| 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 | 34.3 | Very low | 34.7 | Very low | 236 Ų | 236 | 165.3 Ų | 165.3 | 100% | 1.163 | 81% | 0.814 | S | S | * | * | 0 | 89.8 | 0 | -69.5 | -60.2 | -178.1 | 0 | 0 | 110.1 | |||||
| 2 | P | 42.3 | Very low | 34.1 | Very low | 115 Ų | 115 | 165 Ų | 165 | 75% | 0.747 | 82% | 0.818 | S | S | * | * | trans | -86.8 | -179.5 | 163.9 | 39.9 | -33.5 | 0 | 0 | 0 | 109.2 | ||||
| 3 | R | 30.7 | Very low | 33.7 | Very low | 212 Ų | 212 | 159.8 Ų | 159.8 | 80% | 0.8 | 81% | 0.808 | S | S | * | * | cis | -162.7 | 152.7 | 27.3 | -150.9 | 167.1 | -162.5 | 157.7 | 1.9 | 110.3 | ||||
| 4 | S | 34 | Very low | 33.4 | Very low | 102 Ų | 102 | 156.2 Ų | 156.2 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -70.6 | 156.9 | 167.7 | 46 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 5 | F | 30.7 | Very low | 33.3 | Very low | 185 Ų | 185 | 158.9 Ų | 158.9 | 81% | 0.811 | 81% | 0.808 | S | S | * | * | trans | -150.8 | 127.1 | 150 | -94.6 | -67.2 | 0 | 0 | 0 | 113.9 | ||||
| 6 | L | 39.6 | Very low | 33.2 | Very low | 163 Ų | 163 | 161.5 Ų | 161.5 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -71.4 | -175 | 156.5 | -85.9 | 158.5 | 0 | 0 | 0 | 110.6 | ||||
| 7 | V | 32.4 | Very low | 33 | Very low | 118 Ų | 118 | 159.7 Ų | 159.7 | 72% | 0.715 | 81% | 0.814 | S | S | * | * | trans | 109.3 | 131.8 | 164.5 | 172.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 8 | K | 34.7 | Very low | 32.5 | Very low | 175 Ų | 175 | 158 Ų | 158 | 76% | 0.761 | 81% | 0.807 | S | S | * | * | cis | -157 | 163.6 | -10.5 | -114 | 173.7 | -152.8 | 166.3 | 0 | 109.6 | ||||
| 9 | K | 36.8 | Very low | 32.2 | Very low | 186 Ų | 186 | 161 Ų | 161 | 81% | 0.809 | 81% | 0.809 | S | S | * | * | trans | -62.4 | 146.1 | 159.4 | -65.1 | 174.1 | 177.2 | 176.3 | 0 | 110.3 | ||||
| 10 | H | 31.8 | Very low | 31.9 | Very low | 187 Ų | 187 | 156.8 Ų | 156.8 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -121.1 | 123.1 | 149.8 | -103.4 | -83.5 | 0 | 0 | 0 | 110.4 | ||||
| 11 | I | 34.7 | Very low | 31.8 | Very low | 139 Ų | 139 | 157.9 Ų | 157.9 | 71% | 0.713 | 80% | 0.797 | S | S | * | * | trans | -90.7 | 138 | 164.9 | -63.9 | 163.7 | 0 | 0 | 0 | 105.8 | ||||
| 12 | N | 27.3 | Very low | 31.7 | Very low | 162 Ų | 162 | 154.3 Ų | 154.3 | 87% | 0.866 | 78% | 0.782 | S | S | * | * | trans | -143.5 | 145.6 | 141.9 | -152 | -2.6 | 0 | 0 | 0 | 110.9 | ||||
| 13 | S | 28.6 | Very low | 31 | Very low | 98 Ų | 98 | 157.5 Ų | 157.5 | 69% | 0.685 | 79% | 0.787 | S | S | * | * | trans | -127.4 | 124.5 | -169.1 | -179.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 14 | S | 30.5 | Very low | 30.8 | Very low | 109 Ų | 109 | 152.3 Ų | 152.3 | 76% | 0.762 | 78% | 0.784 | S | S | * | * | trans | 174.5 | 128.1 | 174.3 | -90 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 15 | K | 31.8 | Very low | 30.8 | Very low | 197 Ų | 197 | 153.1 Ų | 153.1 | 86% | 0.857 | 79% | 0.787 | S | S | * | * | cis | -141.5 | 152.7 | 3 | -75 | 164.9 | 177.8 | 173.7 | 0 | 109 | ||||
| 16 | K | 30.8 | Very low | 30.7 | Very low | 200 Ų | 200 | 149.3 Ų | 149.3 | 87% | 0.87 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 145.5 | 162 | -61.2 | 178.4 | 179.2 | -179.5 | 0 | 109.6 | ||
| 17 | P | 30.6 | Very low | 30.3 | Very low | 131 Ų | 131 | 147.7 Ų | 147.7 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 129.1 | 141.3 | 31.4 | -24.6 | 0 | 0 | 0 | 109.1 | ||
| 18 | N | 23.3 | Very low | 30.2 | Very low | 129 Ų | 129 | 149.9 Ų | 149.9 | 69% | 0.69 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 132.5 | 164.7 | -179.5 | 9.3 | 0 | 0 | 0 | 107.1 | S20 | N18-S20 PolarHBondContact OD1-N 3.4Š|
| 19 | Y | 27 | Very low | 30.2 | Very low | 215 Ų | 215 | 149.1 Ų | 149.1 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -146.8 | 93 | 160.6 | -131.4 | -87.7 | 0 | 0 | 0 | 108.9 | ||||
| 20 | S | 25.8 | Very low | 29.8 | Very low | 76 Ų | 76 | 142.4 Ų | 142.4 | 53% | 0.531 | 76% | 0.755 | S | S | . | * | trans | -66.8 | 162 | 156.7 | -50.3 | 0 | 0 | 0 | 0 | 109.6 | N18 | N18-S20 PolarHBondContact OD1-N 3.4Š| ||
| 21 | E | 30.4 | Very low | 30.2 | Very low | 180 Ų | 180 | 139.5 Ų | 139.5 | 84% | 0.841 | 75% | 0.752 | S | S | * | * | trans | 65.4 | 90.2 | 160.6 | -62.1 | 173.7 | 163.2 | 0 | 0 | 116.8 | ||||
| 22 | L | 31.6 | Very low | 30.2 | Very low | 161 Ų | 161 | 141.6 Ų | 141.6 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | trans | -151.9 | 145.7 | 132.7 | -106.3 | 144.4 | 0 | 0 | 0 | 109.5 | ||||
| 23 | E | 27.5 | Very low | 30.7 | Very low | 182 Ų | 182 | 139.4 Ų | 139.4 | 85% | 0.85 | 74% | 0.74 | S | S | * | * | trans | -82 | 155.6 | -151.1 | -61.5 | 170.5 | 128.4 | 0 | 0 | 115 | ||||
| 24 | S | 27.2 | Very low | 31.2 | Very low | 104 Ų | 104 | 145.6 Ų | 145.6 | 73% | 0.727 | 75% | 0.75 | S | S | * | * | trans | -72.6 | 135 | 172 | -56.6 | 0 | 0 | 0 | 0 | 112.2 | T26 | S24-T26 PolarHBondContact O-N 3.27Š| ||
| 25 | P | 33.6 | Very low | 31.6 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 77% | 0.773 | 75% | 0.75 | S | S | * | * | trans | -87.7 | 93.5 | 145.7 | 29.9 | -26 | 0 | 0 | 0 | 109 | V27 | P25-V27 PolarHBondContact O-N 3.31Š| ||
| 26 | T | 29.5 | Very low | 32.2 | Very low | 105 Ų | 105 | 143 Ų | 143 | 64% | 0.644 | 75% | 0.747 | S | S | * | * | trans | -65.7 | 100.2 | 177 | -50.3 | 0 | 0 | 0 | 0 | 111 | S24 F28 | S24-T26 PolarHBondContact O-N 3.27Å; T26-F28 HydrophobicContact CG2-CD2 3.83Å; T26-F28 HydrophobicContact CG2-CE2 4.17Å; T26-F28 PolarHBondContact O-N 3.33Å | ||
| 27 | V | 31 | Very low | 32.5 | Very low | 129 Ų | 129 | 140.6 Ų | 140.6 | 78% | 0.782 | 74% | 0.743 | S | S | * | * | trans | -90.8 | 95.5 | 167.2 | -177.4 | 0 | 0 | 0 | 0 | 109.6 | P25 I29 | P25-V27 PolarHBondContact O-N 3.31Å; V27-I29 PolarHBondContact O-N 3.06Å | ||
| 28 | F | 29.4 | Very low | 32.6 | Very low | 164 Ų | 164 | 140.2 Ų | 140.2 | 72% | 0.719 | 74% | 0.74 | S | S | * | * | trans | -58.8 | 121.7 | 167 | -106.3 | -106.8 | 0 | 0 | 0 | 110.7 | T26 S30 | T26-F28 HydrophobicContact CG2-CD2 3.83Å; T26-F28 HydrophobicContact CG2-CE2 4.17Å; T26-F28 PolarHBondContact O-N 3.33Å; F28-S30 VanDerWaalsContact CD1-OG 3.3Å; F28-S30 WeakPolarHBondContact CD1-OG 3.3Å; F28-S30 WeakPolarHBondContact CE1-OG 3.45Å | ||
| 29 | I | 34.8 | Very low | 33.3 | Very low | 158 Ų | 158 | 141.5 Ų | 141.5 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | trans | -128.4 | 93.5 | 146.3 | -57.5 | -176.5 | 0 | 0 | 0 | 107.1 | V27 | V27-I29 PolarHBondContact O-N 3.06Š| ||
| 30 | S | 29.3 | Very low | 33.6 | Very low | 46 Ų | 46 | 136.4 Ų | 136.4 | 32% | 0.322 | 74% | 0.739 | S | S | . | * | trans | -70.8 | 143.8 | 176.2 | -72.3 | 0 | 0 | 0 | 0 | 111.8 | F28 Y32 | F28-S30 VanDerWaalsContact CD1-OG 3.3Å; F28-S30 WeakPolarHBondContact CD1-OG 3.3Å; F28-S30 WeakPolarHBondContact CE1-OG 3.45Å; S30-Y32 PolarHBondContact O-N 3.06Å | ||
| 31 | P | 40.2 | Very low | 34.1 | Very low | 126 Ų | 126 | 139.4 Ų | 139.4 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | trans | -80 | 84 | 172.4 | 33.4 | -33.8 | 0 | 0 | 0 | 110.7 | L33 | P31-L33 PolarHBondContact O-N 3.49Š| ||
| 32 | Y | 34.2 | Very low | 34.7 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 72% | 0.718 | 75% | 0.748 | S | S | * | * | trans | -72.6 | 110.9 | 165.1 | -72.5 | -83.7 | 0 | 0 | 0 | 108.8 | S30 | S30-Y32 PolarHBondContact O-N 3.06Š| ||
| 33 | L | 36.8 | Very low | 34.9 | Very low | 116 Ų | 116 | 135.1 Ų | 135.1 | 61% | 0.607 | 74% | 0.742 | S | S | * | * | 60.5 | 69 | 86 | -76.9 | 165.7 | 0 | 0 | 0 | 113.9 | P31 K35 | P31-L33 PolarHBondContact O-N 3.49Å; L33-K35 VanDerWaalsContact C-N 3.29Å; L33-K35 HydrophobicContact CD2-CD 3.88Å; L33-K35 HydrophobicContact CD2-CG 3.9Å; L33-K35 PolarHBondContact O-N 3.37Å | |||
| 34 | Y | 39.1 | Very low | 35.6 | Very low | 228 Ų | 228 | 134.6 Ų | 134.6 | 89% | 0.894 | 74% | 0.74 | S | S | * | * | trans | -87 | 74.4 | 150.6 | -82.3 | -83.5 | 0 | 0 | 0 | 109.9 | ||||
| 35 | K | 39.2 | Very low | 36.1 | Very low | 175 Ų | 175 | 135 Ų | 135 | 76% | 0.761 | 74% | 0.74 | S | S | * | * | trans | -88.4 | 121.5 | 160.7 | -79.1 | -175.7 | 178.6 | 179.9 | 0 | 108.4 | L33 | L33-K35 VanDerWaalsContact C-N 3.29Å; L33-K35 HydrophobicContact CD2-CD 3.88Å; L33-K35 HydrophobicContact CD2-CG 3.9Å; L33-K35 PolarHBondContact O-N 3.37Å | ||
| 36 | G | 45.5 | Very low | 36.2 | Very low | 76 Ų | 76 | 137.9 Ų | 137.9 | 78% | 0.784 | 74% | 0.743 | S | S | * | * | trans | 63.3 | 77.8 | 154.7 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 37 | L | 35.6 | Very low | 36.5 | Very low | 150 Ų | 150 | 141 Ų | 141 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | trans | -111.9 | 142.4 | 141.7 | -86.8 | 87.8 | 0 | 0 | 0 | 108.9 | ||||
| 38 | P | 33.6 | Very low | 36.6 | Very low | 123 Ų | 123 | 142.8 Ų | 142.8 | 80% | 0.799 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 138.8 | -174.4 | 28.7 | -34.5 | 0 | 0 | 0 | 111.6 | ||
| 39 | L | 36.8 | Very low | 36.6 | Very low | 155 Ų | 155 | 139.5 Ų | 139.5 | 81% | 0.812 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -69 | 141.3 | 170 | -65.8 | 171.3 | 0 | 0 | 0 | 109.7 | V41 | L39-V41 PolarHBondContact O-N 3.09Š|
| 40 | P | 33.5 | Very low | 36.5 | Very low | 108 Ų | 108 | 136.5 Ų | 136.5 | 70% | 0.701 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 124 | 168.4 | 27.1 | -32.6 | 0 | 0 | 0 | 109.2 | I42 | P40-I42 PolarHBondContact O-N 3.49Å; P40-I42 VanDerWaalsContact O-N 3.09Å |
| 41 | V | 38.1 | Very low | 36.6 | Very low | 139 Ų | 139 | 141.3 Ų | 141.3 | 84% | 0.842 | 78% | 0.776 | S | S | * | * | trans | -70.7 | 103.7 | 175.9 | 178.8 | 0 | 0 | 0 | 0 | 108.4 | L39 | L39-V41 PolarHBondContact O-N 3.09Š| ||
| 42 | I | 42.8 | Very low | 36.1 | Very low | 139 Ų | 139 | 139.6 Ų | 139.6 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 128.4 | 169.3 | -57.3 | 176.5 | 0 | 0 | 0 | 107.4 | P40 | P40-I42 PolarHBondContact O-N 3.49Å; P40-I42 VanDerWaalsContact O-N 3.09Å |
| 43 | P | 34.6 | Very low | 36.1 | Very low | 112 Ų | 112 | 141.1 Ų | 141.1 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 138.5 | 179.3 | -24.6 | 34.3 | 0 | 0 | 0 | 112.6 | ||
| 44 | Q | 42.5 | Very low | 36.1 | Very low | 172 Ų | 172 | 142.9 Ų | 142.9 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 133.5 | 169 | -63.1 | -74 | -39 | 0 | 0 | 108.9 | ||
| 45 | P | 37.5 | Very low | 36.4 | Very low | 112 Ų | 112 | 136.7 Ų | 136.7 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 129.4 | 164.3 | 29.3 | -31.4 | 0 | 0 | 0 | 109.3 | ||
| 46 | E | 36.5 | Very low | 36.4 | Very low | 180 Ų | 180 | 135.4 Ų | 135.4 | 84% | 0.841 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 146.8 | -175.1 | -62.5 | -173.1 | 150.1 | 0 | 0 | 112.9 | L48 | E46-L48 PolarHBondContact O-N 3.23Š|
| 47 | I | 35.6 | Very low | 36 | Very low | 169 Ų | 169 | 137.5 Ų | 137.5 | 87% | 0.867 | 77% | 0.774 | S | S | * | * | trans | -82.7 | 104.2 | 177.6 | -54.9 | 169.8 | 0 | 0 | 0 | 108.5 | ||||
| 48 | L | 33.3 | Very low | 36 | Very low | 167 Ų | 167 | 136.2 Ų | 136.2 | 87% | 0.874 | 77% | 0.772 | S | S | * | * | trans | -98.6 | 122.4 | 163.4 | -92.1 | 164.7 | 0 | 0 | 0 | 110.6 | E46 | E46-L48 PolarHBondContact O-N 3.23Š| ||
| 49 | S | 29.4 | Very low | 35.8 | Very low | 96 Ų | 96 | 141.2 Ų | 141.2 | 67% | 0.671 | 78% | 0.775 | S | S | * | * | trans | -80.7 | 149.4 | -177.3 | -176.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 50 | S | 31.5 | Very low | 35.7 | Very low | 95 Ų | 95 | 140 Ų | 140 | 66% | 0.664 | 77% | 0.774 | S | S | * | * | trans | 3.4 | 131 | 159.9 | 59.1 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 51 | V | 32.3 | Very low | 35.7 | Very low | 147 Ų | 147 | 141.3 Ų | 141.3 | 89% | 0.891 | 78% | 0.78 | S | S | * | * | -140.8 | 166.6 | 56.1 | -146.7 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 52 | A | 30.2 | Very low | 35.4 | Very low | 90 Ų | 90 | 139.8 Ų | 139.8 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | cis | -155.5 | -175.3 | 25 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 53 | Y | 34.3 | Very low | 35 | Very low | 215 Ų | 215 | 137.8 Ų | 137.8 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -93.6 | 138.6 | 171.1 | -93.7 | -107.2 | 0 | 0 | 0 | 112 | ||||
| 54 | N | 37.2 | Very low | 34.9 | Very low | 152 Ų | 152 | 142.3 Ų | 142.3 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | 176.7 | 164 | 106.8 | -93.7 | -35 | 0 | 0 | 0 | 113.2 | |||||
| 55 | P | 43.9 | Very low | 34.8 | Very low | 99 Ų | 99 | 139.1 Ų | 139.1 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | -117.7 | 171.1 | -149.4 | 43.9 | -36 | 0 | 0 | 0 | 116.3 | ||||
| 56 | I | 40.8 | Very low | 34.4 | Very low | 148 Ų | 148 | 141.1 Ų | 141.1 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | 59.1 | 112.2 | 159.5 | -58.9 | 151.7 | 0 | 0 | 0 | 117.1 | ||||
| 57 | T | 36 | Very low | 34.3 | Very low | 120 Ų | 120 | 137.5 Ų | 137.5 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | trans | -133.6 | 121.3 | 139 | 48.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 58 | V | 35.4 | Very low | 34.6 | Very low | 122 Ų | 122 | 135.7 Ų | 135.7 | 74% | 0.739 | 78% | 0.775 | S | S | * | * | trans | -69.9 | 136.5 | 163.2 | -91.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 59 | W | 30 | Very low | 34.7 | Very low | 229 Ų | 229 | 134.7 Ų | 134.7 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | -103.6 | 95.8 | 171.9 | -81 | 24.1 | 0 | 0 | 0 | 110.2 | ||||
