 109.3 | 50% | 0.504 | 65% | 0.654 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.4 | -16.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D62 | D62-A64 PolarHBondContact O-N 2.97Å; D62-A64 VanDerWaalsContact OD1-CB 3.29Å; D62-A64 WeakPolarHBondContact OD1-CB 3.49Å; D62-A64 PolarHBondContact OD1-N 2.98Å |
| 65 | L | 57.3 | Low | 60.3 | Low | 141 Ų | 141 | 108.3 Ų | 108.3 | 74% | 0.738 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -98.6 | 0.7 | 178.1 | -56.3 | -173.3 | 0 | 0 | 0 | 113.2 | D62 P63 A67 | D62-L65 HydrophobicContact CB-CB 4.4Å; D62-L65 HydrophobicContact CB-CD1 4.09Å; D62-L65 HydrophobicContact CB-CG 3.9Å; D62-L65 PolarHBondContact O-N 3.43Å; P63-L65 VanDerWaalsContact C-N 3.31Å; L65-A67 PolarHBondContact O-N 3.28Å |
| 66 | E | 61.7 | Low | 60.6 | Low | 111 Ų | 111 | 110 Ų | 110 | 52% | 0.519 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -60.6 | 132.9 | 170.8 | -71.7 | -68.4 | 128.1 | 0 | 0 | 109.5 | S68 S69 | E66-S68 PolarHBondContact O-N 3.02Å; E66-S69 WeakPolarHBondContact O-CB 3.37Å; E66-S69 PolarHBondContact O-N 3.4Å |
| 67 | A | 63.2 | Low | 60.4 | Low | 86 Ų | 86 | 108.6 Ų | 108.6 | 71% | 0.711 | 64% | 0.636 | S | S | * | * | G | 310 helix | trans | -56.2 | -22.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113 | L65 S69 | L65-A67 PolarHBondContact O-N 3.28Å; A67-S69 VanDerWaalsContact C-N 3.34Å |
| 68 | S | 62.3 | Low | 61 | Low | 116 Ų | 116 | 104.9 Ų | 104.9 | 81% | 0.811 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -75.6 | -13 | 174.7 | -57.5 | 0 | 0 | 0 | 0 | 115 | E66 | E66-S68 PolarHBondContact O-N 3.02Š|
| 69 | S | 61.5 | Low | 61.1 | Low | 74 Ų | 74 | 106.6 Ų | 106.6 | 52% | 0.517 | 62% | 0.624 | S | S | . | * | G | 310 helix | trans | -86 | -15.5 | 176.4 | -67.4 | 0 | 0 | 0 | 0 | 112.8 | P63 E66 A67 | P63-S69 PolarHBondContact O-OG 3.45Å; P63-S69 VanDerWaalsContact O-OG 3.08Å; E66-S69 WeakPolarHBondContact O-CB 3.37Å; E66-S69 PolarHBondContact O-N 3.4Å; A67-S69 VanDerWaalsContact C-N 3.34Å |
| 70 | L | 66.4 | Low | 61.1 | Low | 124 Ų | 124 | 105 Ų | 105 | 65% | 0.649 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -79.9 | 146 | 172.1 | -63.5 | 176.8 | 0 | 0 | 0 | 109.7 | ||
| 71 | P | 71.9 | Confident | 60.8 | Low | 106 Ų | 106 | 103.1 Ų | 103.1 | 69% | 0.688 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 140.6 | 170 | 24.7 | -33.2 | 0 | 0 | 0 | 108.8 | ||
| 72 | P | 68.8 | Low | 60.2 | Low | 113 Ų | 113 | 104 Ų | 104 | 73% | 0.734 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 132.2 | 179.4 | 19.3 | -30.3 | 0 | 0 | 0 | 108.4 | D74 | P72-D74 PolarHBondContact O-N 3.1Š|
| 73 | P | 66.6 | Low | 59.7 | Low | 84 Ų | 84 | 104.6 Ų | 104.6 | 55% | 0.545 | 64% | 0.638 | S | S | . | * | P | Polyproline II helix | trans | -55.3 | 135.2 | 179 | 24.4 | -32.8 | 0 | 0 | 0 | 107.3 | ||
| 74 | D | 69.1 | Low | 59.3 | Low | 80 Ų | 80 | 106.5 Ų | 106.5 | 43% | 0.428 | 65% | 0.651 | S | S | . | * | trans | -44 | 137.1 | 178.2 | -103.6 | -19 | 0 | 0 | 0 | 110.5 | P72 W76 L77 | P72-D74 PolarHBondContact O-N 3.1Å; D74-W76 VanDerWaalsContact CB-CD1 3.42Å; D74-W76 HydrophobicContact CB-CG 4.4Å; D74-W76 PolarHBondContact O-N 3.48Å; D74-W76 PolarHBondContact OD2-NE1 3Å; D74-L77 HydrophobicContact CB-CB 4.05Å; D74-L77 HydrophobicContact CB-CD1 3.9Å; D74-L77 HydrophobicContact CB-CG 3.88Å; D74-L77 CarbonylContact O-C 3.41Å; D74-L77 WeakPolarHBondContact O-CA 3.43Å; D74-L77 PolarHBondContact O-N 3.36Å | ||
