| 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 | 45.5 | Very low | 53.2 | Low | 247 Ų | 247 | 184.5 Ų | 184.5 | 100% | 1.217 | 86% | 0.858 | S | S | * | * | 0 | 109 | 0 | -150.3 | 157.3 | -163.2 | 0 | 0 | 106.2 | |||||
| 2 | E | 44.9 | Very low | 52.2 | Low | 139 Ų | 139 | 179.8 Ų | 179.8 | 65% | 0.65 | 85% | 0.852 | S | S | * | * | trans | -67.9 | 146.9 | 177.2 | -60.1 | -174.1 | 82.4 | 0 | 0 | 109.8 | K4 | E2-K4 WeakPolarHBondContact OE1-CE 3.38Å; E2-K4 IonicContact OE1-NZ 2.67Å; E2-K4 PolarHBondContact OE1-NZ 2.95Å; E2-K4 IonicContact OE2-NZ 3.43Å; E2-K4 PolarHBondContact OE2-NZ 3.45Å | ||
| 3 | D | 60.2 | Low | 51.9 | Low | 171 Ų | 171 | 175.2 Ų | 175.2 | 91% | 0.914 | 85% | 0.851 | S | S | * | * | trans | -139.2 | 123.7 | 143.7 | -111.2 | -57.1 | 0 | 0 | 0 | 112.1 | ||||
| 4 | K | 48.6 | Very low | 52.7 | Low | 145 Ų | 145 | 174.4 Ų | 174.4 | 63% | 0.63 | 85% | 0.851 | S | S | * | * | trans | -100.6 | 128 | -168.9 | -80.7 | 166.1 | 159.3 | 137.3 | 0 | 108.8 | E2 | E2-K4 WeakPolarHBondContact OE1-CE 3.38Å; E2-K4 IonicContact OE1-NZ 2.67Å; E2-K4 PolarHBondContact OE1-NZ 2.95Å; E2-K4 IonicContact OE2-NZ 3.43Å; E2-K4 PolarHBondContact OE2-NZ 3.45Å | ||
| 5 | R | 55.4 | Low | 52.9 | Low | 229 Ų | 229 | 170.9 Ų | 170.9 | 86% | 0.864 | 85% | 0.848 | S | S | * | * | trans | 34.7 | 127.8 | 135.3 | -50.8 | -179.2 | 177.8 | -145.7 | -3.4 | 117.8 | ||||
| 6 | K | 54.2 | Low | 53.3 | Low | 213 Ų | 213 | 171.8 Ų | 171.8 | 93% | 0.926 | 85% | 0.848 | S | S | * | * | trans | -149.8 | 99.5 | 136.4 | -107.1 | 161 | -168.5 | 178.7 | 0 | 111.5 | R8 | K6-R8 PolarHBondContact O-N 3.36Š| ||
| 7 | K | 57.3 | Low | 53.6 | Low | 205 Ų | 205 | 168 Ų | 168 | 89% | 0.891 | 84% | 0.84 | S | S | * | * | trans | -63.2 | 123.7 | 162.6 | -67.6 | -130.6 | 177.9 | -170.9 | 0 | 108.4 | ||||
| 8 | R | 56.4 | Low | 54.2 | Low | 247 Ų | 247 | 165.2 Ų | 165.2 | 93% | 0.932 | 84% | 0.835 | S | S | * | * | trans | -96.7 | 99.8 | 171.3 | -164 | 178 | -174.3 | -152.6 | 2.1 | 108 | K6 | K6-R8 PolarHBondContact O-N 3.36Š| ||
| 9 | S | 64.5 | Low | 54.7 | Low | 97 Ų | 97 | 162.6 Ų | 162.6 | 68% | 0.678 | 83% | 0.831 | S | S | * | * | trans | -66 | 149.3 | 172.3 | -53.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 10 | P | 52.8 | Low | 55.4 | Low | 130 Ų | 130 | 160 Ų | 160 | 84% | 0.844 | 83% | 0.826 | S | S | * | * | trans | -73.3 | 137.2 | 171 | 19.8 | -14.4 | 0 | 0 | 0 | 110.6 | ||||
| 11 | K | 45.8 | Very low | 55.6 | Low | 206 Ų | 206 | 158.7 Ų | 158.7 | 90% | 0.896 | 83% | 0.827 | S | S | * | * | trans | -89.6 | 110.1 | -178.1 | -121.4 | 163.5 | 179.2 | 165.4 | 0 | 110.2 | ||||
| 12 | V | 40.8 | Very low | 56.3 | Low | 129 Ų | 129 | 153.6 Ų | 153.6 | 78% | 0.782 | 81% | 0.81 | S | S | * | * | trans | 33.6 | 108.4 | 136.1 | -179.1 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 13 | S | 48.2 | Very low | 56.6 | Low | 120 Ų | 120 | 153 Ų | 153 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 130.2 | 161.7 | -49.2 | 0 | 0 | 0 | 0 | 110.7 | ||
| 14 | L | 62.7 | Low | 56.1 | Low | 163 Ų | 163 | 150.7 Ų | 150.7 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 143.6 | 167.6 | -87 | 138.3 | 0 | 0 | 0 | 110.5 | ||
| 15 | P | 55.4 | Low | 56.4 | Low | 123 Ų | 123 | 154.1 Ų | 154.1 | 80% | 0.799 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 128.4 | 174.6 | 29.2 | -30.1 | 0 | 0 | 0 | 111.2 | ||
| 16 | Q | 60.1 | Low | 56 | Low | 184 Ų | 184 | 152.5 Ų | 152.5 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 139.4 | 173.5 | -158.4 | 178.9 | -11.6 | 0 | 0 | 109.7 | ||
| 17 | P | 58.4 | Low | 56 | Low | 108 Ų | 108 | 151.3 Ų | 151.3 | 70% | 0.701 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 152.8 | 179 | 28.1 | -33 | 0 | 0 | 0 | 112.1 | ||
| 18 | P | 64 | Low | 55.3 | Low | 117 Ų | 117 | 146.7 Ų | 146.7 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 145.8 | -178 | 28.4 | -33.8 | 0 | 0 | 0 | 112.2 | ||
| 19 | P | 64.3 | Low | 55.1 | Low | 117 Ų | 117 | 141.7 Ų | 141.7 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 152.5 | 175.3 | 28.7 | -33.4 | 0 | 0 | 0 | 111.7 | ||