| 60 | T | 33.5 | Very low | 35.1 | Very low | 128 Ų | 128 | 136 Ų | 136 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | -81.7 | 118.1 | 163.9 | 46.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 61 | T | 33.6 | Very low | 35.1 | Very low | 136 Ų | 136 | 135.8 Ų | 135.8 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | -100.7 | 95.4 | 177.9 | 52.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 62 | S | 31.8 | Very low | 35 | Very low | 107 Ų | 107 | 136 Ų | 136 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | trans | -150.7 | 150.4 | 151.5 | 82.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 63 | S | 36.1 | Very low | 35 | Very low | 97 Ų | 97 | 138.9 Ų | 138.9 | 68% | 0.678 | 77% | 0.772 | S | S | * | * | cis | -153.2 | 160 | 7.6 | -51.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 64 | F | 32.1 | Very low | 35 | Very low | 208 Ų | 208 | 133.8 Ų | 133.8 | 91% | 0.912 | 77% | 0.768 | S | S | * | * | trans | -161 | 157.1 | 153.1 | -92 | -54.6 | 0 | 0 | 0 | 109.3 | ||||
| 65 | P | 39 | Very low | 35.3 | Very low | 104 Ų | 104 | 132.5 Ų | 132.5 | 68% | 0.675 | 77% | 0.768 | S | S | * | * | -131.6 | 160.1 | -121.4 | 37.3 | -19.2 | 0 | 0 | 0 | 118.2 | |||||
| 66 | L | 30.9 | Very low | 34.8 | Very low | 155 Ų | 155 | 135.9 Ų | 135.9 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | trans | 43.2 | 106.6 | 146.3 | -68.5 | 165.2 | 0 | 0 | 0 | 121.7 | ||||
| 67 | S | 32.8 | Very low | 34.2 | Very low | 104 Ų | 104 | 134.3 Ų | 134.3 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | 48.1 | 143.6 | 118.3 | -45.2 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 68 | P | 42.4 | Very low | 33.9 | Very low | 131 Ų | 131 | 131.3 Ų | 131.3 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | -135.7 | 164.4 | 81.9 | 28.5 | -10.2 | 0 | 0 | 0 | 116.2 | |||||
| 69 | L | 34.6 | Very low | 33.7 | Very low | 145 Ų | 145 | 136.7 Ų | 136.7 | 76% | 0.759 | 78% | 0.783 | S | S | * | * | trans | -84.9 | 163.9 | 177.5 | -146.1 | 80.9 | 0 | 0 | 0 | 111.7 | ||||
| 70 | P | 37.7 | Very low | 34.1 | Very low | 123 Ų | 123 | 131.8 Ų | 131.8 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | -136.2 | 158.5 | 113.4 | 37.5 | -28.2 | 0 | 0 | 0 | 114.6 | |||||
| 71 | S | 32.2 | Very low | 33.8 | Very low | 91 Ų | 91 | 131.1 Ų | 131.1 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | trans | -78.1 | 145 | 177 | -43.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 72 | D | 30 | Very low | 33.6 | Very low | 152 Ų | 152 | 130 Ų | 130 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | 175.3 | 161 | 106.6 | -110 | -33.8 | 0 | 0 | 0 | 115.1 | |||||
| 73 | L | 31 | Very low | 33.5 | Very low | 150 Ų | 150 | 133.1 Ų | 133.1 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | 69.3 | 98.7 | 160.2 | -66.3 | 163.1 | 0 | 0 | 0 | 121.5 | ||||
| 74 | S | 34.7 | Very low | 33.2 | Very low | 108 Ų | 108 | 133.2 Ų | 133.2 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | 49.9 | 144.2 | 123.5 | -55.5 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 75 | P | 42.3 | Very low | 32.9 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -90.8 | 152.8 | -174.8 | 37.4 | -35.8 | 0 | 0 | 0 | 114.2 | ||||
| 76 | I | 32.8 | Very low | 32.6 | Very low | 169 Ų | 169 | 132.4 Ų | 132.4 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -120.7 | 125.8 | 168.8 | -68.1 | 179.8 | 0 | 0 | 0 | 110.4 | ||||
| 77 | S | 28.3 | Very low | 32.4 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -81.4 | 162.6 | 169.6 | 57.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 78 | G | 29.9 | Very low | 32.4 | Very low | 58 Ų | 58 | 130.7 Ų | 130.7 | 60% | 0.598 | 79% | 0.792 | S | S | * | * | trans | 176.7 | 92.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 79 | Y | 32.6 | Very low | 32.1 | Very low | 235 Ų | 235 | 134.3 Ų | 134.3 | 92% | 0.922 | 80% | 0.795 | S | S | * | * | trans | -147.6 | 135.5 | 130.9 | -83 | -64 | 0 | 0 | 0 | 108.9 | ||||
| 80 | P | 37 | Very low | 31.7 | Very low | 125 Ų | 125 | 133.7 Ų | 133.7 | 81% | 0.812 | 79% | 0.792 | S | S | * | * | trans | -94 | 156.5 | -168.2 | 35.5 | -33.3 | 0 | 0 | 0 | 113.4 | ||||
| 81 | S | 27 | Very low | 31.4 | Very low | 114 Ų | 114 | 136.2 Ų | 136.2 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | trans | -114.5 | 163.6 | 167.1 | -83.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 82 | S | 30.1 | Very low | 31.2 | Very low | 113 Ų | 113 | 137.6 Ų | 137.6 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | 74.3 | 116.9 | 174.3 | 75.4 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 83 | L | 30.4 | Very low | 31 | Very low | 173 Ų | 173 | 134 Ų | 134 | 91% | 0.906 | 80% | 0.802 | S | S | * | * | -133.8 | 126.9 | 110.1 | -93.1 | 172.2 | 0 | 0 | 0 | 107.6 | |||||
| 84 | S | 29.2 | Very low | 30.9 | Very low | 99 Ų | 99 | 132.1 Ų | 132.1 | 69% | 0.692 | 80% | 0.801 | S | S | * | * | trans | -88.7 | 142.8 | 165.4 | 50.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 85 | D | 25.9 | Very low | 30.5 | Very low | 164 Ų | 164 | 136.2 Ų | 136.2 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -145 | 144.3 | 155.4 | -110 | -37.9 | 0 | 0 | 0 | 112.2 | ||||
| 86 | T | 31.9 | Very low | 30.1 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 80% | 0.798 | 81% | 0.805 | S | S | * | * | trans | -108.3 | 136.2 | -175 | 53 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 87 | S | 27.3 | Very low | 30.5 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -171.6 | 142.6 | 138.5 | -157 | 0 | 0 | 0 | 0 | 114 | ||||
| 88 | S | 32.6 | Very low | 30.7 | Very low | 102 Ų | 102 | 138.8 Ų | 138.8 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -49.3 | 150.7 | 176.3 | -43.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 89 | K | 36.3 | Very low | 30.6 | Very low | 207 Ų | 207 | 140.6 Ų | 140.6 | 90% | 0.9 | 81% | 0.808 | S | S | * | * | -159.6 | 148.4 | 127.7 | -120.6 | 172.1 | -176.9 | 175.3 | 0 | 115.5 | |||||
| 90 | D | 26.5 | Very low | 30.5 | Very low | 132 Ų | 132 | 135.9 Ų | 135.9 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | trans | -82 | 155.8 | -160.6 | -52.1 | -88 | 0 | 0 | 0 | 118.3 | ||||
| 91 | H | 32 | Very low | 30.8 | Very low | 177 Ų | 177 | 138 Ų | 138 | 82% | 0.819 | 80% | 0.798 | S | S | * | * | trans | 66.5 | 152.3 | 134.5 | -94.9 | 70.1 | 0 | 0 | 0 | 124.3 | ||||
| 92 | S | 27.8 | Very low | 31.2 | Very low | 120 Ų | 120 | 140.7 Ų | 140.7 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | trans | 70.8 | 131 | 172.1 | 70.2 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 93 | G | 26.1 | Very low | 31.6 | Very low | 77 Ų | 77 | 143.7 Ų | 143.7 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | cis | 133.7 | 102.9 | -9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 94 | S | 28.9 | Very low | 32 | Very low | 109 Ų | 109 | 146 Ų | 146 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -165.8 | 103.5 | 160.6 | 57.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 95 | E | 26.6 | Very low | 32.3 | Very low | 195 Ų | 195 | 147.8 Ų | 147.8 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | trans | 56.3 | 113.1 | 133.3 | -55.9 | -177.7 | 129.4 | 0 | 0 | 121.6 | ||||
| 96 | S | 33.8 | Very low | 33.3 | Very low | 108 Ų | 108 | 147.7 Ų | 147.7 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | trans | -84.5 | 164.5 | 150.8 | -41.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 97 | P | 40.9 | Very low | 33.6 | Very low | 116 Ų | 116 | 146.1 Ų | 146.1 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | -134.6 | 145.1 | 77.6 | 12.1 | 12.2 | 0 | 0 | 0 | 113.7 | |||||
| 98 | R | 31.5 | Very low | 34.5 | Very low | 240 Ų | 240 | 148.9 Ų | 148.9 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | 51.8 | 130 | 90.9 | -60.9 | -178.2 | 175.4 | 167.7 | -1.6 | 113.5 | |||||
| 99 | S | 27.4 | Very low | 34.8 | Very low | 95 Ų | 95 | 151.9 Ų | 151.9 | 66% | 0.664 | 80% | 0.799 | S | S | * | * | cis | -147.3 | 179.6 | 22.4 | 54.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 100 | D | 31.2 | Very low | 34.9 | Very low | 137 Ų | 137 | 148.9 Ų | 148.9 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | cis | -146.1 | 142.5 | 19.9 | -75.9 | -80.1 | 0 | 0 | 0 | 112.1 | ||||
| 101 | E | 43.8 | Very low | 35.4 | Very low | 170 Ų | 170 | 149.8 Ų | 149.8 | 79% | 0.794 | 80% | 0.803 | S | S | * | * | trans | 34.2 | 103.4 | 130.7 | -53.2 | -69.3 | 118.3 | 0 | 0 | 120.4 | ||||
| 102 | D | 34.3 | Very low | 36.4 | Very low | 169 Ų | 169 | 146.3 Ų | 146.3 | 90% | 0.904 | 80% | 0.796 | S | S | * | * | trans | -167.4 | 41 | 136.9 | -111.9 | -16 | 0 | 0 | 0 | 113.2 | ||||
| 103 | D | 39.5 | Very low | 37.2 | Very low | 176 Ų | 176 | 150 Ų | 150 | 94% | 0.941 | 80% | 0.8 | S | S | * | * | trans | -103.5 | 74 | -178.9 | -130.2 | -22.8 | 0 | 0 | 0 | 111.3 | ||||
| 104 | R | 39 | Very low | 38.1 | Very low | 221 Ų | 221 | 149.8 Ų | 149.8 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -137.5 | 76.5 | -177.5 | -166.1 | -175.5 | 167.9 | 162.9 | -1.3 | 114.3 | ||||
| 105 | M | 36 | Very low | 39.1 | Very low | 138 Ų | 138 | 151.3 Ų | 151.3 | 68% | 0.68 | 80% | 0.802 | S | S | * | * | 167.8 | 90.8 | 117.8 | -92.4 | -158.1 | 148.6 | 0 | 0 | 111.6 | T107 | M105-T107 HydrophobicContact CB-CG2 4.25Å; M105-T107 HydrophobicContact CE-CG2 3.9Å; M105-T107 HydrophobicContact CG-CG2 4.18Å; M105-T107 PolarHBondContact O-N 3.33Å; M105-T107 VanDerWaalsContact O-N 3.16Å; M105-T107 HydrophobicContact SD-CG2 3.66Å | |||
| 106 | L | 45.3 | Very low | 39.7 | Very low | 161 Ų | 161 | 151.2 Ų | 151.2 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | trans | -82.3 | 71.8 | 156.9 | -171 | 71.3 | 0 | 0 | 0 | 109.4 | K108 | L106-K108 PolarHBondContact O-N 3.04Š| ||
| 107 | T | 38.7 | Very low | 40.4 | Very low | 98 Ų | 98 | 149.8 Ų | 149.8 | 60% | 0.601 | 80% | 0.796 | S | S | * | * | trans | -76.5 | 89.6 | 171.6 | 46.6 | 0 | 0 | 0 | 0 | 110.1 | M105 L109 | M105-T107 HydrophobicContact CB-CG2 4.25Å; M105-T107 HydrophobicContact CE-CG2 3.9Å; M105-T107 HydrophobicContact CG-CG2 4.18Å; M105-T107 PolarHBondContact O-N 3.33Å; M105-T107 VanDerWaalsContact O-N 3.16Å; M105-T107 HydrophobicContact SD-CG2 3.66Å; T107-L109 PolarHBondContact O-N 2.85Å | ||
| 108 | K | 46.8 | Very low | 41.4 | Very low | 178 Ų | 178 | 152.3 Ų | 152.3 | 77% | 0.774 | 80% | 0.798 | S | S | * | * | trans | -66.8 | 114.9 | 158.7 | -70 | -175.7 | 178.5 | -177.6 | 0 | 108.8 | L106 | L106-K108 PolarHBondContact O-N 3.04Š| ||
| 109 | L | 37.4 | Very low | 43.4 | Very low | 165 Ų | 165 | 146.2 Ų | 146.2 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -136.5 | 106.1 | 153.8 | -76.1 | 178.2 | 0 | 0 | 0 | 108.7 | T107 | T107-L109 PolarHBondContact O-N 2.85Š| ||
| 110 | T | 39.9 | Very low | 45.7 | Very low | 144 Ų | 144 | 145 Ų | 145 | 88% | 0.883 | 76% | 0.762 | S | S | * | * | trans | -77.2 | 125.4 | 160.5 | 45.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 111 | D | 36.3 | Very low | 47.8 | Very low | 151 Ų | 151 | 143.6 Ų | 143.6 | 81% | 0.807 | 75% | 0.752 | S | S | * | * | trans | -124.9 | 132.9 | 165.1 | -125.3 | -30.4 | 0 | 0 | 0 | 109.3 | H113 | D111-H113 PolarHBondContact O-N 3.39Š| ||
| 112 | P | 52.3 | Low | 49.4 | Very low | 104 Ų | 104 | 135.5 Ų | 135.5 | 68% | 0.675 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -89.5 | 92.2 | -177.5 | 33.4 | -28.1 | 0 | 0 | 0 | 109.6 | ||
| 113 | H | 45 | Very low | 51.1 | Low | 198 Ų | 198 | 132 Ų | 132 | 92% | 0.917 | 70% | 0.702 | S | S | * | * | S | Bend | trans | 165.2 | 120.6 | 142.7 | -90.2 | 97.7 | 0 | 0 | 0 | 110 | D111 | D111-H113 PolarHBondContact O-N 3.39Š|
| 114 | G | 45.9 | Very low | 52.4 | Low | 72 Ų | 72 | 129.1 Ų | 129.1 | 74% | 0.742 | 69% | 0.687 | S | S | * | * | S | Bend | trans | 94.7 | 82.3 | 151.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 115 | V | 49 | Very low | 54.1 | Low | 141 Ų | 141 | 121.1 Ų | 121.1 | 86% | 0.855 | 66% | 0.664 | S | S | * | * | trans | 55.2 | 89.9 | 143.1 | -163.2 | 0 | 0 | 0 | 0 | 118 | ||||
| 116 | E | 39.4 | Very low | 55.7 | Low | 194 Ų | 194 | 120 Ų | 120 | 91% | 0.907 | 66% | 0.661 | S | S | * | * | trans | -130 | 115.5 | 137.2 | -70.5 | -157.7 | 147.9 | 0 | 0 | 109.5 | ||||
| 117 | A | 48.3 | Very low | 57.3 | Low | 78 Ų | 78 | 117.8 Ų | 117.8 | 65% | 0.645 | 64% | 0.644 | S | S | * | * | trans | -81.1 | 125.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | Q119 | A117-Q119 WeakPolarHBondContact O-CG 3.43Å; A117-Q119 PolarHBondContact O-N 3.23Å | ||
| 118 | E | 61.5 | Low | 59.4 | Low | 169 Ų | 169 | 116 Ų | 116 | 79% | 0.79 | 64% | 0.635 | S | S | * | * | trans | -60 | 93.2 | 175.2 | -67.7 | -173.6 | 148.9 | 0 | 0 | 110.8 | ||||
| 119 | Q | 73.6 | Confident | 61 | Low | 112 Ų | 112 | 110.2 Ų | 110.2 | 52% | 0.523 | 61% | 0.609 | S | S | . | * | trans | -90.3 | 120.3 | 174.9 | -60.2 | -174.5 | 22.8 | 0 | 0 | 109.7 | A117 Q121 S128 Y129 | A117-Q119 WeakPolarHBondContact O-CG 3.43Å; A117-Q119 PolarHBondContact O-N 3.23Å; Q119-Q121 PolarHBondContact O-N 2.86Å; Q119-Q121 VanDerWaalsContact O-N 3.08Å; Q119-S128 PolarHBondContact OE1-OG 2.8Å; Q119-Y129 CarbonylContact C-O 3.55Å; Q119-Y129 WeakPolarHBondContact CA-O 3.29Å | ||
| 120 | F | 75.4 | Confident | 63 | Low | 68 Ų | 68 | 107.4 Ų | 107.4 | 30% | 0.298 | 60% | 0.604 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -70.8 | 102.7 | -179.7 | -61.2 | -83.5 | 0 | 0 | 0 | 110.3 | Y129 Y132 L135 | F120-Y129 PolarHBondContact N-O 3.34Å; F120-Y129 WeakPolarHBondContact O-CD2 3.44Å; F120-Y129 PolarHBondContact O-N 3.21Å; F120-Y132 AromaticContact CD1-CD2 3.64Å; F120-Y132 HydrophobicContact CD1-CD2 3.64Å; F120-Y132 HydrophobicContact CD1-CG 4.31Å; F120-Y132 AromaticContact CE1-CD2 3.85Å; F120-Y132 HydrophobicContact CE1-CD2 3.85Å; F120-Y132 HydrophobicContact CE1-CG 4.34Å; F120-Y132 VanDerWaalsContact CE2-N 3.33Å; F120-Y132 HydrophobicContact CG-CD2 4.36Å; F120-L135 HydrophobicContact CB-CB 3.79Å; F120-L135 HydrophobicContact CB-CD2 3.7Å; F120-L135 HydrophobicContact CB-CG 4.34Å |