| 75 | P | 64.8 | Low | 59 | Low | 119 Ų | 119 | 107.7 Ų | 107.7 | 77% | 0.773 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -19 | -175 | -24 | 31.2 | 0 | 0 | 0 | 114.3 | ||
| 76 | W | 59.7 | Low | 58.8 | Low | 162 Ų | 162 | 108.9 Ų | 108.9 | 61% | 0.614 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.8 | -5.4 | 176.8 | 62.9 | -64.9 | 0 | 0 | 0 | 112.9 | D74 R95 | D74-W76 VanDerWaalsContact CB-CD1 3.42Å; D74-W76 HydrophobicContact CB-CG 4.4Å; D74-W76 PolarHBondContact O-N 3.48Å; D74-W76 PolarHBondContact OD2-NE1 3Å; W76-R95 PolarHBondContact O-NH2 3.19Å |
| 77 | L | 54.2 | Low | 58.1 | Low | 89 Ų | 89 | 108.7 Ų | 108.7 | 47% | 0.466 | 67% | 0.671 | S | S | . | * | S | Bend | trans | -110.9 | 52.3 | 172.4 | -59.6 | -178.8 | 0 | 0 | 0 | 108.7 | D74 T79 | D74-L77 HydrophobicContact CB-CB 4.05Å; D74-L77 HydrophobicContact CB-CD1 3.9Å; D74-L77 HydrophobicContact CB-CG 3.88Å; D74-L77 CarbonylContact O-C 3.41Å; D74-L77 WeakPolarHBondContact O-CA 3.43Å; D74-L77 PolarHBondContact O-N 3.36Å; L77-T79 PolarHBondContact O-N 3.46Å; L77-T79 PolarHBondContact O-OG1 3.37Å |
| 78 | E | 62.4 | Low | 57.6 | Low | 116 Ų | 116 | 109.1 Ų | 109.1 | 54% | 0.542 | 68% | 0.675 | S | S | . | * | trans | -55.1 | 107.2 | 172.2 | -72.5 | -144.4 | 167 | 0 | 0 | 109.1 | S80 A92 | E78-S80 PolarHBondContact O-N 3.43Å; E78-A92 VanDerWaalsContact CD-CB 3.45Å; E78-A92 WeakPolarHBondContact OE1-CB 3.39Å; E78-A92 WeakPolarHBondContact OE2-CB 3.45Å | ||
| 79 | T | 51.4 | Low | 57.2 | Low | 97 Ų | 97 | 110.4 Ų | 110.4 | 60% | 0.595 | 67% | 0.668 | S | S | * | * | trans | -70 | 114.9 | -179.3 | -64.4 | 0 | 0 | 0 | 0 | 105.9 | L77 S81 | L77-T79 PolarHBondContact O-N 3.46Å; L77-T79 PolarHBondContact O-OG1 3.37Å; T79-S81 PolarHBondContact O-N 3.17Å | ||
| 80 | S | 54.2 | Low | 56.5 | Low | 128 Ų | 128 | 113 Ų | 113 | 90% | 0.895 | 68% | 0.683 | S | S | * | * | trans | -67.8 | 61.1 | 169.7 | 178.2 | 0 | 0 | 0 | 0 | 110 | E78 | E78-S80 PolarHBondContact O-N 3.43Š| ||
| 81 | S | 49.5 | Very low | 56 | Low | 92 Ų | 92 | 110 Ų | 110 | 64% | 0.643 | 68% | 0.682 | S | S | * | * | trans | -114.8 | 89 | 164.5 | -172.3 | 0 | 0 | 0 | 0 | 106.1 | T79 S83 | T79-S81 PolarHBondContact O-N 3.17Å; S81-S83 VanDerWaalsContact C-N 3.28Å; S81-S83 PolarHBondContact O-N 2.91Å | ||
| 82 | S | 48.1 | Very low | 55.4 | Low | 117 Ų | 117 | 107.2 Ų | 107.2 | 82% | 0.818 | 67% | 0.667 | S | S | * | * | trans | -66.3 | 89.1 | 171.1 | 54.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 83 | S | 45.9 | Very low | 55.2 | Low | 84 Ų | 84 | 107 Ų | 107 | 59% | 0.587 | 67% | 0.667 | S | S | * | * | trans | -80.3 | 135.7 | 156.9 | 178.8 | 0 | 0 | 0 | 0 | 108.4 | S81 A85 | S81-S83 VanDerWaalsContact C-N 3.28Å; S81-S83 PolarHBondContact O-N 2.91Å; S83-A85 PolarHBondContact O-N 2.72Å | ||
| 84 | P | 48.9 | Very low | 55.6 | Low | 136 Ų | 136 | 112.5 Ų | 112.5 | 88% | 0.883 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | 4.1 | -172.5 | -12 | 27.8 | 0 | 0 | 0 | 115.2 | ||
| 85 | A | 51.3 | Low | 56.1 | Low | 87 Ų | 87 | 114.9 Ų | 114.9 | 72% | 0.719 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.9 | -1.2 | -158.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | S83 | S83-A85 PolarHBondContact O-N 2.72Š|