| 20 | P | 67.7 | Low | 54.3 | Low | 110 Ų | 110 | 144.7 Ų | 144.7 | 71% | 0.714 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 155.5 | -176.8 | 28.2 | -34.6 | 0 | 0 | 0 | 112.6 | V22 | P20-V22 PolarHBondContact O-N 3.17Š|
| 21 | P | 60.2 | Low | 54 | Low | 132 Ų | 132 | 143.8 Ų | 143.8 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 125.8 | -177.4 | 26.9 | -33.1 | 0 | 0 | 0 | 111.5 | N23 | P21-N23 PolarHBondContact O-N 3.48Š|
| 22 | V | 59.5 | Low | 54.1 | Low | 140 Ų | 140 | 139 Ų | 139 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 116.8 | 178 | -177.5 | 0 | 0 | 0 | 0 | 109.4 | P20 | P20-V22 PolarHBondContact O-N 3.17Š|
| 23 | N | 52.1 | Low | 54.2 | Low | 127 Ų | 127 | 138.4 Ų | 138.4 | 68% | 0.679 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 124 | 174 | -169.3 | -3.6 | 0 | 0 | 0 | 109.5 | P21 R25 | P21-N23 PolarHBondContact O-N 3.48Å; N23-R25 PolarHBondContact O-N 3Å |
| 24 | P | 50.6 | Low | 54.5 | Low | 122 Ų | 122 | 141.8 Ų | 141.8 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -77.7 | 17.3 | -169.9 | 31.4 | -36.3 | 0 | 0 | 0 | 114.6 | ||
| 25 | R | 54.8 | Low | 53.4 | Low | 217 Ų | 217 | 139.4 Ų | 139.4 | 82% | 0.819 | 80% | 0.799 | S | S | * | * | trans | -123.8 | 69.2 | -177.3 | -61.8 | -171.7 | -166.6 | -174.9 | 4.6 | 111.7 | N23 | N23-R25 PolarHBondContact O-N 3Š| ||
| 26 | K | 46 | Very low | 52.9 | Low | 195 Ų | 195 | 138.5 Ų | 138.5 | 85% | 0.848 | 80% | 0.802 | S | S | * | * | trans | -157.3 | 105.7 | 146.6 | -109.8 | -171.4 | -176.6 | -171.9 | 0 | 109.4 | S28 | K26-S28 PolarHBondContact O-N 3.12Å; K26-S28 VanDerWaalsContact O-N 3.17Å | ||
| 27 | L | 54.2 | Low | 52.3 | Low | 188 Ų | 188 | 135.3 Ų | 135.3 | 98% | 0.984 | 80% | 0.795 | S | S | * | * | trans | -59.7 | 109.7 | 165 | -72.2 | 159.4 | 0 | 0 | 0 | 108.2 | ||||
| 28 | S | 42.3 | Very low | 51.7 | Low | 109 Ų | 109 | 138.7 Ų | 138.7 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -111.7 | 111.2 | 165.4 | 48.3 | 0 | 0 | 0 | 0 | 108.4 | K26 L30 | K26-S28 PolarHBondContact O-N 3.12Å; K26-S28 VanDerWaalsContact O-N 3.17Å; S28-L30 PolarHBondContact O-N 3.38Å | ||
| 29 | V | 53.8 | Low | 51 | Low | 142 Ų | 142 | 137.8 Ų | 137.8 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | trans | -22.8 | 120.2 | 169.5 | 176.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 30 | L | 46.4 | Very low | 50.3 | Low | 159 Ų | 159 | 139.1 Ų | 139.1 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -62.2 | 135 | 169 | -74.8 | 160.5 | 0 | 0 | 0 | 110.3 | S28 | S28-L30 PolarHBondContact O-N 3.38Š| ||
| 31 | P | 45.8 | Very low | 49.7 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 72% | 0.721 | 80% | 0.799 | S | S | * | * | trans | -70.8 | 138.5 | 161.8 | 29.4 | -29.4 | 0 | 0 | 0 | 109.1 | S33 | P31-S33 PolarHBondContact O-N 3.09Š| ||
| 32 | S | 49.2 | Very low | 49.5 | Very low | 106 Ų | 106 | 138.2 Ų | 138.2 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -58.5 | 105.6 | 173.3 | 174.6 | 0 | 0 | 0 | 0 | 109.9 | K34 | S32-K34 PolarHBondContact O-N 2.98Å; S32-K34 VanDerWaalsContact O-N 3.12Å | ||
| 33 | S | 42.3 | Very low | 49.2 | Very low | 117 Ų | 117 | 137.1 Ų | 137.1 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -63.3 | 107.3 | 169.3 | -69.4 | 0 | 0 | 0 | 0 | 109.2 | P31 | P31-S33 PolarHBondContact O-N 3.09Š| ||
| 34 | K | 53.9 | Low | 49.3 | Very low | 191 Ų | 191 | 139.5 Ų | 139.5 | 83% | 0.83 | 80% | 0.798 | S | S | * | * | trans | -82.8 | 122.2 | 167.2 | -66.9 | -177.2 | -179.4 | 177.6 | 0 | 108.4 | S32 A36 | S32-K34 PolarHBondContact O-N 2.98Å; S32-K34 VanDerWaalsContact O-N 3.12Å; K34-A36 PolarHBondContact O-N 3.08Å | ||
| 35 | S | 40.1 | Very low | 49.5 | Very low | 112 Ų | 112 | 138.7 Ų | 138.7 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | -50.8 | 126.8 | 172 | -45.6 | 0 | 0 | 0 | 0 | 110.8 | T37 | S35-T37 PolarHBondContact O-N 3.49Å; S35-T37 VanDerWaalsContact O-N 3.09Å | ||
| 36 | A | 45.5 | Very low | 49.8 | Very low | 104 Ų | 104 | 134.4 Ų | 134.4 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -72.4 | 96.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | K34 F38 | K34-A36 PolarHBondContact O-N 3.08Å; A36-F38 PolarHBondContact O-N 3.41Å | ||