| 121 | Q | 76.6 | Confident | 64.9 | Low | 108 Ų | 108 | 104 Ų | 104 | 51% | 0.505 | 58% | 0.583 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -84.6 | 142.8 | -177.7 | -172.9 | 167.2 | -33.1 | 0 | 0 | 113 | Q119 N126 K127 L135 | Q119-Q121 PolarHBondContact O-N 2.86Å; Q119-Q121 VanDerWaalsContact O-N 3.08Å; Q121-N126 VanDerWaalsContact NE2-CG 3.27Å; Q121-N126 PolarHBondContact NE2-OD1 2.96Å; Q121-K127 CarbonylContact C-O 3.6Å; Q121-K127 WeakPolarHBondContact CA-O 3.3Å; Q121-L135 WeakPolarHBondContact O-CD2 3.45Å |
| 122 | C | 76.3 | Confident | 66.7 | Low | 0 Ų | 0 | 103 Ų | 103 | 0% | 0 | 57% | 0.569 | C | S | . | * | trans | -85.5 | 115.4 | 171 | -168 | 0 | 0 | 0 | 0 | 111.6 | L124 C125 N126 K127 L135 H138 H142 | C122-L124 PolarHBondContact O-N 2.99Å; C122-L124 VanDerWaalsContact O-N 3.09Å; C122-C125 PolarHBondContact O-N 3Å; C122-N126 VanDerWaalsContact O-CA 3.25Å; C122-N126 WeakPolarHBondContact O-CA 3.47Å; C122-N126 PolarHBondContact O-N 3.26Å; C122-K127 PolarHBondContact N-O 2.07Å; C122-L135 HydrophobicContact CB-CD1 3.62Å; C122-H138 VanDerWaalsContact CB-CD2 3.47Å; C122-H138 WeakPolarHBondContact CB-CD2 3.39Å; C122-H138 WeakPolarHBondContact CB-NE2 3.29Å; C122-H138 PolarHBondContact SG-NE2 3.06Å; C122-H138 VanDerWaalsContact SG-NE2 3.41Å; C122-H142 VanDerWaalsContact SG-CD2 3.52Å; C122-H142 PolarHBondContact SG-NE2 3.34Å | ||
| 123 | S | 69.8 | Low | 67.9 | Low | 95 Ų | 95 | 101.7 Ų | 101.7 | 66% | 0.664 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -17.3 | 175.2 | 49.5 | 0 | 0 | 0 | 0 | 114.9 | ||
| 124 | L | 67 | Low | 69.5 | Low | 117 Ų | 117 | 93.1 Ų | 93.1 | 61% | 0.613 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | -15.8 | -176.6 | -60.9 | 175.6 | 0 | 0 | 0 | 114.1 | C122 H142 | C122-L124 PolarHBondContact O-N 2.99Å; C122-L124 VanDerWaalsContact O-N 3.09Å; L124-H142 HydrophobicContact CD1-CB 3.49Å; L124-H142 VanDerWaalsContact CD1-CB 3.49Å |
| 125 | C | 74.6 | Confident | 71.1 | Confident | 53 Ų | 53 | 90 Ų | 90 | 36% | 0.358 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -155.8 | 22 | 174.2 | 74.8 | 0 | 0 | 0 | 0 | 115.1 | C122 K127 H138 H142 | C122-C125 PolarHBondContact O-N 3Å; C125-K127 PolarHBondContact O-N 3.17Å; C125-H138 VanDerWaalsContact SG-CE1 3.52Å; C125-H138 PolarHBondContact SG-NE2 3.48Å; C125-H142 PolarHBondContact SG-NE2 2.98Å |
| 126 | N | 71.3 | Confident | 72.3 | Confident | 115 Ų | 115 | 87.3 Ų | 87.3 | 62% | 0.615 | 47% | 0.473 | S | S | * | . | trans | 49.9 | 24.6 | 176.5 | -69.2 | -20.1 | 0 | 0 | 0 | 116.8 | Q121 C122 | Q121-N126 VanDerWaalsContact NE2-CG 3.27Å; Q121-N126 PolarHBondContact NE2-OD1 2.96Å; C122-N126 VanDerWaalsContact O-CA 3.25Å; C122-N126 WeakPolarHBondContact O-CA 3.47Å; C122-N126 PolarHBondContact O-N 3.26Å | ||
| 127 | K | 78.9 | Confident | 74 | Confident | 114 Ų | 114 | 85 Ų | 85 | 50% | 0.496 | 46% | 0.46 | S | S | . | . | trans | -79.6 | 126 | 172.4 | -71.5 | 179.6 | -174.4 | 178.7 | 0 | 110.1 | Q121 C122 C125 Y129 | Q121-K127 CarbonylContact C-O 3.6Å; Q121-K127 WeakPolarHBondContact CA-O 3.3Å; C122-K127 PolarHBondContact N-O 2.07Å; C125-K127 PolarHBondContact O-N 3.17Å; K127-Y129 HydrophobicContact CB-CE2 3.65Å; K127-Y129 WeakPolarHBondContact O-CD2 3.41Å; K127-Y129 WeakPolarHBondContact O-CE2 3.27Å | ||
| 128 | S | 82.1 | Confident | 75.3 | Confident | 59 Ų | 59 | 81.9 Ų | 81.9 | 41% | 0.413 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 147.6 | 176.6 | 68 | 0 | 0 | 0 | 0 | 111.6 | Q119 | Q119-S128 PolarHBondContact OE1-OG 2.8Å |
| 129 | Y | 81.3 | Confident | 75.6 | Confident | 58 Ų | 58 | 77.5 Ų | 77.5 | 23% | 0.227 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.2 | 132.4 | -177.8 | -68.6 | -89.8 | 0 | 0 | 0 | 110.4 | Q119 F120 K127 T131 L135 H138 | Q119-Y129 CarbonylContact C-O 3.55Å; Q119-Y129 WeakPolarHBondContact CA-O 3.29Å; F120-Y129 PolarHBondContact N-O 3.34Å; F120-Y129 WeakPolarHBondContact O-CD2 3.44Å; F120-Y129 PolarHBondContact O-N 3.21Å; K127-Y129 HydrophobicContact CB-CE2 3.65Å; K127-Y129 WeakPolarHBondContact O-CD2 3.41Å; K127-Y129 WeakPolarHBondContact O-CE2 3.27Å; Y129-T131 PolarHBondContact O-N 3.28Å; Y129-L135 HydrophobicContact CD2-CB 4.09Å; Y129-L135 HydrophobicContact CD2-CD1 3.99Å; Y129-L135 HydrophobicContact CE2-CD1 4.35Å; Y129-L135 HydrophobicContact CG-CB 4.27Å; Y129-H138 HydrophobicContact CE1-CB 4.04Å; Y129-H138 HydrophobicContact CE2-CB 3.83Å; Y129-H138 AromaticContact CE2-CD2 3.26Å; Y129-H138 WeakPolarHBondContact CE2-CD2 3.45Å; Y129-H138 AromaticContact CE2-CG 3.64Å; Y129-H138 AromaticContact CZ-CD2 3.58Å; Y129-H138 AromaticContact CZ-CG 3.46Å; Y129-H138 VanDerWaalsContact CZ-CG 3.46Å; Y129-H138 WeakPolarHBondContact OH-CB 3.41Å; Y129-H138 PolarHBondContact OH-CD2 3.44Å; Y129-H138 PolarHBondContact OH-ND1 2.83Å |
| 130 | S | 78.4 | Confident | 75.4 | Confident | 106 Ų | 106 | 77.9 Ų | 77.9 | 74% | 0.741 | 41% | 0.412 | S | S | * | . | S | Bend | trans | -67.6 | -4.3 | 176.2 | 56.1 | 0 | 0 | 0 | 0 | 114.8 | ||
| 131 | T | 80 | Confident | 74.8 | Confident | 73 Ų | 73 | 80.1 Ų | 80.1 | 45% | 0.448 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -145.8 | 140.9 | 177.9 | 54.3 | 0 | 0 | 0 | 0 | 111.3 | Y129 S133 G134 L135 | Y129-T131 PolarHBondContact O-N 3.28Å; T131-S133 PolarHBondContact O-N 3.21Å; T131-G134 WeakPolarHBondContact O-CA 3.39Å; T131-G134 PolarHBondContact O-N 2.82Å; T131-G134 PolarHBondContact OG1-N 3.07Å; T131-L135 PolarHBondContact O-N 2.94Å; T131-L135 VanDerWaalsContact O-N 3.13Å |
| 132 | Y | 73.4 | Confident | 74.3 | Confident | 130 Ų | 130 | 77.6 Ų | 77.6 | 51% | 0.51 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58 | -38.5 | 176.3 | -174.6 | -96.1 | 0 | 0 | 0 | 111.9 | F120 G134 L135 L136 | F120-Y132 AromaticContact CD1-CD2 3.64Å; F120-Y132 HydrophobicContact CD1-CD2 3.64Å; F120-Y132 HydrophobicContact CD1-CG 4.31Å; F120-Y132 AromaticContact CE1-CD2 3.85Å; F120-Y132 HydrophobicContact CE1-CD2 3.85Å; F120-Y132 HydrophobicContact CE1-CG 4.34Å; F120-Y132 VanDerWaalsContact CE2-N 3.33Å; F120-Y132 HydrophobicContact CG-CD2 4.36Å; Y132-G134 PolarHBondContact O-N 2.8Å; Y132-L135 CarbonylContact O-C 3.26Å; Y132-L135 PolarHBondContact O-N 3.48Å; Y132-L135 VanDerWaalsContact O-N 3.15Å; Y132-L136 WeakPolarHBondContact O-CB 3.22Å; Y132-L136 PolarHBondContact O-N 3.44Å |
| 133 | S | 77.2 | Confident | 73.5 | Confident | 76 Ų | 76 | 81.6 Ų | 81.6 | 53% | 0.531 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.2 | -28.8 | 173.8 | -54.5 | 0 | 0 | 0 | 0 | 113.5 | T131 K137 | T131-S133 PolarHBondContact O-N 3.21Å; S133-K137 WeakPolarHBondContact O-CD 3.48Å; S133-K137 VanDerWaalsContact O-CG 3.29Å; S133-K137 WeakPolarHBondContact O-CG 3.41Å; S133-K137 PolarHBondContact O-N 3.43Å |
| 134 | G | 79.6 | Confident | 72.7 | Confident | 17 Ų | 17 | 80.5 Ų | 80.5 | 18% | 0.175 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -70.5 | -47.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | T131 Y132 L136 K137 H138 | T131-G134 WeakPolarHBondContact O-CA 3.39Å; T131-G134 PolarHBondContact O-N 2.82Å; T131-G134 PolarHBondContact OG1-N 3.07Å; Y132-G134 PolarHBondContact O-N 2.8Å; G134-L136 VanDerWaalsContact C-N 3.35Å; G134-L136 PolarHBondContact O-N 2.91Å; G134-K137 PolarHBondContact O-N 2.88Å; G134-H138 WeakPolarHBondContact O-CB 3.33Å; G134-H138 PolarHBondContact O-N 3.05Å |
| 135 | L | 78.9 | Confident | 72.2 | Confident | 8 Ų | 8 | 79.2 Ų | 79.2 | 4% | 0.042 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -59.7 | -42.8 | 174.3 | 175.3 | 61.4 | 0 | 0 | 0 | 111.8 | F120 Q121 C122 Y129 T131 Y132 H138 K139 | F120-L135 HydrophobicContact CB-CB 3.79Å; F120-L135 HydrophobicContact CB-CD2 3.7Å; F120-L135 HydrophobicContact CB-CG 4.34Å; Q121-L135 WeakPolarHBondContact O-CD2 3.45Å; C122-L135 HydrophobicContact CB-CD1 3.62Å; Y129-L135 HydrophobicContact CD2-CB 4.09Å; Y129-L135 HydrophobicContact CD2-CD1 3.99Å; Y129-L135 HydrophobicContact CE2-CD1 4.35Å; Y129-L135 HydrophobicContact CG-CB 4.27Å; T131-L135 PolarHBondContact O-N 2.94Å; T131-L135 VanDerWaalsContact O-N 3.13Å; Y132-L135 CarbonylContact O-C 3.26Å; Y132-L135 PolarHBondContact O-N 3.48Å; Y132-L135 VanDerWaalsContact O-N 3.15Å; L135-H138 CarbonylContact O-C 3.4Å; L135-H138 WeakPolarHBondContact O-CA 3.41Å; L135-H138 WeakPolarHBondContact O-CB 3.45Å; L135-H138 PolarHBondContact O-N 2.9Å; L135-H138 VanDerWaalsContact O-N 3.11Å; L135-K139 HydrophobicContact CD1-CD 4.4Å; L135-K139 HydrophobicContact CD1-CG 4.07Å; L135-K139 HydrophobicContact CG-CD 4.24Å; L135-K139 HydrophobicContact CG-CG 4.31Å; L135-K139 PolarHBondContact O-N 3.27Å |
| 136 | L | 74.5 | Confident | 71.3 | Confident | 83 Ų | 83 | 85.3 Ų | 85.3 | 44% | 0.435 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65 | -42.7 | -177.8 | -172.1 | 62.9 | 0 | 0 | 0 | 112 | Y132 G134 H138 K139 Q140 | Y132-L136 WeakPolarHBondContact O-CB 3.22Å; Y132-L136 PolarHBondContact O-N 3.44Å; G134-L136 VanDerWaalsContact C-N 3.35Å; G134-L136 PolarHBondContact O-N 2.91Å; L136-H138 PolarHBondContact O-N 3.38Å; L136-K139 PolarHBondContact O-N 3.3Å; L136-Q140 WeakPolarHBondContact O-CG 3.36Å; L136-Q140 PolarHBondContact O-N 2.96Å; L136-Q140 VanDerWaalsContact O-N 3.12Å |
| 137 | K | 74.8 | Confident | 70.2 | Confident | 145 Ų | 145 | 85.2 Ų | 85.2 | 63% | 0.63 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -62.9 | -31.8 | 171.7 | -72.3 | 170.2 | -175 | 172.6 | 0 | 112.5 | S133 G134 | S133-K137 WeakPolarHBondContact O-CD 3.48Å; S133-K137 VanDerWaalsContact O-CG 3.29Å; S133-K137 WeakPolarHBondContact O-CG 3.41Å; S133-K137 PolarHBondContact O-N 3.43Å; G134-K137 PolarHBondContact O-N 2.88Å |
| 138 | H | 76 | Confident | 69.1 | Low | 14 Ų | 14 | 89 Ų | 89 | 7% | 0.065 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -77.4 | -37.8 | 175.2 | 170.1 | 53.4 | 0 | 0 | 0 | 112.8 | C122 C125 Y129 G134 L135 L136 Q140 L141 H142 | C122-H138 VanDerWaalsContact CB-CD2 3.47Å; C122-H138 WeakPolarHBondContact CB-CD2 3.39Å; C122-H138 WeakPolarHBondContact CB-NE2 3.29Å; C122-H138 PolarHBondContact SG-NE2 3.06Å; C122-H138 VanDerWaalsContact SG-NE2 3.41Å; C125-H138 VanDerWaalsContact SG-CE1 3.52Å; C125-H138 PolarHBondContact SG-NE2 3.48Å; Y129-H138 HydrophobicContact CE1-CB 4.04Å; Y129-H138 HydrophobicContact CE2-CB 3.83Å; Y129-H138 AromaticContact CE2-CD2 3.26Å; Y129-H138 WeakPolarHBondContact CE2-CD2 3.45Å; Y129-H138 AromaticContact CE2-CG 3.64Å; Y129-H138 AromaticContact CZ-CD2 3.58Å; Y129-H138 AromaticContact CZ-CG 3.46Å; Y129-H138 VanDerWaalsContact CZ-CG 3.46Å; Y129-H138 WeakPolarHBondContact OH-CB 3.41Å; Y129-H138 PolarHBondContact OH-CD2 3.44Å; Y129-H138 PolarHBondContact OH-ND1 2.83Å; G134-H138 WeakPolarHBondContact O-CB 3.33Å; G134-H138 PolarHBondContact O-N 3.05Å; L135-H138 CarbonylContact O-C 3.4Å; L135-H138 WeakPolarHBondContact O-CA 3.41Å; L135-H138 WeakPolarHBondContact O-CB 3.45Å; L135-H138 PolarHBondContact O-N 2.9Å; L135-H138 VanDerWaalsContact O-N 3.11Å; L136-H138 PolarHBondContact O-N 3.38Å; H138-Q140 PolarHBondContact O-N 2.76Å; H138-L141 WeakPolarHBondContact O-CA 3.29Å; H138-L141 VanDerWaalsContact O-CB 3.27Å; H138-L141 WeakPolarHBondContact O-CB 3.01Å; H138-L141 PolarHBondContact O-N 3.16Å; H138-H142 AromaticContact CE1-CD2 3.75Å; H138-H142 AromaticContact CE1-NE2 3.15Å; H138-H142 PolarHBondContact CE1-NE2 3.21Å; H138-H142 AromaticContact NE2-CD2 3.74Å; H138-H142 AromaticContact NE2-NE2 3.09Å; H138-H142 PolarHBondContact NE2-NE2 3.03Å |
| 139 | K | 67.8 | Low | 68.1 | Low | 77 Ų | 77 | 94.1 Ų | 94.1 | 34% | 0.335 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.6 | -32.7 | 171.9 | -77.2 | -176.3 | 173.7 | -176.3 | 0 | 111.8 | L135 L136 L141 H142 C143 | L135-K139 HydrophobicContact CD1-CD 4.4Å; L135-K139 HydrophobicContact CD1-CG 4.07Å; L135-K139 HydrophobicContact CG-CD 4.24Å; L135-K139 HydrophobicContact CG-CG 4.31Å; L135-K139 PolarHBondContact O-N 3.27Å; L136-K139 PolarHBondContact O-N 3.3Å; K139-L141 PolarHBondContact O-N 2.94Å; K139-H142 WeakPolarHBondContact O-CB 2.98Å; K139-H142 PolarHBondContact O-N 3.36Å; K139-C143 PolarHBondContact O-N 3.44Å; K139-C143 VanDerWaalsContact O-N 3.14Å |
| 140 | Q | 69.1 | Low | 67.4 | Low | 120 Ų | 120 | 93.3 Ų | 93.3 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -28.1 | 171.2 | -72.7 | 168.2 | -16.8 | 0 | 0 | 113.5 | L136 H138 H142 C143 | L136-Q140 WeakPolarHBondContact O-CG 3.36Å; L136-Q140 PolarHBondContact O-N 2.96Å; L136-Q140 VanDerWaalsContact O-N 3.12Å; H138-Q140 PolarHBondContact O-N 2.76Å; Q140-H142 VanDerWaalsContact C-N 3.28Å; Q140-H142 PolarHBondContact O-N 3.41Å; Q140-C143 PolarHBondContact O-N 3.09Å |
| 141 | L | 63.8 | Low | 67.2 | Low | 114 Ų | 114 | 91.3 Ų | 91.3 | 60% | 0.597 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | -16.4 | 173.4 | -53.5 | 173.9 | 0 | 0 | 0 | 113.1 | H138 K139 | H138-L141 WeakPolarHBondContact O-CA 3.29Å; H138-L141 VanDerWaalsContact O-CB 3.27Å; H138-L141 WeakPolarHBondContact O-CB 3.01Å; H138-L141 PolarHBondContact O-N 3.16Å; K139-L141 PolarHBondContact O-N 2.94Å |