| 86 | E | 53.8 | Low | 57.2 | Low | 165 Ų | 165 | 112.5 Ų | 112.5 | 77% | 0.771 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -106.2 | 140.9 | 174.5 | -88.9 | -164.6 | 95 | 0 | 0 | 112.8 | A88 | E86-A88 PolarHBondContact O-N 2.98Å; E86-A88 VanDerWaalsContact O-N 3.11Å |
| 87 | P | 46.1 | Very low | 58.9 | Low | 107 Ų | 107 | 107.2 Ų | 107.2 | 70% | 0.695 | 66% | 0.657 | S | S | * | * | trans | -61.5 | 117.6 | 174.3 | 26.6 | -31.9 | 0 | 0 | 0 | 108.5 | Q89 | P87-Q89 PolarHBondContact O-N 3.15Š| ||
| 88 | A | 53.2 | Low | 60.7 | Low | 96 Ų | 96 | 110.1 Ų | 110.1 | 79% | 0.793 | 66% | 0.662 | S | S | * | * | trans | -47.7 | 111.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | E86 P90 | E86-A88 PolarHBondContact O-N 2.98Å; E86-A88 VanDerWaalsContact O-N 3.11Å; A88-P90 WeakPolarHBondContact O-CD 3.49Å | ||
| 89 | Q | 52.9 | Low | 62.2 | Low | 142 Ų | 142 | 108.8 Ų | 108.8 | 66% | 0.664 | 65% | 0.653 | S | S | * | * | trans | -57.8 | 121.8 | 176.5 | -72.7 | -70.6 | -15.9 | 0 | 0 | 108.1 | P87 G91 | P87-Q89 PolarHBondContact O-N 3.15Å; Q89-G91 PolarHBondContact O-N 2.95Å | ||
| 90 | P | 46.2 | Very low | 64.3 | Low | 130 Ų | 130 | 109.9 Ų | 109.9 | 84% | 0.844 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 82.3 | 177.3 | 28 | -30.4 | 0 | 0 | 0 | 108.7 | A88 | A88-P90 WeakPolarHBondContact O-CD 3.49Š|
| 91 | G | 56.3 | Low | 66.3 | Low | 60 Ų | 60 | 109 Ų | 109 | 62% | 0.619 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -173.1 | -14.3 | -177.3 | 0 | 0 | 0 | 0 | 0 | 116 | Q89 C93 | Q89-G91 PolarHBondContact O-N 2.95Å; G91-C93 VanDerWaalsContact C-N 3.31Å; G91-C93 PolarHBondContact O-N 2.92Å |
| 92 | A | 60.1 | Low | 68.5 | Low | 47 Ų | 47 | 109.1 Ų | 109.1 | 39% | 0.388 | 62% | 0.623 | S | S | . | * | trans | -69.5 | 87.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | E78 R94 | E78-A92 VanDerWaalsContact CD-CB 3.45Å; E78-A92 WeakPolarHBondContact OE1-CB 3.39Å; E78-A92 WeakPolarHBondContact OE2-CB 3.45Å; A92-R94 PolarHBondContact O-N 3.09Å | ||
| 93 | C | 63.6 | Low | 70.9 | Confident | 108 Ų | 108 | 108 Ų | 108 | 73% | 0.73 | 61% | 0.607 | S | S | * | * | trans | -49.9 | 112.1 | 165.2 | -75.5 | 0 | 0 | 0 | 0 | 107.4 | G91 R95 | G91-C93 VanDerWaalsContact C-N 3.31Å; G91-C93 PolarHBondContact O-N 2.92Å; C93-R95 PolarHBondContact O-N 3.21Å | ||
| 94 | R | 74.9 | Confident | 73.4 | Confident | 200 Ų | 200 | 109.2 Ų | 109.2 | 76% | 0.755 | 61% | 0.607 | S | S | * | * | trans | -54.9 | 118.6 | -178.3 | -69.8 | -170.5 | 72.5 | -110.1 | 1.4 | 107.9 | A92 D96 | A92-R94 PolarHBondContact O-N 3.09Å; R94-D96 PolarHBondContact O-N 3.38Å | ||
| 95 | R | 80.2 | Confident | 75.7 | Confident | 130 Ų | 130 | 107.2 Ų | 107.2 | 49% | 0.491 | 59% | 0.585 | S | S | . | * | trans | -73.2 | 74.2 | 171.9 | -69.2 | 180 | 175.2 | -174 | -4.9 | 109.1 | W76 C93 W99 | W76-R95 PolarHBondContact O-NH2 3.19Å; C93-R95 PolarHBondContact O-N 3.21Å; R95-W99 HydrophobicContact CB-CE3 4.46Å; R95-W99 HydrophobicContact CG-CD2 4.14Å; R95-W99 HydrophobicContact CG-CE3 4.28Å; R95-W99 HydrophobicContact CG-CG 4.47Å | ||
| 96 | D | 88.4 | Confident | 77.9 | Confident | 70 Ų | 70 | 105.6 Ų | 105.6 | 37% | 0.374 | 57% | 0.572 | S | S | . | * | trans | -86.3 | 179.4 | 172 | 67.7 | 9.7 | 0 | 0 | 0 | 111 | R94 Y98 W99 F100 | R94-D96 PolarHBondContact O-N 3.38Å; D96-Y98 PolarHBondContact O-N 2.95Å; D96-Y98 WeakPolarHBondContact OD1-CB 3.49Å; D96-Y98 PolarHBondContact OD1-N 3.35Å; D96-Y98 VanDerWaalsContact OD1-N 3.08Å; D96-W99 WeakPolarHBondContact O-CB 3.32Å; D96-W99 PolarHBondContact O-N 2.94Å; D96-W99 VanDerWaalsContact O-N 3.15Å; D96-W99 PolarHBondContact OD1-N 3.49Å; D96-W99 VanDerWaalsContact OD1-N 3.12Å; D96-F100 WeakPolarHBondContact O-CD2 3.48Å; D96-F100 PolarHBondContact O-N 3.08Å | ||