| 37 | T | 46.8 | Very low | 50.1 | Low | 118 Ų | 118 | 129.8 Ų | 129.8 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | trans | -73.2 | 107.1 | 159.4 | -63.1 | 0 | 0 | 0 | 0 | 107.3 | S35 S39 | S35-T37 PolarHBondContact O-N 3.49Å; S35-T37 VanDerWaalsContact O-N 3.09Å; T37-S39 VanDerWaalsContact C-N 3.27Å; T37-S39 PolarHBondContact O-N 3.35Å | ||
| 38 | F | 46.7 | Very low | 50.1 | Low | 178 Ų | 178 | 126.8 Ų | 126.8 | 78% | 0.781 | 78% | 0.777 | S | S | * | * | trans | -72.9 | 90.8 | 162.7 | 83 | -80.6 | 0 | 0 | 0 | 107 | A36 L40 | A36-F38 PolarHBondContact O-N 3.41Å; F38-L40 HydrophobicContact CD2-CD1 4.28Å; F38-L40 HydrophobicContact CD2-CG 4.21Å; F38-L40 HydrophobicContact CE2-CD1 4.45Å | ||
| 39 | S | 48.3 | Very low | 50.7 | Low | 99 Ų | 99 | 131 Ų | 131 | 69% | 0.692 | 78% | 0.781 | S | S | * | * | trans | -89.1 | 100.4 | 151.1 | -62.7 | 0 | 0 | 0 | 0 | 104.4 | T37 G41 | T37-S39 VanDerWaalsContact C-N 3.27Å; T37-S39 PolarHBondContact O-N 3.35Å; S39-G41 PolarHBondContact O-N 3.35Å | ||
| 40 | L | 49.9 | Very low | 50.9 | Low | 145 Ų | 145 | 132.4 Ų | 132.4 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | -56.1 | 97.2 | 160.9 | -78.9 | 162.7 | 0 | 0 | 0 | 105.9 | F38 L42 | F38-L40 HydrophobicContact CD2-CD1 4.28Å; F38-L40 HydrophobicContact CD2-CG 4.21Å; F38-L40 HydrophobicContact CE2-CD1 4.45Å; L40-L42 PolarHBondContact O-N 2.93Å | ||
| 41 | G | 54.6 | Low | 51 | Low | 77 Ų | 77 | 135.3 Ų | 135.3 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -69.7 | 68 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | S39 | S39-G41 PolarHBondContact O-N 3.35Š| ||
| 42 | L | 57.4 | Low | 51.1 | Low | 145 Ų | 145 | 133 Ų | 133 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 128 | 159.9 | -131.7 | 78.3 | 0 | 0 | 0 | 106.5 | L40 Q44 | L40-L42 PolarHBondContact O-N 2.93Å; L42-Q44 PolarHBondContact O-N 2.83Å |
| 43 | P | 52 | Low | 50.9 | Low | 118 Ų | 118 | 138 Ų | 138 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 116.3 | 172 | -18.7 | 29.7 | 0 | 0 | 0 | 108.8 | P45 | P43-P45 WeakPolarHBondContact O-CD 3.35Š|
| 44 | Q | 55.2 | Low | 51.1 | Low | 176 Ų | 176 | 141.1 Ų | 141.1 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 122.1 | 173.7 | -166 | 179.9 | 7.8 | 0 | 0 | 107.9 | L42 | L42-Q44 PolarHBondContact O-N 2.83Š|
| 45 | P | 53.9 | Low | 50.6 | Low | 105 Ų | 105 | 141 Ų | 141 | 68% | 0.682 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 139.7 | 177.4 | 25.7 | -32.4 | 0 | 0 | 0 | 109.4 | P43 S47 | P43-P45 WeakPolarHBondContact O-CD 3.35Å; P45-S47 PolarHBondContact O-N 3Å |
| 46 | P | 60.8 | Low | 50.6 | Low | 127 Ų | 127 | 147 Ų | 147 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -62 | 125.9 | 178.4 | 24.8 | -32.3 | 0 | 0 | 0 | 109.9 | ||
| 47 | S | 52.8 | Low | 50.2 | Low | 99 Ų | 99 | 147.5 Ų | 147.5 | 69% | 0.692 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 143.4 | 173.6 | -69.6 | 0 | 0 | 0 | 0 | 111.2 | P45 K49 | P45-S47 PolarHBondContact O-N 3Å; S47-K49 PolarHBondContact O-N 3.33Å; S47-K49 VanDerWaalsContact O-N 3.15Å |
| 48 | P | 54.3 | Low | 49.7 | Very low | 124 Ų | 124 | 149.8 Ų | 149.8 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 120.5 | -177.9 | 23.4 | -31.1 | 0 | 0 | 0 | 110.3 | N50 | P48-N50 PolarHBondContact O-N 3.1Š|
| 49 | K | 56 | Low | 49.1 | Very low | 198 Ų | 198 | 144.9 Ų | 144.9 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -62 | 126.1 | 171.8 | -66.4 | 178.7 | 179.8 | 177.6 | 0 | 108.3 | S47 R51 | S47-K49 PolarHBondContact O-N 3.33Å; S47-K49 VanDerWaalsContact O-N 3.15Å; K49-R51 VanDerWaalsContact C-N 3.34Å; K49-R51 PolarHBondContact O-N 3.4Å |
| 50 | N | 56.4 | Low | 48.3 | Very low | 171 Ų | 171 | 145.1 Ų | 145.1 | 91% | 0.914 | 80% | 0.804 | S | S | * | * | trans | -58.7 | 95.8 | 170.7 | -92.9 | -67.1 | 0 | 0 | 0 | 109.2 | P48 G52 | P48-N50 PolarHBondContact O-N 3.1Å; N50-G52 PolarHBondContact O-N 3.29Å | ||