| 142 | H | 64.8 | Low | 67 | Low | 55 Ų | 55 | 91.4 Ų | 91.4 | 26% | 0.255 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | -26.4 | 172.1 | -67.8 | -74.4 | 0 | 0 | 0 | 112.1 | C122 L124 C125 H138 K139 Q140 D144 A145 | C122-H142 VanDerWaalsContact SG-CD2 3.52Å; C122-H142 PolarHBondContact SG-NE2 3.34Å; L124-H142 HydrophobicContact CD1-CB 3.49Å; L124-H142 VanDerWaalsContact CD1-CB 3.49Å; C125-H142 PolarHBondContact SG-NE2 2.98Å; H138-H142 AromaticContact CE1-CD2 3.75Å; H138-H142 AromaticContact CE1-NE2 3.15Å; H138-H142 PolarHBondContact CE1-NE2 3.21Å; H138-H142 AromaticContact NE2-CD2 3.74Å; H138-H142 AromaticContact NE2-NE2 3.09Å; H138-H142 PolarHBondContact NE2-NE2 3.03Å; K139-H142 WeakPolarHBondContact O-CB 2.98Å; K139-H142 PolarHBondContact O-N 3.36Å; Q140-H142 VanDerWaalsContact C-N 3.28Å; Q140-H142 PolarHBondContact O-N 3.41Å; H142-D144 PolarHBondContact O-N 3.01Å; H142-A145 PolarHBondContact O-N 3.25Å |
| 143 | C | 59.1 | Low | 67.3 | Low | 84 Ų | 84 | 85.7 Ų | 85.7 | 57% | 0.568 | 45% | 0.451 | S | S | * | . | G | 310 helix | trans | -67.4 | -6.7 | 172.1 | -74.8 | 0 | 0 | 0 | 0 | 114.3 | K139 Q140 A145 | K139-C143 PolarHBondContact O-N 3.44Å; K139-C143 VanDerWaalsContact O-N 3.14Å; Q140-C143 PolarHBondContact O-N 3.09Å; C143-A145 PolarHBondContact O-N 2.87Å |
| 144 | D | 54.2 | Low | 67.3 | Low | 72 Ų | 72 | 91.3 Ų | 91.3 | 39% | 0.385 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -68.7 | -11.7 | 175.9 | -74.8 | -30.3 | 0 | 0 | 0 | 113.9 | H142 V161 | H142-D144 PolarHBondContact O-N 3.01Å; D144-V161 WeakPolarHBondContact OD1-CG1 3.38Å |
| 145 | A | 55.5 | Low | 67 | Low | 90 Ų | 90 | 97.6 Ų | 97.6 | 74% | 0.744 | 49% | 0.485 | S | S | * | . | G | 310 helix | trans | -79.3 | -22.7 | -180 | 0 | 0 | 0 | 0 | 0 | 114.9 | H142 C143 | H142-A145 PolarHBondContact O-N 3.25Å; C143-A145 PolarHBondContact O-N 2.87Å |
| 146 | Q | 56.4 | Low | 66.9 | Low | 182 Ų | 182 | 98.6 Ų | 98.6 | 85% | 0.85 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -136.9 | -9.7 | -163.9 | -116.4 | 164.5 | -4.8 | 0 | 0 | 117.6 | ||
| 147 | T | 49 | Very low | 66.9 | Low | 113 Ų | 113 | 104 Ų | 104 | 69% | 0.693 | 52% | 0.516 | S | S | * | . | trans | -136.9 | 85.8 | 169.3 | 53.8 | 0 | 0 | 0 | 0 | 112.1 | K149 | T147-K149 VanDerWaalsContact C-N 3.28Å; T147-K149 PolarHBondContact O-N 3.07Å | ||
| 148 | R | 54.8 | Low | 67 | Low | 192 Ų | 192 | 103 Ų | 103 | 73% | 0.725 | 51% | 0.512 | S | S | * | . | trans | -70.5 | 77.2 | 177.2 | -75.9 | -116.8 | -88.1 | 147.9 | -7.6 | 112.1 | S150 E159 | R148-S150 VanDerWaalsContact C-N 3.28Å; R148-S150 PolarHBondContact O-N 2.9Å; R148-E159 IonicContact CZ-OE2 3.85Å; R148-E159 IonicContact NH1-OE2 2.72Å; R148-E159 PolarHBondContact NH1-OE2 3.28Å | ||
| 149 | K | 61.7 | Low | 67.1 | Low | 168 Ų | 168 | 107.2 Ų | 107.2 | 73% | 0.73 | 53% | 0.531 | S | S | * | . | trans | -89.2 | 68.9 | 159.3 | -164 | 167 | -172.1 | 169.4 | 0 | 109.5 | T147 | T147-K149 VanDerWaalsContact C-N 3.28Å; T147-K149 PolarHBondContact O-N 3.07Å | ||
| 150 | S | 66.3 | Low | 67.5 | Low | 41 Ų | 41 | 105.9 Ų | 105.9 | 29% | 0.287 | 52% | 0.524 | S | S | . | . | trans | -66.6 | 149 | 172.7 | 48.3 | 0 | 0 | 0 | 0 | 111.1 | R148 E159 | R148-S150 VanDerWaalsContact C-N 3.28Å; R148-S150 PolarHBondContact O-N 2.9Å; S150-E159 WeakPolarHBondContact CB-OE1 3.47Å; S150-E159 PolarHBondContact OG-OE1 3.27Å | ||
| 151 | F | 74.6 | Confident | 67.8 | Low | 64 Ų | 64 | 104.8 Ų | 104.8 | 28% | 0.281 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.5 | 106.6 | 174.4 | -64.6 | -87.5 | 0 | 0 | 0 | 108.8 | Y160 L163 L166 | F151-Y160 PolarHBondContact N-O 3.15Å; F151-Y160 PolarHBondContact O-N 2.87Å; F151-L163 HydrophobicContact CD1-CB 4.08Å; F151-L163 HydrophobicContact CD1-CD1 3.85Å; F151-L163 HydrophobicContact CD2-CB 4.33Å; F151-L163 HydrophobicContact CE1-CB 3.9Å; F151-L163 HydrophobicContact CE1-CD1 4.1Å; F151-L163 HydrophobicContact CE1-CG 4.41Å; F151-L163 HydrophobicContact CE2-CB 4.16Å; F151-L163 HydrophobicContact CG-CB 4.29Å; F151-L163 HydrophobicContact CG-CD1 4.5Å; F151-L163 HydrophobicContact CZ-CB 3.94Å; F151-L166 HydrophobicContact CB-CB 4.05Å; F151-L166 HydrophobicContact CB-CD2 3.7Å; F151-L166 HydrophobicContact CB-CG 4.45Å |
| 152 | S | 75.3 | Confident | 68.3 | Low | 74 Ų | 74 | 102.1 Ų | 102.1 | 52% | 0.517 | 52% | 0.517 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 145.1 | 179.9 | 54.6 | 0 | 0 | 0 | 0 | 112.9 | L166 | S152-L166 WeakPolarHBondContact O-CD2 3.47Å |
| 153 | C | 79.9 | Confident | 68.9 | Low | 10 Ų | 10 | 103.2 Ų | 103.2 | 7% | 0.068 | 52% | 0.524 | C | S | . | . | trans | -72.9 | 138.6 | 169.9 | 163.3 | 0 | 0 | 0 | 0 | 110.5 | C156 K158 Y160 L166 H169 H173 | C153-C156 CarbonylContact C-O 3.46Å; C153-C156 VanDerWaalsContact C-O 3.26Å; C153-C156 WeakPolarHBondContact CA-O 3.46Å; C153-C156 HydrophobicContact CB-CB 4.34Å; C153-C156 WeakPolarHBondContact CB-O 3.45Å; C153-C156 WeakPolarHBondContact CB-SG 3.43Å; C153-C156 VanDerWaalsContact SG-CA 3.58Å; C153-C156 WeakPolarHBondContact SG-CB 3.41Å; C153-C156 PolarHBondContact SG-N 2.91Å; C153-C156 PolarHBondContact SG-O 3.44Å; C153-C156 CovalentContact SG-SG 2.07Å; C153-C156 PolarHBondContact SG-SG 2.83Å; C153-K158 HydrophobicContact CB-CB 4.46Å; C153-K158 WeakPolarHBondContact CB-O 3.5Å; C153-K158 PolarHBondContact N-O 3.22Å; C153-Y160 HydrophobicContact CB-CE2 4.31Å; C153-L166 HydrophobicContact CB-CD1 3.95Å; C153-H169 PolarHBondContact SG-NE2 3.27Å; C153-H169 VanDerWaalsContact SG-NE2 3.44Å; C153-H173 PolarHBondContact SG-NE2 3.13Å | ||
| 154 | K | 76.6 | Confident | 69.7 | Low | 194 Ų | 194 | 101.6 Ų | 101.6 | 84% | 0.843 | 52% | 0.522 | S | S | * | . | S | Bend | trans | -83.8 | -20.3 | 178.2 | -64.7 | -168.9 | 177.1 | -169.5 | 0 | 113.5 | ||
| 155 | Y | 74.3 | Confident | 70.8 | Confident | 149 Ų | 149 | 100 Ų | 100 | 58% | 0.584 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -99.9 | -0.8 | -179 | -57 | -78.1 | 0 | 0 | 0 | 112.3 | I170 H173 T174 | Y155-I170 HydrophobicContact CE2-CG2 4.09Å; Y155-H173 HydrophobicContact CD2-CB 3.95Å; Y155-H173 HydrophobicContact CG-CB 4.01Å; Y155-T174 HydrophobicContact CE2-CG2 4.4Å |
| 156 | C | 76.4 | Confident | 72 | Confident | 29 Ų | 29 | 96.4 Ų | 96.4 | 20% | 0.196 | 49% | 0.487 | C | S | . | . | S | Bend | trans | -171.9 | 146.4 | -170.8 | 69.9 | 0 | 0 | 0 | 0 | 110.2 | C153 K158 H169 H173 | C153-C156 CarbonylContact C-O 3.46Å; C153-C156 VanDerWaalsContact C-O 3.26Å; C153-C156 WeakPolarHBondContact CA-O 3.46Å; C153-C156 HydrophobicContact CB-CB 4.34Å; C153-C156 WeakPolarHBondContact CB-O 3.45Å; C153-C156 WeakPolarHBondContact CB-SG 3.43Å; C153-C156 VanDerWaalsContact SG-CA 3.58Å; C153-C156 WeakPolarHBondContact SG-CB 3.41Å; C153-C156 PolarHBondContact SG-N 2.91Å; C153-C156 PolarHBondContact SG-O 3.44Å; C153-C156 CovalentContact SG-SG 2.07Å; C153-C156 PolarHBondContact SG-SG 2.83Å; C156-K158 PolarHBondContact O-N 3.37Å; C156-H169 PolarHBondContact SG-NE2 3.36Å; C156-H173 PolarHBondContact SG-NE2 3.31Å |
| 157 | E | 74.7 | Confident | 73 | Confident | 197 Ų | 197 | 93.9 Ų | 93.9 | 92% | 0.921 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -78.1 | 24.3 | -175.4 | -63.5 | 171 | -175.2 | 0 | 0 | 113.9 | ||
| 158 | K | 76.3 | Confident | 74.2 | Confident | 124 Ų | 124 | 92.3 Ų | 92.3 | 54% | 0.539 | 46% | 0.459 | S | S | . | . | trans | -80.7 | 124.5 | -179.4 | -65.4 | -173.5 | 178.4 | -177.3 | 0 | 111.1 | C153 C156 Y160 | C153-K158 HydrophobicContact CB-CB 4.46Å; C153-K158 WeakPolarHBondContact CB-O 3.5Å; C153-K158 PolarHBondContact N-O 3.22Å; C156-K158 PolarHBondContact O-N 3.37Å; K158-Y160 HydrophobicContact CB-CE2 3.67Å; K158-Y160 WeakPolarHBondContact O-CD2 3.45Å; K158-Y160 WeakPolarHBondContact O-CE2 3.34Å | ||
| 159 | E | 79.4 | Confident | 75.3 | Confident | 102 Ų | 102 | 84.3 Ų | 84.3 | 48% | 0.477 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 144.2 | 173.2 | -61.2 | -161.2 | 117.5 | 0 | 0 | 112.1 | R148 S150 | R148-E159 IonicContact CZ-OE2 3.85Å; R148-E159 IonicContact NH1-OE2 2.72Å; R148-E159 PolarHBondContact NH1-OE2 3.28Å; S150-E159 WeakPolarHBondContact CB-OE1 3.47Å; S150-E159 PolarHBondContact OG-OE1 3.27Å |
| 160 | Y | 76 | Confident | 76 | Confident | 49 Ų | 49 | 78.5 Ų | 78.5 | 19% | 0.192 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 133.9 | 176.3 | -66 | -84.5 | 0 | 0 | 0 | 110.8 | F151 C153 K158 S162 A165 L166 H169 | F151-Y160 PolarHBondContact N-O 3.15Å; F151-Y160 PolarHBondContact O-N 2.87Å; C153-Y160 HydrophobicContact CB-CE2 4.31Å; K158-Y160 HydrophobicContact CB-CE2 3.67Å; K158-Y160 WeakPolarHBondContact O-CD2 3.45Å; K158-Y160 WeakPolarHBondContact O-CE2 3.34Å; Y160-S162 PolarHBondContact O-N 3.27Å; Y160-A165 HydrophobicContact CD1-CB 3.84Å; Y160-A165 HydrophobicContact CG-CB 4.37Å; Y160-L166 HydrophobicContact CD2-CB 4.12Å; Y160-L166 HydrophobicContact CD2-CD1 3.79Å; Y160-L166 HydrophobicContact CE2-CD1 4.26Å; Y160-L166 HydrophobicContact CG-CB 4.2Å; Y160-H169 HydrophobicContact CE1-CB 3.94Å; Y160-H169 HydrophobicContact CE2-CB 3.9Å; Y160-H169 AromaticContact CE2-CD2 3.34Å; Y160-H169 WeakPolarHBondContact CE2-CD2 3.43Å; Y160-H169 AromaticContact CE2-CG 3.69Å; Y160-H169 AromaticContact CZ-CD2 3.47Å; Y160-H169 VanDerWaalsContact CZ-CD2 3.47Å; Y160-H169 AromaticContact CZ-CG 3.37Å; Y160-H169 PolarHBondContact OH-CD2 3.29Å; Y160-H169 PolarHBondContact OH-ND1 2.72Å |
| 161 | V | 74.6 | Confident | 76.1 | Confident | 98 Ų | 98 | 81.7 Ų | 81.7 | 59% | 0.594 | 41% | 0.412 | S | S | * | . | S | Bend | trans | -61.9 | -28.3 | 175.9 | 174.9 | 0 | 0 | 0 | 0 | 112.3 | D144 | D144-V161 WeakPolarHBondContact OD1-CG1 3.38Š|
| 162 | S | 75.1 | Confident | 75.7 | Confident | 57 Ų | 57 | 81.8 Ų | 81.8 | 40% | 0.399 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -129.7 | 143.9 | 179.6 | 67.9 | 0 | 0 | 0 | 0 | 113.3 | Y160 G164 A165 L166 | Y160-S162 PolarHBondContact O-N 3.27Å; S162-G164 PolarHBondContact O-N 2.84Å; S162-A165 PolarHBondContact O-N 3.29Å; S162-A165 VanDerWaalsContact OG-CB 3.32Å; S162-A165 WeakPolarHBondContact OG-CB 3.5Å; S162-A165 PolarHBondContact OG-N 3.36Å; S162-L166 PolarHBondContact O-N 3.19Å |
| 163 | L | 76.1 | Confident | 75.4 | Confident | 78 Ų | 78 | 81.8 Ų | 81.8 | 41% | 0.408 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -57.9 | -30.1 | 172.5 | -176.6 | 62.4 | 0 | 0 | 0 | 112.3 | F151 L166 K167 | F151-L163 HydrophobicContact CD1-CB 4.08Å; F151-L163 HydrophobicContact CD1-CD1 3.85Å; F151-L163 HydrophobicContact CD2-CB 4.33Å; F151-L163 HydrophobicContact CE1-CB 3.9Å; F151-L163 HydrophobicContact CE1-CD1 4.1Å; F151-L163 HydrophobicContact CE1-CG 4.41Å; F151-L163 HydrophobicContact CE2-CB 4.16Å; F151-L163 HydrophobicContact CG-CB 4.29Å; F151-L163 HydrophobicContact CG-CD1 4.5Å; F151-L163 HydrophobicContact CZ-CB 3.94Å; L163-L166 HydrophobicContact CD1-CD2 4.42Å; L163-K167 HydrophobicContact CG-CD 4.4Å; L163-K167 WeakPolarHBondContact O-CB 3.48Å; L163-K167 VanDerWaalsContact O-CG 3.3Å; L163-K167 WeakPolarHBondContact O-CG 3.39Å; L163-K167 PolarHBondContact O-N 3.04Å |
| 164 | G | 77.1 | Confident | 74.7 | Confident | 51 Ų | 51 | 84.5 Ų | 84.5 | 53% | 0.526 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66.3 | -43.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.7 | S162 K167 M168 | S162-G164 PolarHBondContact O-N 2.84Å; G164-K167 PolarHBondContact O-N 2.93Å; G164-M168 WeakPolarHBondContact O-CB 3.49Å; G164-M168 PolarHBondContact O-N 3.13Å |
| 165 | A | 77.7 | Confident | 74.3 | Confident | 38 Ų | 38 | 78.7 Ų | 78.7 | 31% | 0.314 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y160 S162 M168 H169 | Y160-A165 HydrophobicContact CD1-CB 3.84Å; Y160-A165 HydrophobicContact CG-CB 4.37Å; S162-A165 PolarHBondContact O-N 3.29Å; S162-A165 VanDerWaalsContact OG-CB 3.32Å; S162-A165 WeakPolarHBondContact OG-CB 3.5Å; S162-A165 PolarHBondContact OG-N 3.36Å; A165-M168 PolarHBondContact O-N 3.28Å; A165-H169 WeakPolarHBondContact O-CB 3.38Å; A165-H169 PolarHBondContact O-N 2.96Å |
| 166 | L | 79 | Confident | 73.9 | Confident | 15 Ų | 15 | 75 Ų | 75 | 8% | 0.079 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.6 | -48.3 | 172.8 | 175.2 | 60.6 | 0 | 0 | 0 | 111.6 | F151 S152 C153 Y160 S162 L163 M168 H169 I170 | F151-L166 HydrophobicContact CB-CB 4.05Å; F151-L166 HydrophobicContact CB-CD2 3.7Å; F151-L166 HydrophobicContact CB-CG 4.45Å; S152-L166 WeakPolarHBondContact O-CD2 3.47Å; C153-L166 HydrophobicContact CB-CD1 3.95Å; Y160-L166 HydrophobicContact CD2-CB 4.12Å; Y160-L166 HydrophobicContact CD2-CD1 3.79Å; Y160-L166 HydrophobicContact CE2-CD1 4.26Å; Y160-L166 HydrophobicContact CG-CB 4.2Å; S162-L166 PolarHBondContact O-N 3.19Å; L163-L166 HydrophobicContact CD1-CD2 4.42Å; L166-M168 VanDerWaalsContact C-N 3.31Å; L166-M168 PolarHBondContact O-N 2.86Å; L166-H169 CarbonylContact O-C 3.55Å; L166-H169 WeakPolarHBondContact O-CA 3.41Å; L166-H169 WeakPolarHBondContact O-CB 3.28Å; L166-H169 PolarHBondContact O-N 2.7Å; L166-I170 HydrophobicContact CD1-CD1 3.83Å; L166-I170 HydrophobicContact CD1-CG1 3.87Å; L166-I170 HydrophobicContact CD2-CD1 4.26Å; L166-I170 HydrophobicContact CG-CD1 3.76Å; L166-I170 HydrophobicContact CG-CG1 4.25Å; L166-I170 WeakPolarHBondContact O-CG1 3.32Å; L166-I170 PolarHBondContact O-N 3.32Å |
| 167 | K | 77.4 | Confident | 73.8 | Confident | 129 Ų | 129 | 74.4 Ų | 74.4 | 56% | 0.561 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -60.7 | -38.9 | 177.5 | -77.5 | 176.5 | 178.4 | -178.4 | 0 | 112.3 | L163 G164 H169 | L163-K167 HydrophobicContact CG-CD 4.4Å; L163-K167 WeakPolarHBondContact O-CB 3.48Å; L163-K167 VanDerWaalsContact O-CG 3.3Å; L163-K167 WeakPolarHBondContact O-CG 3.39Å; L163-K167 PolarHBondContact O-N 3.04Å; G164-K167 PolarHBondContact O-N 2.93Å; K167-H169 VanDerWaalsContact C-N 3.31Å |
| 168 | M | 74.1 | Confident | 73.8 | Confident | 80 Ų | 80 | 68.8 Ų | 68.8 | 39% | 0.394 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.5 | -35.4 | 173.5 | -175.5 | 64.1 | 67.6 | 0 | 0 | 111.8 | G164 A165 L166 R188 | G164-M168 WeakPolarHBondContact O-CB 3.49Å; G164-M168 PolarHBondContact O-N 3.13Å; A165-M168 PolarHBondContact O-N 3.28Å; L166-M168 VanDerWaalsContact C-N 3.31Å; L166-M168 PolarHBondContact O-N 2.86Å; M168-R188 HydrophobicContact SD-CG 4.46Å |