| 97 | G | 94.3 | Very high | 80.1 | Confident | 50 Ų | 50 | 101.6 Ų | 101.6 | 52% | 0.515 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.2 | -29.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | F100 L101 | G97-F100 PolarHBondContact O-N 3.02Å; G97-L101 WeakPolarHBondContact O-CG 3.44Å; G97-L101 PolarHBondContact O-N 3.16Å |
| 98 | Y | 93.4 | Very high | 82.6 | Confident | 150 Ų | 150 | 100 Ų | 100 | 59% | 0.588 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -67.9 | -37.7 | 179 | -172.5 | -98.3 | 0 | 0 | 0 | 111.7 | D96 F100 L101 K102 | D96-Y98 PolarHBondContact O-N 2.95Å; D96-Y98 WeakPolarHBondContact OD1-CB 3.49Å; D96-Y98 PolarHBondContact OD1-N 3.35Å; D96-Y98 VanDerWaalsContact OD1-N 3.08Å; Y98-F100 PolarHBondContact O-N 3.12Å; Y98-L101 PolarHBondContact O-N 3.15Å; Y98-K102 HydrophobicContact CD1-CG 4.12Å; Y98-K102 HydrophobicContact CE1-CD 4.32Å; Y98-K102 HydrophobicContact CE1-CG 3.81Å; Y98-K102 WeakPolarHBondContact O-CG 3.46Å; Y98-K102 PolarHBondContact O-N 3.29Å; Y98-K102 WeakPolarHBondContact OH-CE 3.47Å |
| 99 | W | 92.9 | Very high | 84.7 | Confident | 89 Ų | 89 | 100.7 Ų | 100.7 | 34% | 0.337 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.1 | -45.8 | 173.2 | -176.1 | 87.2 | 0 | 0 | 0 | 112.1 | R95 D96 K102 L103 | R95-W99 HydrophobicContact CB-CE3 4.46Å; R95-W99 HydrophobicContact CG-CD2 4.14Å; R95-W99 HydrophobicContact CG-CE3 4.28Å; R95-W99 HydrophobicContact CG-CG 4.47Å; D96-W99 WeakPolarHBondContact O-CB 3.32Å; D96-W99 PolarHBondContact O-N 2.94Å; D96-W99 VanDerWaalsContact O-N 3.15Å; D96-W99 PolarHBondContact OD1-N 3.49Å; D96-W99 VanDerWaalsContact OD1-N 3.12Å; W99-K102 PolarHBondContact O-N 3.45Å; W99-L103 HydrophobicContact CH2-CD2 3.83Å; W99-L103 HydrophobicContact CZ3-CD2 3.97Å; W99-L103 PolarHBondContact O-N 2.69Å |
| 100 | F | 95.4 | Very high | 86.9 | Confident | 119 Ų | 119 | 98.8 Ų | 98.8 | 52% | 0.522 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 176.6 | -71.6 | -75.3 | 0 | 0 | 0 | 112.5 | D96 G97 Y98 K102 L103 L104 | D96-F100 WeakPolarHBondContact O-CD2 3.48Å; D96-F100 PolarHBondContact O-N 3.08Å; G97-F100 PolarHBondContact O-N 3.02Å; Y98-F100 PolarHBondContact O-N 3.12Å; F100-K102 VanDerWaalsContact C-N 3.3Å; F100-K102 PolarHBondContact O-N 3.33Å; F100-L103 PolarHBondContact O-N 2.98Å; F100-L104 WeakPolarHBondContact O-CB 3.49Å; F100-L104 PolarHBondContact O-N 3.31Å |
| 101 | L | 96.8 | Very high | 89.4 | Confident | 109 Ų | 109 | 96.4 Ų | 96.4 | 57% | 0.571 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.8 | -39.8 | 174.5 | -72.8 | 172.3 | 0 | 0 | 0 | 111.6 | G97 Y98 L104 Q105 | G97-L101 WeakPolarHBondContact O-CG 3.44Å; G97-L101 PolarHBondContact O-N 3.16Å; Y98-L101 PolarHBondContact O-N 3.15Å; L101-L104 PolarHBondContact O-N 3.26Å; L101-Q105 WeakPolarHBondContact O-CB 2.97Å; L101-Q105 PolarHBondContact O-N 3.46Å |