| 51 | R | 49.6 | Very low | 47.4 | Very low | 220 Ų | 220 | 145.6 Ų | 145.6 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 117.7 | 176 | -163.8 | 172 | 162.6 | -175.9 | -5.3 | 107.5 | K49 | K49-R51 VanDerWaalsContact C-N 3.34Å; K49-R51 PolarHBondContact O-N 3.4Å |
| 52 | G | 47 | Very low | 46.3 | Very low | 63 Ų | 63 | 145.4 Ų | 145.4 | 65% | 0.649 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 147.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | N50 F54 | N50-G52 PolarHBondContact O-N 3.29Å; G52-F54 PolarHBondContact O-N 3.01Å |
| 53 | K | 45.4 | Very low | 45.2 | Very low | 210 Ų | 210 | 147.4 Ų | 147.4 | 91% | 0.913 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 118.5 | -175.4 | -54.7 | -161.6 | 178.5 | -174.1 | 0 | 110.6 | K55 | K53-K55 PolarHBondContact O-N 3.41Š|
| 54 | F | 45.9 | Very low | 44.4 | Very low | 184 Ų | 184 | 147.7 Ų | 147.7 | 81% | 0.807 | 82% | 0.821 | S | S | * | * | trans | -66.2 | 113 | 163.2 | -120.8 | -95.8 | 0 | 0 | 0 | 107.8 | G52 R56 | G52-F54 PolarHBondContact O-N 3.01Å; F54-R56 PolarHBondContact O-N 2.95Å | ||
| 55 | K | 43.6 | Very low | 43.4 | Very low | 189 Ų | 189 | 148.1 Ų | 148.1 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | trans | -67.6 | 110.3 | 163.9 | -94.4 | -168.8 | 164.1 | -174.5 | 0 | 107.5 | K53 S57 | K53-K55 PolarHBondContact O-N 3.41Å; K55-S57 PolarHBondContact O-N 3.21Å | ||
| 56 | R | 41 | Very low | 42.4 | Very low | 236 Ų | 236 | 150.4 Ų | 150.4 | 89% | 0.891 | 83% | 0.826 | S | S | * | * | trans | -76 | 105.9 | 158.4 | -108.6 | -174 | -71.3 | -124.6 | 0.3 | 107.2 | F54 I58 | F54-R56 PolarHBondContact O-N 2.95Å; R56-I58 PolarHBondContact O-N 2.91Å | ||
| 57 | S | 36.2 | Very low | 40.9 | Very low | 116 Ų | 116 | 150 Ų | 150 | 81% | 0.811 | 82% | 0.821 | S | S | * | * | trans | -74.8 | 114.8 | 160.6 | -68.9 | 0 | 0 | 0 | 0 | 107.4 | K55 G59 | K55-S57 PolarHBondContact O-N 3.21Å; S57-G59 PolarHBondContact O-N 3.42Å | ||
| 58 | I | 36 | Very low | 40 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 85% | 0.851 | 83% | 0.83 | S | S | * | * | trans | -86.1 | 106.9 | 174.6 | -21.4 | 171.6 | 0 | 0 | 0 | 105.7 | R56 | R56-I58 PolarHBondContact O-N 2.91Š| ||
| 59 | G | 34 | Very low | 38.7 | Very low | 74 Ų | 74 | 153.2 Ų | 153.2 | 76% | 0.763 | 83% | 0.833 | S | S | * | * | trans | -70 | 129.4 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | S57 | S57-G59 PolarHBondContact O-N 3.42Š| ||
| 60 | A | 31.2 | Very low | 37.7 | Very low | 105 Ų | 105 | 150.4 Ų | 150.4 | 87% | 0.868 | 83% | 0.832 | S | S | * | * | trans | -78.7 | 129.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 61 | V | 32.8 | Very low | 36.7 | Very low | 155 Ų | 155 | 148.7 Ų | 148.7 | 94% | 0.939 | 83% | 0.827 | S | S | * | * | 178.5 | 145.1 | 124.6 | 82.7 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 62 | G | 31.6 | Very low | 35.8 | Very low | 72 Ų | 72 | 144.6 Ų | 144.6 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | trans | 137.4 | 94.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 63 | Q | 32.5 | Very low | 35.1 | Very low | 187 Ų | 187 | 146.1 Ų | 146.1 | 87% | 0.874 | 83% | 0.833 | S | S | * | * | trans | -62.2 | 145.3 | 172 | -60.4 | 172.6 | 15.1 | 0 | 0 | 111.5 | ||||
| 64 | S | 36.4 | Very low | 34.7 | Very low | 125 Ų | 125 | 140.9 Ų | 140.9 | 87% | 0.874 | 83% | 0.829 | S | S | * | * | trans | -166.8 | 142.4 | 131 | -79.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 65 | K | 34 | Very low | 34.5 | Very low | 184 Ų | 184 | 137.5 Ų | 137.5 | 80% | 0.8 | 83% | 0.825 | S | S | * | * | trans | -78.1 | 144.3 | -178.9 | -59.1 | 165.1 | 178.9 | 176.2 | 0 | 108 | ||||
| 66 | D | 32.1 | Very low | 34.3 | Very low | 153 Ų | 153 | 134.6 Ų | 134.6 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | 174.2 | 138.2 | 116.2 | -87.1 | -53.1 | 0 | 0 | 0 | 112.5 | |||||
| 67 | V | 30.9 | Very low | 33.9 | Very low | 118 Ų | 118 | 133 Ų | 133 | 72% | 0.715 | 83% | 0.825 | S | S | * | * | trans | -13.5 | 128.9 | 163 | -166.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 68 | L | 33.4 | Very low | 34.2 | Very low | 168 Ų | 168 | 134.2 Ų | 134.2 | 88% | 0.88 | 83% | 0.828 | S | S | * | * | 175.5 | 120.3 | 115.8 | -87.8 | 166.4 | 0 | 0 | 0 | 111 | |||||
