| 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 | 35.3 | Very low | 42.9 | Very low | 235 Ų | 235 | 152.5 Ų | 152.5 | 100% | 1.158 | 81% | 0.812 | S | S | * | * | 0 | 116 | 0 | -70.3 | 164 | 138.3 | 0 | 0 | 106.8 | |||||
| 2 | C | 40 | Very low | 43.5 | Very low | 115 Ų | 115 | 156.2 Ų | 156.2 | 78% | 0.777 | 82% | 0.82 | S | S | * | * | trans | -120.8 | 108.2 | -178 | -65.1 | 0 | 0 | 0 | 0 | 107 | T4 | C2-T4 PolarHBondContact O-N 2.62Š| ||
| 3 | D | 33.6 | Very low | 43.5 | Very low | 162 Ų | 162 | 152.8 Ų | 152.8 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | -73.4 | 95.5 | -179.3 | -67.1 | -40.5 | 0 | 0 | 0 | 110 | R5 | D3-R5 PolarHBondContact O-N 3.43Š| ||
| 4 | T | 42.3 | Very low | 43.9 | Very low | 136 Ų | 136 | 151.3 Ų | 151.3 | 83% | 0.834 | 82% | 0.818 | S | S | * | * | trans | -78.7 | 88.1 | 177.8 | -56.4 | 0 | 0 | 0 | 0 | 109.8 | C2 | C2-T4 PolarHBondContact O-N 2.62Š| ||
| 5 | R | 43.6 | Very low | 44.2 | Very low | 210 Ų | 210 | 147.3 Ų | 147.3 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | trans | -96.5 | 93.9 | 176.9 | -170.1 | 172.6 | 179.7 | 170.1 | 0 | 111.4 | D3 L7 | D3-R5 PolarHBondContact O-N 3.43Å; R5-L7 PolarHBondContact O-N 2.9Å | ||
| 6 | A | 48.2 | Very low | 44.7 | Very low | 83 Ų | 83 | 148.9 Ų | 148.9 | 69% | 0.686 | 80% | 0.803 | S | S | * | * | trans | -66.5 | 119 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | L | 45.8 | Very low | 45.2 | Very low | 152 Ų | 152 | 149.2 Ų | 149.2 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | -100.3 | 90.8 | 174.3 | -84.4 | 149.6 | 0 | 0 | 0 | 109.2 | R5 N9 | R5-L7 PolarHBondContact O-N 2.9Å; L7-N9 PolarHBondContact O-N 3.14Å | ||
| 8 | I | 52.4 | Low | 45.4 | Very low | 139 Ų | 139 | 145.3 Ų | 145.3 | 71% | 0.713 | 78% | 0.784 | S | S | * | * | trans | -82.1 | 110.3 | 177.9 | -56.1 | 175.1 | 0 | 0 | 0 | 108.6 | T10 | I8-T10 HydrophobicContact CG2-CG2 3.65Š| ||
| 9 | N | 39.1 | Very low | 45.7 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | trans | -97.4 | 87.1 | 175.2 | -174.6 | 0 | 0 | 0 | 0 | 110.5 | L7 K11 | L7-N9 PolarHBondContact O-N 3.14Å; N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.08Å | ||
| 10 | T | 46.8 | Very low | 46.2 | Very low | 125 Ų | 125 | 144.1 Ų | 144.1 | 77% | 0.767 | 77% | 0.772 | S | S | * | * | trans | -80.1 | 61.9 | -179 | 41.9 | 0 | 0 | 0 | 0 | 113.2 | I8 Q12 | I8-T10 HydrophobicContact CG2-CG2 3.65Å; T10-Q12 VanDerWaalsContact C-N 3.35Å; T10-Q12 PolarHBondContact O-N 3.38Å | ||
| 11 | K | 45.4 | Very low | 46.8 | Very low | 179 Ų | 179 | 142.5 Ų | 142.5 | 78% | 0.778 | 76% | 0.763 | S | S | * | * | trans | -82.7 | 85 | 158.4 | -80.2 | -150.7 | 172.3 | -169.7 | 0 | 110.8 | N9 T13 | N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.08Å; K11-T13 PolarHBondContact O-N 3.03Å | ||
| 12 | Q | 49 | Very low | 47.7 | Very low | 196 Ų | 196 | 137.2 Ų | 137.2 | 92% | 0.916 | 74% | 0.738 | S | S | * | * | trans | 30.2 | 75.3 | 152.2 | -164 | 174.3 | 36 | 0 | 0 | 115.9 | T10 | T10-Q12 VanDerWaalsContact C-N 3.35Å; T10-Q12 PolarHBondContact O-N 3.38Å | ||
| 13 | T | 44.5 | Very low | 48.2 | Very low | 113 Ų | 113 | 140.3 Ų | 140.3 | 69% | 0.693 | 73% | 0.734 | S | S | * | * | trans | -119.5 | 121.9 | 156.7 | 55.2 | 0 | 0 | 0 | 0 | 107.9 | K11 D15 | K11-T13 PolarHBondContact O-N 3.03Å; T13-D15 PolarHBondContact O-N 3.35Å | ||
| 14 | S | 49.1 | Very low | 49.1 | Very low | 131 Ų | 131 | 138 Ų | 138 | 92% | 0.916 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -76.7 | 32.7 | 177.3 | 55.8 | 0 | 0 | 0 | 0 | 112.4 | ||
| 15 | D | 47.6 | Very low | 49.5 | Very low | 92 Ų | 92 | 139.1 Ų | 139.1 | 49% | 0.492 | 72% | 0.72 | S | S | . | * | trans | -153.7 | 96.4 | -161 | -145.4 | 50.1 | 0 | 0 | 0 | 107.9 | T13 H17 | T13-D15 PolarHBondContact O-N 3.35Å; D15-H17 PolarHBondContact O-N 3.27Å; D15-H17 VanDerWaalsContact O-N 3.1Å; D15-H17 IonicContact OD1-CE1 2.64Å; D15-H17 PolarHBondContact OD1-CE1 2.83Å; D15-H17 IonicContact OD1-ND1 3.52Å; D15-H17 PolarHBondContact OD1-ND1 3.28Å; D15-H17 IonicContact OD2-CE1 3.21Å; D15-H17 IonicContact OD2-CG 3.34Å; D15-H17 IonicContact OD2-ND1 2.79Å; D15-H17 PolarHBondContact OD2-ND1 3.44Å | ||
| 16 | L | 53.2 | Low | 50.1 | Low | 172 Ų | 172 | 135.8 Ų | 135.8 | 90% | 0.901 | 73% | 0.728 | S | S | * | * | trans | -76.4 | 13.4 | -173.8 | -83.1 | 158.2 | 0 | 0 | 0 | 113.5 | S18 | L16-S18 VanDerWaalsContact C-N 3.26Å; L16-S18 PolarHBondContact O-N 3.43Å; L16-S18 VanDerWaalsContact O-N 3.15Å | ||
| 17 | H | 53 | Low | 50.7 | Low | 155 Ų | 155 | 135.7 Ų | 135.7 | 72% | 0.718 | 72% | 0.716 | S | S | * | * | trans | -76.4 | 3.4 | -168.6 | -59 | 125.3 | 0 | 0 | 0 | 115.8 | D15 | D15-H17 PolarHBondContact O-N 3.27Å; D15-H17 VanDerWaalsContact O-N 3.1Å; D15-H17 IonicContact OD1-CE1 2.64Å; D15-H17 PolarHBondContact OD1-CE1 2.83Å; D15-H17 IonicContact OD1-ND1 3.52Å; D15-H17 PolarHBondContact OD1-ND1 3.28Å; D15-H17 IonicContact OD2-CE1 3.21Å; D15-H17 IonicContact OD2-CG 3.34Å; D15-H17 IonicContact OD2-ND1 2.79Å; D15-H17 PolarHBondContact OD2-ND1 3.44Å | ||
| 18 | S | 47.8 | Very low | 51.1 | Low | 78 Ų | 78 | 131.6 Ų | 131.6 | 55% | 0.545 | 71% | 0.711 | S | S | . | * | trans | -148 | 86.9 | 173.9 | 61.9 | 0 | 0 | 0 | 0 | 113.4 | L16 | L16-S18 VanDerWaalsContact C-N 3.26Å; L16-S18 PolarHBondContact O-N 3.43Å; L16-S18 VanDerWaalsContact O-N 3.15Å | ||
| 19 | C | 52.4 | Low | 51.2 | Low | 110 Ų | 110 | 133.7 Ų | 133.7 | 74% | 0.743 | 71% | 0.71 | S | S | * | * | trans | -85.4 | 111.6 | 167 | 52.5 | 0 | 0 | 0 | 0 | 110.3 | I21 | C19-I21 PolarHBondContact O-N 2.72Š| ||
| 20 | W | 54.6 | Low | 52.2 | Low | 157 Ų | 157 | 135.3 Ų | 135.3 | 60% | 0.595 | 71% | 0.713 | S | S | * | * | trans | -91.2 | 102.3 | 179.4 | -59.5 | 90.8 | 0 | 0 | 0 | 110.4 | V34 | W20-V34 HydrophobicContact CH2-CG1 4.19Å; W20-V34 HydrophobicContact CZ3-CB 4.35Å; W20-V34 HydrophobicContact CZ3-CG1 3.76Å; W20-V34 HydrophobicContact CZ3-CG2 3.86Å | ||
| 21 | I | 58.3 | Low | 52.6 | Low | 111 Ų | 111 | 139.4 Ų | 139.4 | 57% | 0.569 | 71% | 0.714 | S | S | * | * | trans | -84.8 | 113.7 | 175.1 | -53.5 | -179.7 | 0 | 0 | 0 | 109.3 | C19 Y23 | C19-I21 PolarHBondContact O-N 2.72Å; I21-Y23 HydrophobicContact CB-CE2 4.31Å; I21-Y23 HydrophobicContact CG2-CD2 4.17Å; I21-Y23 HydrophobicContact CG2-CE1 4.16Å; I21-Y23 HydrophobicContact CG2-CE2 3.57Å | ||
| 22 | I | 55.8 | Low | 52.9 | Low | 123 Ų | 123 | 136.8 Ų | 136.8 | 63% | 0.631 | 71% | 0.708 | S | S | * | * | trans | -101.2 | 113.4 | 179.1 | -55.2 | 178.1 | 0 | 0 | 0 | 109.4 | T24 | I22-T24 HydrophobicContact CG2-CG2 4.3Š| ||
| 23 | Y | 49.9 | Very low | 53.2 | Low | 180 Ų | 180 | 132.5 Ų | 132.5 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | trans | -93.3 | 102.8 | 172.9 | -63.7 | -81 | 0 | 0 | 0 | 110.8 | I21 | I21-Y23 HydrophobicContact CB-CE2 4.31Å; I21-Y23 HydrophobicContact CG2-CD2 4.17Å; I21-Y23 HydrophobicContact CG2-CE1 4.16Å; I21-Y23 HydrophobicContact CG2-CE2 3.57Å | ||
| 24 | T | 52 | Low | 53.5 | Low | 115 Ų | 115 | 130.9 Ų | 130.9 | 71% | 0.706 | 69% | 0.685 | S | S | * | * | trans | -84.8 | 110.7 | 170.4 | 48.3 | 0 | 0 | 0 | 0 | 110.2 | I22 | I22-T24 HydrophobicContact CG2-CG2 4.3Š| ||
| 25 | K | 51.1 | Low | 53.7 | Low | 159 Ų | 159 | 130.2 Ų | 130.2 | 69% | 0.691 | 68% | 0.676 | S | S | * | * | trans | -76.6 | 142.3 | 166 | -60.8 | -170.2 | 74.1 | 178.8 | 0 | 108.9 | D27 G28 | K25-D27 PolarHBondContact O-N 2.89Å; K25-G28 PolarHBondContact O-N 2.76Å | ||
| 26 | S | 56.5 | Low | 53.7 | Low | 139 Ų | 139 | 132.8 Ų | 132.8 | 97% | 0.972 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 3.4 | -177.8 | 52.9 | 0 | 0 | 0 | 0 | 115.4 | ||
| 27 | D | 59.2 | Low | 53.6 | Low | 81 Ų | 81 | 130.8 Ų | 130.8 | 43% | 0.433 | 68% | 0.684 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.5 | 4 | 176.4 | 87.1 | -34.8 | 0 | 0 | 0 | 114 | K25 R29 | K25-D27 PolarHBondContact O-N 2.89Å; D27-R29 PolarHBondContact O-N 3.03Å; D27-R29 PolarHBondContact OD1-N 3.09Å; D27-R29 IonicContact OD2-CZ 3.68Å; D27-R29 IonicContact OD2-NE 2.78Å; D27-R29 PolarHBondContact OD2-NE 3.03Å; D27-R29 IonicContact OD2-NH2 2.99Å; D27-R29 PolarHBondContact OD2-NH2 3.46Å |
| 28 | G | 55.9 | Low | 53.5 | Low | 66 Ų | 66 | 132.3 Ų | 132.3 | 68% | 0.68 | 69% | 0.689 | S | S | * | * | S | Bend | trans | 73.6 | 6.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | K25 E30 | K25-G28 PolarHBondContact O-N 2.76Å; G28-E30 PolarHBondContact O-N 2.9Å |
| 29 | R | 54.1 | Low | 53.7 | Low | 183 Ų | 183 | 134.1 Ų | 134.1 | 69% | 0.691 | 70% | 0.699 | S | S | * | * | trans | -94.7 | 93.8 | 172.7 | -77.9 | -178.8 | -75.4 | -139.7 | -8.1 | 111 | D27 R31 | D27-R29 PolarHBondContact O-N 3.03Å; D27-R29 PolarHBondContact OD1-N 3.09Å; D27-R29 IonicContact OD2-CZ 3.68Å; D27-R29 IonicContact OD2-NE 2.78Å; D27-R29 PolarHBondContact OD2-NE 3.03Å; D27-R29 IonicContact OD2-NH2 2.99Å; D27-R29 PolarHBondContact OD2-NH2 3.46Å; R29-R31 PolarHBondContact O-N 3.07Å | ||
| 30 | E | 60.2 | Low | 53.6 | Low | 176 Ų | 176 | 134.7 Ų | 134.7 | 82% | 0.822 | 70% | 0.699 | S | S | * | * | trans | -60.5 | 129.4 | 170 | -62.1 | 177.8 | -178.4 | 0 | 0 | 110.7 | G28 | G28-E30 PolarHBondContact O-N 2.9Š| ||
| 31 | R | 54.7 | Low | 53.1 | Low | 211 Ų | 211 | 134.8 Ų | 134.8 | 80% | 0.796 | 71% | 0.708 | S | S | * | * | trans | -138.3 | 105 | 169.3 | -71.2 | -170.7 | 64.7 | 151.9 | -0.1 | 109 | R29 T33 | R29-R31 PolarHBondContact O-N 3.07Å; R31-T33 PolarHBondContact O-N 3.17Å | ||
| 32 | L | 52.5 | Low | 52.7 | Low | 125 Ų | 125 | 137.2 Ų | 137.2 | 65% | 0.654 | 72% | 0.718 | S | S | * | * | trans | -70.2 | 118.9 | 171.6 | -173.2 | 67.5 | 0 | 0 | 0 | 109 | V34 | L32-V34 HydrophobicContact CD2-CG2 4.26Å; L32-V34 HydrophobicContact CG-CG2 4.18Å | ||
| 33 | T | 54 | Low | 52.4 | Low | 106 Ų | 106 | 136.2 Ų | 136.2 | 65% | 0.65 | 72% | 0.718 | S | S | * | * | trans | -109.8 | 114.3 | 171.5 | -56 | 0 | 0 | 0 | 0 | 107.6 | R31 | R31-T33 PolarHBondContact O-N 3.17Š| ||
| 34 | V | 51.8 | Low | 52.5 | Low | 78 Ų | 78 | 133.7 Ų | 133.7 | 47% | 0.473 | 72% | 0.722 | S | S | . | * | trans | -94.7 | 121.7 | 176.4 | -177.1 | 0 | 0 | 0 | 0 | 108.4 | W20 L32 | W20-V34 HydrophobicContact CH2-CG1 4.19Å; W20-V34 HydrophobicContact CZ3-CB 4.35Å; W20-V34 HydrophobicContact CZ3-CG1 3.76Å; W20-V34 HydrophobicContact CZ3-CG2 3.86Å; L32-V34 HydrophobicContact CD2-CG2 4.26Å; L32-V34 HydrophobicContact CG-CG2 4.18Å | ||
| 35 | T | 52.2 | Low | 52 | Low | 117 Ų | 117 | 134.4 Ų | 134.4 | 72% | 0.718 | 72% | 0.721 | S | S | * | * | trans | -118.7 | 100 | 171.6 | 36.3 | 0 | 0 | 0 | 0 | 108.9 | T37 | T35-T37 PolarHBondContact O-N 3.34Š| ||
| 36 | D | 47.9 | Very low | 51.8 | Low | 146 Ų | 146 | 135 Ų | 135 | 78% | 0.781 | 73% | 0.731 | S | S | * | * | trans | -67.1 | 109.2 | 170.9 | -77.7 | -24.9 | 0 | 0 | 0 | 109.9 | ||||
| 37 | T | 52.7 | Low | 51.1 | Low | 130 Ų | 130 | 133.3 Ų | 133.3 | 80% | 0.798 | 72% | 0.72 | S | S | * | * | trans | -87 | 110.8 | 165.6 | 39.8 | 0 | 0 | 0 | 0 | 109.1 | T35 | T35-T37 PolarHBondContact O-N 3.34Š| ||
| 38 | K | 49.9 | Very low | 50.5 | Low | 188 Ų | 188 | 136.9 Ų | 136.9 | 82% | 0.817 | 74% | 0.738 | S | S | * | * | trans | -74.9 | 132.7 | 173.6 | -69.9 | -178 | 178.1 | 178.6 | 0 | 109.7 | V40 | K38-V40 PolarHBondContact O-N 3.12Š| ||
| 39 | P | 52.2 | Low | 50 | Low | 116 Ų | 116 | 140.9 Ų | 140.9 | 75% | 0.753 | 74% | 0.744 | S | S | * | * | trans | -66.2 | 132.3 | 175.4 | 27 | -33.6 | 0 | 0 | 0 | 110.6 | M41 | P39-M41 PolarHBondContact O-N 3.17Š| ||
| 40 | V | 49.2 | Very low | 49.8 | Very low | 121 Ų | 121 | 139.4 Ų | 139.4 | 73% | 0.733 | 75% | 0.75 | S | S | * | * | trans | -80.1 | 100 | 169.6 | 177.6 | 0 | 0 | 0 | 0 | 107.8 | K38 M42 | K38-V40 PolarHBondContact O-N 3.12Å; V40-M42 HydrophobicContact CG1-CE 4.22Å; V40-M42 HydrophobicContact CG1-SD 4.47Å; V40-M42 PolarHBondContact O-N 2.85Å | ||
| 41 | M | 45.1 | Very low | 48.6 | Very low | 160 Ų | 160 | 134.3 Ų | 134.3 | 79% | 0.788 | 75% | 0.745 | S | S | * | * | trans | -77.1 | 102.6 | 167.8 | -64.1 | -157.7 | -56.1 | 0 | 0 | 108.8 | P39 T43 | P39-M41 PolarHBondContact O-N 3.17Å; M41-T43 PolarHBondContact O-N 2.88Å | ||