| 102 | K | 96.3 | Very high | 91.4 | Very high | 96 Ų | 96 | 99.6 Ų | 99.6 | 42% | 0.417 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.3 | -42.3 | 175.2 | -73.8 | -68.7 | 175 | -167.8 | 0 | 112.7 | Y98 W99 F100 Q105 A106 | Y98-K102 HydrophobicContact CD1-CG 4.12Å; Y98-K102 HydrophobicContact CE1-CD 4.32Å; Y98-K102 HydrophobicContact CE1-CG 3.81Å; Y98-K102 WeakPolarHBondContact O-CG 3.46Å; Y98-K102 PolarHBondContact O-N 3.29Å; Y98-K102 WeakPolarHBondContact OH-CE 3.47Å; W99-K102 PolarHBondContact O-N 3.45Å; F100-K102 VanDerWaalsContact C-N 3.3Å; F100-K102 PolarHBondContact O-N 3.33Å; K102-Q105 PolarHBondContact O-N 2.92Å; K102-A106 WeakPolarHBondContact O-CB 3.41Å; K102-A106 PolarHBondContact O-N 2.83Å |
| 103 | L | 97.1 | Very high | 93.2 | Very high | 94 Ų | 94 | 99.3 Ų | 99.3 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.5 | -43.9 | 175.5 | -173.6 | 65 | 0 | 0 | 0 | 111.6 | W99 F100 A106 E107 | W99-L103 HydrophobicContact CH2-CD2 3.83Å; W99-L103 HydrophobicContact CZ3-CD2 3.97Å; W99-L103 PolarHBondContact O-N 2.69Å; F100-L103 PolarHBondContact O-N 2.98Å; L103-A106 PolarHBondContact O-N 2.83Å; L103-E107 WeakPolarHBondContact O-CB 3.45Å; L103-E107 PolarHBondContact O-N 2.91Å |
| 104 | L | 98.5 | Very high | 94.9 | Very high | 109 Ų | 109 | 102.5 Ų | 102.5 | 57% | 0.571 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.5 | -43.4 | 177.5 | -179.2 | 63.1 | 0 | 0 | 0 | 111.8 | F100 L101 E107 T108 | F100-L104 WeakPolarHBondContact O-CB 3.49Å; F100-L104 PolarHBondContact O-N 3.31Å; L101-L104 PolarHBondContact O-N 3.26Å; L104-E107 PolarHBondContact O-N 3.01Å; L104-T108 WeakPolarHBondContact O-CB 3.37Å; L104-T108 PolarHBondContact O-N 2.87Å; L104-T108 PolarHBondContact O-OG1 2.63Å |
| 105 | Q | 98.4 | Very high | 95.9 | Very high | 93 Ų | 93 | 96.7 Ų | 96.7 | 44% | 0.435 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.7 | -50.1 | 176.4 | -179.6 | 176.7 | -8.8 | 0 | 0 | 110.9 | L101 K102 E107 T108 E109 | L101-Q105 WeakPolarHBondContact O-CB 2.97Å; L101-Q105 PolarHBondContact O-N 3.46Å; K102-Q105 PolarHBondContact O-N 2.92Å; Q105-E107 VanDerWaalsContact C-N 3.32Å; Q105-E107 PolarHBondContact O-N 3.2Å; Q105-T108 WeakPolarHBondContact O-CB 3.46Å; Q105-T108 PolarHBondContact O-N 3.48Å; Q105-T108 VanDerWaalsContact O-N 3.15Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.43Å; Q105-E109 PolarHBondContact NE2-OE1 3.24Å; Q105-E109 WeakPolarHBondContact O-CG 3.46Å; Q105-E109 PolarHBondContact O-N 3.41Å |
| 106 | A | 98.1 | Very high | 96.7 | Very high | 53 Ų | 53 | 94.1 Ų | 94.1 | 44% | 0.438 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.4 | -42.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | K102 L103 R110 | K102-A106 WeakPolarHBondContact O-CB 3.41Å; K102-A106 PolarHBondContact O-N 2.83Å; L103-A106 PolarHBondContact O-N 2.83Å; A106-R110 WeakPolarHBondContact O-CB 3.35Å; A106-R110 PolarHBondContact O-N 3.11Å; A106-R110 VanDerWaalsContact O-N 3.1Å |
| 107 | E | 98.7 | Very high | 97.1 | Very high | 81 Ų | 81 | 95.3 Ų | 95.3 | 38% | 0.379 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -68.5 | -35.5 | 177.5 | -175.2 | 61.4 | -173.5 | 0 | 0 | 112.3 | L103 L104 Q105 R110 L111 | L103-E107 WeakPolarHBondContact O-CB 3.45Å; L103-E107 PolarHBondContact O-N 2.91Å; L104-E107 PolarHBondContact O-N 3.01Å; Q105-E107 VanDerWaalsContact C-N 3.32Å; Q105-E107 PolarHBondContact O-N 3.2Å; E107-R110 PolarHBondContact O-N 2.74Å; E107-R110 IonicContact OE1-CZ 3.66Å; E107-R110 IonicContact OE1-NE 2.92Å; E107-R110 IonicContact OE1-NH2 3.53Å; E107-R110 PolarHBondContact OE1-NH2 2.8Å; E107-R110 IonicContact OE2-CZ 3.55Å; E107-R110 IonicContact OE2-NE 3.6Å; E107-R110 PolarHBondContact OE2-NE 2.95Å; E107-R110 IonicContact OE2-NH2 2.69Å; E107-L111 HydrophobicContact CG-CD1 4.3Å; E107-L111 WeakPolarHBondContact O-CG 3.38Å; E107-L111 PolarHBondContact O-N 2.83Å; E107-L111 VanDerWaalsContact O-N 3.09Å |