| 69 | S | 27.8 | Very low | 34.4 | Very low | 123 Ų | 123 | 133 Ų | 133 | 86% | 0.86 | 83% | 0.828 | S | S | * | * | trans | -70.7 | 126.2 | 169.9 | -94.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 70 | V | 33.2 | Very low | 34.7 | Very low | 140 Ų | 140 | 140.6 Ų | 140.6 | 85% | 0.848 | 83% | 0.834 | S | S | * | * | trans | -139.9 | 118.1 | 152 | 143.5 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 71 | V | 35.2 | Very low | 35.1 | Very low | 135 Ų | 135 | 141.5 Ų | 141.5 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -60.4 | 133.7 | 168.7 | 153.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 72 | V | 32.5 | Very low | 35.1 | Very low | 133 Ų | 133 | 141.5 Ų | 141.5 | 81% | 0.806 | 82% | 0.82 | S | S | * | * | trans | -169.8 | 134.6 | 140.6 | 156.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 73 | A | 32.3 | Very low | 35.4 | Very low | 95 Ų | 95 | 147 Ų | 147 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | trans | 73.1 | 115.3 | 154.6 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 74 | A | 37.1 | Very low | 35.5 | Very low | 101 Ų | 101 | 146.2 Ų | 146.2 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -114.5 | 141.2 | 155.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 75 | P | 40.8 | Very low | 35.6 | Very low | 113 Ų | 113 | 149.3 Ų | 149.3 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | -119.4 | 150 | 148.6 | 33.7 | -23 | 0 | 0 | 0 | 111.3 | ||||
| 76 | P | 39.3 | Very low | 35.6 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | trans | -82.2 | 148.5 | -164.8 | 32.1 | -33.3 | 0 | 0 | 0 | 113.7 | ||||
| 77 | K | 32.4 | Very low | 35.6 | Very low | 202 Ų | 202 | 149.2 Ų | 149.2 | 88% | 0.878 | 82% | 0.82 | S | S | * | * | trans | -81.7 | 130.7 | 172.1 | -60.4 | 172.1 | 178.4 | 172.3 | 0 | 109.2 | ||||
| 78 | T | 43.6 | Very low | 36.1 | Very low | 142 Ų | 142 | 147.8 Ų | 147.8 | 87% | 0.871 | 82% | 0.821 | S | S | * | * | trans | -104.8 | 129.2 | 163.6 | 52.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 79 | T | 38.8 | Very low | 36.7 | Very low | 139 Ų | 139 | 145.3 Ų | 145.3 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | trans | -84.9 | 137.3 | -179.5 | 35.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 80 | R | 40.4 | Very low | 37.6 | Very low | 235 Ų | 235 | 148.1 Ų | 148.1 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | trans | -65.2 | 161.3 | 167.3 | -66.6 | -179.2 | -83 | 178.8 | -5.4 | 110.3 | ||||
| 81 | P | 40.8 | Very low | 38.3 | Very low | 123 Ų | 123 | 147 Ų | 147 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | -148.3 | 166.1 | 53.2 | 36.6 | -12.8 | 0 | 0 | 0 | 115 | |||||
| 82 | H | 32.6 | Very low | 38.5 | Very low | 155 Ų | 155 | 145.7 Ų | 145.7 | 72% | 0.718 | 81% | 0.813 | S | S | * | * | -178.5 | 136.5 | 91.2 | -179.9 | -102.6 | 0 | 0 | 0 | 109.5 | |||||
| 83 | K | 37.3 | Very low | 38.9 | Very low | 188 Ų | 188 | 142.1 Ų | 142.1 | 82% | 0.817 | 80% | 0.804 | S | S | * | * | trans | -102.6 | 109.6 | 178.6 | 170 | -174.1 | 177.4 | 179.3 | 0 | 106.3 | ||||
| 84 | E | 34.8 | Very low | 39.6 | Very low | 170 Ų | 170 | 144.1 Ų | 144.1 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -109.6 | 127.3 | 167.2 | -154.7 | -176.9 | 127.7 | 0 | 0 | 109.5 | ||||
| 85 | K | 37.9 | Very low | 39.8 | Very low | 190 Ų | 190 | 143.7 Ų | 143.7 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | trans | -128.5 | 115.1 | 173.1 | -173.8 | 180 | -176.3 | -177.1 | 0 | 106.5 | ||||
| 86 | A | 34.4 | Very low | 40.3 | Very low | 89 Ų | 89 | 148.3 Ų | 148.3 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | 153.7 | 107.6 | 124.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 87 | R | 32.6 | Very low | 40.5 | Very low | 246 Ų | 246 | 149.5 Ų | 149.5 | 93% | 0.928 | 80% | 0.804 | S | S | * | * | trans | -160.9 | 123.9 | 135.3 | -140.4 | 168.3 | -161.7 | -153.7 | 2.6 | 111.7 | ||||