| 42 | M | 49.7 | Very low | 47.7 | Very low | 161 Ų | 161 | 127.6 Ų | 127.6 | 79% | 0.793 | 74% | 0.741 | S | S | * | * | trans | -65.7 | 100.2 | 165.9 | -72.3 | -67.1 | -177.3 | 0 | 0 | 108.7 | V40 T44 | V40-M42 HydrophobicContact CG1-CE 4.22Å; V40-M42 HydrophobicContact CG1-SD 4.47Å; V40-M42 PolarHBondContact O-N 2.85Å; M42-T44 PolarHBondContact O-N 2.96Å | ||
| 43 | T | 49.2 | Very low | 46.9 | Very low | 103 Ų | 103 | 129 Ų | 129 | 63% | 0.632 | 75% | 0.748 | S | S | * | * | trans | -78.2 | 99.6 | 170.9 | 46.7 | 0 | 0 | 0 | 0 | 109.2 | M41 D45 | M41-T43 PolarHBondContact O-N 2.88Å; T43-D45 VanDerWaalsContact C-N 3.28Å; T43-D45 PolarHBondContact O-N 2.84Å | ||
| 44 | T | 52.8 | Low | 45.9 | Very low | 127 Ų | 127 | 132 Ų | 132 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | trans | -73.3 | 85.4 | 167.3 | 1.1 | 0 | 0 | 0 | 0 | 109.1 | M42 L46 | M42-T44 PolarHBondContact O-N 2.96Å; T44-L46 VanDerWaalsContact C-N 3.34Å; T44-L46 PolarHBondContact O-N 3.42Å | ||
| 45 | D | 40.3 | Very low | 45.2 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 70% | 0.695 | 77% | 0.766 | S | S | * | * | trans | -66.4 | 90.9 | 173.9 | -74 | -40.4 | 0 | 0 | 0 | 110.2 | T43 S47 | T43-D45 VanDerWaalsContact C-N 3.28Å; T43-D45 PolarHBondContact O-N 2.84Å; D45-S47 PolarHBondContact O-N 2.8Å | ||
| 46 | L | 48.5 | Very low | 44.4 | Very low | 170 Ų | 170 | 135.6 Ų | 135.6 | 89% | 0.89 | 77% | 0.772 | S | S | * | * | trans | -65.8 | 75.6 | 169.7 | -82.7 | 141.3 | 0 | 0 | 0 | 110.4 | T44 N48 | T44-L46 VanDerWaalsContact C-N 3.34Å; T44-L46 PolarHBondContact O-N 3.42Å; L46-N48 PolarHBondContact O-N 3.17Å | ||
| 47 | S | 41.4 | Very low | 44 | Very low | 105 Ų | 105 | 133.7 Ų | 133.7 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -68.2 | 98.4 | 174.8 | -71.6 | 0 | 0 | 0 | 0 | 110.2 | D45 N49 | D45-S47 PolarHBondContact O-N 2.8Å; S47-N49 PolarHBondContact O-N 3.16Å | ||
| 48 | N | 46.2 | Very low | 43.4 | Very low | 155 Ų | 155 | 135.5 Ų | 135.5 | 83% | 0.829 | 78% | 0.775 | S | S | * | * | trans | -54 | 105.1 | 170 | 172.9 | 31.7 | 0 | 0 | 0 | 110.9 | L46 | L46-N48 PolarHBondContact O-N 3.17Š| ||
| 49 | N | 44.6 | Very low | 42.5 | Very low | 150 Ų | 150 | 129.6 Ų | 129.6 | 80% | 0.802 | 77% | 0.768 | S | S | * | * | trans | -115.6 | 98.9 | 178 | -158.6 | 7.5 | 0 | 0 | 0 | 111.2 | S47 G51 | S47-N49 PolarHBondContact O-N 3.16Å; N49-G51 PolarHBondContact O-N 3Å | ||
| 50 | N | 50.3 | Low | 41.7 | Very low | 153 Ų | 153 | 132 Ų | 132 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -74.1 | 87.4 | 174.5 | 177.3 | 28.3 | 0 | 0 | 0 | 110.4 | ||||
| 51 | G | 35.2 | Very low | 41.1 | Very low | 68 Ų | 68 | 133.6 Ų | 133.6 | 70% | 0.701 | 78% | 0.777 | S | S | * | * | trans | -120.6 | 76.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | N49 | N49-G51 PolarHBondContact O-N 3Š| ||
| 52 | G | 36.4 | Very low | 40.8 | Very low | 70 Ų | 70 | 131 Ų | 131 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | -78.2 | 124.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 53 | I | 35.7 | Very low | 40 | Very low | 156 Ų | 156 | 132.1 Ų | 132.1 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | trans | -146.9 | 129.8 | 159 | -89 | -156.7 | 0 | 0 | 0 | 111.2 | ||||
| 54 | H | 32.2 | Very low | 39.3 | Very low | 169 Ų | 169 | 131.2 Ų | 131.2 | 78% | 0.782 | 78% | 0.78 | S | S | * | * | trans | 59.1 | 124 | 155.6 | -82.6 | -107.5 | 0 | 0 | 0 | 122.8 | ||||
| 55 | A | 37.2 | Very low | 38.5 | Very low | 86 Ų | 86 | 133.4 Ų | 133.4 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -72.7 | 147.4 | 167 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 56 | H | 35.8 | Very low | 38 | Very low | 184 Ų | 184 | 130.4 Ų | 130.4 | 85% | 0.852 | 79% | 0.787 | S | S | * | * | trans | -129.3 | 129.7 | 144.8 | -79.5 | -78 | 0 | 0 | 0 | 109.9 | ||||
| 57 | S | 38.9 | Very low | 37.2 | Very low | 105 Ų | 105 | 134.7 Ų | 134.7 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | trans | -75.5 | 143.1 | -179.4 | 51.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 58 | N | 39.7 | Very low | 36.8 | Very low | 168 Ų | 168 | 139 Ų | 139 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | trans | -152.7 | 130.8 | 133.9 | -91.7 | -28.8 | 0 | 0 | 0 | 108.4 | ||||
| 59 | G | 32.5 | Very low | 36.2 | Very low | 65 Ų | 65 | 136.5 Ų | 136.5 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | trans | -112.3 | -162.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 60 | L | 34.8 | Very low | 35.6 | Very low | 167 Ų | 167 | 140.1 Ų | 140.1 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | 78.9 | 126.4 | -176.4 | -60.4 | 158.2 | 0 | 0 | 0 | 112.7 | ||||
| 61 | L | 37 | Very low | 34.6 | Very low | 153 Ų | 153 | 138.8 Ų | 138.8 | 80% | 0.801 | 80% | 0.796 | S | S | * | * | cis | -139.3 | 142.4 | 5.9 | -96.5 | 143 | 0 | 0 | 0 | 111.9 | ||||
| 62 | S | 37.5 | Very low | 34.8 | Very low | 105 Ų | 105 | 144.6 Ų | 144.6 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | trans | -86.8 | 139.5 | 167.3 | 39.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 63 | H | 33.2 | Very low | 34.6 | Very low | 186 Ų | 186 | 149.3 Ų | 149.3 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | trans | -135.8 | 105.9 | 153.4 | -109.5 | -88.8 | 0 | 0 | 0 | 108.9 | ||||
| 64 | A | 34.5 | Very low | 34.9 | Very low | 84 Ų | 84 | 149.8 Ų | 149.8 | 69% | 0.694 | 81% | 0.811 | S | S | * | * | trans | -96.9 | 144.2 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 65 | N | 36.4 | Very low | 34.8 | Very low | 173 Ų | 173 | 148.6 Ų | 148.6 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | trans | 165.7 | 138.3 | 157.1 | -84.6 | -18.1 | 0 | 0 | 0 | 105.8 | ||||
| 66 | G | 29.4 | Very low | 34.9 | Very low | 67 Ų | 67 | 153.9 Ų | 153.9 | 69% | 0.691 | 82% | 0.816 | S | S | * | * | cis | -166.9 | 163 | -4.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 67 | W | 32.5 | Very low | 34.7 | Very low | 260 Ų | 260 | 152.3 Ų | 152.3 | 99% | 0.985 | 81% | 0.809 | S | S | * | * | trans | -76.6 | 129.1 | -176.5 | -71.2 | 43.4 | 0 | 0 | 0 | 111.2 | ||||
| 68 | Q | 32.2 | Very low | 35 | Very low | 195 Ų | 195 | 155.2 Ų | 155.2 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | trans | -153.4 | 116.6 | 152.5 | -137.6 | 159.4 | -9.4 | 0 | 0 | 111.5 | ||||
| 69 | A | 34.3 | Very low | 34.6 | Very low | 102 Ų | 102 | 154.2 Ų | 154.2 | 84% | 0.843 | 80% | 0.801 | S | S | * | * | trans | -81.8 | 134.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 70 | R | 31.5 | Very low | 34.8 | Very low | 227 Ų | 227 | 159 Ų | 159 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | trans | -157.3 | 136.7 | 148.8 | -153.2 | 167.3 | -177.5 | 163.9 | -2.9 | 113.2 | ||||
| 71 | D | 29.1 | Very low | 35.1 | Very low | 124 Ų | 124 | 158.4 Ų | 158.4 | 66% | 0.663 | 80% | 0.798 | S | S | * | * | trans | -18.9 | 144.6 | 166.1 | -40.4 | -49 | 0 | 0 | 0 | 119.9 | ||||
| 72 | E | 39.9 | Very low | 35.2 | Very low | 191 Ų | 191 | 158.7 Ų | 158.7 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | trans | 46.6 | 101.3 | 141.3 | -61.6 | -178.4 | 139.5 | 0 | 0 | 120 | ||||
| 73 | E | 31.5 | Very low | 35.5 | Very low | 168 Ų | 168 | 161 Ų | 161 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | -150 | 135.7 | 130 | -140.3 | 175.7 | 131.6 | 0 | 0 | 111.7 | Q75 | E73-Q75 PolarHBondContact O-N 3.33Š| |||
| 74 | L | 42.1 | Very low | 36 | Very low | 167 Ų | 167 | 157.2 Ų | 157.2 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -78.5 | 111.9 | 171.8 | -75.7 | 159 | 0 | 0 | 0 | 108.8 | ||||
| 75 | Q | 31.6 | Very low | 36.6 | Very low | 144 Ų | 144 | 160.5 Ų | 160.5 | 67% | 0.673 | 79% | 0.794 | S | S | * | * | trans | -127.2 | 99.8 | 159.9 | -81 | 178.4 | 24.2 | 0 | 0 | 109.4 | E73 Q77 | E73-Q75 PolarHBondContact O-N 3.33Å; Q75-Q77 PolarHBondContact O-N 3.28Å | ||
| 76 | E | 37.6 | Very low | 37.2 | Very low | 196 Ų | 196 | 156.2 Ų | 156.2 | 92% | 0.916 | 78% | 0.777 | S | S | * | * | trans | -55.8 | 114.2 | 159.6 | -65 | 167.2 | 136.4 | 0 | 0 | 107 | ||||
| 77 | Q | 32.9 | Very low | 38 | Very low | 152 Ų | 152 | 160.2 Ų | 160.2 | 71% | 0.71 | 78% | 0.782 | S | S | * | * | trans | -117.5 | 98.2 | 175.8 | -162.1 | 155.8 | 93.6 | 0 | 0 | 107.7 | Q75 H79 | Q75-Q77 PolarHBondContact O-N 3.28Å; Q77-H79 PolarHBondContact O-N 2.91Å | ||
| 78 | E | 44.3 | Very low | 38.8 | Very low | 165 Ų | 165 | 155.1 Ų | 155.1 | 77% | 0.771 | 77% | 0.774 | S | S | * | * | trans | -46.1 | 109.6 | 178.9 | -64.2 | 160.6 | 161.3 | 0 | 0 | 110.1 | ||||
| 79 | H | 32.2 | Very low | 40 | Very low | 148 Ų | 148 | 150.2 Ų | 150.2 | 69% | 0.685 | 76% | 0.757 | S | S | * | * | trans | -109.6 | 57.7 | 161.3 | -105.2 | 99.3 | 0 | 0 | 0 | 108.4 | Q77 Q81 | Q77-H79 PolarHBondContact O-N 2.91Å; H79-Q81 PolarHBondContact O-N 3.19Å | ||
| 80 | E | 35.9 | Very low | 40.4 | Very low | 166 Ų | 166 | 152.9 Ų | 152.9 | 78% | 0.776 | 76% | 0.757 | S | S | * | * | trans | -67.7 | 78.4 | 158.3 | -62.5 | -168.7 | -140.4 | 0 | 0 | 107.4 | E82 | E80-E82 PolarHBondContact O-N 3.45Š| ||
| 81 | Q | 41 | Very low | 41.3 | Very low | 153 Ų | 153 | 147.7 Ų | 147.7 | 72% | 0.715 | 75% | 0.751 | S | S | * | * | trans | -70.7 | 81.6 | 160.2 | -81.1 | 176 | 13.9 | 0 | 0 | 107.1 | H79 I83 | H79-Q81 PolarHBondContact O-N 3.19Å; Q81-I83 VanDerWaalsContact C-N 3.3Å; Q81-I83 PolarHBondContact O-N 3.49Å | ||
| 82 | E | 40.2 | Very low | 42 | Very low | 160 Ų | 160 | 146.9 Ų | 146.9 | 75% | 0.748 | 75% | 0.746 | S | S | * | * | trans | -29 | 93.4 | 152.6 | -171.6 | 173.6 | -145.3 | 0 | 0 | 109.5 | E80 V84 | E80-E82 PolarHBondContact O-N 3.45Å; E82-V84 HydrophobicContact CG-CG1 4.27Å; E82-V84 PolarHBondContact O-N 3.23Å | ||
| 83 | I | 44.1 | Very low | 42.7 | Very low | 153 Ų | 153 | 143 Ų | 143 | 79% | 0.785 | 74% | 0.737 | S | S | * | * | trans | -67.9 | 95.5 | 165.3 | -61.7 | 176.7 | 0 | 0 | 0 | 103.9 | Q81 N85 | Q81-I83 VanDerWaalsContact C-N 3.3Å; Q81-I83 PolarHBondContact O-N 3.49Å; I83-N85 PolarHBondContact O-N 3.48Å | ||
| 84 | V | 43.7 | Very low | 43.3 | Very low | 107 Ų | 107 | 141.8 Ų | 141.8 | 65% | 0.648 | 74% | 0.736 | S | S | * | * | trans | -56.4 | 83.7 | 178.6 | -82.5 | 0 | 0 | 0 | 0 | 110.5 | E82 S86 | E82-V84 HydrophobicContact CG-CG1 4.27Å; E82-V84 PolarHBondContact O-N 3.23Å; V84-S86 PolarHBondContact O-N 3.37Å | ||
| 85 | N | 47.1 | Very low | 44 | Very low | 152 Ų | 152 | 142.5 Ų | 142.5 | 81% | 0.813 | 74% | 0.735 | S | S | * | * | trans | -94.5 | 40.2 | 176.2 | -156.7 | 88.9 | 0 | 0 | 0 | 110 | I83 | I83-N85 PolarHBondContact O-N 3.48Š| ||
| 86 | S | 48.1 | Very low | 45.5 | Very low | 83 Ų | 83 | 140.2 Ų | 140.2 | 58% | 0.58 | 73% | 0.728 | S | S | * | * | trans | -135.7 | 52.1 | -174.2 | 44.7 | 0 | 0 | 0 | 0 | 109.8 | V84 D88 | V84-S86 PolarHBondContact O-N 3.37Å; S86-D88 VanDerWaalsContact C-N 3.32Å | ||
| 87 | L | 47.3 | Very low | 46.3 | Very low | 152 Ų | 152 | 138.7 Ų | 138.7 | 80% | 0.796 | 72% | 0.721 | S | S | * | * | trans | -98.9 | 65.6 | 152.9 | -156.6 | 82.7 | 0 | 0 | 0 | 108.4 | V89 | L87-V89 HydrophobicContact CD1-CG2 4.5Å; L87-V89 HydrophobicContact CD2-CG2 3.53Å; L87-V89 HydrophobicContact CG-CG2 3.58Å; L87-V89 PolarHBondContact O-N 3.2Å | ||
| 88 | D | 48.2 | Very low | 47.2 | Very low | 153 Ų | 153 | 136.7 Ų | 136.7 | 82% | 0.818 | 72% | 0.715 | S | S | * | * | trans | -65.2 | 82.6 | 157.8 | -76.3 | -57.7 | 0 | 0 | 0 | 107.1 | S86 D90 | S86-D88 VanDerWaalsContact C-N 3.32Å; D88-D90 PolarHBondContact O-N 3.1Å | ||
| 89 | V | 57 | Low | 47.2 | Very low | 91 Ų | 91 | 133.9 Ų | 133.9 | 55% | 0.552 | 71% | 0.705 | S | S | * | * | trans | -75.1 | 115.6 | 161.5 | -172.7 | 0 | 0 | 0 | 0 | 105.8 | L87 V91 | L87-V89 HydrophobicContact CD1-CG2 4.5Å; L87-V89 HydrophobicContact CD2-CG2 3.53Å; L87-V89 HydrophobicContact CG-CG2 3.58Å; L87-V89 PolarHBondContact O-N 3.2Å; V89-V91 VanDerWaalsContact C-N 3.32Å; V89-V91 PolarHBondContact O-N 3.34Å | ||
| 90 | D | 43.3 | Very low | 48.1 | Very low | 158 Ų | 158 | 129.8 Ų | 129.8 | 85% | 0.845 | 70% | 0.703 | S | S | * | * | trans | -58.1 | 100 | 160.8 | -73.8 | -63.7 | 0 | 0 | 0 | 107.6 | D88 D92 | D88-D90 PolarHBondContact O-N 3.1Å; D90-D92 VanDerWaalsContact C-N 3.29Å; D90-D92 PolarHBondContact O-N 3.11Å | ||
| 91 | V | 51 | Low | 49 | Very low | 119 Ų | 119 | 124.9 Ų | 124.9 | 72% | 0.721 | 68% | 0.684 | S | S | * | * | trans | -72.6 | 88.7 | 177.1 | 177.7 | 0 | 0 | 0 | 0 | 108.1 | V89 P93 | V89-V91 VanDerWaalsContact C-N 3.32Å; V89-V91 PolarHBondContact O-N 3.34Å; V91-P93 WeakPolarHBondContact O-CD 3.14Å | ||