| 108 | T | 98.6 | Very high | 97.2 | Very high | 75 Ų | 75 | 98.5 Ų | 98.5 | 46% | 0.46 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.6 | -50 | 175.5 | -56.5 | 0 | 0 | 0 | 0 | 111.1 | L104 Q105 R110 L111 E112 | L104-T108 WeakPolarHBondContact O-CB 3.37Å; L104-T108 PolarHBondContact O-N 2.87Å; L104-T108 PolarHBondContact O-OG1 2.63Å; Q105-T108 WeakPolarHBondContact O-CB 3.46Å; Q105-T108 PolarHBondContact O-N 3.48Å; Q105-T108 VanDerWaalsContact O-N 3.15Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 3.18Å; T108-L111 PolarHBondContact O-N 2.91Å; T108-E112 WeakPolarHBondContact O-CB 3.32Å; T108-E112 PolarHBondContact O-N 2.93Å |
| 109 | E | 98.4 | Very high | 97.3 | Very high | 109 Ų | 109 | 96.5 Ų | 96.5 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.7 | -40.3 | 179 | -70.6 | 171.1 | -176.6 | 0 | 0 | 111.4 | Q105 G113 | Q105-E109 WeakPolarHBondContact CG-OE1 3.43Å; Q105-E109 PolarHBondContact NE2-OE1 3.24Å; Q105-E109 WeakPolarHBondContact O-CG 3.46Å; Q105-E109 PolarHBondContact O-N 3.41Å; E109-G113 PolarHBondContact O-N 3.37Å |
| 110 | R | 98.7 | Very high | 97.4 | Very high | 102 Ų | 102 | 98.3 Ų | 98.3 | 39% | 0.385 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 176.8 | -170.1 | -171.4 | 71.2 | 74.2 | -1.5 | 112.1 | A106 E107 T108 W114 | A106-R110 WeakPolarHBondContact O-CB 3.35Å; A106-R110 PolarHBondContact O-N 3.11Å; A106-R110 VanDerWaalsContact O-N 3.1Å; E107-R110 PolarHBondContact O-N 2.74Å; E107-R110 IonicContact OE1-CZ 3.66Å; E107-R110 IonicContact OE1-NE 2.92Å; E107-R110 IonicContact OE1-NH2 3.53Å; E107-R110 PolarHBondContact OE1-NH2 2.8Å; E107-R110 IonicContact OE2-CZ 3.55Å; E107-R110 IonicContact OE2-NE 3.6Å; E107-R110 PolarHBondContact OE2-NE 2.95Å; E107-R110 IonicContact OE2-NH2 2.69Å; T108-R110 VanDerWaalsContact C-N 3.29Å; T108-R110 PolarHBondContact O-N 3.18Å; R110-W114 PolarHBondContact O-N 2.73Å |
| 111 | L | 98.6 | Very high | 97.3 | Very high | 80 Ų | 80 | 97.7 Ų | 97.7 | 42% | 0.419 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.7 | -39.8 | -179.9 | -72.6 | 172.5 | 0 | 0 | 0 | 112 | E107 T108 G113 W114 C115 | E107-L111 HydrophobicContact CG-CD1 4.3Å; E107-L111 WeakPolarHBondContact O-CG 3.38Å; E107-L111 PolarHBondContact O-N 2.83Å; E107-L111 VanDerWaalsContact O-N 3.09Å; T108-L111 PolarHBondContact O-N 2.91Å; L111-G113 VanDerWaalsContact C-N 3.35Å; L111-G113 PolarHBondContact O-N 3.06Å; L111-W114 WeakPolarHBondContact O-CB 3.47Å; L111-W114 PolarHBondContact O-N 2.83Å; L111-C115 PolarHBondContact O-N 3.42Å; L111-C115 PolarHBondContact O-SG 3.2Å; L111-C115 VanDerWaalsContact O-SG 3.38Å |
| 112 | E | 98.4 | Very high | 97 | Very high | 127 Ų | 127 | 96.9 Ų | 96.9 | 59% | 0.593 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.8 | -44.8 | 175.3 | -174.4 | 173.8 | -162.8 | 0 | 0 | 111.2 | T108 W114 C115 C116 | T108-E112 WeakPolarHBondContact O-CB 3.32Å; T108-E112 PolarHBondContact O-N 2.93Å; E112-W114 VanDerWaalsContact C-N 3.28Å; E112-W114 PolarHBondContact O-N 3.07Å; E112-C115 WeakPolarHBondContact O-CB 3.34Å; E112-C115 PolarHBondContact O-N 2.9Å; E112-C115 VanDerWaalsContact O-N 3.16Å; E112-C116 PolarHBondContact O-N 3.31Å; E112-C116 PolarHBondContact O-SG 3.45Å; E112-C116 VanDerWaalsContact O-SG 3.42Å |