| 88 | A | 39.9 | Very low | 41.5 | Very low | 89 Ų | 89 | 144.6 Ų | 144.6 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | trans | -110.2 | 176.3 | 158.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 89 | P | 46.6 | Very low | 41.7 | Very low | 116 Ų | 116 | 146.1 Ų | 146.1 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | -108.3 | 156.5 | -75.4 | 34.9 | -23.2 | 0 | 0 | 0 | 110.2 | |||||
| 90 | Q | 46.8 | Very low | 42.4 | Very low | 182 Ų | 182 | 145 Ų | 145 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | trans | -131.9 | 127.7 | 167.7 | -78.4 | -85.2 | -18 | 0 | 0 | 109.5 | ||||
| 91 | P | 48 | Very low | 42.9 | Very low | 117 Ų | 117 | 138.5 Ų | 138.5 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | trans | -94.8 | 128.4 | -178.4 | 35.1 | -27.7 | 0 | 0 | 0 | 110.4 | ||||
| 92 | A | 39.9 | Very low | 43.5 | Very low | 106 Ų | 106 | 137.3 Ų | 137.3 | 88% | 0.876 | 78% | 0.779 | S | S | * | * | trans | -168.7 | 125.7 | 158.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 93 | G | 41 | Very low | 44.8 | Very low | 59 Ų | 59 | 137.6 Ų | 137.6 | 61% | 0.608 | 79% | 0.785 | S | S | * | * | trans | 115 | 122.4 | 153.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | S95 | G93-S95 VanDerWaalsContact C-N 3.3Å; G93-S95 PolarHBondContact O-N 3.44Å | ||
| 94 | P | 46 | Very low | 45.6 | Very low | 137 Ų | 137 | 135.7 Ų | 135.7 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | -77.1 | 83.6 | 173.2 | 32.4 | -30 | 0 | 0 | 0 | 108.9 | K96 | P94-K96 PolarHBondContact O-N 2.92Š| ||
| 95 | S | 42.4 | Very low | 46.7 | Very low | 91 Ų | 91 | 135.3 Ų | 135.3 | 64% | 0.636 | 78% | 0.777 | S | S | * | * | trans | -68.7 | 117.1 | 159.8 | 28.4 | 0 | 0 | 0 | 0 | 107.3 | G93 M97 | G93-S95 VanDerWaalsContact C-N 3.3Å; G93-S95 PolarHBondContact O-N 3.44Å; S95-M97 PolarHBondContact O-N 3.48Å | ||
| 96 | K | 50 | Low | 48.1 | Very low | 211 Ų | 211 | 131 Ų | 131 | 92% | 0.917 | 77% | 0.77 | S | S | * | * | trans | -55.5 | 89.1 | 169.2 | -71 | -178.9 | 176.5 | -176.9 | 0 | 108.3 | P94 A98 | P94-K96 PolarHBondContact O-N 2.92Å; K96-A98 PolarHBondContact O-N 3.43Å; K96-A98 VanDerWaalsContact O-N 3.17Å | ||
| 97 | M | 44.2 | Very low | 49.5 | Very low | 153 Ų | 153 | 135.2 Ų | 135.2 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | trans | -67.6 | 111.4 | 164.1 | -64.4 | -175.3 | -151.4 | 0 | 0 | 105.1 | S95 Q99 | S95-M97 PolarHBondContact O-N 3.48Å; M97-Q99 PolarHBondContact O-N 3.33Å | ||
| 98 | A | 52.9 | Low | 51.5 | Low | 98 Ų | 98 | 127.2 Ų | 127.2 | 81% | 0.81 | 75% | 0.748 | S | S | * | * | trans | -52.3 | 102.1 | 157.7 | 0 | 0 | 0 | 0 | 0 | 105.9 | K96 S100 | K96-A98 PolarHBondContact O-N 3.43Å; K96-A98 VanDerWaalsContact O-N 3.17Å; A98-S100 VanDerWaalsContact C-N 3.34Å; A98-S100 PolarHBondContact O-N 2.67Å | ||
| 99 | Q | 48.7 | Very low | 53.1 | Low | 175 Ų | 175 | 129.4 Ų | 129.4 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | trans | -66.5 | 102.9 | 172.6 | -66 | -149.7 | -28.5 | 0 | 0 | 105.4 | M97 S101 | M97-Q99 PolarHBondContact O-N 3.33Å; Q99-S101 VanDerWaalsContact C-N 3.29Å; Q99-S101 PolarHBondContact O-N 2.84Å | ||
| 100 | S | 54.3 | Low | 55.1 | Low | 115 Ų | 115 | 127.7 Ų | 127.7 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | trans | -58 | 105.5 | 155.1 | 42.4 | 0 | 0 | 0 | 0 | 105.8 | A98 | A98-S100 VanDerWaalsContact C-N 3.34Å; A98-S100 PolarHBondContact O-N 2.67Å | ||
| 101 | S | 49.9 | Very low | 57.1 | Low | 99 Ų | 99 | 122.7 Ų | 122.7 | 69% | 0.692 | 72% | 0.718 | S | S | * | * | trans | -53.8 | 135 | 175.1 | -58.7 | 0 | 0 | 0 | 0 | 108.5 | Q99 | Q99-S101 VanDerWaalsContact C-N 3.29Å; Q99-S101 PolarHBondContact O-N 2.84Å | ||
| 102 | P | 52.7 | Low | 59.2 | Low | 98 Ų | 98 | 120.4 Ų | 120.4 | 64% | 0.636 | 71% | 0.705 | S | S | * | * | trans | -54.4 | 144.4 | 168.4 | -17.6 | 29.2 | 0 | 0 | 0 | 108.4 | Q104 | P102-Q104 VanDerWaalsContact C-N 3.26Å; P102-Q104 WeakPolarHBondContact O-CG 3.42Å; P102-Q104 PolarHBondContact O-N 2.97Å | ||
| 103 | L | 60.8 | Low | 61.7 | Low | 160 Ų | 160 | 118.4 Ų | 118.4 | 84% | 0.838 | 68% | 0.68 | S | S | * | * | trans | -56.5 | 88.2 | 177.8 | -168 | 85.7 | 0 | 0 | 0 | 110 | ||||