| 92 | D | 42.3 | Very low | 49.6 | Very low | 107 Ų | 107 | 119.8 Ų | 119.8 | 57% | 0.572 | 66% | 0.66 | S | S | * | * | trans | -68.6 | 114.7 | 161.5 | -159.1 | -21.3 | 0 | 0 | 0 | 107.5 | D90 D94 | D90-D92 VanDerWaalsContact C-N 3.29Å; D90-D92 PolarHBondContact O-N 3.11Å; D92-D94 PolarHBondContact O-N 2.87Å | ||
| 93 | P | 54.4 | Low | 50.4 | Low | 108 Ų | 108 | 118.3 Ų | 118.3 | 70% | 0.701 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | -0.6 | -169.9 | 29.6 | -37 | 0 | 0 | 0 | 114.5 | V91 | V91-P93 WeakPolarHBondContact O-CD 3.14Š|
| 94 | D | 45.2 | Very low | 51.5 | Low | 143 Ų | 143 | 114.1 Ų | 114.1 | 77% | 0.765 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.2 | -3.3 | -173.8 | -70 | -34.3 | 0 | 0 | 0 | 114.6 | D92 D96 | D92-D94 PolarHBondContact O-N 2.87Å; D94-D96 VanDerWaalsContact C-N 3.27Å; D94-D96 PolarHBondContact O-N 3.32Å |
| 95 | E | 55.5 | Low | 52.7 | Low | 182 Ų | 182 | 112 Ų | 112 | 85% | 0.85 | 62% | 0.622 | S | S | * | * | trans | -83.2 | 62.1 | 174.1 | -69.4 | -145.6 | 156.8 | 0 | 0 | 113.4 | ||||
| 96 | D | 64.9 | Low | 54 | Low | 96 Ų | 96 | 105.3 Ų | 105.3 | 51% | 0.513 | 59% | 0.588 | S | S | . | * | trans | -101.1 | 70.5 | 169.4 | -174.5 | 2.4 | 0 | 0 | 0 | 110.9 | D94 R130 | D94-D96 VanDerWaalsContact C-N 3.27Å; D94-D96 PolarHBondContact O-N 3.32Å; D96-R130 PolarHBondContact O-NH2 2.64Å; D96-R130 VanDerWaalsContact O-NH2 3.09Å; D96-R130 IonicContact OD1-CZ 2.72Å; D96-R130 IonicContact OD1-NE 2.82Å; D96-R130 IonicContact OD1-NH2 2.89Å; D96-R130 PolarHBondContact OD1-NH2 3.21Å; D96-R130 IonicContact OD2-CZ 2.64Å; D96-R130 IonicContact OD2-NE 3.2Å; D96-R130 PolarHBondContact OD2-NE 2.87Å; D96-R130 IonicContact OD2-NH2 2.72Å; D96-R130 PolarHBondContact OD2-NH2 2.89Å | ||
| 97 | E | 53.7 | Low | 55.7 | Low | 164 Ų | 164 | 107.9 Ų | 107.9 | 77% | 0.766 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -165.9 | 120 | 154.4 | -115.6 | 167.5 | -132.9 | 0 | 0 | 115.6 | ||
| 98 | N | 52.3 | Low | 57.6 | Low | 110 Ų | 110 | 106 Ų | 106 | 59% | 0.588 | 58% | 0.581 | S | S | * | * | trans | 61.3 | 71.6 | 142 | -171.1 | 86.7 | 0 | 0 | 0 | 117.3 | ||||
| 99 | D | 44.4 | Very low | 59.5 | Low | 107 Ų | 107 | 99.5 Ų | 99.5 | 57% | 0.572 | 55% | 0.545 | S | S | * | . | trans | -68.5 | 134.1 | 131.5 | 179.7 | 29.3 | 0 | 0 | 0 | 108 | T101 E102 | D99-T101 VanDerWaalsContact CG-OG1 3.3Å; D99-T101 PolarHBondContact O-N 2.97Å; D99-T101 PolarHBondContact OD1-OG1 2.83Å; D99-T101 WeakPolarHBondContact OD2-CB 3.36Å; D99-T101 PolarHBondContact OD2-OG1 3.28Å; D99-E102 PolarHBondContact O-N 2.89Å; D99-E102 VanDerWaalsContact O-N 3.14Å | ||
| 100 | G | 49.5 | Very low | 61.1 | Low | 61 Ų | 61 | 100.8 Ų | 100.8 | 63% | 0.629 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -6 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 101 | T | 55.8 | Low | 63.3 | Low | 63 Ų | 63 | 98.4 Ų | 98.4 | 39% | 0.387 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -19.5 | 178.9 | -38.2 | 0 | 0 | 0 | 0 | 113.4 | D99 Q103 S104 L105 | D99-T101 VanDerWaalsContact CG-OG1 3.3Å; D99-T101 PolarHBondContact O-N 2.97Å; D99-T101 PolarHBondContact OD1-OG1 2.83Å; D99-T101 WeakPolarHBondContact OD2-CB 3.36Å; D99-T101 PolarHBondContact OD2-OG1 3.28Å; T101-Q103 PolarHBondContact O-N 3.45Å; T101-S104 WeakPolarHBondContact O-CA 3.46Å; T101-S104 WeakPolarHBondContact O-CB 3.22Å; T101-S104 PolarHBondContact O-N 3.5Å; T101-L105 HydrophobicContact CG2-CD1 4.45Å; T101-L105 HydrophobicContact CG2-CG 4.31Å; T101-L105 PolarHBondContact O-N 3.08Å; T101-L105 VanDerWaalsContact O-N 3.08Å |
| 102 | E | 52.7 | Low | 65.1 | Low | 46 Ų | 46 | 101.9 Ų | 101.9 | 22% | 0.215 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -70.7 | -28.5 | -170.1 | -65.9 | -151.5 | 134.1 | 0 | 0 | 115.2 | D99 S104 R133 K137 | D99-E102 PolarHBondContact O-N 2.89Å; D99-E102 VanDerWaalsContact O-N 3.14Å; E102-S104 VanDerWaalsContact C-N 3.32Å; E102-R133 IonicContact OE2-CZ 3.99Å; E102-R133 IonicContact OE2-NH1 2.83Å; E102-R133 PolarHBondContact OE2-NH1 3.38Å; E102-K137 IonicContact OE1-NZ 3.21Å; E102-K137 PolarHBondContact OE1-NZ 2.76Å |
| 103 | Q | 57 | Low | 67.4 | Low | 130 Ų | 130 | 100.9 Ų | 100.9 | 61% | 0.607 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.9 | -41.1 | 169.7 | -64.5 | -179 | 17.5 | 0 | 0 | 110.1 | T101 L105 A106 E107 | T101-Q103 PolarHBondContact O-N 3.45Å; Q103-L105 VanDerWaalsContact C-N 3.34Å; Q103-L105 PolarHBondContact O-N 3.49Å; Q103-A106 PolarHBondContact O-N 2.96Å; Q103-E107 WeakPolarHBondContact O-CB 3.4Å; Q103-E107 PolarHBondContact O-N 3.4Å; Q103-E107 VanDerWaalsContact O-N 3.17Å |
| 104 | S | 67.6 | Low | 69.2 | Low | 64 Ų | 64 | 99 Ų | 99 | 45% | 0.448 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.2 | -32 | 180 | -167.3 | 0 | 0 | 0 | 0 | 113.5 | T101 E102 | T101-S104 WeakPolarHBondContact O-CA 3.46Å; T101-S104 WeakPolarHBondContact O-CB 3.22Å; T101-S104 PolarHBondContact O-N 3.5Å; E102-S104 VanDerWaalsContact C-N 3.32Å |
| 105 | L | 69.1 | Low | 71.4 | Confident | 63 Ų | 63 | 93.1 Ų | 93.1 | 33% | 0.33 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -77.4 | -32.2 | -179.8 | -70.8 | 172 | 0 | 0 | 0 | 113.7 | T101 Q103 I108 L140 | T101-L105 HydrophobicContact CG2-CD1 4.45Å; T101-L105 HydrophobicContact CG2-CG 4.31Å; T101-L105 PolarHBondContact O-N 3.08Å; T101-L105 VanDerWaalsContact O-N 3.08Å; Q103-L105 VanDerWaalsContact C-N 3.34Å; Q103-L105 PolarHBondContact O-N 3.49Å; L105-I108 VanDerWaalsContact O-CG1 3.25Å; L105-I108 WeakPolarHBondContact O-CG1 3.25Å; L105-L140 HydrophobicContact CB-CD2 4.23Å; L105-L140 HydrophobicContact CD2-CD2 3.93Å |
| 106 | A | 74.5 | Confident | 73 | Confident | 11 Ų | 11 | 92.2 Ų | 92.2 | 9% | 0.091 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -75 | -32.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q103 I108 L109 | Q103-A106 PolarHBondContact O-N 2.96Å; A106-I108 VanDerWaalsContact C-N 3.28Å; A106-I108 PolarHBondContact O-N 3.24Å; A106-L109 WeakPolarHBondContact O-CB 3.44Å; A106-L109 PolarHBondContact O-N 2.93Å |
| 107 | E | 83.3 | Confident | 74.2 | Confident | 138 Ų | 138 | 93 Ų | 93 | 65% | 0.645 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -72 | -16 | -175.7 | -164.7 | 168 | -143.8 | 0 | 0 | 114 | Q103 Q114 | Q103-E107 WeakPolarHBondContact O-CB 3.4Å; Q103-E107 PolarHBondContact O-N 3.4Å; Q103-E107 VanDerWaalsContact O-N 3.17Å; E107-Q114 PolarHBondContact O-NE2 3.47Å; E107-Q114 VanDerWaalsContact O-NE2 3.12Å |
| 108 | I | 87.4 | Confident | 76 | Confident | 113 Ų | 113 | 87.3 Ų | 87.3 | 58% | 0.579 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | -7.6 | 171.3 | 61.5 | 165.1 | 0 | 0 | 0 | 114.4 | L105 A106 L140 | L105-I108 VanDerWaalsContact O-CG1 3.25Å; L105-I108 WeakPolarHBondContact O-CG1 3.25Å; A106-I108 VanDerWaalsContact C-N 3.28Å; A106-I108 PolarHBondContact O-N 3.24Å; I108-L140 HydrophobicContact CD1-CD1 3.93Å; I108-L140 HydrophobicContact CD1-CD2 3.76Å; I108-L140 HydrophobicContact CG1-CD1 4.39Å; I108-L140 HydrophobicContact CG1-CD2 4.18Å |
| 109 | L | 88.3 | Confident | 77.9 | Confident | 15 Ų | 15 | 87.2 Ų | 87.2 | 8% | 0.079 | 48% | 0.478 | C | S | . | . | S | Bend | trans | -72.5 | 154.9 | 169.5 | -62.7 | -179.4 | 0 | 0 | 0 | 110.6 | A106 L113 Q114 A136 Y139 L140 | A106-L109 WeakPolarHBondContact O-CB 3.44Å; A106-L109 PolarHBondContact O-N 2.93Å; L109-L113 HydrophobicContact CB-CB 4.29Å; L109-Q114 HydrophobicContact CB-CG 4.29Å; L109-Q114 PolarHBondContact O-NE2 3Å; L109-A136 HydrophobicContact CD1-CB 3.7Å; L109-Y139 HydrophobicContact CD1-CD1 4.3Å; L109-Y139 HydrophobicContact CD2-CD1 3.69Å; L109-Y139 HydrophobicContact CD2-CE1 3.89Å; L109-L140 HydrophobicContact CD2-CB 4.16Å; L109-L140 HydrophobicContact CD2-CD1 4.09Å |
| 110 | D | 90.8 | Very high | 80.1 | Confident | 119 Ų | 119 | 87.3 Ų | 87.3 | 64% | 0.636 | 49% | 0.485 | S | S | * | . | trans | -53.1 | 140.7 | 170.5 | -80.1 | -29.7 | 0 | 0 | 0 | 110.5 | E112 L113 Q114 | D110-E112 PolarHBondContact O-N 3.41Å; D110-L113 HydrophobicContact CB-CD1 4.42Å; D110-L113 PolarHBondContact O-N 3.48Å; D110-Q114 PolarHBondContact O-N 2.92Å | ||
| 111 | P | 89.3 | Confident | 82 | Confident | 107 Ų | 107 | 92.3 Ų | 92.3 | 70% | 0.695 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -24.2 | -173.9 | -29.2 | 35.9 | 0 | 0 | 0 | 115.7 | L113 | P111-L113 VanDerWaalsContact C-N 3.31Š|
| 112 | E | 89.7 | Confident | 83.8 | Confident | 193 Ų | 193 | 92.1 Ų | 92.1 | 90% | 0.902 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -14.9 | 176.4 | -59.7 | -171.5 | 168.7 | 0 | 0 | 113.6 | D110 | D110-E112 PolarHBondContact O-N 3.41Š|
| 113 | L | 89.6 | Confident | 85.7 | Confident | 85 Ų | 85 | 93.6 Ų | 93.6 | 45% | 0.445 | 51% | 0.514 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | -2.1 | 178.8 | -60.4 | 177.1 | 0 | 0 | 0 | 112.9 | L109 D110 P111 Y139 | L109-L113 HydrophobicContact CB-CB 4.29Å; D110-L113 HydrophobicContact CB-CD1 4.42Å; D110-L113 PolarHBondContact O-N 3.48Å; P111-L113 VanDerWaalsContact C-N 3.31Å; L113-Y139 HydrophobicContact CD1-CE1 3.83Å |
| 114 | Q | 92.2 | Very high | 87.4 | Confident | 69 Ų | 69 | 94 Ų | 94 | 32% | 0.322 | 52% | 0.516 | S | S | . | . | S | Bend | trans | -77.5 | 140.9 | 179.2 | -63.4 | -172.6 | 3.2 | 0 | 0 | 111.2 | E107 L109 D110 E116 | E107-Q114 PolarHBondContact O-NE2 3.47Å; E107-Q114 VanDerWaalsContact O-NE2 3.12Å; L109-Q114 HydrophobicContact CB-CG 4.29Å; L109-Q114 PolarHBondContact O-NE2 3Å; D110-Q114 PolarHBondContact O-N 2.92Å; Q114-E116 PolarHBondContact O-N 3.3Å |
| 115 | P | 91.4 | Very high | 88.7 | Confident | 20 Ų | 20 | 91.9 Ų | 91.9 | 13% | 0.13 | 50% | 0.501 | C | S | . | . | P | Polyproline II helix | trans | -60.3 | 122.7 | 175.9 | -24.5 | 34.4 | 0 | 0 | 0 | 112.6 | Y129 H132 R133 A136 | P115-Y129 HydrophobicContact CB-CD2 3.98Å; P115-Y129 HydrophobicContact CB-CE2 3.84Å; P115-H132 HydrophobicContact CB-CB 3.93Å; P115-H132 HydrophobicContact CG-CB 4.3Å; P115-R133 HydrophobicContact CG-CG 4.39Å; P115-A136 HydrophobicContact CG-CB 3.94Å |
| 116 | E | 90.1 | Very high | 89.8 | Confident | 163 Ų | 163 | 93.5 Ų | 93.5 | 76% | 0.762 | 51% | 0.507 | S | S | * | . | P | Polyproline II helix | trans | -59.9 | 134.7 | 175.6 | -68.7 | -170.3 | 177.5 | 0 | 0 | 111.5 | Q114 Y129 | Q114-E116 PolarHBondContact O-N 3.3Å; E116-Y129 WeakPolarHBondContact O-CD2 3.39Å |
| 117 | P | 89.1 | Confident | 90.6 | Very high | 113 Ų | 113 | 98.8 Ų | 98.8 | 73% | 0.734 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -57.4 | 139.3 | 179.5 | -26.3 | 34.7 | 0 | 0 | 0 | 113.2 | ||
| 118 | P | 92.5 | Very high | 91.1 | Very high | 44 Ų | 44 | 95.7 Ų | 95.7 | 29% | 0.286 | 52% | 0.52 | S | S | . | . | P | Polyproline II helix | trans | -69.7 | 147.5 | -174.8 | 27.7 | -33.1 | 0 | 0 | 0 | 112.4 | P120 S125 Q126 Y129 | P118-P120 WeakPolarHBondContact O-CD 3.39Å; P118-S125 WeakPolarHBondContact CA-OG 3.16Å; P118-Q126 HydrophobicContact CB-CG 4.15Å; P118-Y129 HydrophobicContact CB-CD1 4.46Å; P118-Y129 HydrophobicContact CB-CG 4.15Å; P118-Y129 HydrophobicContact CG-CD1 3.85Å; P118-Y129 HydrophobicContact CG-CE1 4.37Å; P118-Y129 HydrophobicContact CG-CG 3.92Å |
| 119 | I | 92.1 | Very high | 91.4 | Very high | 108 Ų | 108 | 93.7 Ų | 93.7 | 55% | 0.554 | 51% | 0.506 | S | S | * | . | P | Polyproline II helix | trans | -69.2 | 124 | 175.1 | -61.8 | 168.3 | 0 | 0 | 0 | 109.2 | N121 D122 S125 | I119-N121 PolarHBondContact O-N 3.03Å; I119-D122 HydrophobicContact CB-CB 4.28Å; I119-D122 HydrophobicContact CG2-CB 4.26Å; I119-D122 PolarHBondContact O-N 2.88Å; I119-S125 PolarHBondContact N-OG 2.89Å |
| 120 | P | 89.5 | Confident | 91.5 | Very high | 109 Ų | 109 | 98.3 Ų | 98.3 | 71% | 0.708 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | 135.4 | -178.2 | -25.9 | 34.9 | 0 | 0 | 0 | 113.5 | P118 D122 | P118-P120 WeakPolarHBondContact O-CD 3.39Å; P120-D122 PolarHBondContact O-N 2.92Å |
| 121 | N | 89.4 | Confident | 91.6 | Very high | 165 Ų | 165 | 96.7 Ų | 96.7 | 88% | 0.882 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65 | 5.6 | -178.5 | -51.1 | -62.9 | 0 | 0 | 0 | 116.3 | I119 | I119-N121 PolarHBondContact O-N 3.03Š|