| 169 | H | 79 | Confident | 74.2 | Confident | 24 Ų | 24 | 63 Ų | 63 | 11% | 0.111 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -75.4 | -40.7 | 177.8 | 177.1 | 52.1 | 0 | 0 | 0 | 113 | C153 C156 Y160 A165 L166 K167 R171 T172 H173 | C153-H169 PolarHBondContact SG-NE2 3.27Å; C153-H169 VanDerWaalsContact SG-NE2 3.44Å; C156-H169 PolarHBondContact SG-NE2 3.36Å; Y160-H169 HydrophobicContact CE1-CB 3.94Å; Y160-H169 HydrophobicContact CE2-CB 3.9Å; Y160-H169 AromaticContact CE2-CD2 3.34Å; Y160-H169 WeakPolarHBondContact CE2-CD2 3.43Å; Y160-H169 AromaticContact CE2-CG 3.69Å; Y160-H169 AromaticContact CZ-CD2 3.47Å; Y160-H169 VanDerWaalsContact CZ-CD2 3.47Å; Y160-H169 AromaticContact CZ-CG 3.37Å; Y160-H169 PolarHBondContact OH-CD2 3.29Å; Y160-H169 PolarHBondContact OH-ND1 2.72Å; A165-H169 WeakPolarHBondContact O-CB 3.38Å; A165-H169 PolarHBondContact O-N 2.96Å; L166-H169 CarbonylContact O-C 3.55Å; L166-H169 WeakPolarHBondContact O-CA 3.41Å; L166-H169 WeakPolarHBondContact O-CB 3.28Å; L166-H169 PolarHBondContact O-N 2.7Å; K167-H169 VanDerWaalsContact C-N 3.31Å; H169-R171 PolarHBondContact O-N 3.19Å; H169-R171 VanDerWaalsContact O-N 3.07Å; H169-T172 PolarHBondContact CE1-OG1 3.39Å; H169-T172 VanDerWaalsContact CE1-OG1 3.27Å; H169-T172 PolarHBondContact ND1-OG1 3.31Å; H169-T172 WeakPolarHBondContact O-CB 3.09Å; H169-T172 PolarHBondContact O-N 2.81Å; H169-T172 PolarHBondContact O-OG1 3.45Å; H169-H173 AromaticContact CD2-NE2 3.91Å; H169-H173 AromaticContact CE1-NE2 3.36Å; H169-H173 PolarHBondContact CE1-NE2 3.33Å; H169-H173 AromaticContact NE2-CD2 3.69Å; H169-H173 AromaticContact NE2-CE1 3.96Å; H169-H173 AromaticContact NE2-NE2 2.94Å; H169-H173 PolarHBondContact NE2-NE2 2.93Å |
| 170 | I | 75.3 | Confident | 74.2 | Confident | 46 Ų | 46 | 68.4 Ų | 68.4 | 24% | 0.236 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -55.6 | -31.7 | 176.5 | -71 | 167.5 | 0 | 0 | 0 | 111.3 | Y155 L166 T172 H173 T174 | Y155-I170 HydrophobicContact CE2-CG2 4.09Å; L166-I170 HydrophobicContact CD1-CD1 3.83Å; L166-I170 HydrophobicContact CD1-CG1 3.87Å; L166-I170 HydrophobicContact CD2-CD1 4.26Å; L166-I170 HydrophobicContact CG-CD1 3.76Å; L166-I170 HydrophobicContact CG-CG1 4.25Å; L166-I170 WeakPolarHBondContact O-CG1 3.32Å; L166-I170 PolarHBondContact O-N 3.32Å; I170-T172 PolarHBondContact O-N 3.26Å; I170-H173 WeakPolarHBondContact O-CB 3.45Å; I170-H173 PolarHBondContact O-N 3.12Å; I170-T174 HydrophobicContact CG2-CG2 4.04Å; I170-T174 PolarHBondContact O-N 3.31Å; I170-T174 PolarHBondContact O-OG1 2.81Å |
| 171 | R | 69.9 | Low | 74.5 | Confident | 107 Ų | 107 | 71.1 Ų | 71.1 | 40% | 0.404 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.6 | -15.9 | 173 | -69.5 | 176.3 | 148.8 | 148.8 | -4.5 | 115.4 | H169 H173 L175 P176 S187 | H169-R171 PolarHBondContact O-N 3.19Å; H169-R171 VanDerWaalsContact O-N 3.07Å; R171-H173 VanDerWaalsContact C-N 3.34Å; R171-L175 PolarHBondContact O-N 3.45Å; R171-P176 HydrophobicContact CG-CG 4.2Å; R171-S187 WeakPolarHBondContact CB-O 3.48Å |
| 172 | T | 66 | Low | 74.8 | Confident | 67 Ų | 67 | 69 Ų | 69 | 41% | 0.411 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -76.8 | -25 | 169.8 | 68.5 | 0 | 0 | 0 | 0 | 112 | H169 I170 | H169-T172 PolarHBondContact CE1-OG1 3.39Å; H169-T172 VanDerWaalsContact CE1-OG1 3.27Å; H169-T172 PolarHBondContact ND1-OG1 3.31Å; H169-T172 WeakPolarHBondContact O-CB 3.09Å; H169-T172 PolarHBondContact O-N 2.81Å; H169-T172 PolarHBondContact O-OG1 3.45Å; I170-T172 PolarHBondContact O-N 3.26Å |
| 173 | H | 68.4 | Low | 74.9 | Confident | 74 Ų | 74 | 68.9 Ų | 68.9 | 34% | 0.343 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -86.9 | -38.5 | 174.4 | -58.5 | -66.2 | 0 | 0 | 0 | 111.9 | C153 Y155 C156 H169 I170 R171 | C153-H173 PolarHBondContact SG-NE2 3.13Å; Y155-H173 HydrophobicContact CD2-CB 3.95Å; Y155-H173 HydrophobicContact CG-CB 4.01Å; C156-H173 PolarHBondContact SG-NE2 3.31Å; H169-H173 AromaticContact CD2-NE2 3.91Å; H169-H173 AromaticContact CE1-NE2 3.36Å; H169-H173 PolarHBondContact CE1-NE2 3.33Å; H169-H173 AromaticContact NE2-CD2 3.69Å; H169-H173 AromaticContact NE2-CE1 3.96Å; H169-H173 AromaticContact NE2-NE2 2.94Å; H169-H173 PolarHBondContact NE2-NE2 2.93Å; I170-H173 WeakPolarHBondContact O-CB 3.45Å; I170-H173 PolarHBondContact O-N 3.12Å; R171-H173 VanDerWaalsContact C-N 3.34Å |
| 174 | T | 66 | Low | 75 | Confident | 67 Ų | 67 | 71.4 Ų | 71.4 | 41% | 0.411 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -93.8 | -1.6 | -173.5 | 59.8 | 0 | 0 | 0 | 0 | 115.3 | Y155 I170 P176 | Y155-T174 HydrophobicContact CE2-CG2 4.4Å; I170-T174 HydrophobicContact CG2-CG2 4.04Å; I170-T174 PolarHBondContact O-N 3.31Å; I170-T174 PolarHBondContact O-OG1 2.81Å; T174-P176 VanDerWaalsContact C-CD 3.44Å; T174-P176 VanDerWaalsContact C-N 3.3Å; T174-P176 WeakPolarHBondContact O-CA 3.29Å; T174-P176 WeakPolarHBondContact O-CD 3.46Å |
| 175 | L | 66.7 | Low | 75.1 | Confident | 71 Ų | 71 | 71.1 Ų | 71.1 | 37% | 0.372 | 38% | 0.383 | S | S | . | . | trans | 23.4 | 56.7 | -179.9 | -63.2 | 178.1 | 0 | 0 | 0 | 115.5 | R171 C177 A185 F186 | R171-L175 PolarHBondContact O-N 3.45Å; L175-C177 PolarHBondContact O-N 3.15Å; L175-A185 HydrophobicContact CB-CB 3.79Å; L175-A185 HydrophobicContact CD1-CB 4.11Å; L175-F186 CarbonylContact C-O 3.37Å | ||
| 176 | P | 67.1 | Low | 75.2 | Confident | 71 Ų | 71 | 71.3 Ų | 71.3 | 46% | 0.461 | 38% | 0.377 | S | S | . | . | trans | -75.9 | 0.2 | -160.9 | 31.1 | -37.7 | 0 | 0 | 0 | 114.3 | R171 T174 | R171-P176 HydrophobicContact CG-CG 4.2Å; T174-P176 VanDerWaalsContact C-CD 3.44Å; T174-P176 VanDerWaalsContact C-N 3.3Å; T174-P176 WeakPolarHBondContact O-CA 3.29Å; T174-P176 WeakPolarHBondContact O-CD 3.46Å | ||
| 177 | C | 73.2 | Confident | 75.2 | Confident | 18 Ų | 18 | 72 Ų | 72 | 12% | 0.122 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 84.4 | -176.7 | -58.5 | 0 | 0 | 0 | 0 | 110 | L175 F186 L192 | L175-C177 PolarHBondContact O-N 3.15Å; C177-F186 HydrophobicContact CB-CB 4.3Å; C177-F186 WeakPolarHBondContact CB-O 3.47Å; C177-F186 PolarHBondContact N-O 3.18Å; C177-F186 PolarHBondContact O-N 3.5Å; C177-L192 HydrophobicContact CB-CB 4.04Å; C177-L192 HydrophobicContact CB-CD2 3.83Å |
| 178 | V | 76.3 | Confident | 75.1 | Confident | 79 Ų | 79 | 70.6 Ų | 70.6 | 48% | 0.479 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.5 | 136.5 | -179.9 | -173.4 | 0 | 0 | 0 | 0 | 111.6 | K180 G183 A185 | V178-K180 PolarHBondContact O-N 3.39Å; V178-G183 WeakPolarHBondContact CG1-O 3.4Å; V178-A185 HydrophobicContact CG2-CB 4.02Å |
| 179 | C | 82.8 | Confident | 75.2 | Confident | 1 Ų | 1 | 70.2 Ų | 70.2 | 1% | 0.007 | 38% | 0.378 | C | S | . | . | trans | -76.6 | 117.9 | 172.2 | -173.8 | 0 | 0 | 0 | 0 | 110.8 | I181 G183 K184 F186 L192 | C179-I181 PolarHBondContact O-N 2.9Å; C179-G183 VanDerWaalsContact O-CA 3.29Å; C179-G183 WeakPolarHBondContact O-CA 3.37Å; C179-G183 PolarHBondContact O-N 3.48Å; C179-K184 WeakPolarHBondContact CB-O 3.48Å; C179-K184 PolarHBondContact N-O 3.3Å; C179-F186 HydrophobicContact CB-CE2 4.32Å; C179-L192 HydrophobicContact CB-CD1 3.64Å | ||
| 180 | K | 79.9 | Confident | 75.3 | Confident | 216 Ų | 216 | 76.1 Ų | 76.1 | 94% | 0.939 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -17.6 | 177.9 | -64 | -171.7 | 177 | -173.5 | 0 | 114.3 | V178 | V178-K180 PolarHBondContact O-N 3.39Š|
| 181 | I | 81.8 | Confident | 75.6 | Confident | 107 Ų | 107 | 76.8 Ų | 76.8 | 55% | 0.549 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -35.1 | -176.6 | -56.3 | 172.4 | 0 | 0 | 0 | 111.7 | C179 H199 | C179-I181 PolarHBondContact O-N 2.9Å; I181-H199 HydrophobicContact CD1-CB 3.64Å; I181-H199 HydrophobicContact CG2-CB 4.26Å |
| 182 | C | 82.6 | Confident | 76.3 | Confident | 53 Ų | 53 | 72.8 Ų | 72.8 | 36% | 0.358 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -138.9 | 10.2 | -173.1 | 70.4 | 0 | 0 | 0 | 0 | 115 | K184 H195 H199 | C182-K184 PolarHBondContact O-N 3.08Å; C182-H195 PolarHBondContact SG-NE2 3.04Å; C182-H199 PolarHBondContact SG-NE2 3.09Å; C182-H199 VanDerWaalsContact SG-NE2 3.44Å |
| 183 | G | 76.9 | Confident | 77 | Confident | 55 Ų | 55 | 74.8 Ų | 74.8 | 57% | 0.567 | 39% | 0.394 | S | S | * | . | trans | 69.5 | -3.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | V178 C179 A185 | V178-G183 WeakPolarHBondContact CG1-O 3.4Å; C179-G183 VanDerWaalsContact O-CA 3.29Å; C179-G183 WeakPolarHBondContact O-CA 3.37Å; C179-G183 PolarHBondContact O-N 3.48Å; G183-A185 PolarHBondContact O-N 3.4Å | ||
| 184 | K | 78.3 | Confident | 77.7 | Confident | 131 Ų | 131 | 72.4 Ų | 72.4 | 57% | 0.57 | 39% | 0.39 | S | S | * | . | trans | -66.4 | 128.6 | -178 | -71.3 | -176.2 | 178.7 | -178.4 | 0 | 111.8 | C179 C182 F186 | C179-K184 WeakPolarHBondContact CB-O 3.48Å; C179-K184 PolarHBondContact N-O 3.3Å; C182-K184 PolarHBondContact O-N 3.08Å; K184-F186 HydrophobicContact CB-CE2 3.82Å; K184-F186 HydrophobicContact CB-CZ 4.09Å; K184-F186 WeakPolarHBondContact O-CD2 3.27Å; K184-F186 VanDerWaalsContact O-CE2 3.27Å; K184-F186 WeakPolarHBondContact O-CE2 3.5Å | ||
| 185 | A | 78.8 | Confident | 78.6 | Confident | 44 Ų | 44 | 70.5 Ų | 70.5 | 36% | 0.364 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 140.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L175 V178 G183 | L175-A185 HydrophobicContact CB-CB 3.79Å; L175-A185 HydrophobicContact CD1-CB 4.11Å; V178-A185 HydrophobicContact CG2-CB 4.02Å; G183-A185 PolarHBondContact O-N 3.4Å |
| 186 | F | 80.4 | Confident | 79.4 | Confident | 42 Ų | 42 | 69.3 Ų | 69.3 | 18% | 0.184 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 146.9 | -176.2 | -62.2 | -91.3 | 0 | 0 | 0 | 111.3 | L175 C177 C179 K184 R188 L191 L192 H195 | L175-F186 CarbonylContact C-O 3.37Å; C177-F186 HydrophobicContact CB-CB 4.3Å; C177-F186 WeakPolarHBondContact CB-O 3.47Å; C177-F186 PolarHBondContact N-O 3.18Å; C177-F186 PolarHBondContact O-N 3.5Å; C179-F186 HydrophobicContact CB-CE2 4.32Å; K184-F186 HydrophobicContact CB-CE2 3.82Å; K184-F186 HydrophobicContact CB-CZ 4.09Å; K184-F186 WeakPolarHBondContact O-CD2 3.27Å; K184-F186 VanDerWaalsContact O-CE2 3.27Å; K184-F186 WeakPolarHBondContact O-CE2 3.5Å; F186-R188 VanDerWaalsContact C-N 3.32Å; F186-R188 PolarHBondContact O-N 3.11Å; F186-L191 HydrophobicContact CB-CB 4.22Å; F186-L191 HydrophobicContact CD1-CB 3.92Å; F186-L191 HydrophobicContact CG-CB 4.37Å; F186-L192 HydrophobicContact CB-CB 4.22Å; F186-L192 HydrophobicContact CD2-CB 4.02Å; F186-L192 HydrophobicContact CD2-CD1 3.87Å; F186-L192 HydrophobicContact CE2-CD1 4.12Å; F186-L192 HydrophobicContact CG-CB 4.24Å; F186-H195 HydrophobicContact CE1-CB 3.95Å; F186-H195 HydrophobicContact CE2-CB 3.97Å; F186-H195 AromaticContact CE2-CD2 3.29Å; F186-H195 WeakPolarHBondContact CE2-CD2 3.36Å; F186-H195 AromaticContact CE2-CG 3.77Å; F186-H195 HydrophobicContact CZ-CB 3.48Å; F186-H195 VanDerWaalsContact CZ-CB 3.48Å; F186-H195 AromaticContact CZ-CD2 3.29Å; F186-H195 WeakPolarHBondContact CZ-CD2 3.42Å; F186-H195 AromaticContact CZ-CG 3.31Å |
| 187 | S | 77.6 | Confident | 80.3 | Confident | 29 Ų | 29 | 68.9 Ų | 68.9 | 20% | 0.203 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -77.8 | -13.7 | 179 | 58.6 | 0 | 0 | 0 | 0 | 114.1 | R171 | R171-S187 WeakPolarHBondContact CB-O 3.48Š|
| 188 | R | 75.1 | Confident | 80.8 | Confident | 101 Ų | 101 | 72.4 Ų | 72.4 | 38% | 0.381 | 38% | 0.38 | S | S | . | . | S | Bend | trans | -141.7 | 141.2 | -177.1 | -58.6 | -176.4 | 176.5 | 168.8 | -3.3 | 111.8 | M168 F186 W190 L191 L192 | M168-R188 HydrophobicContact SD-CG 4.46Å; F186-R188 VanDerWaalsContact C-N 3.32Å; F186-R188 PolarHBondContact O-N 3.11Å; R188-W190 VanDerWaalsContact C-N 3.31Å; R188-W190 VanDerWaalsContact CD-NE1 3.33Å; R188-W190 PolarHBondContact O-N 3.29Å; R188-L191 HydrophobicContact CB-CD1 4Å; R188-L191 HydrophobicContact CB-CG 4.23Å; R188-L191 HydrophobicContact CG-CD1 4.27Å; R188-L191 WeakPolarHBondContact O-CB 3.47Å; R188-L191 PolarHBondContact O-N 2.94Å; R188-L191 VanDerWaalsContact O-N 3.13Å; R188-L192 PolarHBondContact O-N 3.14Å |
| 189 | P | 77.4 | Confident | 81.1 | Confident | 72 Ų | 72 | 72.2 Ų | 72.2 | 47% | 0.468 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.3 | -37.4 | 179.2 | -25.9 | 33.4 | 0 | 0 | 0 | 114.3 | L191 L192 Q193 | P189-L191 VanDerWaalsContact C-N 3.32Å; P189-L191 PolarHBondContact O-N 3.06Å; P189-L192 PolarHBondContact O-N 2.76Å; P189-Q193 WeakPolarHBondContact O-CG 3.49Å; P189-Q193 PolarHBondContact O-N 2.98Å |
| 190 | W | 79.8 | Confident | 81 | Confident | 147 Ų | 147 | 75.5 Ų | 75.5 | 56% | 0.557 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -70.2 | -27.5 | 179.9 | 69 | -101.4 | 0 | 0 | 0 | 113.2 | R188 G194 | R188-W190 VanDerWaalsContact C-N 3.31Å; R188-W190 VanDerWaalsContact CD-NE1 3.33Å; R188-W190 PolarHBondContact O-N 3.29Å; W190-G194 PolarHBondContact O-N 3.13Å |
| 191 | L | 82.4 | Confident | 81.1 | Confident | 60 Ų | 60 | 67.4 Ų | 67.4 | 31% | 0.314 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -69.4 | -43.6 | 172.2 | -72.7 | 169.4 | 0 | 0 | 0 | 110.3 | F186 R188 P189 G194 H195 | F186-L191 HydrophobicContact CB-CB 4.22Å; F186-L191 HydrophobicContact CD1-CB 3.92Å; F186-L191 HydrophobicContact CG-CB 4.37Å; R188-L191 HydrophobicContact CB-CD1 4Å; R188-L191 HydrophobicContact CB-CG 4.23Å; R188-L191 HydrophobicContact CG-CD1 4.27Å; R188-L191 WeakPolarHBondContact O-CB 3.47Å; R188-L191 PolarHBondContact O-N 2.94Å; R188-L191 VanDerWaalsContact O-N 3.13Å; P189-L191 VanDerWaalsContact C-N 3.32Å; P189-L191 PolarHBondContact O-N 3.06Å; L191-G194 PolarHBondContact O-N 3.32Å; L191-H195 WeakPolarHBondContact O-CB 3.49Å; L191-H195 PolarHBondContact O-N 3.07Å |