| 104 | Q | 53.8 | Low | 64.2 | Low | 148 Ų | 148 | 119 Ų | 119 | 69% | 0.692 | 67% | 0.671 | S | S | * | * | trans | -82.4 | 123.2 | 173.4 | -65.5 | -64.8 | -29.8 | 0 | 0 | 106 | P102 S106 | P102-Q104 VanDerWaalsContact C-N 3.26Å; P102-Q104 WeakPolarHBondContact O-CG 3.42Å; P102-Q104 PolarHBondContact O-N 2.97Å; Q104-S106 PolarHBondContact O-N 2.69Å | ||
| 105 | H | 57.3 | Low | 66.5 | Low | 163 Ų | 163 | 120 Ų | 120 | 76% | 0.755 | 66% | 0.657 | S | S | * | * | trans | -61.2 | 90 | 164.9 | -59 | -72.2 | 0 | 0 | 0 | 107.5 | F107 | H105-F107 PolarHBondContact O-N 2.77Å; H105-F107 VanDerWaalsContact O-N 3.1Å | ||
| 106 | S | 68 | Low | 69.1 | Low | 98 Ų | 98 | 122.7 Ų | 122.7 | 69% | 0.685 | 66% | 0.66 | S | S | * | * | trans | -67.9 | 109.4 | 177 | -169.1 | 0 | 0 | 0 | 0 | 107.2 | Q104 L108 | Q104-S106 PolarHBondContact O-N 2.69Å; S106-L108 PolarHBondContact O-N 2.79Å | ||
| 107 | F | 64.3 | Low | 71.2 | Confident | 179 Ų | 179 | 117.4 Ų | 117.4 | 79% | 0.785 | 64% | 0.64 | S | S | * | * | trans | -56.1 | 128.2 | 162 | -70.3 | -85.8 | 0 | 0 | 0 | 107.1 | H105 T109 | H105-F107 PolarHBondContact O-N 2.77Å; H105-F107 VanDerWaalsContact O-N 3.1Å; F107-T109 PolarHBondContact O-N 2.87Å | ||
| 108 | L | 74.1 | Confident | 73.7 | Confident | 78 Ų | 78 | 115.8 Ų | 115.8 | 41% | 0.408 | 63% | 0.63 | S | S | . | * | trans | -62.1 | 107.8 | 174.7 | -64.4 | -178.5 | 0 | 0 | 0 | 108 | S106 D113 V114 M117 | S106-L108 PolarHBondContact O-N 2.79Å; L108-D113 HydrophobicContact CB-CB 4.29Å; L108-D113 HydrophobicContact CD1-CB 4.04Å; L108-D113 HydrophobicContact CD2-CB 3.87Å; L108-D113 HydrophobicContact CG-CB 4.3Å; L108-V114 HydrophobicContact CB-CG2 4.23Å; L108-M117 HydrophobicContact CD1-CE 3.08Å; L108-M117 HydrophobicContact CG-CE 4.35Å | ||
| 109 | T | 74.8 | Confident | 75.8 | Confident | 134 Ų | 134 | 113.1 Ų | 113.1 | 82% | 0.822 | 61% | 0.612 | S | S | * | * | trans | -91.9 | -20.6 | -178.7 | 48.1 | 0 | 0 | 0 | 0 | 112.4 | F107 | F107-T109 PolarHBondContact O-N 2.87Š| ||
| 110 | D | 88.3 | Confident | 78.2 | Confident | 80 Ų | 80 | 106.9 Ų | 106.9 | 43% | 0.428 | 60% | 0.595 | S | S | . | * | trans | -89.3 | 135.2 | 176.9 | -162.4 | -27.3 | 0 | 0 | 0 | 110.6 | S112 D113 V114 | D110-S112 PolarHBondContact O-N 3.14Å; D110-S112 WeakPolarHBondContact OD1-CB 3.45Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 2.93Å; D110-D113 PolarHBondContact O-N 3.4Å; D110-V114 PolarHBondContact O-N 2.91Å | ||
| 111 | V | 87.8 | Confident | 80.2 | Confident | 78 Ų | 78 | 106.1 Ų | 106.1 | 47% | 0.473 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.5 | -24 | 175 | -161 | 0 | 0 | 0 | 0 | 111 | V114 R115 | V111-V114 PolarHBondContact O-N 3.28Å; V111-R115 WeakPolarHBondContact O-CG 3.34Å; V111-R115 PolarHBondContact O-N 2.9Å; V111-R115 VanDerWaalsContact O-N 3.08Å |
| 112 | S | 92.1 | Very high | 82.5 | Confident | 68 Ų | 68 | 107 Ų | 107 | 48% | 0.476 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.4 | -46.6 | 174.9 | -49.3 | 0 | 0 | 0 | 0 | 111.2 | D110 V114 R115 E116 | D110-S112 PolarHBondContact O-N 3.14Å; D110-S112 WeakPolarHBondContact OD1-CB 3.45Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 2.93Å; S112-V114 VanDerWaalsContact C-N 3.31Å; S112-V114 PolarHBondContact O-N 3.17Å; S112-R115 PolarHBondContact O-N 3.32Å; S112-E116 PolarHBondContact O-N 3.47Å |
| 113 | D | 92.4 | Very high | 84.6 | Confident | 65 Ų | 65 | 106.6 Ų | 106.6 | 35% | 0.348 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.5 | -37.4 | 178.3 | -56.6 | -20.3 | 0 | 0 | 0 | 111.8 | L108 D110 E116 M117 | L108-D113 HydrophobicContact CB-CB 4.29Å; L108-D113 HydrophobicContact CD1-CB 4.04Å; L108-D113 HydrophobicContact CD2-CB 3.87Å; L108-D113 HydrophobicContact CG-CB 4.3Å; D110-D113 PolarHBondContact O-N 3.4Å; D113-E116 PolarHBondContact O-N 2.95Å; D113-M117 PolarHBondContact O-N 2.73Å |
| 114 | V | 93.6 | Very high | 86.4 | Confident | 71 Ų | 71 | 103.1 Ų | 103.1 | 43% | 0.43 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.9 | -43.2 | 176.3 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | L108 D110 V111 S112 M117 E118 | L108-V114 HydrophobicContact CB-CG2 4.23Å; D110-V114 PolarHBondContact O-N 2.91Å; V111-V114 PolarHBondContact O-N 3.28Å; S112-V114 VanDerWaalsContact C-N 3.31Å; S112-V114 PolarHBondContact O-N 3.17Å; V114-M117 PolarHBondContact O-N 2.97Å; V114-E118 WeakPolarHBondContact O-CB 3.43Å; V114-E118 PolarHBondContact O-N 2.8Å |