| 122 | D | 94.4 | Very high | 91.8 | Very high | 59 Ų | 59 | 95.4 Ų | 95.4 | 32% | 0.316 | 50% | 0.498 | S | S | . | . | trans | -91.7 | 128.2 | 166 | 178.6 | 32 | 0 | 0 | 0 | 110.4 | I119 P120 E124 S125 Q126 | I119-D122 HydrophobicContact CB-CB 4.28Å; I119-D122 HydrophobicContact CG2-CB 4.26Å; I119-D122 PolarHBondContact O-N 2.88Å; P120-D122 PolarHBondContact O-N 2.92Å; D122-E124 PolarHBondContact OD1-N 3.5Å; D122-S125 WeakPolarHBondContact OD2-CB 3.12Å; D122-S125 PolarHBondContact OD2-N 3.13Å; D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.38Å; D122-Q126 PolarHBondContact O-NE2 3.07Å | ||
| 123 | A | 92.4 | Very high | 91.9 | Very high | 78 Ų | 78 | 88.7 Ų | 88.7 | 65% | 0.645 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -79 | -30.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L127 | A123-L127 PolarHBondContact O-N 3.35Å |
| 124 | E | 93.3 | Very high | 91.9 | Very high | 138 Ų | 138 | 89.7 Ų | 89.7 | 65% | 0.645 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -70.9 | -49.5 | 179.4 | -174.4 | 171 | -174.5 | 0 | 0 | 110.4 | D122 Q126 L127 I128 | D122-E124 PolarHBondContact OD1-N 3.5Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 2.87Å; E124-L127 WeakPolarHBondContact O-CB 3.34Å; E124-L127 PolarHBondContact O-N 2.95Å; E124-L127 VanDerWaalsContact O-N 3.11Å; E124-I128 HydrophobicContact CG-CD1 3.96Å; E124-I128 WeakPolarHBondContact O-CG1 3.37Å; E124-I128 PolarHBondContact O-N 3.19Å |
| 125 | S | 93.6 | Very high | 92 | Very high | 19 Ų | 19 | 90.9 Ų | 90.9 | 13% | 0.133 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -60.5 | -35.9 | 175.5 | -177.4 | 0 | 0 | 0 | 0 | 113.7 | P118 I119 D122 Y129 | P118-S125 WeakPolarHBondContact CA-OG 3.16Å; I119-S125 PolarHBondContact N-OG 2.89Å; D122-S125 WeakPolarHBondContact OD2-CB 3.12Å; D122-S125 PolarHBondContact OD2-N 3.13Å; S125-Y129 WeakPolarHBondContact O-CB 3.35Å; S125-Y129 PolarHBondContact O-N 3.33Å |
| 126 | Q | 92 | Very high | 92 | Very high | 98 Ų | 98 | 90.3 Ų | 90.3 | 46% | 0.458 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 173.6 | -79.8 | 172.7 | 81.6 | 0 | 0 | 112.6 | P118 D122 E124 Y129 R130 | P118-Q126 HydrophobicContact CB-CG 4.15Å; D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.38Å; D122-Q126 PolarHBondContact O-NE2 3.07Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 2.87Å; Q126-Y129 PolarHBondContact O-N 3.07Å; Q126-R130 PolarHBondContact O-N 2.85Å |
| 127 | L | 92.4 | Very high | 92 | Very high | 121 Ų | 121 | 86.9 Ų | 86.9 | 63% | 0.634 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -66.7 | -46.8 | 176.4 | -176.4 | 61.5 | 0 | 0 | 0 | 111.4 | A123 E124 Y129 R130 D131 | A123-L127 PolarHBondContact O-N 3.35Å; E124-L127 WeakPolarHBondContact O-CB 3.34Å; E124-L127 PolarHBondContact O-N 2.95Å; E124-L127 VanDerWaalsContact O-N 3.11Å; L127-Y129 VanDerWaalsContact C-N 3.27Å; L127-Y129 PolarHBondContact O-N 2.86Å; L127-R130 PolarHBondContact O-N 2.83Å; L127-D131 PolarHBondContact O-N 3.46Å; L127-D131 VanDerWaalsContact O-N 3.1Å |
| 128 | I | 93.3 | Very high | 92.1 | Very high | 74 Ų | 74 | 85.8 Ų | 85.8 | 38% | 0.379 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -58.1 | -41.3 | 176.3 | -67.7 | 168.3 | 0 | 0 | 0 | 110.6 | E124 R130 D131 H132 | E124-I128 HydrophobicContact CG-CD1 3.96Å; E124-I128 WeakPolarHBondContact O-CG1 3.37Å; E124-I128 PolarHBondContact O-N 3.19Å; I128-R130 PolarHBondContact O-N 2.72Å; I128-D131 PolarHBondContact O-N 3.25Å; I128-H132 WeakPolarHBondContact CG2-NE2 3.3Å; I128-H132 WeakPolarHBondContact O-CB 3.29Å; I128-H132 PolarHBondContact O-CD2 3.15Å; I128-H132 VanDerWaalsContact O-CD2 3.24Å; I128-H132 VanDerWaalsContact O-CG 3.28Å; I128-H132 PolarHBondContact O-N 3.48Å |
| 129 | Y | 93.1 | Very high | 92.2 | Very high | 71 Ų | 71 | 89 Ų | 89 | 28% | 0.278 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.8 | -41.1 | 177.1 | 177 | -109.9 | 0 | 0 | 0 | 113.3 | P115 E116 P118 S125 Q126 L127 R133 | P115-Y129 HydrophobicContact CB-CD2 3.98Å; P115-Y129 HydrophobicContact CB-CE2 3.84Å; E116-Y129 WeakPolarHBondContact O-CD2 3.39Å; P118-Y129 HydrophobicContact CB-CD1 4.46Å; P118-Y129 HydrophobicContact CB-CG 4.15Å; P118-Y129 HydrophobicContact CG-CD1 3.85Å; P118-Y129 HydrophobicContact CG-CE1 4.37Å; P118-Y129 HydrophobicContact CG-CG 3.92Å; S125-Y129 WeakPolarHBondContact O-CB 3.35Å; S125-Y129 PolarHBondContact O-N 3.33Å; Q126-Y129 PolarHBondContact O-N 3.07Å; L127-Y129 VanDerWaalsContact C-N 3.27Å; L127-Y129 PolarHBondContact O-N 2.86Å; Y129-R133 HydrophobicContact CE1-CG 4.31Å; Y129-R133 HydrophobicContact CE2-CG 4.45Å; Y129-R133 WeakPolarHBondContact O-CB 3.39Å; Y129-R133 PolarHBondContact O-N 3.27Å |
| 130 | R | 91.1 | Very high | 92.3 | Very high | 112 Ų | 112 | 85.2 Ų | 85.2 | 42% | 0.423 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 174.9 | -68.5 | -176.2 | 94.6 | 122.4 | 15.4 | 111.3 | D96 Q126 L127 I128 R133 H134 | D96-R130 PolarHBondContact O-NH2 2.64Å; D96-R130 VanDerWaalsContact O-NH2 3.09Å; D96-R130 IonicContact OD1-CZ 2.72Å; D96-R130 IonicContact OD1-NE 2.82Å; D96-R130 IonicContact OD1-NH2 2.89Å; D96-R130 PolarHBondContact OD1-NH2 3.21Å; D96-R130 IonicContact OD2-CZ 2.64Å; D96-R130 IonicContact OD2-NE 3.2Å; D96-R130 PolarHBondContact OD2-NE 2.87Å; D96-R130 IonicContact OD2-NH2 2.72Å; D96-R130 PolarHBondContact OD2-NH2 2.89Å; Q126-R130 PolarHBondContact O-N 2.85Å; L127-R130 PolarHBondContact O-N 2.83Å; I128-R130 PolarHBondContact O-N 2.72Å; R130-R133 VanDerWaalsContact O-CB 3.3Å; R130-R133 WeakPolarHBondContact O-CB 3.38Å; R130-R133 PolarHBondContact O-N 2.87Å; R130-H134 PolarHBondContact O-N 3.19Å |
| 131 | D | 92.7 | Very high | 92.4 | Very high | 84 Ų | 84 | 82.5 Ų | 82.5 | 45% | 0.449 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 178.1 | -173.8 | 59.5 | 0 | 0 | 0 | 111.8 | L127 I128 R133 H134 M135 | L127-D131 PolarHBondContact O-N 3.46Å; L127-D131 VanDerWaalsContact O-N 3.1Å; I128-D131 PolarHBondContact O-N 3.25Å; D131-R133 PolarHBondContact O-N 3.41Å; D131-H134 WeakPolarHBondContact O-CB 3.46Å; D131-H134 PolarHBondContact O-N 3.41Å; D131-H134 VanDerWaalsContact O-N 3.16Å; D131-M135 PolarHBondContact O-N 2.85Å; D131-M135 WeakPolarHBondContact OD2-CE 3.48Å |
| 132 | H | 94.1 | Very high | 92.7 | Very high | 81 Ų | 81 | 79 Ų | 79 | 38% | 0.375 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -38.2 | 175.4 | -71.7 | -160.8 | 0 | 0 | 0 | 112.3 | P115 I128 H134 M135 A136 | P115-H132 HydrophobicContact CB-CB 3.93Å; P115-H132 HydrophobicContact CG-CB 4.3Å; I128-H132 WeakPolarHBondContact CG2-NE2 3.3Å; I128-H132 WeakPolarHBondContact O-CB 3.29Å; I128-H132 PolarHBondContact O-CD2 3.15Å; I128-H132 VanDerWaalsContact O-CD2 3.24Å; I128-H132 VanDerWaalsContact O-CG 3.28Å; I128-H132 PolarHBondContact O-N 3.48Å; H132-H134 VanDerWaalsContact C-N 3.33Å; H132-H134 PolarHBondContact O-N 2.97Å; H132-M135 WeakPolarHBondContact CD2-CE 3.35Å; H132-M135 PolarHBondContact O-N 3.46Å; H132-A136 WeakPolarHBondContact O-CB 3.14Å; H132-A136 PolarHBondContact O-N 3.44Å |
| 133 | R | 91 | Very high | 92.6 | Very high | 51 Ų | 51 | 79.7 Ų | 79.7 | 19% | 0.192 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -57.4 | -43.8 | 170.8 | -106.2 | -79.8 | -135.2 | 98 | 3.1 | 111.9 | E102 P115 Y129 R130 D131 K137 | E102-R133 IonicContact OE2-CZ 3.99Å; E102-R133 IonicContact OE2-NH1 2.83Å; E102-R133 PolarHBondContact OE2-NH1 3.38Å; P115-R133 HydrophobicContact CG-CG 4.39Å; Y129-R133 HydrophobicContact CE1-CG 4.31Å; Y129-R133 HydrophobicContact CE2-CG 4.45Å; Y129-R133 WeakPolarHBondContact O-CB 3.39Å; Y129-R133 PolarHBondContact O-N 3.27Å; R130-R133 VanDerWaalsContact O-CB 3.3Å; R130-R133 WeakPolarHBondContact O-CB 3.38Å; R130-R133 PolarHBondContact O-N 2.87Å; D131-R133 PolarHBondContact O-N 3.41Å; R133-K137 PolarHBondContact O-N 2.92Å |
| 134 | H | 89.9 | Confident | 92.7 | Very high | 106 Ų | 106 | 78.6 Ų | 78.6 | 49% | 0.491 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.7 | -47.3 | 177.4 | 179.9 | 58.8 | 0 | 0 | 0 | 111.4 | R130 D131 H132 A136 K137 E138 | R130-H134 PolarHBondContact O-N 3.19Å; D131-H134 WeakPolarHBondContact O-CB 3.46Å; D131-H134 PolarHBondContact O-N 3.41Å; D131-H134 VanDerWaalsContact O-N 3.16Å; H132-H134 VanDerWaalsContact C-N 3.33Å; H132-H134 PolarHBondContact O-N 2.97Å; H134-A136 VanDerWaalsContact C-N 3.31Å; H134-A136 PolarHBondContact O-N 3.22Å; H134-K137 WeakPolarHBondContact O-CB 3.42Å; H134-K137 PolarHBondContact O-N 2.87Å; H134-K137 VanDerWaalsContact O-N 3.13Å; H134-E138 PolarHBondContact O-N 3.46Å; H134-E138 VanDerWaalsContact O-N 3.07Å |
| 135 | M | 93.7 | Very high | 92.9 | Very high | 94 Ų | 94 | 76.8 Ų | 76.8 | 46% | 0.463 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.1 | -37.1 | 176.4 | -72.8 | -168.4 | -72.3 | 0 | 0 | 113.4 | D131 H132 K137 E138 Y139 | D131-M135 PolarHBondContact O-N 2.85Å; D131-M135 WeakPolarHBondContact OD2-CE 3.48Å; H132-M135 WeakPolarHBondContact CD2-CE 3.35Å; H132-M135 PolarHBondContact O-N 3.46Å; M135-K137 VanDerWaalsContact C-N 3.35Å; M135-K137 PolarHBondContact O-N 2.91Å; M135-E138 PolarHBondContact O-N 2.83Å; M135-Y139 WeakPolarHBondContact O-CB 3.35Å; M135-Y139 PolarHBondContact O-N 3.01Å |
| 136 | A | 93.1 | Very high | 93 | Very high | 8 Ų | 8 | 81.1 Ų | 81.1 | 7% | 0.066 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.1 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L109 P115 H132 H134 Y139 L140 | L109-A136 HydrophobicContact CD1-CB 3.7Å; P115-A136 HydrophobicContact CG-CB 3.94Å; H132-A136 WeakPolarHBondContact O-CB 3.14Å; H132-A136 PolarHBondContact O-N 3.44Å; H134-A136 VanDerWaalsContact C-N 3.31Å; H134-A136 PolarHBondContact O-N 3.22Å; A136-Y139 PolarHBondContact O-N 3.42Å; A136-L140 PolarHBondContact O-N 3.45Å; A136-L140 VanDerWaalsContact O-N 3.08Å |
| 137 | K | 88.7 | Confident | 93.3 | Very high | 91 Ų | 91 | 83.8 Ų | 83.8 | 40% | 0.396 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 175.4 | -176.1 | -179.6 | -177.2 | 174 | 0 | 111.5 | E102 R133 H134 M135 L140 S141 | E102-K137 IonicContact OE1-NZ 3.21Å; E102-K137 PolarHBondContact OE1-NZ 2.76Å; R133-K137 PolarHBondContact O-N 2.92Å; H134-K137 WeakPolarHBondContact O-CB 3.42Å; H134-K137 PolarHBondContact O-N 2.87Å; H134-K137 VanDerWaalsContact O-N 3.13Å; M135-K137 VanDerWaalsContact C-N 3.35Å; M135-K137 PolarHBondContact O-N 2.91Å; K137-L140 PolarHBondContact O-N 2.72Å; K137-S141 PolarHBondContact O-N 2.95Å |
| 138 | E | 93 | Very high | 93.5 | Very high | 91 Ų | 91 | 84.8 Ų | 84.8 | 43% | 0.425 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 176.5 | -67.7 | -55.7 | 108.7 | 0 | 0 | 112.1 | H134 M135 L140 S141 V142 | H134-E138 PolarHBondContact O-N 3.46Å; H134-E138 VanDerWaalsContact O-N 3.07Å; M135-E138 PolarHBondContact O-N 2.83Å; E138-L140 PolarHBondContact O-N 3.02Å; E138-S141 WeakPolarHBondContact O-CB 3.41Å; E138-S141 PolarHBondContact O-N 3.28Å; E138-V142 WeakPolarHBondContact O-CG2 3.44Å; E138-V142 PolarHBondContact O-N 3.32Å |
| 139 | Y | 94.3 | Very high | 93.7 | Very high | 112 Ų | 112 | 84.1 Ų | 84.1 | 44% | 0.439 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -58.5 | -48.6 | 174.5 | 174.4 | -97 | 0 | 0 | 0 | 111.8 | L109 L113 M135 A136 S141 V142 D143 | L109-Y139 HydrophobicContact CD1-CD1 4.3Å; L109-Y139 HydrophobicContact CD2-CD1 3.69Å; L109-Y139 HydrophobicContact CD2-CE1 3.89Å; L113-Y139 HydrophobicContact CD1-CE1 3.83Å; M135-Y139 WeakPolarHBondContact O-CB 3.35Å; M135-Y139 PolarHBondContact O-N 3.01Å; A136-Y139 PolarHBondContact O-N 3.42Å; Y139-S141 VanDerWaalsContact C-N 3.33Å; Y139-S141 PolarHBondContact O-N 3.03Å; Y139-V142 PolarHBondContact O-N 2.94Å; Y139-D143 WeakPolarHBondContact O-CB 3.36Å; Y139-D143 PolarHBondContact O-N 3.27Å |
| 140 | L | 92.4 | Very high | 93.8 | Very high | 28 Ų | 28 | 84.5 Ų | 84.5 | 15% | 0.147 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 177.6 | -179.9 | 68.1 | 0 | 0 | 0 | 112.3 | L105 I108 L109 A136 K137 E138 D143 T144 | L105-L140 HydrophobicContact CB-CD2 4.23Å; L105-L140 HydrophobicContact CD2-CD2 3.93Å; I108-L140 HydrophobicContact CD1-CD1 3.93Å; I108-L140 HydrophobicContact CD1-CD2 3.76Å; I108-L140 HydrophobicContact CG1-CD1 4.39Å; I108-L140 HydrophobicContact CG1-CD2 4.18Å; L109-L140 HydrophobicContact CD2-CB 4.16Å; L109-L140 HydrophobicContact CD2-CD1 4.09Å; A136-L140 PolarHBondContact O-N 3.45Å; A136-L140 VanDerWaalsContact O-N 3.08Å; K137-L140 PolarHBondContact O-N 2.72Å; E138-L140 PolarHBondContact O-N 3.02Å; L140-D143 PolarHBondContact O-N 3.46Å; L140-T144 VanDerWaalsContact O-CB 3.29Å; L140-T144 WeakPolarHBondContact O-CB 3.49Å; L140-T144 PolarHBondContact O-N 2.88Å; L140-T144 PolarHBondContact O-OG1 3.48Å |