| 192 | L | 83.8 | Confident | 81.2 | Confident | 24 Ų | 24 | 67.3 Ų | 67.3 | 13% | 0.126 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 172.8 | 171.6 | 61 | 0 | 0 | 0 | 111.3 | C177 C179 F186 R188 P189 H195 I196 | C177-L192 HydrophobicContact CB-CB 4.04Å; C177-L192 HydrophobicContact CB-CD2 3.83Å; C179-L192 HydrophobicContact CB-CD1 3.64Å; F186-L192 HydrophobicContact CB-CB 4.22Å; F186-L192 HydrophobicContact CD2-CB 4.02Å; F186-L192 HydrophobicContact CD2-CD1 3.87Å; F186-L192 HydrophobicContact CE2-CD1 4.12Å; F186-L192 HydrophobicContact CG-CB 4.24Å; R188-L192 PolarHBondContact O-N 3.14Å; P189-L192 PolarHBondContact O-N 2.76Å; L192-H195 CarbonylContact O-C 3.57Å; L192-H195 WeakPolarHBondContact O-CB 3.46Å; L192-H195 PolarHBondContact O-N 2.77Å; L192-H195 VanDerWaalsContact O-N 3.13Å; L192-I196 HydrophobicContact CD1-CD1 4.06Å; L192-I196 HydrophobicContact CD1-CG1 4.11Å; L192-I196 HydrophobicContact CG-CD1 3.96Å; L192-I196 HydrophobicContact CG-CG1 4.47Å; L192-I196 WeakPolarHBondContact O-CG1 3.43Å; L192-I196 PolarHBondContact O-N 2.82Å |
| 193 | Q | 81.9 | Confident | 81.3 | Confident | 109 Ų | 109 | 71 Ų | 71 | 51% | 0.509 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 177.2 | -73.6 | -66.5 | -12.1 | 0 | 0 | 112.6 | P189 H195 I196 R197 | P189-Q193 WeakPolarHBondContact O-CG 3.49Å; P189-Q193 PolarHBondContact O-N 2.98Å; Q193-H195 PolarHBondContact O-N 3.16Å; Q193-I196 PolarHBondContact O-N 3.14Å; Q193-R197 PolarHBondContact O-N 3.3Å |
| 194 | G | 83.1 | Confident | 81.6 | Confident | 24 Ų | 24 | 71.8 Ų | 71.8 | 25% | 0.247 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.5 | -33.1 | 172 | 0 | 0 | 0 | 0 | 0 | 113.1 | W190 L191 | W190-G194 PolarHBondContact O-N 3.13Å; L191-G194 PolarHBondContact O-N 3.32Å |
| 195 | H | 85 | Confident | 82 | Confident | 26 Ų | 26 | 67.2 Ų | 67.2 | 12% | 0.12 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -75 | -35.9 | 173.9 | 175 | 51.1 | 0 | 0 | 0 | 113.6 | C182 F186 L191 L192 Q193 R197 T198 H199 | C182-H195 PolarHBondContact SG-NE2 3.04Å; F186-H195 HydrophobicContact CE1-CB 3.95Å; F186-H195 HydrophobicContact CE2-CB 3.97Å; F186-H195 AromaticContact CE2-CD2 3.29Å; F186-H195 WeakPolarHBondContact CE2-CD2 3.36Å; F186-H195 AromaticContact CE2-CG 3.77Å; F186-H195 HydrophobicContact CZ-CB 3.48Å; F186-H195 VanDerWaalsContact CZ-CB 3.48Å; F186-H195 AromaticContact CZ-CD2 3.29Å; F186-H195 WeakPolarHBondContact CZ-CD2 3.42Å; F186-H195 AromaticContact CZ-CG 3.31Å; L191-H195 WeakPolarHBondContact O-CB 3.49Å; L191-H195 PolarHBondContact O-N 3.07Å; L192-H195 CarbonylContact O-C 3.57Å; L192-H195 WeakPolarHBondContact O-CB 3.46Å; L192-H195 PolarHBondContact O-N 2.77Å; L192-H195 VanDerWaalsContact O-N 3.13Å; Q193-H195 PolarHBondContact O-N 3.16Å; H195-R197 PolarHBondContact O-N 3.48Å; H195-T198 PolarHBondContact CE1-OG1 2.87Å; H195-T198 PolarHBondContact ND1-OG1 3.12Å; H195-T198 VanDerWaalsContact ND1-OG1 3.09Å; H195-T198 WeakPolarHBondContact O-CB 3.4Å; H195-T198 PolarHBondContact O-N 3.14Å; H195-T198 PolarHBondContact O-OG1 3.45Å; H195-H199 AromaticContact CD2-NE2 3.91Å; H195-H199 AromaticContact CE1-CE1 3.94Å; H195-H199 AromaticContact CE1-NE2 3.27Å; H195-H199 PolarHBondContact CE1-NE2 3.23Å; H195-H199 VanDerWaalsContact CE1-NE2 3.27Å; H195-H199 AromaticContact NE2-CD2 3.87Å; H195-H199 AromaticContact NE2-CE1 3.96Å; H195-H199 AromaticContact NE2-NE2 3.03Å; H195-H199 PolarHBondContact NE2-NE2 3.15Å |
| 196 | I | 84.2 | Confident | 82.5 | Confident | 46 Ų | 46 | 69 Ų | 69 | 24% | 0.236 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57.8 | -36.4 | 177.1 | -72.8 | 164 | 0 | 0 | 0 | 110.7 | L192 Q193 T198 H199 T200 | L192-I196 HydrophobicContact CD1-CD1 4.06Å; L192-I196 HydrophobicContact CD1-CG1 4.11Å; L192-I196 HydrophobicContact CG-CD1 3.96Å; L192-I196 HydrophobicContact CG-CG1 4.47Å; L192-I196 WeakPolarHBondContact O-CG1 3.43Å; L192-I196 PolarHBondContact O-N 2.82Å; Q193-I196 PolarHBondContact O-N 3.14Å; I196-T198 PolarHBondContact O-N 2.65Å; I196-T198 VanDerWaalsContact O-N 3.15Å; I196-H199 WeakPolarHBondContact O-CA 3.01Å; I196-H199 WeakPolarHBondContact O-CB 3.45Å; I196-H199 PolarHBondContact O-N 3.41Å; I196-T200 HydrophobicContact CG2-CG2 4.23Å; I196-T200 PolarHBondContact O-N 3.37Å; I196-T200 VanDerWaalsContact O-N 3.07Å |
| 197 | R | 85.4 | Confident | 82.9 | Confident | 62 Ų | 62 | 67.4 Ų | 67.4 | 23% | 0.234 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.6 | -20.1 | 172.8 | -63.3 | -179.1 | -174.1 | 140.2 | 7.8 | 115 | Q193 H195 H199 G201 E202 A215 | Q193-R197 PolarHBondContact O-N 3.3Å; H195-R197 PolarHBondContact O-N 3.48Å; R197-H199 VanDerWaalsContact C-N 3.28Å; R197-G201 WeakPolarHBondContact O-CA 3.38Å; R197-G201 PolarHBondContact O-N 3.45Å; R197-E202 HydrophobicContact CB-CB 4.32Å; R197-E202 HydrophobicContact CG-CB 4.07Å; R197-A215 HydrophobicContact CB-CB 3.86Å; R197-A215 VanDerWaalsContact CD-O 3.28Å; R197-A215 WeakPolarHBondContact CD-O 3.47Å; R197-A215 PolarHBondContact NH1-O 2.93Å |
| 198 | T | 83.5 | Confident | 83.4 | Confident | 93 Ų | 93 | 70.9 Ų | 70.9 | 57% | 0.571 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -75.9 | -19 | 172.3 | 69.7 | 0 | 0 | 0 | 0 | 112.8 | H195 I196 | H195-T198 PolarHBondContact CE1-OG1 2.87Å; H195-T198 PolarHBondContact ND1-OG1 3.12Å; H195-T198 VanDerWaalsContact ND1-OG1 3.09Å; H195-T198 WeakPolarHBondContact O-CB 3.4Å; H195-T198 PolarHBondContact O-N 3.14Å; H195-T198 PolarHBondContact O-OG1 3.45Å; I196-T198 PolarHBondContact O-N 2.65Å; I196-T198 VanDerWaalsContact O-N 3.15Å |
| 199 | H | 81.9 | Confident | 83.9 | Confident | 74 Ų | 74 | 72.3 Ų | 72.3 | 34% | 0.343 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -91.8 | -41.9 | 173 | -59.3 | -67.8 | 0 | 0 | 0 | 111.9 | I181 C182 H195 I196 R197 G201 | I181-H199 HydrophobicContact CD1-CB 3.64Å; I181-H199 HydrophobicContact CG2-CB 4.26Å; C182-H199 PolarHBondContact SG-NE2 3.09Å; C182-H199 VanDerWaalsContact SG-NE2 3.44Å; H195-H199 AromaticContact CD2-NE2 3.91Å; H195-H199 AromaticContact CE1-CE1 3.94Å; H195-H199 AromaticContact CE1-NE2 3.27Å; H195-H199 PolarHBondContact CE1-NE2 3.23Å; H195-H199 VanDerWaalsContact CE1-NE2 3.27Å; H195-H199 AromaticContact NE2-CD2 3.87Å; H195-H199 AromaticContact NE2-CE1 3.96Å; H195-H199 AromaticContact NE2-NE2 3.03Å; H195-H199 PolarHBondContact NE2-NE2 3.15Å; I196-H199 WeakPolarHBondContact O-CA 3.01Å; I196-H199 WeakPolarHBondContact O-CB 3.45Å; I196-H199 PolarHBondContact O-N 3.41Å; R197-H199 VanDerWaalsContact C-N 3.28Å; H199-G201 VanDerWaalsContact C-N 3.32Å |
| 200 | T | 82.2 | Confident | 84.5 | Confident | 71 Ų | 71 | 70.8 Ų | 70.8 | 44% | 0.436 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -79.6 | -13.5 | 179.2 | 64.9 | 0 | 0 | 0 | 0 | 113.7 | I196 E202 | I196-T200 HydrophobicContact CG2-CG2 4.23Å; I196-T200 PolarHBondContact O-N 3.37Å; I196-T200 VanDerWaalsContact O-N 3.07Å; T200-E202 PolarHBondContact O-N 3.35Å; T200-E202 WeakPolarHBondContact OG1-CG 3.43Å; T200-E202 PolarHBondContact OG1-OE1 3.33Å; T200-E202 VanDerWaalsContact OG1-OE1 3.04Å |
| 201 | G | 81.8 | Confident | 84.8 | Confident | 45 Ų | 45 | 70 Ų | 70 | 46% | 0.464 | 40% | 0.398 | S | S | . | . | trans | 74.2 | 0.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | R197 H199 K203 | R197-G201 WeakPolarHBondContact O-CA 3.38Å; R197-G201 PolarHBondContact O-N 3.45Å; H199-G201 VanDerWaalsContact C-N 3.32Å; G201-K203 WeakPolarHBondContact O-CG 3.47Å; G201-K203 PolarHBondContact O-N 2.84Å | ||
| 202 | E | 82.7 | Confident | 85 | Confident | 105 Ų | 105 | 74.7 Ų | 74.7 | 49% | 0.491 | 41% | 0.411 | S | S | . | . | trans | -57.6 | 126.5 | -178.8 | -80.6 | 169.6 | -133.4 | 0 | 0 | 113 | R197 T200 P204 | R197-E202 HydrophobicContact CB-CB 4.32Å; R197-E202 HydrophobicContact CG-CB 4.07Å; T200-E202 PolarHBondContact O-N 3.35Å; T200-E202 WeakPolarHBondContact OG1-CG 3.43Å; T200-E202 PolarHBondContact OG1-OE1 3.33Å; T200-E202 VanDerWaalsContact OG1-OE1 3.04Å; E202-P204 VanDerWaalsContact C-CD 3.47Å; E202-P204 WeakPolarHBondContact O-CD 3.4Å | ||
| 203 | K | 84.4 | Confident | 85.2 | Confident | 132 Ų | 132 | 75.2 Ų | 75.2 | 57% | 0.574 | 42% | 0.419 | S | S | * | . | trans | -125.8 | 69.7 | -178.9 | -72.6 | 159.5 | -179.3 | 173.6 | 0 | 110.8 | G201 F205 A213 F214 | G201-K203 WeakPolarHBondContact O-CG 3.47Å; G201-K203 PolarHBondContact O-N 2.84Å; K203-F205 PolarHBondContact O-N 3.32Å; K203-F205 VanDerWaalsContact O-N 3.08Å; K203-A213 HydrophobicContact CB-CB 3.63Å; K203-A213 WeakPolarHBondContact CD-O 3.48Å; K203-F214 CarbonylContact C-O 3.55Å; K203-F214 WeakPolarHBondContact CA-O 3.26Å | ||
| 204 | P | 84.4 | Confident | 85.3 | Confident | 71 Ų | 71 | 72.1 Ų | 72.1 | 46% | 0.461 | 40% | 0.404 | S | S | . | . | trans | -69.3 | -3.9 | -175.2 | 29 | -36.5 | 0 | 0 | 0 | 114.6 | E202 | E202-P204 VanDerWaalsContact C-CD 3.47Å; E202-P204 WeakPolarHBondContact O-CD 3.4Å | ||
| 205 | F | 86.6 | Confident | 85.4 | Confident | 34 Ų | 34 | 72 Ų | 72 | 15% | 0.149 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 88.5 | -178.6 | -53.4 | -59.3 | 0 | 0 | 0 | 110.8 | K203 A213 F214 D216 R217 L220 | K203-F205 PolarHBondContact O-N 3.32Å; K203-F205 VanDerWaalsContact O-N 3.08Å; F205-A213 CarbonylContact O-C 3.54Å; F205-A213 WeakPolarHBondContact O-CA 3.25Å; F205-F214 WeakPolarHBondContact CB-O 3.43Å; F205-F214 PolarHBondContact N-O 3.39Å; F205-F214 VanDerWaalsContact N-O 3.14Å; F205-F214 PolarHBondContact O-N 3.27Å; F205-D216 VanDerWaalsContact CD2-C 3.45Å; F205-R217 HydrophobicContact CD1-CG 3.8Å; F205-R217 HydrophobicContact CD2-CG 4.04Å; F205-R217 HydrophobicContact CE1-CG 3.53Å; F205-R217 HydrophobicContact CE2-CG 3.76Å; F205-R217 HydrophobicContact CG-CG 4.06Å; F205-R217 HydrophobicContact CZ-CG 3.51Å; F205-L220 HydrophobicContact CB-CB 4.16Å; F205-L220 HydrophobicContact CB-CD2 3.84Å |
| 206 | S | 88.6 | Confident | 85.3 | Confident | 82 Ų | 82 | 73.1 Ų | 73.1 | 57% | 0.573 | 41% | 0.408 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.3 | 152.7 | 172.4 | 48.1 | 0 | 0 | 0 | 0 | 112.3 | L220 | S206-L220 WeakPolarHBondContact O-CD2 3.38Å |
| 207 | C | 89.8 | Confident | 85.3 | Confident | 8 Ų | 8 | 79.5 Ų | 79.5 | 5% | 0.054 | 43% | 0.429 | C | S | . | . | trans | -82.6 | 136.2 | 166 | -172.4 | 0 | 0 | 0 | 0 | 109.7 | H209 C210 R212 L220 H223 H227 | C207-H209 VanDerWaalsContact C-N 3.27Å; C207-H209 PolarHBondContact O-N 2.78Å; C207-H209 PolarHBondContact SG-N 3.09Å; C207-C210 WeakPolarHBondContact CB-O 3.47Å; C207-R212 WeakPolarHBondContact CB-O 3.44Å; C207-R212 PolarHBondContact N-O 3.32Å; C207-L220 HydrophobicContact CB-CD1 4.16Å; C207-H223 PolarHBondContact SG-NE2 2.99Å; C207-H227 PolarHBondContact SG-NE2 2.7Å | ||
| 208 | P | 87.4 | Confident | 85.3 | Confident | 103 Ų | 103 | 79.9 Ų | 79.9 | 67% | 0.669 | 44% | 0.441 | S | S | * | . | S | Bend | trans | -75.1 | -15.4 | 173.7 | 31.1 | -34.8 | 0 | 0 | 0 | 113.1 | L224 | P208-L224 HydrophobicContact CG-CD2 4.34Š|
| 209 | H | 86.6 | Confident | 85.4 | Confident | 130 Ų | 130 | 79.2 Ų | 79.2 | 60% | 0.602 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -103.2 | -8.3 | -176.5 | -55.4 | -61.2 | 0 | 0 | 0 | 113.9 | C207 H227 | C207-H209 VanDerWaalsContact C-N 3.27Å; C207-H209 PolarHBondContact O-N 2.78Å; C207-H209 PolarHBondContact SG-N 3.09Å; H209-H227 PolarHBondContact O-CE1 3.08Å |
| 210 | C | 88.9 | Confident | 85.7 | Confident | 40 Ų | 40 | 77 Ų | 77 | 27% | 0.27 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -161.5 | 166.5 | 173.8 | 68.2 | 0 | 0 | 0 | 0 | 112.1 | C207 R212 H223 H227 | C207-C210 WeakPolarHBondContact CB-O 3.47Å; C210-R212 PolarHBondContact O-N 2.8Å; C210-H223 PolarHBondContact SG-NE2 3.21Å; C210-H223 VanDerWaalsContact SG-NE2 3.35Å; C210-H227 WeakPolarHBondContact CB-CE1 3.43Å; C210-H227 PolarHBondContact SG-CE1 3.4Å; C210-H227 PolarHBondContact SG-NE2 3.35Å |
| 211 | S | 87.2 | Confident | 85.9 | Confident | 130 Ų | 130 | 82.6 Ų | 82.6 | 91% | 0.909 | 44% | 0.438 | S | S | * | . | S | Bend | trans | -67.9 | 8.2 | -178.5 | 55.3 | 0 | 0 | 0 | 0 | 115.9 | ||
| 212 | R | 85.4 | Confident | 86 | Confident | 160 Ų | 160 | 81 Ų | 81 | 60% | 0.604 | 42% | 0.42 | S | S | * | . | trans | -79.2 | 133.8 | 178.1 | -77.4 | -177.4 | 161.2 | 161.6 | -3.2 | 111.6 | C207 C210 F214 | C207-R212 WeakPolarHBondContact CB-O 3.44Å; C207-R212 PolarHBondContact N-O 3.32Å; C210-R212 PolarHBondContact O-N 2.8Å; R212-F214 HydrophobicContact CB-CE2 3.87Å; R212-F214 HydrophobicContact CB-CZ 3.98Å | ||
| 213 | A | 87.4 | Confident | 86.2 | Confident | 35 Ų | 35 | 76.8 Ų | 76.8 | 29% | 0.289 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 150.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | K203 F205 | K203-A213 HydrophobicContact CB-CB 3.63Å; K203-A213 WeakPolarHBondContact CD-O 3.48Å; F205-A213 CarbonylContact O-C 3.54Å; F205-A213 WeakPolarHBondContact O-CA 3.25Å |