| 113 | G | 97.8 | Very high | 96.4 | Very high | 41 Ų | 41 | 101.2 Ų | 101.2 | 42% | 0.423 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -38.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | E109 L111 Q117 | E109-G113 PolarHBondContact O-N 3.37Å; L111-G113 VanDerWaalsContact C-N 3.35Å; L111-G113 PolarHBondContact O-N 3.06Å; G113-Q117 WeakPolarHBondContact O-CB 3.34Å; G113-Q117 PolarHBondContact O-N 2.95Å |
| 114 | W | 98.3 | Very high | 95.2 | Very high | 176 Ų | 176 | 104.4 Ų | 104.4 | 67% | 0.667 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.6 | -41.3 | 174.4 | -87.4 | 30.2 | 0 | 0 | 0 | 112.9 | R110 L111 E112 Q117 M118 | R110-W114 PolarHBondContact O-N 2.73Å; L111-W114 WeakPolarHBondContact O-CB 3.47Å; L111-W114 PolarHBondContact O-N 2.83Å; E112-W114 VanDerWaalsContact C-N 3.28Å; E112-W114 PolarHBondContact O-N 3.07Å; W114-Q117 PolarHBondContact O-N 3.09Å; W114-M118 PolarHBondContact O-N 3.21Å |
| 115 | C | 97.2 | Very high | 93.2 | Very high | 77 Ų | 77 | 108.6 Ų | 108.6 | 52% | 0.52 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.6 | -49.7 | 175.3 | -69.7 | 0 | 0 | 0 | 0 | 111.2 | L111 E112 Q117 M118 D119 | L111-C115 PolarHBondContact O-N 3.42Å; L111-C115 PolarHBondContact O-SG 3.2Å; L111-C115 VanDerWaalsContact O-SG 3.38Å; E112-C115 WeakPolarHBondContact O-CB 3.34Å; E112-C115 PolarHBondContact O-N 2.9Å; E112-C115 VanDerWaalsContact O-N 3.16Å; C115-Q117 VanDerWaalsContact C-N 3.28Å; C115-Q117 PolarHBondContact O-N 3.3Å; C115-M118 PolarHBondContact O-N 3.35Å; C115-D119 PolarHBondContact O-N 3Å |
| 116 | C | 96.3 | Very high | 93 | Very high | 77 Ų | 77 | 109.4 Ų | 109.4 | 52% | 0.52 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.9 | -38.3 | 178.1 | -64.3 | 0 | 0 | 0 | 0 | 112.7 | E112 D119 K120 | E112-C116 PolarHBondContact O-N 3.31Å; E112-C116 PolarHBondContact O-SG 3.45Å; E112-C116 VanDerWaalsContact O-SG 3.42Å; C116-D119 PolarHBondContact O-N 3.08Å; C116-K120 PolarHBondContact O-N 2.87Å |
| 117 | Q | 97.2 | Very high | 92.7 | Very high | 94 Ų | 94 | 112.4 Ų | 112.4 | 44% | 0.439 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.2 | -45.6 | 177.2 | -177.8 | 59.7 | 34.2 | 0 | 0 | 111.3 | G113 W114 C115 D119 K120 E121 | G113-Q117 WeakPolarHBondContact O-CB 3.34Å; G113-Q117 PolarHBondContact O-N 2.95Å; W114-Q117 PolarHBondContact O-N 3.09Å; C115-Q117 VanDerWaalsContact C-N 3.28Å; C115-Q117 PolarHBondContact O-N 3.3Å; Q117-D119 PolarHBondContact O-N 2.78Å; Q117-K120 WeakPolarHBondContact O-CB 3.32Å; Q117-K120 PolarHBondContact O-N 2.88Å; Q117-E121 WeakPolarHBondContact CG-OE1 3.34Å; Q117-E121 PolarHBondContact NE2-OE1 2.95Å; Q117-E121 WeakPolarHBondContact O-CG 3.29Å; Q117-E121 PolarHBondContact O-N 3.1Å |
| 118 | M | 96.9 | Very high | 92.4 | Very high | 118 Ų | 118 | 114.1 Ų | 114.1 | 58% | 0.581 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -62.6 | -41.2 | 175.6 | -80.5 | -153.5 | 68.5 | 0 | 0 | 112.7 | W114 C115 K120 E121 T122 | W114-M118 PolarHBondContact O-N 3.21Å; C115-M118 PolarHBondContact O-N 3.35Å; M118-K120 PolarHBondContact O-N 3.12Å; M118-E121 PolarHBondContact O-N 2.94Å; M118-T122 WeakPolarHBondContact O-CB 3.01Å; M118-T122 WeakPolarHBondContact O-CG2 3.35Å; M118-T122 PolarHBondContact O-N 2.97Å; M118-T122 PolarHBondContact O-OG1 3.03Å |