| 141 | S | 91.6 | Very high | 94 | Very high | 52 Ų | 52 | 81.7 Ų | 81.7 | 36% | 0.364 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 174.7 | 177.8 | 0 | 0 | 0 | 0 | 111.1 | K137 E138 Y139 N145 | K137-S141 PolarHBondContact O-N 2.95Å; E138-S141 WeakPolarHBondContact O-CB 3.41Å; E138-S141 PolarHBondContact O-N 3.28Å; Y139-S141 VanDerWaalsContact C-N 3.33Å; Y139-S141 PolarHBondContact O-N 3.03Å; S141-N145 WeakPolarHBondContact O-CB 3.36Å; S141-N145 VanDerWaalsContact O-CG 3.29Å; S141-N145 PolarHBondContact O-N 3.5Å; S141-N145 PolarHBondContact O-ND2 2.92Å |
| 142 | V | 95.9 | Very high | 94.1 | Very high | 90 Ų | 90 | 84.2 Ų | 84.2 | 55% | 0.545 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.8 | -42.5 | 178.6 | 171.2 | 0 | 0 | 0 | 0 | 112.1 | E138 Y139 N145 L146 | E138-V142 WeakPolarHBondContact O-CG2 3.44Å; E138-V142 PolarHBondContact O-N 3.32Å; Y139-V142 PolarHBondContact O-N 2.94Å; V142-N145 PolarHBondContact O-N 2.85Å; V142-L146 VanDerWaalsContact O-CB 3.31Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.01Å |
| 143 | D | 93.4 | Very high | 94.1 | Very high | 74 Ų | 74 | 84.9 Ų | 84.9 | 40% | 0.396 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 178 | -172.4 | 66 | 0 | 0 | 0 | 111.7 | Y139 L140 N145 L146 Y147 | Y139-D143 WeakPolarHBondContact O-CB 3.36Å; Y139-D143 PolarHBondContact O-N 3.27Å; L140-D143 PolarHBondContact O-N 3.46Å; D143-N145 VanDerWaalsContact C-N 3.34Å; D143-N145 PolarHBondContact O-N 3.22Å; D143-L146 WeakPolarHBondContact O-CB 3.1Å; D143-L146 PolarHBondContact O-N 3.38Å; D143-Y147 PolarHBondContact O-N 2.88Å |
| 144 | T | 94.7 | Very high | 94.1 | Very high | 56 Ų | 56 | 86 Ų | 86 | 34% | 0.344 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58 | -46.1 | 173.5 | -59.9 | 0 | 0 | 0 | 0 | 111.5 | L140 Y147 Y148 | L140-T144 VanDerWaalsContact O-CB 3.29Å; L140-T144 WeakPolarHBondContact O-CB 3.49Å; L140-T144 PolarHBondContact O-N 2.88Å; L140-T144 PolarHBondContact O-OG1 3.48Å; T144-Y147 PolarHBondContact O-N 2.97Å; T144-Y148 HydrophobicContact CG2-CD2 3.94Å; T144-Y148 HydrophobicContact CG2-CE2 3.54Å; T144-Y148 WeakPolarHBondContact O-CD2 3.48Å; T144-Y148 PolarHBondContact O-N 3.04Å; T144-Y148 VanDerWaalsContact O-N 3.15Å |
| 145 | N | 96.1 | Very high | 94.3 | Very high | 100 Ų | 100 | 86.2 Ų | 86.2 | 54% | 0.535 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.4 | -37.9 | 177.2 | -74.9 | -43 | 0 | 0 | 0 | 112.4 | S141 V142 D143 Y148 A149 | S141-N145 WeakPolarHBondContact O-CB 3.36Å; S141-N145 VanDerWaalsContact O-CG 3.29Å; S141-N145 PolarHBondContact O-N 3.5Å; S141-N145 PolarHBondContact O-ND2 2.92Å; V142-N145 PolarHBondContact O-N 2.85Å; D143-N145 VanDerWaalsContact C-N 3.34Å; D143-N145 PolarHBondContact O-N 3.22Å; N145-Y148 PolarHBondContact O-N 3.22Å; N145-A149 VanDerWaalsContact O-CB 3.32Å; N145-A149 WeakPolarHBondContact O-CB 3.43Å; N145-A149 PolarHBondContact O-N 2.68Å |
| 146 | L | 97.4 | Very high | 94.1 | Very high | 110 Ų | 110 | 85.8 Ų | 85.8 | 58% | 0.576 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -64.1 | -42.4 | 175.8 | -179.8 | 62.2 | 0 | 0 | 0 | 111.4 | V142 D143 A149 Q150 | V142-L146 VanDerWaalsContact O-CB 3.31Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.01Å; D143-L146 WeakPolarHBondContact O-CB 3.1Å; D143-L146 PolarHBondContact O-N 3.38Å; L146-A149 PolarHBondContact O-N 3.01Å; L146-Q150 WeakPolarHBondContact O-CB 3.49Å; L146-Q150 PolarHBondContact O-N 2.76Å |
| 147 | Y | 96.6 | Very high | 93.7 | Very high | 154 Ų | 154 | 88.6 Ų | 88.6 | 60% | 0.604 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -58.4 | -49.8 | 174.5 | 177.1 | -93.8 | 0 | 0 | 0 | 111.7 | D143 T144 Q150 D151 | D143-Y147 PolarHBondContact O-N 2.88Å; T144-Y147 PolarHBondContact O-N 2.97Å; Y147-Q150 WeakPolarHBondContact O-CB 3.32Å; Y147-Q150 PolarHBondContact O-N 3.23Å; Y147-D151 PolarHBondContact O-N 3.15Å |
| 148 | Y | 97.3 | Very high | 93.6 | Very high | 142 Ų | 142 | 89.9 Ų | 89.9 | 56% | 0.557 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.2 | -36.8 | 177.9 | -70.3 | -56.8 | 0 | 0 | 0 | 113.1 | T144 N145 Q150 D151 F152 | T144-Y148 HydrophobicContact CG2-CD2 3.94Å; T144-Y148 HydrophobicContact CG2-CE2 3.54Å; T144-Y148 WeakPolarHBondContact O-CD2 3.48Å; T144-Y148 PolarHBondContact O-N 3.04Å; T144-Y148 VanDerWaalsContact O-N 3.15Å; N145-Y148 PolarHBondContact O-N 3.22Å; Y148-Q150 VanDerWaalsContact C-N 3.31Å; Y148-Q150 PolarHBondContact O-N 2.72Å; Y148-D151 PolarHBondContact O-N 3.48Å; Y148-F152 VanDerWaalsContact O-CB 3.27Å; Y148-F152 WeakPolarHBondContact O-CB 3.46Å; Y148-F152 PolarHBondContact O-N 3.44Å |
| 149 | A | 97.6 | Very high | 93.1 | Very high | 59 Ų | 59 | 92.8 Ų | 92.8 | 49% | 0.488 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.6 | -35.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N145 L146 K153 | N145-A149 VanDerWaalsContact O-CB 3.32Å; N145-A149 WeakPolarHBondContact O-CB 3.43Å; N145-A149 PolarHBondContact O-N 2.68Å; L146-A149 PolarHBondContact O-N 3.01Å; A149-K153 VanDerWaalsContact O-CB 3.29Å; A149-K153 WeakPolarHBondContact O-CB 3.4Å; A149-K153 PolarHBondContact O-N 2.79Å |
| 150 | Q | 95.8 | Very high | 92.5 | Very high | 79 Ų | 79 | 88.9 Ų | 88.9 | 37% | 0.369 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -67.8 | -49.2 | 174.9 | 177.3 | 60 | 53.3 | 0 | 0 | 111.5 | L146 Y147 Y148 F152 K153 D154 | L146-Q150 WeakPolarHBondContact O-CB 3.49Å; L146-Q150 PolarHBondContact O-N 2.76Å; Y147-Q150 WeakPolarHBondContact O-CB 3.32Å; Y147-Q150 PolarHBondContact O-N 3.23Å; Y148-Q150 VanDerWaalsContact C-N 3.31Å; Y148-Q150 PolarHBondContact O-N 2.72Å; Q150-F152 PolarHBondContact O-N 3.4Å; Q150-K153 VanDerWaalsContact NE2-CE 3.27Å; Q150-K153 WeakPolarHBondContact O-CB 3.31Å; Q150-K153 PolarHBondContact O-N 3.15Å; Q150-D154 PolarHBondContact NE2-OD1 3.32Å; Q150-D154 PolarHBondContact NE2-OD2 3.07Å; Q150-D154 PolarHBondContact O-N 3.44Å |
| 151 | D | 94.9 | Very high | 92.3 | Very high | 54 Ų | 54 | 93 Ų | 93 | 29% | 0.289 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.3 | -42.7 | 175.6 | 166.9 | 73.9 | 0 | 0 | 0 | 112.2 | Y147 Y148 K153 D154 K155 | Y147-D151 PolarHBondContact O-N 3.15Å; Y148-D151 PolarHBondContact O-N 3.48Å; D151-K153 PolarHBondContact O-N 2.92Å; D151-D154 PolarHBondContact O-N 3Å; D151-K155 VanDerWaalsContact CG-NZ 3.32Å; D151-K155 WeakPolarHBondContact O-CB 3.27Å; D151-K155 WeakPolarHBondContact O-CG 3.32Å; D151-K155 PolarHBondContact O-N 3.27Å; D151-K155 WeakPolarHBondContact OD1-CE 3.42Å; D151-K155 IonicContact OD1-NZ 3.15Å; D151-K155 PolarHBondContact OD1-NZ 3.44Å; D151-K155 VanDerWaalsContact OD2-CE 3.28Å; D151-K155 WeakPolarHBondContact OD2-CE 3.47Å; D151-K155 IonicContact OD2-NZ 2.76Å; D151-K155 PolarHBondContact OD2-NZ 3.45Å |
| 152 | F | 95.6 | Very high | 92 | Very high | 137 Ų | 137 | 99.2 Ų | 99.2 | 60% | 0.601 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.2 | -44.6 | 174.9 | -179.3 | -98.2 | 0 | 0 | 0 | 111.9 | Y148 Q150 D154 K155 L156 | Y148-F152 VanDerWaalsContact O-CB 3.27Å; Y148-F152 WeakPolarHBondContact O-CB 3.46Å; Y148-F152 PolarHBondContact O-N 3.44Å; Q150-F152 PolarHBondContact O-N 3.4Å; F152-D154 VanDerWaalsContact C-N 3.34Å; F152-D154 PolarHBondContact O-N 2.93Å; F152-K155 PolarHBondContact O-N 3.19Å; F152-L156 HydrophobicContact CE1-CD2 4.37Å; F152-L156 VanDerWaalsContact O-CB 3.29Å; F152-L156 WeakPolarHBondContact O-CB 3.4Å; F152-L156 PolarHBondContact O-N 2.97Å |
| 153 | K | 93.7 | Very high | 91.7 | Very high | 95 Ų | 95 | 98.9 Ų | 98.9 | 41% | 0.413 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 174.9 | 177.5 | -171.5 | 68.8 | -170.4 | 0 | 111.5 | A149 Q150 D151 L156 I157 | A149-K153 VanDerWaalsContact O-CB 3.29Å; A149-K153 WeakPolarHBondContact O-CB 3.4Å; A149-K153 PolarHBondContact O-N 2.79Å; Q150-K153 VanDerWaalsContact NE2-CE 3.27Å; Q150-K153 WeakPolarHBondContact O-CB 3.31Å; Q150-K153 PolarHBondContact O-N 3.15Å; D151-K153 PolarHBondContact O-N 2.92Å; K153-L156 PolarHBondContact O-N 3.37Å; K153-I157 HydrophobicContact CD-CD1 4.48Å; K153-I157 HydrophobicContact CG-CD1 3.91Å; K153-I157 WeakPolarHBondContact O-CB 3.29Å; K153-I157 VanDerWaalsContact O-CG1 3.24Å; K153-I157 WeakPolarHBondContact O-CG1 3.29Å; K153-I157 PolarHBondContact O-N 3.02Å |
| 154 | D | 91.3 | Very high | 91.5 | Very high | 73 Ų | 73 | 100 Ų | 100 | 39% | 0.39 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -71 | -39.5 | -178.2 | -67.4 | -21.9 | 0 | 0 | 0 | 111.6 | Q150 D151 F152 I157 V158 | Q150-D154 PolarHBondContact NE2-OD1 3.32Å; Q150-D154 PolarHBondContact NE2-OD2 3.07Å; Q150-D154 PolarHBondContact O-N 3.44Å; D151-D154 PolarHBondContact O-N 3Å; F152-D154 VanDerWaalsContact C-N 3.34Å; F152-D154 PolarHBondContact O-N 2.93Å; D154-I157 PolarHBondContact O-N 3.16Å; D154-V158 WeakPolarHBondContact O-CG2 3.24Å; D154-V158 PolarHBondContact O-N 3.31Å |
| 155 | K | 92.6 | Very high | 91.2 | Very high | 112 Ų | 112 | 100.7 Ų | 100.7 | 49% | 0.487 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.7 | -46.5 | 169.5 | -75.7 | 168.1 | 176.5 | 165 | 0 | 111.9 | D151 F152 I157 V158 Q159 | D151-K155 VanDerWaalsContact CG-NZ 3.32Å; D151-K155 WeakPolarHBondContact O-CB 3.27Å; D151-K155 WeakPolarHBondContact O-CG 3.32Å; D151-K155 PolarHBondContact O-N 3.27Å; D151-K155 WeakPolarHBondContact OD1-CE 3.42Å; D151-K155 IonicContact OD1-NZ 3.15Å; D151-K155 PolarHBondContact OD1-NZ 3.44Å; D151-K155 VanDerWaalsContact OD2-CE 3.28Å; D151-K155 WeakPolarHBondContact OD2-CE 3.47Å; D151-K155 IonicContact OD2-NZ 2.76Å; D151-K155 PolarHBondContact OD2-NZ 3.45Å; F152-K155 PolarHBondContact O-N 3.19Å; K155-I157 VanDerWaalsContact C-N 3.34Å; K155-I157 PolarHBondContact O-N 3.34Å; K155-V158 PolarHBondContact O-N 3.12Å; K155-V158 VanDerWaalsContact O-N 3.15Å; K155-Q159 WeakPolarHBondContact O-CG 3.47Å; K155-Q159 PolarHBondContact O-N 2.99Å |
| 156 | L | 89.8 | Confident | 91 | Very high | 84 Ų | 84 | 100.4 Ų | 100.4 | 44% | 0.44 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 176.2 | -176.7 | 63.3 | 0 | 0 | 0 | 111.3 | F152 K153 V158 Q159 M160 | F152-L156 HydrophobicContact CE1-CD2 4.37Å; F152-L156 VanDerWaalsContact O-CB 3.29Å; F152-L156 WeakPolarHBondContact O-CB 3.4Å; F152-L156 PolarHBondContact O-N 2.97Å; K153-L156 PolarHBondContact O-N 3.37Å; L156-V158 VanDerWaalsContact C-N 3.3Å; L156-V158 PolarHBondContact O-N 3.06Å; L156-Q159 PolarHBondContact O-N 2.78Å; L156-M160 WeakPolarHBondContact O-CG 3.4Å; L156-M160 PolarHBondContact O-N 3.1Å |
| 157 | I | 85.6 | Confident | 90.8 | Very high | 68 Ų | 68 | 101.6 Ų | 101.6 | 35% | 0.349 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.6 | -36.7 | 174.3 | -73.1 | 165.7 | 0 | 0 | 0 | 111.4 | K153 D154 K155 R165 | K153-I157 HydrophobicContact CD-CD1 4.48Å; K153-I157 HydrophobicContact CG-CD1 3.91Å; K153-I157 WeakPolarHBondContact O-CB 3.29Å; K153-I157 VanDerWaalsContact O-CG1 3.24Å; K153-I157 WeakPolarHBondContact O-CG1 3.29Å; K153-I157 PolarHBondContact O-N 3.02Å; D154-I157 PolarHBondContact O-N 3.16Å; K155-I157 VanDerWaalsContact C-N 3.34Å; K155-I157 PolarHBondContact O-N 3.34Å; I157-R165 VanDerWaalsContact O-CZ 3.32Å; I157-R165 PolarHBondContact O-NE 3.5Å; I157-R165 VanDerWaalsContact O-NE 3.15Å; I157-R165 PolarHBondContact O-NH2 3.39Å |
| 158 | V | 85.9 | Confident | 90.6 | Very high | 118 Ų | 118 | 99.8 Ų | 99.8 | 72% | 0.715 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -70 | -39.6 | 175 | 170.9 | 0 | 0 | 0 | 0 | 111.4 | D154 K155 L156 | D154-V158 WeakPolarHBondContact O-CG2 3.24Å; D154-V158 PolarHBondContact O-N 3.31Å; K155-V158 PolarHBondContact O-N 3.12Å; K155-V158 VanDerWaalsContact O-N 3.15Å; L156-V158 VanDerWaalsContact C-N 3.3Å; L156-V158 PolarHBondContact O-N 3.06Å |
| 159 | Q | 83.1 | Confident | 90.4 | Very high | 152 Ų | 152 | 99 Ų | 99 | 71% | 0.71 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -68.7 | -30.4 | 177.2 | -72.9 | 176.1 | -10.5 | 0 | 0 | 113.7 | K155 L156 D161 | K155-Q159 WeakPolarHBondContact O-CG 3.47Å; K155-Q159 PolarHBondContact O-N 2.99Å; L156-Q159 PolarHBondContact O-N 2.78Å; Q159-D161 PolarHBondContact O-N 3.15Å |