| 214 | F | 85.1 | Confident | 86.2 | Confident | 43 Ų | 43 | 73 Ų | 73 | 19% | 0.189 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 148 | -169 | -57.8 | -92 | 0 | 0 | 0 | 111.8 | K203 F205 R212 N219 L220 H223 | K203-F214 CarbonylContact C-O 3.55Å; K203-F214 WeakPolarHBondContact CA-O 3.26Å; F205-F214 WeakPolarHBondContact CB-O 3.43Å; F205-F214 PolarHBondContact N-O 3.39Å; F205-F214 VanDerWaalsContact N-O 3.14Å; F205-F214 PolarHBondContact O-N 3.27Å; R212-F214 HydrophobicContact CB-CE2 3.87Å; R212-F214 HydrophobicContact CB-CZ 3.98Å; F214-N219 HydrophobicContact CB-CB 4.38Å; F214-N219 HydrophobicContact CD1-CB 4.02Å; F214-N219 HydrophobicContact CG-CB 4.48Å; F214-L220 HydrophobicContact CB-CB 4.39Å; F214-L220 HydrophobicContact CD2-CB 4.12Å; F214-L220 HydrophobicContact CD2-CD1 3.93Å; F214-L220 HydrophobicContact CE2-CD1 4.17Å; F214-L220 HydrophobicContact CG-CB 4.4Å; F214-H223 HydrophobicContact CE1-CB 4.07Å; F214-H223 HydrophobicContact CE2-CB 4Å; F214-H223 AromaticContact CE2-CD2 3.25Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.44Å; F214-H223 AromaticContact CE2-CG 3.79Å; F214-H223 HydrophobicContact CZ-CB 3.54Å; F214-H223 AromaticContact CZ-CD2 3.32Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.32Å; F214-H223 AromaticContact CZ-CG 3.4Å |
| 215 | A | 83.9 | Confident | 86.1 | Confident | 23 Ų | 23 | 73.4 Ų | 73.4 | 19% | 0.19 | 38% | 0.382 | C | S | . | . | S | Bend | trans | -76.4 | -19.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | R197 | R197-A215 HydrophobicContact CB-CB 3.86Å; R197-A215 VanDerWaalsContact CD-O 3.28Å; R197-A215 WeakPolarHBondContact CD-O 3.47Å; R197-A215 PolarHBondContact NH1-O 2.93Å |
| 216 | D | 83.4 | Confident | 85.8 | Confident | 49 Ų | 49 | 75.3 Ų | 75.3 | 26% | 0.262 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -135.2 | 145.3 | -178.6 | -179.8 | 38.5 | 0 | 0 | 0 | 113 | F205 S218 N219 L220 | F205-D216 VanDerWaalsContact CD2-C 3.45Å; D216-S218 VanDerWaalsContact C-N 3.32Å; D216-S218 PolarHBondContact O-N 3.39Å; D216-S218 WeakPolarHBondContact OD2-CB 3.25Å; D216-S218 PolarHBondContact OD2-N 2.93Å; D216-S218 VanDerWaalsContact OD2-N 3.14Å; D216-S218 PolarHBondContact OD2-OG 2.83Å; D216-N219 PolarHBondContact O-N 3.45Å; D216-L220 PolarHBondContact O-N 3.02Å; D216-L220 VanDerWaalsContact O-N 3.12Å |
| 217 | R | 85.3 | Confident | 85.5 | Confident | 179 Ų | 179 | 75.2 Ų | 75.2 | 68% | 0.675 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -64.3 | -33.6 | 177.8 | -69.8 | -174.3 | 173.6 | 138.8 | -3.3 | 112.5 | F205 N219 L220 R221 | F205-R217 HydrophobicContact CD1-CG 3.8Å; F205-R217 HydrophobicContact CD2-CG 4.04Å; F205-R217 HydrophobicContact CE1-CG 3.53Å; F205-R217 HydrophobicContact CE2-CG 3.76Å; F205-R217 HydrophobicContact CG-CG 4.06Å; F205-R217 HydrophobicContact CZ-CG 3.51Å; R217-N219 VanDerWaalsContact C-N 3.29Å; R217-N219 PolarHBondContact O-N 2.85Å; R217-L220 PolarHBondContact O-N 2.95Å; R217-R221 WeakPolarHBondContact O-CB 3.37Å; R217-R221 PolarHBondContact O-N 2.74Å |
| 218 | S | 84.7 | Confident | 84.6 | Confident | 71 Ų | 71 | 78.4 Ų | 78.4 | 50% | 0.497 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.5 | -39.7 | 178.5 | -34.4 | 0 | 0 | 0 | 0 | 110.7 | D216 A222 | D216-S218 VanDerWaalsContact C-N 3.32Å; D216-S218 PolarHBondContact O-N 3.39Å; D216-S218 WeakPolarHBondContact OD2-CB 3.25Å; D216-S218 PolarHBondContact OD2-N 2.93Å; D216-S218 VanDerWaalsContact OD2-N 3.14Å; D216-S218 PolarHBondContact OD2-OG 2.83Å; S218-A222 WeakPolarHBondContact O-CB 3.48Å; S218-A222 PolarHBondContact O-N 3.48Å |
| 219 | N | 85.2 | Confident | 83.6 | Confident | 79 Ų | 79 | 79.5 Ų | 79.5 | 42% | 0.422 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -69.9 | -42.1 | 176.2 | -72.5 | -21.1 | 0 | 0 | 0 | 112 | F214 D216 R217 A222 H223 | F214-N219 HydrophobicContact CB-CB 4.38Å; F214-N219 HydrophobicContact CD1-CB 4.02Å; F214-N219 HydrophobicContact CG-CB 4.48Å; D216-N219 PolarHBondContact O-N 3.45Å; R217-N219 VanDerWaalsContact C-N 3.29Å; R217-N219 PolarHBondContact O-N 2.85Å; N219-A222 PolarHBondContact O-N 3.29Å; N219-H223 WeakPolarHBondContact O-CB 3.42Å; N219-H223 PolarHBondContact O-N 3.48Å |
| 220 | L | 88.1 | Confident | 82.7 | Confident | 28 Ų | 28 | 77 Ų | 77 | 15% | 0.147 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -58.5 | -50.8 | 171.4 | 173.9 | 61.6 | 0 | 0 | 0 | 111.1 | F205 S206 C207 F214 D216 R217 A222 H223 L224 | F205-L220 HydrophobicContact CB-CB 4.16Å; F205-L220 HydrophobicContact CB-CD2 3.84Å; S206-L220 WeakPolarHBondContact O-CD2 3.38Å; C207-L220 HydrophobicContact CB-CD1 4.16Å; F214-L220 HydrophobicContact CB-CB 4.39Å; F214-L220 HydrophobicContact CD2-CB 4.12Å; F214-L220 HydrophobicContact CD2-CD1 3.93Å; F214-L220 HydrophobicContact CE2-CD1 4.17Å; F214-L220 HydrophobicContact CG-CB 4.4Å; D216-L220 PolarHBondContact O-N 3.02Å; D216-L220 VanDerWaalsContact O-N 3.12Å; R217-L220 PolarHBondContact O-N 2.95Å; L220-A222 VanDerWaalsContact C-N 3.29Å; L220-A222 PolarHBondContact O-N 2.9Å; L220-H223 CarbonylContact O-C 3.52Å; L220-H223 WeakPolarHBondContact O-CA 3.41Å; L220-H223 WeakPolarHBondContact O-CB 3.44Å; L220-H223 PolarHBondContact O-N 3.15Å; L220-L224 HydrophobicContact CD1-CD1 4.46Å; L220-L224 HydrophobicContact CD1-CD2 4.3Å; L220-L224 HydrophobicContact CD1-CG 4.13Å; L220-L224 HydrophobicContact CG-CD1 4.26Å; L220-L224 HydrophobicContact CG-CG 4.37Å; L220-L224 WeakPolarHBondContact O-CG 3.3Å; L220-L224 PolarHBondContact O-N 2.84Å |
| 221 | R | 86.9 | Confident | 81.8 | Confident | 188 Ų | 188 | 80.7 Ų | 80.7 | 71% | 0.709 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -56.5 | -42.6 | 179.3 | 176.3 | 177.7 | -76.5 | 161 | -5.9 | 112.2 | R217 H223 L224 Q225 | R217-R221 WeakPolarHBondContact O-CB 3.37Å; R217-R221 PolarHBondContact O-N 2.74Å; R221-H223 VanDerWaalsContact C-N 3.31Å; R221-L224 PolarHBondContact O-N 3.3Å; R221-Q225 PolarHBondContact O-N 3.35Å |
| 222 | A | 83.6 | Confident | 81.2 | Confident | 11 Ų | 11 | 81.9 Ų | 81.9 | 9% | 0.091 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -75.5 | -19.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | S218 N219 L220 R244 | S218-A222 WeakPolarHBondContact O-CB 3.48Å; S218-A222 PolarHBondContact O-N 3.48Å; N219-A222 PolarHBondContact O-N 3.29Å; L220-A222 VanDerWaalsContact C-N 3.29Å; L220-A222 PolarHBondContact O-N 2.9Å; A222-R244 VanDerWaalsContact CB-CZ 3.44Å; A222-R244 VanDerWaalsContact CB-NH1 3.28Å |
| 223 | H | 86.3 | Confident | 80.9 | Confident | 16 Ų | 16 | 78.3 Ų | 78.3 | 7% | 0.074 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -78.4 | -37.9 | 167.1 | 169.4 | 46.5 | 0 | 0 | 0 | 112.1 | C207 C210 F214 N219 L220 R221 Q225 T226 H227 | C207-H223 PolarHBondContact SG-NE2 2.99Å; C210-H223 PolarHBondContact SG-NE2 3.21Å; C210-H223 VanDerWaalsContact SG-NE2 3.35Å; F214-H223 HydrophobicContact CE1-CB 4.07Å; F214-H223 HydrophobicContact CE2-CB 4Å; F214-H223 AromaticContact CE2-CD2 3.25Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.44Å; F214-H223 AromaticContact CE2-CG 3.79Å; F214-H223 HydrophobicContact CZ-CB 3.54Å; F214-H223 AromaticContact CZ-CD2 3.32Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.32Å; F214-H223 AromaticContact CZ-CG 3.4Å; N219-H223 WeakPolarHBondContact O-CB 3.42Å; N219-H223 PolarHBondContact O-N 3.48Å; L220-H223 CarbonylContact O-C 3.52Å; L220-H223 WeakPolarHBondContact O-CA 3.41Å; L220-H223 WeakPolarHBondContact O-CB 3.44Å; L220-H223 PolarHBondContact O-N 3.15Å; R221-H223 VanDerWaalsContact C-N 3.31Å; H223-Q225 PolarHBondContact O-N 3.28Å; H223-Q225 VanDerWaalsContact O-N 3.16Å; H223-T226 PolarHBondContact ND1-OG1 2.76Å; H223-T226 VanDerWaalsContact ND1-OG1 3.14Å; H223-T226 WeakPolarHBondContact O-CB 3.41Å; H223-T226 PolarHBondContact O-N 3.32Å; H223-T226 PolarHBondContact O-OG1 2.45Å; H223-H227 AromaticContact CD2-NE2 3.55Å; H223-H227 AromaticContact CE1-CD2 3.72Å; H223-H227 AromaticContact CE1-NE2 2.8Å; H223-H227 PolarHBondContact CE1-NE2 2.95Å; H223-H227 AromaticContact ND1-NE2 3.93Å; H223-H227 AromaticContact NE2-CD2 3.79Å; H223-H227 AromaticContact NE2-NE2 2.45Å; H223-H227 PolarHBondContact NE2-NE2 3.39Å |
| 224 | L | 85.5 | Confident | 80.7 | Confident | 54 Ų | 54 | 82.3 Ų | 82.3 | 28% | 0.283 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -56.7 | -33.3 | 176 | -68 | 172.7 | 0 | 0 | 0 | 111.9 | P208 L220 R221 T226 H227 S228 | P208-L224 HydrophobicContact CG-CD2 4.34Å; L220-L224 HydrophobicContact CD1-CD1 4.46Å; L220-L224 HydrophobicContact CD1-CD2 4.3Å; L220-L224 HydrophobicContact CD1-CG 4.13Å; L220-L224 HydrophobicContact CG-CD1 4.26Å; L220-L224 HydrophobicContact CG-CG 4.37Å; L220-L224 WeakPolarHBondContact O-CG 3.3Å; L220-L224 PolarHBondContact O-N 2.84Å; R221-L224 PolarHBondContact O-N 3.3Å; L224-T226 PolarHBondContact O-N 2.8Å; L224-T226 VanDerWaalsContact O-N 3.14Å; L224-H227 PolarHBondContact O-N 3.14Å; L224-S228 PolarHBondContact O-N 2.84Å; L224-S228 PolarHBondContact O-OG 3.01Å |
| 225 | Q | 82.6 | Confident | 80.6 | Confident | 79 Ų | 79 | 80.4 Ų | 80.4 | 37% | 0.369 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -19.5 | 172.1 | -67.4 | 173.4 | -13.4 | 0 | 0 | 114.4 | R221 H223 | R221-Q225 PolarHBondContact O-N 3.35Å; H223-Q225 PolarHBondContact O-N 3.28Å; H223-Q225 VanDerWaalsContact O-N 3.16Å |
| 226 | T | 81 | Confident | 80.4 | Confident | 73 Ų | 73 | 88.6 Ų | 88.6 | 45% | 0.448 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83 | -14.4 | 173.8 | 74.1 | 0 | 0 | 0 | 0 | 113.3 | H223 L224 | H223-T226 PolarHBondContact ND1-OG1 2.76Å; H223-T226 VanDerWaalsContact ND1-OG1 3.14Å; H223-T226 WeakPolarHBondContact O-CB 3.41Å; H223-T226 PolarHBondContact O-N 3.32Å; H223-T226 PolarHBondContact O-OG1 2.45Å; L224-T226 PolarHBondContact O-N 2.8Å; L224-T226 VanDerWaalsContact O-N 3.14Å |
| 227 | H | 81.3 | Confident | 80.2 | Confident | 80 Ų | 80 | 91.3 Ų | 91.3 | 37% | 0.37 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | -17.7 | 172 | -69.6 | -75.8 | 0 | 0 | 0 | 112.5 | C207 H209 C210 H223 L224 | C207-H227 PolarHBondContact SG-NE2 2.7Å; H209-H227 PolarHBondContact O-CE1 3.08Å; C210-H227 WeakPolarHBondContact CB-CE1 3.43Å; C210-H227 PolarHBondContact SG-CE1 3.4Å; C210-H227 PolarHBondContact SG-NE2 3.35Å; H223-H227 AromaticContact CD2-NE2 3.55Å; H223-H227 AromaticContact CE1-CD2 3.72Å; H223-H227 AromaticContact CE1-NE2 2.8Å; H223-H227 PolarHBondContact CE1-NE2 2.95Å; H223-H227 AromaticContact ND1-NE2 3.93Å; H223-H227 AromaticContact NE2-CD2 3.79Å; H223-H227 AromaticContact NE2-NE2 2.45Å; H223-H227 PolarHBondContact NE2-NE2 3.39Å; L224-H227 PolarHBondContact O-N 3.14Å |
| 228 | S | 71 | Confident | 80 | Confident | 75 Ų | 75 | 84.3 Ų | 84.3 | 52% | 0.524 | 42% | 0.42 | S | S | . | . | S | Bend | trans | -95.8 | 0.3 | -175.3 | -45.8 | 0 | 0 | 0 | 0 | 114.5 | L224 V230 | L224-S228 PolarHBondContact O-N 2.84Å; L224-S228 PolarHBondContact O-OG 3.01Å; S228-V230 WeakPolarHBondContact O-CG2 3.46Å; S228-V230 PolarHBondContact O-N 2.97Å |
| 229 | D | 66.7 | Low | 79.7 | Confident | 127 Ų | 127 | 86.1 Ų | 86.1 | 68% | 0.679 | 43% | 0.432 | S | S | * | . | trans | 50.6 | 4.8 | -175.2 | -79.3 | -46.7 | 0 | 0 | 0 | 118.1 | K231 | D229-K231 VanDerWaalsContact C-N 3.33Å; D229-K231 PolarHBondContact O-N 3.14Å | ||
| 230 | V | 68 | Low | 79.4 | Confident | 78 Ų | 78 | 87.2 Ų | 87.2 | 47% | 0.473 | 43% | 0.433 | S | S | . | . | trans | -74.5 | 80.9 | -176.2 | -155.8 | 0 | 0 | 0 | 0 | 111.7 | S228 K232 | S228-V230 WeakPolarHBondContact O-CG2 3.46Å; S228-V230 PolarHBondContact O-N 2.97Å; V230-K232 VanDerWaalsContact C-N 3.34Å; V230-K232 HydrophobicContact CB-CG 4.47Å; V230-K232 HydrophobicContact CG1-CD 4.25Å; V230-K232 VanDerWaalsContact CG1-CE 3.46Å; V230-K232 HydrophobicContact CG1-CG 3.67Å; V230-K232 PolarHBondContact O-N 3.21Å | ||
| 231 | K | 69.1 | Low | 79.1 | Confident | 117 Ų | 117 | 88.8 Ų | 88.8 | 51% | 0.509 | 44% | 0.444 | S | S | . | . | trans | -77 | 79 | 174.9 | -62.3 | 175 | -172.4 | 171.6 | 0 | 111 | D229 Y233 T241 F242 | D229-K231 VanDerWaalsContact C-N 3.33Å; D229-K231 PolarHBondContact O-N 3.14Å; K231-Y233 VanDerWaalsContact C-N 3.33Å; K231-Y233 PolarHBondContact O-N 3.38Å; K231-T241 WeakPolarHBondContact CD-OG1 3.28Å; K231-F242 CarbonylContact C-O 3.48Å; K231-F242 WeakPolarHBondContact CA-O 3.4Å | ||
| 232 | K | 75.1 | Confident | 78.8 | Confident | 154 Ų | 154 | 81.7 Ų | 81.7 | 67% | 0.67 | 42% | 0.418 | S | S | * | . | trans | -72.6 | -16.9 | -175.4 | -61.5 | -169.9 | 179.1 | -169.8 | 0 | 115.4 | V230 F242 | V230-K232 VanDerWaalsContact C-N 3.34Å; V230-K232 HydrophobicContact CB-CG 4.47Å; V230-K232 HydrophobicContact CG1-CD 4.25Å; V230-K232 VanDerWaalsContact CG1-CE 3.46Å; V230-K232 HydrophobicContact CG1-CG 3.67Å; V230-K232 PolarHBondContact O-N 3.21Å; K232-F242 PolarHBondContact N-O 3.03Å | ||
| 233 | Y | 79.3 | Confident | 78.7 | Confident | 85 Ų | 85 | 82.3 Ų | 82.3 | 33% | 0.333 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 100.9 | -168.4 | -56.5 | -79.2 | 0 | 0 | 0 | 110.6 | K231 F242 M245 | K231-Y233 VanDerWaalsContact C-N 3.33Å; K231-Y233 PolarHBondContact O-N 3.38Å; Y233-F242 PolarHBondContact N-O 2.98Å; Y233-F242 PolarHBondContact O-N 3.12Å; Y233-M245 HydrophobicContact CD1-CB 4.02Å; Y233-M245 HydrophobicContact CD1-CG 4.32Å; Y233-M245 HydrophobicContact CE1-CB 3.88Å; Y233-M245 HydrophobicContact CE1-CG 4.32Å; Y233-M245 HydrophobicContact CE1-SD 4.38Å; Y233-M245 HydrophobicContact CE2-CB 4.47Å; Y233-M245 HydrophobicContact CG-CB 4.39Å |
| 234 | Q | 82.1 | Confident | 78.3 | Confident | 119 Ų | 119 | 85.6 Ų | 85.6 | 56% | 0.556 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 140.2 | 175.6 | -168.5 | 174 | 9.2 | 0 | 0 | 110.4 | T241 | Q234-T241 HydrophobicContact CB-CG2 3.98Å; Q234-T241 HydrophobicContact CG-CG2 3.82Å |
| 235 | C | 83.2 | Confident | 78.2 | Confident | 4 Ų | 4 | 89 Ų | 89 | 3% | 0.027 | 45% | 0.449 | C | S | . | . | trans | -71 | 140.6 | 167.9 | -175.6 | 0 | 0 | 0 | 0 | 110 | N237 C238 K240 F242 L248 | C235-N237 VanDerWaalsContact C-N 3.33Å; C235-N237 PolarHBondContact SG-N 2.83Å; C235-C238 CarbonylContact C-O 3.56Å; C235-C238 WeakPolarHBondContact CB-O 3.25Å; C235-K240 PolarHBondContact N-O 3.46Å; C235-F242 HydrophobicContact CB-CE2 4.43Å; C235-L248 HydrophobicContact CB-CD1 3.56Å | ||