| 119 | D | 95 | Very high | 92 | Very high | 108 Ų | 108 | 116.4 Ų | 116.4 | 58% | 0.578 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.9 | -33.2 | 177.3 | -70.2 | -23.6 | 0 | 0 | 0 | 111.8 | C115 C116 Q117 T122 K123 | C115-D119 PolarHBondContact O-N 3Å; C116-D119 PolarHBondContact O-N 3.08Å; Q117-D119 PolarHBondContact O-N 2.78Å; D119-T122 WeakPolarHBondContact CA-OG1 3.36Å; D119-T122 PolarHBondContact O-OG1 3.03Å; D119-T122 VanDerWaalsContact O-OG1 3.1Å; D119-K123 WeakPolarHBondContact O-CB 3.38Å; D119-K123 PolarHBondContact O-N 2.94Å |
| 120 | K | 93.9 | Very high | 91.6 | Very high | 127 Ų | 127 | 116.9 Ų | 116.9 | 55% | 0.552 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -71.3 | -48.8 | 175 | -173.8 | -176.2 | 173.7 | -172.4 | 0 | 111.7 | C116 Q117 M118 T122 K123 E124 | C116-K120 PolarHBondContact O-N 2.87Å; Q117-K120 WeakPolarHBondContact O-CB 3.32Å; Q117-K120 PolarHBondContact O-N 2.88Å; M118-K120 PolarHBondContact O-N 3.12Å; K120-T122 VanDerWaalsContact C-N 3.29Å; K120-T122 PolarHBondContact O-N 3.06Å; K120-K123 PolarHBondContact O-N 2.91Å; K120-K123 VanDerWaalsContact O-N 3.13Å; K120-E124 PolarHBondContact O-N 3.16Å |
| 121 | E | 94.2 | Very high | 91.1 | Very high | 106 Ų | 106 | 117.9 Ų | 117.9 | 50% | 0.495 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -61 | -38.5 | -179.7 | -73.3 | 173.8 | -166.9 | 0 | 0 | 112.2 | Q117 M118 K123 | Q117-E121 WeakPolarHBondContact CG-OE1 3.34Å; Q117-E121 PolarHBondContact NE2-OE1 2.95Å; Q117-E121 WeakPolarHBondContact O-CG 3.29Å; Q117-E121 PolarHBondContact O-N 3.1Å; M118-E121 PolarHBondContact O-N 2.94Å; E121-K123 VanDerWaalsContact C-N 3.29Å; E121-K123 PolarHBondContact O-N 2.93Å |
| 122 | T | 90.1 | Very high | 90.6 | Very high | 92 Ų | 92 | 120.6 Ų | 120.6 | 56% | 0.564 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -71.7 | -21.7 | 177.5 | 52.3 | 0 | 0 | 0 | 0 | 113.9 | M118 D119 K120 | M118-T122 WeakPolarHBondContact O-CB 3.01Å; M118-T122 WeakPolarHBondContact O-CG2 3.35Å; M118-T122 PolarHBondContact O-N 2.97Å; M118-T122 PolarHBondContact O-OG1 3.03Å; D119-T122 WeakPolarHBondContact CA-OG1 3.36Å; D119-T122 PolarHBondContact O-OG1 3.03Å; D119-T122 VanDerWaalsContact O-OG1 3.1Å; K120-T122 VanDerWaalsContact C-N 3.29Å; K120-T122 PolarHBondContact O-N 3.06Å |
| 123 | K | 83.4 | Confident | 90 | Very high | 187 Ų | 187 | 120.1 Ų | 120.1 | 81% | 0.813 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -91.2 | -23.5 | 178.1 | -170.4 | 172.7 | 178.8 | 175.5 | 0 | 113.1 | D119 K120 E121 N125 | D119-K123 WeakPolarHBondContact O-CB 3.38Å; D119-K123 PolarHBondContact O-N 2.94Å; K120-K123 PolarHBondContact O-N 2.91Å; K120-K123 VanDerWaalsContact O-N 3.13Å; E121-K123 VanDerWaalsContact C-N 3.29Å; E121-K123 PolarHBondContact O-N 2.93Å; K123-N125 VanDerWaalsContact C-N 3.32Å |
| 124 | E | 72.5 | Confident | 89.3 | Confident | 161 Ų | 161 | 126.7 Ų | 126.7 | 75% | 0.752 | 63% | 0.628 | S | S | * | * | trans | -85.8 | -4.3 | 178.5 | -146.8 | -169 | 156.6 | 0 | 0 | 113.3 | K120 | K120-E124 PolarHBondContact O-N 3.16Š| ||
| 125 | N | 56.9 | Low | 88.5 | Confident | 197 Ų | 197 | 122.2 Ų | 122.2 | 100% | 1.053 | 62% | 0.624 | S | S | * | * | trans | -116.3 | 0 | -176.5 | -152.4 | 112.6 | 0 | 0 | 0 | 112.5 | K123 | K123-N125 VanDerWaalsContact C-N 3.32Š|
Retrieved 125 of 125 residues in 16.4 ms
(Link to these results)