| 160 | M | 81.4 | Confident | 90.4 | Very high | 29 Ų | 29 | 99 Ų | 99 | 14% | 0.143 | 47% | 0.47 | C | S | . | . | S | Bend | trans | -56 | 137.4 | 176.1 | -76.8 | -173.6 | 81.2 | 0 | 0 | 112 | L156 E164 R165 K168 | L156-M160 WeakPolarHBondContact O-CG 3.4Å; L156-M160 PolarHBondContact O-N 3.1Å; M160-E164 HydrophobicContact CE-CB 4.25Å; M160-E164 HydrophobicContact CE-CG 3.64Å; M160-E164 WeakPolarHBondContact CE-OE1 3.41Å; M160-E164 WeakPolarHBondContact CE-OE2 3.31Å; M160-R165 PolarHBondContact O-NH2 2.98Å; M160-K168 HydrophobicContact CE-CD 4.17Å |
| 161 | D | 87.2 | Confident | 90.5 | Very high | 116 Ų | 116 | 100.1 Ų | 100.1 | 62% | 0.62 | 48% | 0.479 | S | S | * | . | trans | -60.7 | 146.2 | 175.7 | -94.2 | -33.4 | 0 | 0 | 0 | 111.5 | Q159 T163 E164 R165 | Q159-D161 PolarHBondContact O-N 3.15Å; D161-T163 VanDerWaalsContact C-N 3.29Å; D161-T163 PolarHBondContact O-N 2.95Å; D161-E164 HydrophobicContact CB-CB 4.11Å; D161-E164 PolarHBondContact O-N 3.09Å; D161-E164 VanDerWaalsContact O-N 3.16Å; D161-R165 PolarHBondContact O-N 3.44Å | ||
| 162 | R | 86.6 | Confident | 90.5 | Very high | 181 Ų | 181 | 102.7 Ų | 102.7 | 68% | 0.683 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.7 | -43.4 | -179.1 | 179.8 | 176.4 | 172.5 | 168.7 | 1.2 | 112.4 | R165 E166 | R162-R165 PolarHBondContact O-N 3.48Å; R162-E166 WeakPolarHBondContact CG-OE1 3.43Å; R162-E166 IonicContact CZ-OE1 3.03Å; R162-E166 IonicContact NE-OE1 3.65Å; R162-E166 PolarHBondContact NE-OE1 3.28Å; R162-E166 IonicContact NH2-OE1 3.76Å; R162-E166 PolarHBondContact NH2-OE1 2.9Å; R162-E166 WeakPolarHBondContact O-CB 3.48Å; R162-E166 VanDerWaalsContact O-CG 3.31Å; R162-E166 WeakPolarHBondContact O-CG 3.41Å; R162-E166 PolarHBondContact O-N 2.92Å |
| 163 | T | 88.6 | Confident | 90.7 | Very high | 84 Ų | 84 | 102.8 Ų | 102.8 | 52% | 0.515 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.8 | -41.1 | 177.2 | 43.7 | 0 | 0 | 0 | 0 | 112.1 | D161 E166 Q167 | D161-T163 VanDerWaalsContact C-N 3.29Å; D161-T163 PolarHBondContact O-N 2.95Å; T163-E166 PolarHBondContact O-N 2.97Å; T163-Q167 WeakPolarHBondContact O-CB 3.43Å; T163-Q167 VanDerWaalsContact O-CG 3.24Å; T163-Q167 WeakPolarHBondContact O-CG 3.45Å; T163-Q167 PolarHBondContact O-N 3.35Å |
| 164 | E | 90 | Very high | 90.9 | Very high | 98 Ų | 98 | 104 Ų | 104 | 46% | 0.458 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.5 | -44.3 | 177.2 | -165.3 | -166.1 | 178.6 | 0 | 0 | 111.3 | M160 D161 E166 Q167 K168 | M160-E164 HydrophobicContact CE-CB 4.25Å; M160-E164 HydrophobicContact CE-CG 3.64Å; M160-E164 WeakPolarHBondContact CE-OE1 3.41Å; M160-E164 WeakPolarHBondContact CE-OE2 3.31Å; D161-E164 HydrophobicContact CB-CB 4.11Å; D161-E164 PolarHBondContact O-N 3.09Å; D161-E164 VanDerWaalsContact O-N 3.16Å; E164-E166 VanDerWaalsContact C-N 3.35Å; E164-E166 PolarHBondContact O-N 3.43Å; E164-Q167 PolarHBondContact O-N 3.01Å; E164-K168 WeakPolarHBondContact O-CB 3.42Å; E164-K168 PolarHBondContact O-N 3.49Å |
| 165 | R | 87.8 | Confident | 91.2 | Very high | 69 Ų | 69 | 104.8 Ų | 104.8 | 26% | 0.26 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 176.1 | -161.5 | -173.9 | -59.4 | 95.8 | -0.7 | 111.8 | I157 M160 D161 R162 Q169 | I157-R165 VanDerWaalsContact O-CZ 3.32Å; I157-R165 PolarHBondContact O-NE 3.5Å; I157-R165 VanDerWaalsContact O-NE 3.15Å; I157-R165 PolarHBondContact O-NH2 3.39Å; M160-R165 PolarHBondContact O-NH2 2.98Å; D161-R165 PolarHBondContact O-N 3.44Å; R162-R165 PolarHBondContact O-N 3.48Å; R165-Q169 WeakPolarHBondContact O-CG 3.48Å; R165-Q169 PolarHBondContact O-N 2.93Å; R165-Q169 VanDerWaalsContact O-N 3.12Å |
| 166 | E | 92.4 | Very high | 91.4 | Very high | 94 Ų | 94 | 106.9 Ų | 106.9 | 44% | 0.439 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.9 | -42.7 | 176 | -73.4 | 170.8 | -173.3 | 0 | 0 | 111.6 | R162 T163 E164 K168 Q169 E170 | R162-E166 WeakPolarHBondContact CG-OE1 3.43Å; R162-E166 IonicContact CZ-OE1 3.03Å; R162-E166 IonicContact NE-OE1 3.65Å; R162-E166 PolarHBondContact NE-OE1 3.28Å; R162-E166 IonicContact NH2-OE1 3.76Å; R162-E166 PolarHBondContact NH2-OE1 2.9Å; R162-E166 WeakPolarHBondContact O-CB 3.48Å; R162-E166 VanDerWaalsContact O-CG 3.31Å; R162-E166 WeakPolarHBondContact O-CG 3.41Å; R162-E166 PolarHBondContact O-N 2.92Å; T163-E166 PolarHBondContact O-N 2.97Å; E164-E166 VanDerWaalsContact C-N 3.35Å; E164-E166 PolarHBondContact O-N 3.43Å; E166-K168 PolarHBondContact O-N 3.36Å; E166-Q169 PolarHBondContact O-N 3.46Å; E166-E170 WeakPolarHBondContact O-CB 3.4Å; E166-E170 PolarHBondContact O-N 2.64Å |
| 167 | Q | 93.9 | Very high | 91.8 | Very high | 135 Ų | 135 | 107 Ų | 107 | 63% | 0.631 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.3 | -42.1 | 175 | -74.3 | 172.7 | 23 | 0 | 0 | 112.7 | T163 E164 E170 L171 | T163-Q167 WeakPolarHBondContact O-CB 3.43Å; T163-Q167 VanDerWaalsContact O-CG 3.24Å; T163-Q167 WeakPolarHBondContact O-CG 3.45Å; T163-Q167 PolarHBondContact O-N 3.35Å; E164-Q167 PolarHBondContact O-N 3.01Å; Q167-E170 PolarHBondContact O-N 3.03Å; Q167-L171 WeakPolarHBondContact O-CB 3.24Å; Q167-L171 PolarHBondContact O-N 3.39Å |
| 168 | K | 92.4 | Very high | 92.4 | Very high | 116 Ų | 116 | 110.3 Ų | 110.3 | 50% | 0.504 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 176.2 | -179 | 174.7 | 178 | 175.8 | 0 | 111.8 | M160 E164 E166 L171 L172 | M160-K168 HydrophobicContact CE-CD 4.17Å; E164-K168 WeakPolarHBondContact O-CB 3.42Å; E164-K168 PolarHBondContact O-N 3.49Å; E166-K168 PolarHBondContact O-N 3.36Å; K168-L171 PolarHBondContact O-N 3.46Å; K168-L172 HydrophobicContact CG-CD1 4.41Å; K168-L172 WeakPolarHBondContact O-CG 3.04Å; K168-L172 PolarHBondContact O-N 3.48Å; K168-L172 VanDerWaalsContact O-N 3.09Å |
| 169 | Q | 93.4 | Very high | 93 | Very high | 126 Ų | 126 | 110.2 Ų | 110.2 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.1 | -41.2 | 176 | -71.8 | 180 | 10.8 | 0 | 0 | 112.2 | R165 E166 L171 L172 R173 | R165-Q169 WeakPolarHBondContact O-CG 3.48Å; R165-Q169 PolarHBondContact O-N 2.93Å; R165-Q169 VanDerWaalsContact O-N 3.12Å; E166-Q169 PolarHBondContact O-N 3.46Å; Q169-L171 PolarHBondContact O-N 2.72Å; Q169-L172 PolarHBondContact O-N 2.82Å; Q169-R173 PolarHBondContact O-N 3.19Å |
| 170 | E | 96.5 | Very high | 93.7 | Very high | 58 Ų | 58 | 105 Ų | 105 | 27% | 0.271 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 176 | -177.5 | 61.5 | -144.6 | 0 | 0 | 112.1 | E166 Q167 R173 K174 | E166-E170 WeakPolarHBondContact O-CB 3.4Å; E166-E170 PolarHBondContact O-N 2.64Å; Q167-E170 PolarHBondContact O-N 3.03Å; E170-R173 PolarHBondContact O-N 3.45Å; E170-R173 IonicContact OE1-CZ 3.77Å; E170-R173 IonicContact OE1-NH2 3.46Å; E170-R173 PolarHBondContact OE1-NH2 3.34Å; E170-R173 IonicContact OE2-CZ 3.68Å; E170-R173 IonicContact OE2-NH1 3.06Å; E170-R173 PolarHBondContact OE2-NH1 3.29Å; E170-R173 IonicContact OE2-NH2 2.8Å; E170-R173 PolarHBondContact OE2-NH2 3.09Å; E170-K174 HydrophobicContact CG-CD 4.3Å; E170-K174 WeakPolarHBondContact O-CG 3.36Å; E170-K174 PolarHBondContact O-N 3.44Å; E170-K174 WeakPolarHBondContact OE1-CE 3.41Å; E170-K174 IonicContact OE1-NZ 3.29Å; E170-K174 PolarHBondContact OE1-NZ 3.39Å |
| 171 | L | 97.3 | Very high | 94.5 | Very high | 104 Ų | 104 | 109.6 Ų | 109.6 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.4 | -46.5 | 176.8 | -179.4 | 62.4 | 0 | 0 | 0 | 111.7 | Q167 K168 Q169 R173 K174 M175 | Q167-L171 WeakPolarHBondContact O-CB 3.24Å; Q167-L171 PolarHBondContact O-N 3.39Å; K168-L171 PolarHBondContact O-N 3.46Å; Q169-L171 PolarHBondContact O-N 2.72Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 3.18Å; L171-K174 PolarHBondContact O-N 2.92Å; L171-M175 WeakPolarHBondContact O-CG 3.46Å; L171-M175 PolarHBondContact O-N 3.26Å |
| 172 | L | 96.4 | Very high | 95 | Very high | 107 Ų | 107 | 109 Ų | 109 | 56% | 0.56 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.7 | -41.5 | 177.4 | -71.9 | 169.7 | 0 | 0 | 0 | 111.9 | K168 Q169 M175 K176 | K168-L172 HydrophobicContact CG-CD1 4.41Å; K168-L172 WeakPolarHBondContact O-CG 3.04Å; K168-L172 PolarHBondContact O-N 3.48Å; K168-L172 VanDerWaalsContact O-N 3.09Å; Q169-L172 PolarHBondContact O-N 2.82Å; L172-M175 PolarHBondContact O-N 3.28Å; L172-K176 PolarHBondContact O-N 3.23Å; L172-K176 VanDerWaalsContact O-N 3.09Å |
| 173 | R | 98 | Very high | 95.6 | Very high | 139 Ų | 139 | 104.1 Ų | 104.1 | 53% | 0.525 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.6 | -50 | 174.4 | -171.1 | 178.3 | 73.6 | -147.5 | -0.8 | 111.2 | Q169 E170 L171 M175 K176 D177 | Q169-R173 PolarHBondContact O-N 3.19Å; E170-R173 PolarHBondContact O-N 3.45Å; E170-R173 IonicContact OE1-CZ 3.77Å; E170-R173 IonicContact OE1-NH2 3.46Å; E170-R173 PolarHBondContact OE1-NH2 3.34Å; E170-R173 IonicContact OE2-CZ 3.68Å; E170-R173 IonicContact OE2-NH1 3.06Å; E170-R173 PolarHBondContact OE2-NH1 3.29Å; E170-R173 IonicContact OE2-NH2 2.8Å; E170-R173 PolarHBondContact OE2-NH2 3.09Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 3.18Å; R173-M175 VanDerWaalsContact C-N 3.3Å; R173-M175 PolarHBondContact O-N 3.3Å; R173-K176 PolarHBondContact O-N 3.16Å; R173-D177 VanDerWaalsContact O-CG 3.3Å; R173-D177 PolarHBondContact O-N 2.8Å |
| 174 | K | 98.1 | Very high | 96 | Very high | 120 Ų | 120 | 105.7 Ų | 105.7 | 52% | 0.522 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60 | -36.5 | 178.1 | -77.1 | 171.2 | 173 | 154.9 | 0 | 113.3 | E170 L171 K178 | E170-K174 HydrophobicContact CG-CD 4.3Å; E170-K174 WeakPolarHBondContact O-CG 3.36Å; E170-K174 PolarHBondContact O-N 3.44Å; E170-K174 WeakPolarHBondContact OE1-CE 3.41Å; E170-K174 IonicContact OE1-NZ 3.29Å; E170-K174 PolarHBondContact OE1-NZ 3.39Å; L171-K174 PolarHBondContact O-N 2.92Å; K174-K178 VanDerWaalsContact O-CB 3.26Å; K174-K178 WeakPolarHBondContact O-CB 3.26Å; K174-K178 PolarHBondContact O-N 2.93Å |
| 175 | M | 97.9 | Very high | 96.4 | Very high | 91 Ų | 91 | 107.9 Ų | 107.9 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.8 | -48.6 | 174.7 | -75.9 | -175.7 | 61.8 | 0 | 0 | 111.5 | L171 L172 R173 D177 K178 E179 | L171-M175 WeakPolarHBondContact O-CG 3.46Å; L171-M175 PolarHBondContact O-N 3.26Å; L172-M175 PolarHBondContact O-N 3.28Å; R173-M175 VanDerWaalsContact C-N 3.3Å; R173-M175 PolarHBondContact O-N 3.3Å; M175-D177 VanDerWaalsContact C-N 3.35Å; M175-D177 PolarHBondContact O-N 2.97Å; M175-K178 WeakPolarHBondContact O-CB 3.38Å; M175-K178 PolarHBondContact O-N 2.91Å; M175-E179 WeakPolarHBondContact O-CG 3.44Å; M175-E179 PolarHBondContact O-N 3.42Å |
| 176 | K | 97.9 | Very high | 96.9 | Very high | 156 Ų | 156 | 108.6 Ų | 108.6 | 68% | 0.678 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.3 | -43.8 | 176.5 | -176.2 | 177.4 | -179.2 | 175.8 | 0 | 112.4 | L172 R173 E179 G180 | L172-K176 PolarHBondContact O-N 3.23Å; L172-K176 VanDerWaalsContact O-N 3.09Å; R173-K176 PolarHBondContact O-N 3.16Å; K176-E179 PolarHBondContact O-N 2.98Å; K176-G180 PolarHBondContact O-N 3.2Å |
| 177 | D | 98.2 | Very high | 97.1 | Very high | 85 Ų | 85 | 107.7 Ų | 107.7 | 46% | 0.455 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 177.5 | -66.1 | -22.2 | 0 | 0 | 0 | 111.1 | R173 M175 G180 L181 | R173-D177 VanDerWaalsContact O-CG 3.3Å; R173-D177 PolarHBondContact O-N 2.8Å; M175-D177 VanDerWaalsContact C-N 3.35Å; M175-D177 PolarHBondContact O-N 2.97Å; D177-G180 PolarHBondContact O-N 3.39Å; D177-L181 VanDerWaalsContact O-CD1 3.24Å; D177-L181 WeakPolarHBondContact O-CD1 3.49Å; D177-L181 PolarHBondContact O-N 3.34Å |
| 178 | K | 98.4 | Very high | 97.2 | Very high | 139 Ų | 139 | 104.9 Ų | 104.9 | 60% | 0.604 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.1 | -46.7 | 174.7 | 176 | -167.5 | 169.2 | -167.1 | 0 | 111.8 | K174 M175 L181 Q182 | K174-K178 VanDerWaalsContact O-CB 3.26Å; K174-K178 WeakPolarHBondContact O-CB 3.26Å; K174-K178 PolarHBondContact O-N 2.93Å; M175-K178 WeakPolarHBondContact O-CB 3.38Å; M175-K178 PolarHBondContact O-N 2.91Å; K178-L181 PolarHBondContact O-N 2.91Å; K178-Q182 VanDerWaalsContact O-CB 3.32Å; K178-Q182 WeakPolarHBondContact O-CB 3.24Å; K178-Q182 PolarHBondContact O-N 3.22Å |