| 236 | K | 80.3 | Confident | 78.3 | Confident | 195 Ų | 195 | 88.2 Ų | 88.2 | 85% | 0.848 | 45% | 0.453 | S | S | * | . | S | Bend | trans | -74.9 | -27.4 | 178 | -66.2 | -178 | -179.9 | 179 | 0 | 112.5 | ||
| 237 | N | 80 | Confident | 78.4 | Confident | 106 Ų | 106 | 88.5 Ų | 88.5 | 57% | 0.567 | 45% | 0.451 | S | S | * | . | S | Bend | trans | -98.7 | -9.3 | -173.7 | -61.3 | 70.4 | 0 | 0 | 0 | 113.3 | C235 C257 | C235-N237 VanDerWaalsContact C-N 3.33Å; C235-N237 PolarHBondContact SG-N 2.83Å; N237-C257 HydrophobicContact CB-CB 3.56Å |
| 238 | C | 80.4 | Confident | 78.6 | Confident | 32 Ų | 32 | 85.5 Ų | 85.5 | 22% | 0.216 | 44% | 0.438 | C | S | . | . | S | Bend | trans | -150.8 | 153.8 | 166.2 | 78.6 | 0 | 0 | 0 | 0 | 111.2 | C235 K240 H251 | C235-C238 CarbonylContact C-O 3.56Å; C235-C238 WeakPolarHBondContact CB-O 3.25Å; C238-K240 PolarHBondContact O-N 3.16Å; C238-K240 VanDerWaalsContact SG-CG 3.55Å; C238-H251 PolarHBondContact SG-NE2 3.36Å |
| 239 | S | 77.9 | Confident | 79.3 | Confident | 108 Ų | 108 | 87 Ų | 87 | 76% | 0.755 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -69.6 | 14.7 | -176 | -49.4 | 0 | 0 | 0 | 0 | 115.5 | ||
| 240 | K | 80 | Confident | 80.1 | Confident | 103 Ų | 103 | 87.8 Ų | 87.8 | 45% | 0.448 | 43% | 0.434 | S | S | . | . | trans | -74.6 | 132.6 | 178.1 | -66.3 | 176 | -174.7 | 168.3 | 0 | 110.6 | C235 C238 F242 C256 | C235-K240 PolarHBondContact N-O 3.46Å; C238-K240 PolarHBondContact O-N 3.16Å; C238-K240 VanDerWaalsContact SG-CG 3.55Å; K240-F242 HydrophobicContact CB-CE2 3.89Å; K240-F242 HydrophobicContact CB-CZ 3.97Å; K240-C256 PolarHBondContact NZ-SG 3.4Å; K240-C256 VanDerWaalsContact NZ-SG 3.43Å | ||
| 241 | T | 81.2 | Confident | 80.9 | Confident | 60 Ų | 60 | 85 Ų | 85 | 37% | 0.368 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 138.8 | 179.6 | 56.3 | 0 | 0 | 0 | 0 | 111.4 | K231 Q234 | K231-T241 WeakPolarHBondContact CD-OG1 3.28Å; Q234-T241 HydrophobicContact CB-CG2 3.98Å; Q234-T241 HydrophobicContact CG-CG2 3.82Å |
| 242 | F | 81 | Confident | 81.5 | Confident | 40 Ų | 40 | 83.4 Ų | 83.4 | 18% | 0.175 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 146.4 | -173.5 | -58.2 | -87.6 | 0 | 0 | 0 | 110.5 | K231 K232 Y233 C235 K240 R244 L247 L248 H251 | K231-F242 CarbonylContact C-O 3.48Å; K231-F242 WeakPolarHBondContact CA-O 3.4Å; K232-F242 PolarHBondContact N-O 3.03Å; Y233-F242 PolarHBondContact N-O 2.98Å; Y233-F242 PolarHBondContact O-N 3.12Å; C235-F242 HydrophobicContact CB-CE2 4.43Å; K240-F242 HydrophobicContact CB-CE2 3.89Å; K240-F242 HydrophobicContact CB-CZ 3.97Å; F242-R244 VanDerWaalsContact C-N 3.34Å; F242-L247 HydrophobicContact CB-CB 4.36Å; F242-L247 HydrophobicContact CD1-CB 3.92Å; F242-L247 HydrophobicContact CG-CB 4.41Å; F242-L248 HydrophobicContact CB-CB 4.47Å; F242-L248 HydrophobicContact CD2-CB 4Å; F242-L248 HydrophobicContact CD2-CD1 3.88Å; F242-L248 HydrophobicContact CE2-CD1 3.95Å; F242-L248 HydrophobicContact CG-CB 4.35Å; F242-H251 HydrophobicContact CE1-CB 4.14Å; F242-H251 HydrophobicContact CE2-CB 4.21Å; F242-H251 AromaticContact CE2-CD2 3.47Å; F242-H251 VanDerWaalsContact CE2-CD2 3.47Å; F242-H251 WeakPolarHBondContact CE2-CD2 3.35Å; F242-H251 AromaticContact CE2-CG 3.97Å; F242-H251 HydrophobicContact CZ-CB 3.62Å; F242-H251 AromaticContact CZ-CD2 3.37Å; F242-H251 WeakPolarHBondContact CZ-CD2 3.46Å; F242-H251 AromaticContact CZ-CG 3.42Å; F242-H251 VanDerWaalsContact CZ-CG 3.42Å |
| 243 | S | 80.7 | Confident | 81.9 | Confident | 23 Ų | 23 | 82.4 Ų | 82.4 | 16% | 0.161 | 41% | 0.407 | C | S | . | . | S | Bend | trans | -77.6 | -18.1 | 174.3 | 53.3 | 0 | 0 | 0 | 0 | 113.5 | ||
| 244 | R | 78.5 | Confident | 81.9 | Confident | 85 Ų | 85 | 82.1 Ų | 82.1 | 32% | 0.321 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -136.6 | 134.6 | -175.6 | -63.7 | 175.5 | 62.5 | 158 | 3.8 | 112 | A222 F242 S246 L247 L248 | A222-R244 VanDerWaalsContact CB-CZ 3.44Å; A222-R244 VanDerWaalsContact CB-NH1 3.28Å; F242-R244 VanDerWaalsContact C-N 3.34Å; R244-S246 PolarHBondContact O-N 3.2Å; R244-L247 HydrophobicContact CB-CD1 4.14Å; R244-L247 HydrophobicContact CB-CG 4.16Å; R244-L247 WeakPolarHBondContact O-CB 3.37Å; R244-L247 PolarHBondContact O-N 2.9Å; R244-L248 PolarHBondContact O-N 2.83Å |
| 245 | M | 83.4 | Confident | 81.4 | Confident | 126 Ų | 126 | 78.5 Ų | 78.5 | 62% | 0.621 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -56.8 | -33.9 | 175.6 | -165.2 | 169.1 | 78.4 | 0 | 0 | 113.3 | Y233 L247 L248 H249 | Y233-M245 HydrophobicContact CD1-CB 4.02Å; Y233-M245 HydrophobicContact CD1-CG 4.32Å; Y233-M245 HydrophobicContact CE1-CB 3.88Å; Y233-M245 HydrophobicContact CE1-CG 4.32Å; Y233-M245 HydrophobicContact CE1-SD 4.38Å; Y233-M245 HydrophobicContact CE2-CB 4.47Å; Y233-M245 HydrophobicContact CG-CB 4.39Å; M245-L247 PolarHBondContact O-N 3.3Å; M245-L248 PolarHBondContact O-N 3.4Å; M245-H249 PolarHBondContact O-N 2.98Å |
| 246 | S | 83.7 | Confident | 80.5 | Confident | 62 Ų | 62 | 81.6 Ų | 81.6 | 43% | 0.434 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -69.1 | -17.4 | 176 | 61.8 | 0 | 0 | 0 | 0 | 114.5 | R244 K250 | R244-S246 PolarHBondContact O-N 3.2Å; S246-K250 WeakPolarHBondContact O-CG 3.45Å |
| 247 | L | 83.4 | Confident | 79.5 | Confident | 79 Ų | 79 | 73.8 Ų | 73.8 | 41% | 0.414 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -87.8 | -37.8 | 172.9 | -65.4 | 174.2 | 0 | 0 | 0 | 110.6 | F242 R244 M245 K250 H251 | F242-L247 HydrophobicContact CB-CB 4.36Å; F242-L247 HydrophobicContact CD1-CB 3.92Å; F242-L247 HydrophobicContact CG-CB 4.41Å; R244-L247 HydrophobicContact CB-CD1 4.14Å; R244-L247 HydrophobicContact CB-CG 4.16Å; R244-L247 WeakPolarHBondContact O-CB 3.37Å; R244-L247 PolarHBondContact O-N 2.9Å; M245-L247 PolarHBondContact O-N 3.3Å; L247-K250 PolarHBondContact O-N 3.5Å; L247-H251 WeakPolarHBondContact O-CB 3.43Å; L247-H251 PolarHBondContact O-N 3.28Å; L247-H251 VanDerWaalsContact O-N 3.08Å |
| 248 | L | 85.4 | Confident | 78.5 | Confident | 18 Ų | 18 | 74.3 Ų | 74.3 | 9% | 0.094 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -58.5 | -50.9 | 171.2 | 173.5 | 60 | 0 | 0 | 0 | 111.1 | C235 F242 R244 M245 K250 H251 E252 | C235-L248 HydrophobicContact CB-CD1 3.56Å; F242-L248 HydrophobicContact CB-CB 4.47Å; F242-L248 HydrophobicContact CD2-CB 4Å; F242-L248 HydrophobicContact CD2-CD1 3.88Å; F242-L248 HydrophobicContact CE2-CD1 3.95Å; F242-L248 HydrophobicContact CG-CB 4.35Å; R244-L248 PolarHBondContact O-N 2.83Å; M245-L248 PolarHBondContact O-N 3.4Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.95Å; L248-H251 WeakPolarHBondContact O-CA 3.45Å; L248-H251 WeakPolarHBondContact O-CB 3.1Å; L248-H251 PolarHBondContact O-N 3.04Å; L248-E252 HydrophobicContact CD1-CG 3.94Å; L248-E252 WeakPolarHBondContact CD1-OE1 3.48Å; L248-E252 HydrophobicContact CG-CG 4.42Å; L248-E252 WeakPolarHBondContact O-CG 3.43Å; L248-E252 PolarHBondContact O-N 3.38Å |
| 249 | H | 85.3 | Confident | 77.3 | Confident | 105 Ų | 105 | 78.4 Ų | 78.4 | 49% | 0.486 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -56.4 | -46.7 | -180 | -165.1 | -86.1 | 0 | 0 | 0 | 112 | M245 H251 E252 E253 | M245-H249 PolarHBondContact O-N 2.98Å; H249-H251 VanDerWaalsContact C-N 3.26Å; H249-H251 PolarHBondContact O-N 3.08Å; H249-E252 PolarHBondContact O-N 2.95Å; H249-E253 IonicContact CE1-OE1 3.15Å; H249-E253 PolarHBondContact CE1-OE1 3.43Å; H249-E253 IonicContact CE1-OE2 3.59Å; H249-E253 IonicContact CG-OE2 3.92Å; H249-E253 IonicContact ND1-OE1 3.28Å; H249-E253 PolarHBondContact ND1-OE1 2.97Å; H249-E253 IonicContact ND1-OE2 2.84Å; H249-E253 PolarHBondContact ND1-OE2 3.16Å; H249-E253 WeakPolarHBondContact O-CB 3.37Å; H249-E253 VanDerWaalsContact O-CG 3.3Å; H249-E253 WeakPolarHBondContact O-CG 3.47Å; H249-E253 PolarHBondContact O-N 3.33Å |
| 250 | K | 84.6 | Confident | 75.7 | Confident | 145 Ų | 145 | 85.1 Ų | 85.1 | 63% | 0.63 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61.3 | -33.1 | 175.5 | -75.6 | -174.9 | 174.9 | -162 | 0 | 113.6 | S246 L247 L248 E253 S254 | S246-K250 WeakPolarHBondContact O-CG 3.45Å; L247-K250 PolarHBondContact O-N 3.5Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.95Å; K250-E253 WeakPolarHBondContact CA-OE2 3.46Å; K250-S254 VanDerWaalsContact O-CB 3.25Å; K250-S254 WeakPolarHBondContact O-CB 3.43Å; K250-S254 PolarHBondContact O-N 3.5Å |
| 251 | H | 83.9 | Confident | 75.5 | Confident | 19 Ų | 19 | 84.2 Ų | 84.2 | 9% | 0.088 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -74.8 | -36 | 177.7 | 168.2 | 56.8 | 0 | 0 | 0 | 112.2 | C238 F242 L247 L248 H249 S254 C257 | C238-H251 PolarHBondContact SG-NE2 3.36Å; F242-H251 HydrophobicContact CE1-CB 4.14Å; F242-H251 HydrophobicContact CE2-CB 4.21Å; F242-H251 AromaticContact CE2-CD2 3.47Å; F242-H251 VanDerWaalsContact CE2-CD2 3.47Å; F242-H251 WeakPolarHBondContact CE2-CD2 3.35Å; F242-H251 AromaticContact CE2-CG 3.97Å; F242-H251 HydrophobicContact CZ-CB 3.62Å; F242-H251 AromaticContact CZ-CD2 3.37Å; F242-H251 WeakPolarHBondContact CZ-CD2 3.46Å; F242-H251 AromaticContact CZ-CG 3.42Å; F242-H251 VanDerWaalsContact CZ-CG 3.42Å; L247-H251 WeakPolarHBondContact O-CB 3.43Å; L247-H251 PolarHBondContact O-N 3.28Å; L247-H251 VanDerWaalsContact O-N 3.08Å; L248-H251 WeakPolarHBondContact O-CA 3.45Å; L248-H251 WeakPolarHBondContact O-CB 3.1Å; L248-H251 PolarHBondContact O-N 3.04Å; H249-H251 VanDerWaalsContact C-N 3.26Å; H249-H251 PolarHBondContact O-N 3.08Å; H251-S254 PolarHBondContact O-OG 2.79Å; H251-C257 PolarHBondContact NE2-SG 3.17Å |
| 252 | E | 82.9 | Confident | 75.2 | Confident | 84 Ų | 84 | 85.5 Ų | 85.5 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -69.1 | -44.4 | 172.8 | -68.4 | 172.8 | 153.6 | 0 | 0 | 110.6 | L248 H249 S254 G255 | L248-E252 HydrophobicContact CD1-CG 3.94Å; L248-E252 WeakPolarHBondContact CD1-OE1 3.48Å; L248-E252 HydrophobicContact CG-CG 4.42Å; L248-E252 WeakPolarHBondContact O-CG 3.43Å; L248-E252 PolarHBondContact O-N 3.38Å; H249-E252 PolarHBondContact O-N 2.95Å; E252-S254 VanDerWaalsContact C-N 3.31Å; E252-S254 PolarHBondContact O-N 2.77Å; E252-G255 PolarHBondContact O-N 3.42Å |
| 253 | E | 82.4 | Confident | 74.8 | Confident | 133 Ų | 133 | 88 Ų | 88 | 62% | 0.621 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.5 | -33.5 | 172.6 | -73.2 | 172 | 130.4 | 0 | 0 | 113.1 | H249 K250 G255 | H249-E253 IonicContact CE1-OE1 3.15Å; H249-E253 PolarHBondContact CE1-OE1 3.43Å; H249-E253 IonicContact CE1-OE2 3.59Å; H249-E253 IonicContact CG-OE2 3.92Å; H249-E253 IonicContact ND1-OE1 3.28Å; H249-E253 PolarHBondContact ND1-OE1 2.97Å; H249-E253 IonicContact ND1-OE2 2.84Å; H249-E253 PolarHBondContact ND1-OE2 3.16Å; H249-E253 WeakPolarHBondContact O-CB 3.37Å; H249-E253 VanDerWaalsContact O-CG 3.3Å; H249-E253 WeakPolarHBondContact O-CG 3.47Å; H249-E253 PolarHBondContact O-N 3.33Å; K250-E253 WeakPolarHBondContact CA-OE2 3.46Å; E253-G255 PolarHBondContact O-N 3.35Å; E253-G255 VanDerWaalsContact O-N 3.12Å |
| 254 | S | 79.6 | Confident | 74.5 | Confident | 79 Ų | 79 | 91.8 Ų | 91.8 | 55% | 0.552 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.2 | 6.3 | -178.3 | 78.8 | 0 | 0 | 0 | 0 | 114 | K250 H251 E252 C256 | K250-S254 VanDerWaalsContact O-CB 3.25Å; K250-S254 WeakPolarHBondContact O-CB 3.43Å; K250-S254 PolarHBondContact O-N 3.5Å; H251-S254 PolarHBondContact O-OG 2.79Å; E252-S254 VanDerWaalsContact C-N 3.31Å; E252-S254 PolarHBondContact O-N 2.77Å; S254-C256 PolarHBondContact O-N 3.02Å |
| 255 | G | 70.7 | Confident | 74.3 | Confident | 42 Ų | 42 | 92.3 Ų | 92.3 | 43% | 0.433 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 62.3 | 13.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115 | E252 E253 C257 V258 | E252-G255 PolarHBondContact O-N 3.42Å; E253-G255 PolarHBondContact O-N 3.35Å; E253-G255 VanDerWaalsContact O-N 3.12Å; G255-C257 PolarHBondContact O-N 3Å; G255-V258 WeakPolarHBondContact O-CG2 3.35Å; G255-V258 PolarHBondContact O-N 2.79Å |
| 256 | C | 64.4 | Low | 73.6 | Confident | 69 Ų | 69 | 90 Ų | 90 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | trans | -70.3 | 1 | -174.1 | -175.5 | 0 | 0 | 0 | 0 | 113.1 | K240 S254 | K240-C256 PolarHBondContact NZ-SG 3.4Å; K240-C256 VanDerWaalsContact NZ-SG 3.43Å; S254-C256 PolarHBondContact O-N 3.02Å | ||
| 257 | C | 60.8 | Low | 72.9 | Confident | 32 Ų | 32 | 92 Ų | 92 | 22% | 0.216 | 50% | 0.498 | C | S | . | . | trans | -118.7 | 50.9 | 176.6 | -57 | 0 | 0 | 0 | 0 | 110.7 | N237 H251 G255 V259 | N237-C257 HydrophobicContact CB-CB 3.56Å; H251-C257 PolarHBondContact NE2-SG 3.17Å; G255-C257 PolarHBondContact O-N 3Å; C257-V259 PolarHBondContact O-N 2.83Å; C257-V259 VanDerWaalsContact O-N 3.17Å | ||
| 258 | V | 59 | Low | 72.1 | Confident | 117 Ų | 117 | 93 Ų | 93 | 71% | 0.709 | 50% | 0.504 | S | S | * | . | trans | -64.5 | 114.2 | 165 | -173.1 | 0 | 0 | 0 | 0 | 107.4 | G255 H260 | G255-V258 WeakPolarHBondContact O-CG2 3.35Å; G255-V258 PolarHBondContact O-N 2.79Å; V258-H260 PolarHBondContact O-N 3.47Å | ||
| 259 | V | 53.6 | Low | 71 | Confident | 117 Ų | 117 | 99.3 Ų | 99.3 | 71% | 0.709 | 54% | 0.538 | S | S | * | . | trans | -72.7 | 118.6 | 169.9 | -175.9 | 0 | 0 | 0 | 0 | 106.7 | C257 | C257-V259 PolarHBondContact O-N 2.83Å; C257-V259 VanDerWaalsContact O-N 3.17Å | ||
| 260 | H | 45.1 | Very low | 69.7 | Low | 249 Ų | 249 | 98.7 Ų | 98.7 | 100% | 1.153 | 54% | 0.543 | S | S | * | . | trans | -85.3 | 0 | 169.7 | -109.6 | -68.1 | 0 | 0 | 0 | 110.4 | V258 | V258-H260 PolarHBondContact O-N 3.47Š|
Retrieved 260 of 260 residues in 600.4 ms
(Link to these results)