| 179 | E | 98.1 | Very high | 97.4 | Very high | 115 Ų | 115 | 104.2 Ų | 104.2 | 54% | 0.537 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 178.3 | -73.7 | 167.2 | -176 | 0 | 0 | 111.5 | M175 K176 Q182 S183 | M175-E179 WeakPolarHBondContact O-CG 3.44Å; M175-E179 PolarHBondContact O-N 3.42Å; K176-E179 PolarHBondContact O-N 2.98Å; E179-Q182 PolarHBondContact O-N 2.86Å; E179-S183 WeakPolarHBondContact O-CB 3.37Å; E179-S183 PolarHBondContact O-N 3.49Å |
| 180 | G | 98.2 | Very high | 97.5 | Very high | 42 Ų | 42 | 104.3 Ų | 104.3 | 43% | 0.433 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.8 | -47.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | K176 D177 Q182 S183 L184 | K176-G180 PolarHBondContact O-N 3.2Å; D177-G180 PolarHBondContact O-N 3.39Å; G180-Q182 PolarHBondContact O-N 3.34Å; G180-S183 PolarHBondContact O-N 3.32Å; G180-L184 WeakPolarHBondContact O-CB 3.32Å; G180-L184 PolarHBondContact O-N 3.04Å |
| 181 | L | 98.3 | Very high | 97.5 | Very high | 126 Ų | 126 | 106.2 Ų | 106.2 | 66% | 0.66 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.1 | -40.1 | 175.7 | -95.6 | 73.2 | 0 | 0 | 0 | 112.2 | D177 K178 L184 Y185 | D177-L181 VanDerWaalsContact O-CD1 3.24Å; D177-L181 WeakPolarHBondContact O-CD1 3.49Å; D177-L181 PolarHBondContact O-N 3.34Å; K178-L181 PolarHBondContact O-N 2.91Å; L181-L184 PolarHBondContact O-N 2.98Å; L181-Y185 WeakPolarHBondContact O-CB 3.39Å; L181-Y185 PolarHBondContact O-N 2.86Å |
| 182 | Q | 97.8 | Very high | 97.2 | Very high | 105 Ų | 105 | 108 Ų | 108 | 49% | 0.491 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68.9 | -38.5 | 179.6 | -170.4 | 163.2 | 10.7 | 0 | 0 | 111.6 | K178 E179 G180 Y185 N186 | K178-Q182 VanDerWaalsContact O-CB 3.32Å; K178-Q182 WeakPolarHBondContact O-CB 3.24Å; K178-Q182 PolarHBondContact O-N 3.22Å; E179-Q182 PolarHBondContact O-N 2.86Å; G180-Q182 PolarHBondContact O-N 3.34Å; Q182-Y185 PolarHBondContact O-N 3.29Å; Q182-N186 WeakPolarHBondContact O-CB 3.45Å; Q182-N186 PolarHBondContact O-N 3.42Å; Q182-N186 PolarHBondContact O-ND2 2.89Å |
| 183 | S | 97.9 | Very high | 97 | Very high | 78 Ų | 78 | 105.1 Ų | 105.1 | 55% | 0.545 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 171.5 | -173.5 | 0 | 0 | 0 | 0 | 111.9 | E179 G180 Y185 N186 N187 | E179-S183 WeakPolarHBondContact O-CB 3.37Å; E179-S183 PolarHBondContact O-N 3.49Å; G180-S183 PolarHBondContact O-N 3.32Å; S183-Y185 PolarHBondContact O-N 3.45Å; S183-N186 PolarHBondContact O-N 2.98Å; S183-N187 WeakPolarHBondContact O-CB 3.44Å; S183-N187 PolarHBondContact O-N 3.38Å |
| 184 | L | 97.8 | Very high | 96.6 | Very high | 116 Ų | 116 | 101.8 Ų | 101.8 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.3 | -44.5 | 175.7 | 177.5 | 61.3 | 0 | 0 | 0 | 112.1 | G180 L181 N187 L188 | G180-L184 WeakPolarHBondContact O-CB 3.32Å; G180-L184 PolarHBondContact O-N 3.04Å; L181-L184 PolarHBondContact O-N 2.98Å; L184-N187 PolarHBondContact O-N 3.25Å; L184-L188 WeakPolarHBondContact O-CB 3.34Å; L184-L188 PolarHBondContact O-N 2.84Å |
| 185 | Y | 97.9 | Very high | 96.1 | Very high | 144 Ų | 144 | 104.3 Ų | 104.3 | 57% | 0.565 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.1 | -50 | 175.6 | 172.5 | -92.9 | 0 | 0 | 0 | 111.4 | L181 Q182 S183 N187 L188 Q189 | L181-Y185 WeakPolarHBondContact O-CB 3.39Å; L181-Y185 PolarHBondContact O-N 2.86Å; Q182-Y185 PolarHBondContact O-N 3.29Å; S183-Y185 PolarHBondContact O-N 3.45Å; Y185-N187 PolarHBondContact O-N 2.88Å; Y185-L188 PolarHBondContact O-N 3.46Å; Y185-Q189 WeakPolarHBondContact O-CB 3.38Å; Y185-Q189 PolarHBondContact O-N 3.5Å |
| 186 | N | 97.4 | Very high | 95.2 | Very high | 84 Ų | 84 | 107.4 Ų | 107.4 | 45% | 0.449 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 178.6 | -71.3 | -22.8 | 0 | 0 | 0 | 111.7 | Q182 S183 Q189 Q190 | Q182-N186 WeakPolarHBondContact O-CB 3.45Å; Q182-N186 PolarHBondContact O-N 3.42Å; Q182-N186 PolarHBondContact O-ND2 2.89Å; S183-N186 PolarHBondContact O-N 2.98Å; N186-Q189 PolarHBondContact O-N 3.43Å; N186-Q190 WeakPolarHBondContact O-CB 3.47Å; N186-Q190 PolarHBondContact O-N 2.93Å |
| 187 | N | 97.3 | Very high | 94 | Very high | 76 Ų | 76 | 106.3 Ų | 106.3 | 41% | 0.406 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 177.5 | -171.2 | -89.6 | 0 | 0 | 0 | 111.6 | S183 L184 Y185 Q190 Q191 | S183-N187 WeakPolarHBondContact O-CB 3.44Å; S183-N187 PolarHBondContact O-N 3.38Å; L184-N187 PolarHBondContact O-N 3.25Å; Y185-N187 PolarHBondContact O-N 2.88Å; N187-Q190 WeakPolarHBondContact O-CB 3.4Å; N187-Q190 PolarHBondContact O-N 3.39Å; N187-Q191 WeakPolarHBondContact O-CG 3.43Å; N187-Q191 PolarHBondContact O-N 2.93Å; N187-Q191 PolarHBondContact OD1-NE2 3.35Å |
| 188 | L | 96.7 | Very high | 92.5 | Very high | 75 Ų | 75 | 105.4 Ų | 105.4 | 39% | 0.393 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 178.9 | -177.4 | 59.8 | 0 | 0 | 0 | 111.8 | L184 Y185 Q190 Q191 Y192 | L184-L188 WeakPolarHBondContact O-CB 3.34Å; L184-L188 PolarHBondContact O-N 2.84Å; Y185-L188 PolarHBondContact O-N 3.46Å; L188-Q190 VanDerWaalsContact C-N 3.32Å; L188-Q190 PolarHBondContact O-N 2.95Å; L188-Q191 PolarHBondContact O-N 3.36Å; L188-Y192 HydrophobicContact CD1-CD2 4.05Å; L188-Y192 HydrophobicContact CD1-CE2 3.6Å; L188-Y192 HydrophobicContact CD2-CE2 4.05Å; L188-Y192 HydrophobicContact CG-CD2 3.9Å; L188-Y192 HydrophobicContact CG-CE2 3.56Å; L188-Y192 WeakPolarHBondContact O-CD2 3.18Å; L188-Y192 PolarHBondContact O-N 3.1Å |
| 189 | Q | 96.4 | Very high | 90.7 | Very high | 103 Ų | 103 | 102.5 Ų | 102.5 | 48% | 0.481 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 173.7 | -174.3 | 178.4 | 3.8 | 0 | 0 | 111.4 | Y185 N186 Y192 A193 | Y185-Q189 WeakPolarHBondContact O-CB 3.38Å; Y185-Q189 PolarHBondContact O-N 3.5Å; N186-Q189 PolarHBondContact O-N 3.43Å; Q189-Y192 PolarHBondContact O-N 2.93Å; Q189-A193 PolarHBondContact O-N 2.94Å |
| 190 | Q | 95.6 | Very high | 88.7 | Confident | 128 Ų | 128 | 100.1 Ų | 100.1 | 60% | 0.598 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -45.3 | 174.3 | -169.3 | 178.7 | 33.7 | 0 | 0 | 111.4 | N186 N187 L188 Y192 A193 S194 | N186-Q190 WeakPolarHBondContact O-CB 3.47Å; N186-Q190 PolarHBondContact O-N 2.93Å; N187-Q190 WeakPolarHBondContact O-CB 3.4Å; N187-Q190 PolarHBondContact O-N 3.39Å; L188-Q190 VanDerWaalsContact C-N 3.32Å; L188-Q190 PolarHBondContact O-N 2.95Å; Q190-Y192 VanDerWaalsContact C-N 3.32Å; Q190-Y192 PolarHBondContact O-N 3.46Å; Q190-A193 PolarHBondContact O-N 3.24Å; Q190-S194 PolarHBondContact O-N 3.29Å; Q190-S194 PolarHBondContact O-OG 3.35Å; Q190-S194 VanDerWaalsContact O-OG 3.14Å |
| 191 | Q | 95.1 | Very high | 86.4 | Confident | 97 Ų | 97 | 105.5 Ų | 105.5 | 45% | 0.453 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59 | -41.2 | 175.3 | -70.4 | -177.1 | 34.5 | 0 | 0 | 112.5 | N187 L188 R195 | N187-Q191 WeakPolarHBondContact O-CG 3.43Å; N187-Q191 PolarHBondContact O-N 2.93Å; N187-Q191 PolarHBondContact OD1-NE2 3.35Å; L188-Q191 PolarHBondContact O-N 3.36Å; Q191-R195 VanDerWaalsContact O-CB 3.29Å; Q191-R195 WeakPolarHBondContact O-CB 3.46Å; Q191-R195 PolarHBondContact O-N 2.85Å |
| 192 | Y | 92.6 | Very high | 83.9 | Confident | 142 Ų | 142 | 106.4 Ų | 106.4 | 56% | 0.557 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.5 | -46.3 | 175.3 | -80.1 | -62.7 | 0 | 0 | 0 | 111.8 | L188 Q189 Q190 R195 Q196 | L188-Y192 HydrophobicContact CD1-CD2 4.05Å; L188-Y192 HydrophobicContact CD1-CE2 3.6Å; L188-Y192 HydrophobicContact CD2-CE2 4.05Å; L188-Y192 HydrophobicContact CG-CD2 3.9Å; L188-Y192 HydrophobicContact CG-CE2 3.56Å; L188-Y192 WeakPolarHBondContact O-CD2 3.18Å; L188-Y192 PolarHBondContact O-N 3.1Å; Q189-Y192 PolarHBondContact O-N 2.93Å; Q190-Y192 VanDerWaalsContact C-N 3.32Å; Q190-Y192 PolarHBondContact O-N 3.46Å; Y192-R195 PolarHBondContact O-N 3.32Å; Y192-Q196 WeakPolarHBondContact O-CG 3.29Å; Y192-Q196 PolarHBondContact O-N 3.14Å |
| 193 | A | 92.1 | Very high | 81.4 | Confident | 46 Ų | 46 | 106.6 Ų | 106.6 | 38% | 0.38 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -59.4 | -49.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q189 Q190 R195 Q196 L197 | Q189-A193 PolarHBondContact O-N 2.94Å; Q190-A193 PolarHBondContact O-N 3.24Å; A193-R195 VanDerWaalsContact C-N 3.3Å; A193-R195 PolarHBondContact O-N 2.98Å; A193-Q196 PolarHBondContact O-N 2.89Å; A193-L197 WeakPolarHBondContact O-CG 3.36Å; A193-L197 PolarHBondContact O-N 3.25Å; A193-L197 VanDerWaalsContact O-N 3.1Å |
| 194 | S | 89.4 | Confident | 78.9 | Confident | 69 Ų | 69 | 109.8 Ų | 109.8 | 48% | 0.483 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -59.6 | -38.4 | 175.9 | -61 | 0 | 0 | 0 | 0 | 112.6 | Q190 L197 A198 | Q190-S194 PolarHBondContact O-N 3.29Å; Q190-S194 PolarHBondContact O-OG 3.35Å; Q190-S194 VanDerWaalsContact O-OG 3.14Å; S194-L197 PolarHBondContact O-N 3.39Å; S194-A198 WeakPolarHBondContact O-CB 3.45Å; S194-A198 PolarHBondContact O-N 2.95Å |
| 195 | R | 88 | Confident | 76.5 | Confident | 173 Ų | 173 | 109 Ų | 109 | 65% | 0.653 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -70.7 | -35 | 178.7 | -164.8 | -179 | -61.4 | -100.8 | 2.6 | 112.6 | Q191 Y192 A193 A198 A199 | Q191-R195 VanDerWaalsContact O-CB 3.29Å; Q191-R195 WeakPolarHBondContact O-CB 3.46Å; Q191-R195 PolarHBondContact O-N 2.85Å; Y192-R195 PolarHBondContact O-N 3.32Å; A193-R195 VanDerWaalsContact C-N 3.3Å; A193-R195 PolarHBondContact O-N 2.98Å; R195-A198 PolarHBondContact O-N 3.35Å; R195-A199 WeakPolarHBondContact O-CB 3.35Å; R195-A199 PolarHBondContact O-N 3.24Å |
| 196 | Q | 79.2 | Confident | 74.1 | Confident | 156 Ų | 156 | 109.2 Ų | 109.2 | 73% | 0.729 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -66.2 | -42.1 | 173.2 | -70.2 | -164.9 | 107.5 | 0 | 0 | 111.8 | Y192 A193 A198 A199 | Y192-Q196 WeakPolarHBondContact O-CG 3.29Å; Y192-Q196 PolarHBondContact O-N 3.14Å; A193-Q196 PolarHBondContact O-N 2.89Å; Q196-A198 VanDerWaalsContact C-N 3.35Å; Q196-A198 PolarHBondContact O-N 2.96Å; Q196-A199 PolarHBondContact O-N 2.97Å |
| 197 | L | 72.6 | Confident | 71.5 | Confident | 133 Ų | 133 | 110.7 Ų | 110.7 | 70% | 0.696 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.3 | -36.8 | 175.3 | -65.9 | 170.8 | 0 | 0 | 0 | 112.5 | A193 S194 H201 | A193-L197 WeakPolarHBondContact O-CG 3.36Å; A193-L197 PolarHBondContact O-N 3.25Å; A193-L197 VanDerWaalsContact O-N 3.1Å; S194-L197 PolarHBondContact O-N 3.39Å; L197-H201 PolarHBondContact O-ND1 3.46Å |
| 198 | A | 66.8 | Low | 69 | Low | 66 Ų | 66 | 115.1 Ų | 115.1 | 55% | 0.545 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -70.8 | -34.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S194 R195 Q196 G200 H201 | S194-A198 WeakPolarHBondContact O-CB 3.45Å; S194-A198 PolarHBondContact O-N 2.95Å; R195-A198 PolarHBondContact O-N 3.35Å; Q196-A198 VanDerWaalsContact C-N 3.35Å; Q196-A198 PolarHBondContact O-N 2.96Å; A198-G200 PolarHBondContact O-N 3.1Å; A198-H201 PolarHBondContact O-N 3.25Å; A198-H201 VanDerWaalsContact O-N 3.08Å |
| 199 | A | 59.8 | Low | 66.6 | Low | 78 Ų | 78 | 117 Ų | 117 | 65% | 0.645 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.5 | -21.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | R195 Q196 H201 | R195-A199 WeakPolarHBondContact O-CB 3.35Å; R195-A199 PolarHBondContact O-N 3.24Å; Q196-A199 PolarHBondContact O-N 2.97Å; A199-H201 PolarHBondContact O-N 3.46Å |
| 200 | G | 55.5 | Low | 64.1 | Low | 65 Ų | 65 | 121 Ų | 121 | 67% | 0.67 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -10.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 115 | A198 | A198-G200 PolarHBondContact O-N 3.1Š|
| 201 | H | 50.9 | Low | 62 | Low | 156 Ų | 156 | 120.3 Ų | 120.3 | 72% | 0.722 | 66% | 0.657 | S | S | * | * | trans | -116.8 | 48.1 | -173 | -69.1 | 92.6 | 0 | 0 | 0 | 112.9 | L197 A198 A199 P203 | L197-H201 PolarHBondContact O-ND1 3.46Å; A198-H201 PolarHBondContact O-N 3.25Å; A198-H201 VanDerWaalsContact O-N 3.08Å; A199-H201 PolarHBondContact O-N 3.46Å; H201-P203 WeakPolarHBondContact O-CD 3.03Å | ||
| 202 | H | 44.2 | Very low | 59.4 | Low | 144 Ų | 144 | 123 Ų | 123 | 67% | 0.667 | 68% | 0.675 | S | S | * | * | trans | -84.5 | 105.5 | 166 | -169.3 | -12.5 | 0 | 0 | 0 | 109.8 | Q204 | H202-Q204 PolarHBondContact O-N 2.94Å; H202-Q204 VanDerWaalsContact O-N 3.1Å | ||
| 203 | P | 46.5 | Very low | 57 | Low | 110 Ų | 110 | 124.6 Ų | 124.6 | 71% | 0.714 | 69% | 0.687 | S | S | * | * | trans | -66.2 | 113.3 | 161.7 | 28.4 | -32.6 | 0 | 0 | 0 | 107.8 | H201 | H201-P203 WeakPolarHBondContact O-CD 3.03Š| ||
| 204 | Q | 46.1 | Very low | 54.6 | Low | 145 Ų | 145 | 128.8 Ų | 128.8 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | trans | -9.5 | 120.7 | 160.7 | -177.1 | 177.5 | 2.2 | 0 | 0 | 115.2 | H202 H206 | H202-Q204 PolarHBondContact O-N 2.94Å; H202-Q204 VanDerWaalsContact O-N 3.1Å; Q204-H206 PolarHBondContact O-N 3.34Å | ||
| 205 | P | 47.1 | Very low | 52.1 | Low | 100 Ų | 100 | 133.1 Ų | 133.1 | 65% | 0.649 | 72% | 0.715 | S | S | * | * | trans | -66.5 | 118.1 | 169.7 | 28.1 | -32 | 0 | 0 | 0 | 109.1 | ||||
| 206 | H | 45.7 | Very low | 49.8 | Very low | 147 Ų | 147 | 132.6 Ų | 132.6 | 68% | 0.681 | 72% | 0.72 | S | S | * | * | trans | -66.4 | 134.4 | 174.1 | -74.3 | -61 | 0 | 0 | 0 | 110.5 | Q204 H208 | Q204-H206 PolarHBondContact O-N 3.34Å; H206-H208 PolarHBondContact O-N 3.08Å | ||
| 207 | P | 44.5 | Very low | 48.3 | Very low | 116 Ų | 116 | 129.3 Ų | 129.3 | 75% | 0.753 | 71% | 0.712 | S | S | * | * | trans | -76.9 | 112 | 175 | 30.7 | -32 | 0 | 0 | 0 | 109.6 | ||||
| 208 | H | 44.9 | Very low | 46.5 | Very low | 168 Ų | 168 | 131.1 Ų | 131.1 | 78% | 0.778 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -89.5 | 137.2 | 165.2 | -72.6 | -40.6 | 0 | 0 | 0 | 110.3 | H206 | H206-H208 PolarHBondContact O-N 3.08Š|
| 209 | P | 45.2 | Very low | 44.8 | Very low | 116 Ų | 116 | 133.3 Ų | 133.3 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 134.8 | -172.5 | 30.5 | -34.6 | 0 | 0 | 0 | 111.9 | ||
| 210 | H | 45.1 | Very low | 43.8 | Very low | 186 Ų | 186 | 138.4 Ų | 138.4 | 86% | 0.861 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 134.6 | 163.2 | -95.1 | -90.5 | 0 | 0 | 0 | 110.9 | ||
| 211 | P | 49.8 | Very low | 43.7 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 73% | 0.734 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 135.5 | 146.8 | 32.1 | -28 | 0 | 0 | 0 | 109.7 | ||
| 212 | N | 40.9 | Very low | 44.1 | Very low | 155 Ų | 155 | 138.1 Ų | 138.1 | 83% | 0.829 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 147.8 | 173.1 | -83 | -33.5 | 0 | 0 | 0 | 112.7 | ||
| 213 | Q | 42.9 | Very low | 43.7 | Very low | 174 Ų | 174 | 138.7 Ų | 138.7 | 81% | 0.813 | 74% | 0.743 | S | S | * | * | -166.3 | 135 | 116.1 | -106.9 | 173.4 | 83.4 | 0 | 0 | 114.5 | |||||
| 214 | L | 41.4 | Very low | 43.3 | Very low | 134 Ų | 134 | 139.2 Ų | 139.2 | 70% | 0.702 | 74% | 0.736 | S | S | * | * | trans | 60.7 | 102.6 | 165 | -77 | 63.5 | 0 | 0 | 0 | 117.2 | ||||
| 215 | Q | 37.3 | Very low | 42.6 | Very low | 160 Ų | 160 | 140.2 Ų | 140.2 | 75% | 0.748 | 74% | 0.738 | S | S | * | * | 56.7 | 103 | 78.5 | -61.8 | -176.8 | 17.9 | 0 | 0 | 111.9 | |||||
| 216 | H | 38.7 | Very low | 42 | Very low | 163 Ų | 163 | 141.3 Ų | 141.3 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | 134.1 | 169 | 61.1 | -93.6 | -36.1 | 0 | 0 | 0 | 106.5 | |||||
| 217 | P | 48.5 | Very low | 41.4 | Very low | 87 Ų | 87 | 142.2 Ų | 142.2 | 57% | 0.565 | 74% | 0.742 | S | S | * | * | -131.1 | -159.3 | -70 | 30.8 | -7.5 | 0 | 0 | 0 | 113 | |||||
| 218 | H | 34.1 | Very low | 40.9 | Very low | 170 Ų | 170 | 143.4 Ų | 143.4 | 79% | 0.787 | 74% | 0.743 | S | S | * | * | trans | 81 | 145.6 | 170.1 | -41.3 | -63.9 | 0 | 0 | 0 | 116.3 | ||||
| 219 | S | 32.6 | Very low | 40.6 | Very low | 112 Ų | 112 | 143.6 Ų | 143.6 | 78% | 0.783 | 74% | 0.744 | S | S | * | * | cis | -167.1 | 141.9 | -11.6 | 38.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 220 | H | 37.1 | Very low | 39.8 | Very low | 185 Ų | 185 | 141.9 Ų | 141.9 | 86% | 0.856 | 75% | 0.747 | S | S | * | * | trans | -91.2 | 174.4 | 159.1 | -78.4 | -65.9 | 0 | 0 | 0 | 109.8 | ||||
| 221 | P | 54.4 | Low | 39.3 | Very low | 112 Ų | 112 | 138.8 Ų | 138.8 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | cis | -132 | -125.2 | -30.4 | 35.9 | -14.3 | 0 | 0 | 0 | 109.1 | ||||
| 222 | P | 59.2 | Low | 38.4 | Very low | 103 Ų | 103 | 137 Ų | 137 | 67% | 0.669 | 75% | 0.748 | S | S | * | * | -114.7 | -167.9 | -62.4 | 35.3 | -18.3 | 0 | 0 | 0 | 112.2 | |||||
| 223 | M | 35.2 | Very low | 38.1 | Very low | 156 Ų | 156 | 137.7 Ų | 137.7 | 77% | 0.768 | 75% | 0.75 | S | S | * | * | trans | 149.7 | 150.5 | 140.1 | -78.6 | -44.2 | -104 | 0 | 0 | 110.5 | ||||
| 224 | H | 38.1 | Very low | 37.9 | Very low | 121 Ų | 121 | 137.3 Ų | 137.3 | 56% | 0.56 | 75% | 0.753 | S | S | * | * | cis | -176.7 | 128 | -20.1 | -179.8 | -100.9 | 0 | 0 | 0 | 109.7 | ||||
| 225 | F | 31.6 | Very low | 38.1 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 73% | 0.728 | 76% | 0.761 | S | S | * | * | trans | 64.4 | 166.7 | 159.7 | -80.1 | -150.4 | 0 | 0 | 0 | 116.9 | ||||
| 226 | L | 35.1 | Very low | 37.7 | Very low | 124 Ų | 124 | 133.6 Ų | 133.6 | 65% | 0.649 | 77% | 0.766 | S | S | * | * | cis | -155.5 | 154 | 15.4 | -133.5 | 145 | 0 | 0 | 0 | 111.5 | ||||
| 227 | Q | 33.4 | Very low | 37.5 | Very low | 165 Ų | 165 | 131.4 Ų | 131.4 | 77% | 0.771 | 77% | 0.768 | S | S | * | * | trans | 70.1 | 143.9 | 153 | -121.5 | 138.2 | 24.2 | 0 | 0 | 118.6 | ||||
| 228 | D | 32.9 | Very low | 36.8 | Very low | 142 Ų | 142 | 134 Ų | 134 | 76% | 0.759 | 78% | 0.783 | S | S | * | * | cis | -139.4 | 160.5 | 15.1 | -165.2 | 32.5 | 0 | 0 | 0 | 113.6 | ||||
| 229 | E | 39.1 | Very low | 36.6 | Very low | 172 Ų | 172 | 131.6 Ų | 131.6 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -104.7 | 157.1 | -176.8 | -64 | -147.2 | 133.1 | 0 | 0 | 113.9 | ||||
| 230 | G | 29.5 | Very low | 36.4 | Very low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | -172 | 70.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 231 | C | 34 | Very low | 36.1 | Very low | 121 Ų | 121 | 125 Ų | 125 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -67.1 | 153.1 | -170.4 | -65.7 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 232 | G | 30.5 | Very low | 35.4 | Very low | 76 Ų | 76 | 125.4 Ų | 125.4 | 78% | 0.784 | 79% | 0.789 | S | S | * | * | trans | -157.6 | 48.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 233 | L | 34.3 | Very low | 34.1 | Very low | 168 Ų | 168 | 129.3 Ų | 129.3 | 88% | 0.88 | 80% | 0.798 | S | S | * | * | trans | 25.6 | 120.1 | 157.7 | -60.8 | 169.8 | 0 | 0 | 0 | 121.2 | ||||
| 234 | L | 39.9 | Very low | 34.9 | Very low | 166 Ų | 166 | 126.8 Ų | 126.8 | 87% | 0.869 | 80% | 0.795 | S | S | * | * | trans | -94.8 | 163.3 | 152.8 | -54.6 | 172.6 | 0 | 0 | 0 | 109.3 | ||||
| 235 | P | 44.1 | Very low | 35.2 | Very low | 135 Ų | 135 | 127.1 Ų | 127.1 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | -153.7 | 161.8 | 82.6 | 39.1 | -19.9 | 0 | 0 | 0 | 117.2 | |||||
| 236 | G | 30.4 | Very low | 35.8 | Very low | 82 Ų | 82 | 127.3 Ų | 127.3 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | trans | 168.1 | 112.2 | 164.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 237 | S | 34.5 | Very low | 37 | Very low | 116 Ų | 116 | 130.1 Ų | 130.1 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | -147.8 | 152.9 | -173.8 | -178.4 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 238 | V | 32.8 | Very low | 37.1 | Very low | 143 Ų | 143 | 125.5 Ų | 125.5 | 87% | 0.867 | 82% | 0.816 | S | S | * | * | trans | 70.1 | 144.7 | 172.7 | 109.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 239 | C | 30.7 | Very low | 38.3 | Very low | 119 Ų | 119 | 129.5 Ų | 129.5 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | cis | -145.6 | -177.9 | 3.3 | 61.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 240 | G | 28.6 | Very low | 38.9 | Very low | 77 Ų | 77 | 127.5 Ų | 127.5 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | cis | 150.1 | 106.2 | -10.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 241 | G | 29.8 | Very low | 40.2 | Very low | 81 Ų | 81 | 129.7 Ų | 129.7 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | 100.6 | 151.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 242 | S | 39.5 | Very low | 41.3 | Very low | 121 Ų | 121 | 130.8 Ų | 130.8 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | cis | -168.9 | 133.5 | -4.3 | 53.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 243 | E | 32.8 | Very low | 42.1 | Very low | 184 Ų | 184 | 131.8 Ų | 131.8 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -152.9 | 130.5 | 138.3 | -170.9 | 153.6 | 93.9 | 0 | 0 | 109.2 | V245 | E243-V245 HydrophobicContact CG-CG2 4.46Š| ||
| 244 | S | 51.5 | Low | 43.1 | Very low | 103 Ų | 103 | 128.7 Ų | 128.7 | 72% | 0.72 | 80% | 0.795 | S | S | * | * | trans | -98 | 126.3 | 176.5 | -174.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 245 | V | 44.2 | Very low | 43.3 | Very low | 128 Ų | 128 | 129.1 Ų | 129.1 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | -128.5 | 111.4 | 162.9 | -161.9 | 0 | 0 | 0 | 0 | 107.2 | E243 | E243-V245 HydrophobicContact CG-CG2 4.46Š| ||
| 246 | E | 45.1 | Very low | 43.8 | Very low | 170 Ų | 170 | 130.5 Ų | 130.5 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | -71.9 | 172.2 | 179.6 | -64.1 | -164.2 | 151.4 | 0 | 0 | 112.1 | G248 | E246-G248 PolarHBondContact O-N 3.25Š| ||
| 247 | E | 58.7 | Low | 44.5 | Very low | 183 Ų | 183 | 134.1 Ų | 134.1 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -45.8 | 89.5 | -179.6 | -58.2 | 177.9 | 164.7 | 0 | 0 | 114.1 | W249 | E247-W249 PolarHBondContact O-N 3.25Š| ||
| 248 | G | 37.1 | Very low | 44.8 | Very low | 69 Ų | 69 | 137 Ų | 137 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | trans | -90 | 87.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E246 V250 | E246-G248 PolarHBondContact O-N 3.25Å; G248-V250 PolarHBondContact O-N 3.49Å | ||
| 249 | W | 57.9 | Low | 45.4 | Very low | 226 Ų | 226 | 136.7 Ų | 136.7 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | -61.7 | 124.9 | 165.9 | -74.6 | 88.9 | 0 | 0 | 0 | 110.7 | E247 V251 | E247-W249 PolarHBondContact O-N 3.25Å; W249-V251 PolarHBondContact O-N 3.4Å; W249-V251 VanDerWaalsContact O-N 3.1Å | ||
| 250 | V | 51.8 | Low | 46.2 | Very low | 130 Ų | 130 | 137.6 Ų | 137.6 | 79% | 0.788 | 82% | 0.816 | S | S | * | * | trans | -76.4 | 99.3 | 173.5 | 178.8 | 0 | 0 | 0 | 0 | 109.3 | G248 I252 | G248-V250 PolarHBondContact O-N 3.49Å; V250-I252 HydrophobicContact CG1-CG1 4.33Å | ||
| 251 | V | 56.4 | Low | 47.1 | Very low | 126 Ų | 126 | 141 Ų | 141 | 76% | 0.764 | 82% | 0.817 | S | S | * | * | trans | -84.5 | 112.7 | 173.4 | 179.3 | 0 | 0 | 0 | 0 | 109.4 | W249 | W249-V251 PolarHBondContact O-N 3.4Å; W249-V251 VanDerWaalsContact O-N 3.1Å | ||
| 252 | I | 56.9 | Low | 48.2 | Very low | 144 Ų | 144 | 144.5 Ų | 144.5 | 74% | 0.738 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 120.1 | 174.2 | -59.2 | 170.2 | 0 | 0 | 0 | 108.4 | V250 | V250-I252 HydrophobicContact CG1-CG1 4.33Š|
| 253 | P | 46.8 | Very low | 48.7 | Very low | 96 Ų | 96 | 146 Ų | 146 | 62% | 0.623 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 150.5 | 179.3 | 30.4 | -34.3 | 0 | 0 | 0 | 111.9 | H255 | P253-H255 PolarHBondContact O-N 3.17Š|
| 254 | P | 54.8 | Low | 49.8 | Very low | 103 Ų | 103 | 143.5 Ų | 143.5 | 67% | 0.669 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 118.9 | -178.8 | 28.1 | -33.8 | 0 | 0 | 0 | 111.9 | H256 | P254-H256 PolarHBondContact O-N 3.1Å; P254-H256 VanDerWaalsContact O-N 3.16Å; P254-H256 PolarHBondContact O-ND1 3.28Å |
| 255 | H | 44.1 | Very low | 49.6 | Very low | 176 Ų | 176 | 146.4 Ų | 146.4 | 82% | 0.815 | 82% | 0.818 | S | S | * | * | trans | -58.9 | 115.8 | 167.1 | -97.3 | -102.5 | 0 | 0 | 0 | 110 | P253 | P253-H255 PolarHBondContact O-N 3.17Š| ||
| 256 | H | 54.8 | Low | 50.1 | Low | 164 Ų | 164 | 147.8 Ų | 147.8 | 76% | 0.759 | 82% | 0.821 | S | S | * | * | trans | -89.5 | 112.1 | 165.7 | -70.8 | 65.7 | 0 | 0 | 0 | 107.5 | P254 | P254-H256 PolarHBondContact O-N 3.1Å; P254-H256 VanDerWaalsContact O-N 3.16Å; P254-H256 PolarHBondContact O-ND1 3.28Å | ||
| 257 | N | 45.6 | Very low | 50.5 | Low | 158 Ų | 158 | 145.9 Ų | 145.9 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | -75 | 128.6 | 167.1 | -70.3 | -25.9 | 0 | 0 | 0 | 108.6 | ||||
| 258 | A | 40.8 | Very low | 49.7 | Very low | 176 Ų | 176 | 142.5 Ų | 142.5 | 100% | 1.455 | 82% | 0.82 | S | S | * | * | trans | -138.4 | 0 | 169.2 | 0 | 0 | 0 | 0 | 0 | 108.1 |
Retrieved 258 of 258 residues in 73.8 ms
(Link to these results)