| 115 | R | 94.7 | Very high | 88.4 | Confident | 157 Ų | 157 | 100.5 Ų | 100.5 | 59% | 0.592 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.1 | -36.4 | 177.4 | -74 | -176.8 | -120.3 | -87.6 | 9.3 | 112.6 | V111 S112 E118 G119 | V111-R115 WeakPolarHBondContact O-CG 3.34Å; V111-R115 PolarHBondContact O-N 2.9Å; V111-R115 VanDerWaalsContact O-N 3.08Å; S112-R115 PolarHBondContact O-N 3.32Å; R115-E118 PolarHBondContact O-N 3.31Å; R115-G119 PolarHBondContact O-N 2.94Å |
| 116 | E | 96 | Very high | 90.3 | Very high | 148 Ų | 148 | 97.6 Ų | 97.6 | 69% | 0.692 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.9 | -46.3 | 174.7 | -173.9 | -179.5 | 161.5 | 0 | 0 | 110.9 | S112 D113 G119 G120 | S112-E116 PolarHBondContact O-N 3.47Å; D113-E116 PolarHBondContact O-N 2.95Å; E116-G119 PolarHBondContact O-N 3.43Å; E116-G120 PolarHBondContact O-N 2.96Å |
| 117 | M | 95.7 | Very high | 91.7 | Very high | 100 Ų | 100 | 94 Ų | 94 | 49% | 0.493 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 175.4 | -170.9 | -167.2 | -44 | 0 | 0 | 111.9 | L108 D113 V114 G119 G120 L121 | L108-M117 HydrophobicContact CD1-CE 3.08Å; L108-M117 HydrophobicContact CG-CE 4.35Å; D113-M117 PolarHBondContact O-N 2.73Å; V114-M117 PolarHBondContact O-N 2.97Å; M117-G119 VanDerWaalsContact C-N 3.28Å; M117-G119 PolarHBondContact O-N 3.44Å; M117-G120 PolarHBondContact O-N 3.5Å; M117-G120 VanDerWaalsContact O-N 3.14Å; M117-L121 HydrophobicContact CG-CD1 4.19Å; M117-L121 HydrophobicContact CG-CG 4.35Å; M117-L121 WeakPolarHBondContact O-CG 3.36Å; M117-L121 PolarHBondContact O-N 3.13Å; M117-L121 HydrophobicContact SD-CD1 4.44Å |
| 118 | E | 95.9 | Very high | 93.2 | Very high | 119 Ų | 119 | 91.9 Ų | 91.9 | 56% | 0.556 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -55.5 | -46.7 | 175.3 | -177 | -177.2 | -177.9 | 0 | 0 | 110.6 | V114 R115 G120 L121 L122 | V114-E118 WeakPolarHBondContact O-CB 3.43Å; V114-E118 PolarHBondContact O-N 2.8Å; R115-E118 PolarHBondContact O-N 3.31Å; E118-G120 PolarHBondContact O-N 3.47Å; E118-L121 PolarHBondContact O-N 3.36Å; E118-L122 WeakPolarHBondContact O-CB 3.12Å; E118-L122 PolarHBondContact O-N 3.38Å |
| 119 | G | 97.6 | Very high | 94.2 | Very high | 42 Ų | 42 | 95.6 Ų | 95.6 | 43% | 0.433 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R115 E116 M117 L122 N123 | R115-G119 PolarHBondContact O-N 2.94Å; E116-G119 PolarHBondContact O-N 3.43Å; M117-G119 VanDerWaalsContact C-N 3.28Å; M117-G119 PolarHBondContact O-N 3.44Å; G119-L122 PolarHBondContact O-N 2.86Å; G119-N123 WeakPolarHBondContact O-CB 3.45Å; G119-N123 PolarHBondContact O-N 2.94Å |
| 120 | G | 97.3 | Very high | 95.2 | Very high | 45 Ų | 45 | 92.8 Ų | 92.8 | 46% | 0.464 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E116 M117 E118 N123 L124 | E116-G120 PolarHBondContact O-N 2.96Å; M117-G120 PolarHBondContact O-N 3.5Å; M117-G120 VanDerWaalsContact O-N 3.14Å; E118-G120 PolarHBondContact O-N 3.47Å; G120-N123 PolarHBondContact O-N 3.49Å; G120-L124 WeakPolarHBondContact O-CB 3.37Å; G120-L124 PolarHBondContact O-N 3.47Å |
| 121 | L | 97.9 | Very high | 95.2 | Very high | 99 Ų | 99 | 91.4 Ų | 91.4 | 52% | 0.518 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.8 | -40.4 | 177.4 | -67.3 | 175.3 | 0 | 0 | 0 | 112.1 | M117 E118 N123 L124 L125 | M117-L121 HydrophobicContact CG-CD1 4.19Å; M117-L121 HydrophobicContact CG-CG 4.35Å; M117-L121 WeakPolarHBondContact O-CG 3.36Å; M117-L121 PolarHBondContact O-N 3.13Å; M117-L121 HydrophobicContact SD-CD1 4.44Å; E118-L121 PolarHBondContact O-N 3.36Å; L121-N123 VanDerWaalsContact C-N 3.33Å; L121-L124 PolarHBondContact O-N 3.31Å; L121-L125 PolarHBondContact O-N 2.97Å |
| 122 | L | 97.6 | Very high | 95.5 | Very high | 116 Ų | 116 | 94.8 Ų | 94.8 | 61% | 0.607 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64 | -41.1 | 176.3 | -135.2 | 78.7 | 0 | 0 | 0 | 111.2 | E118 G119 L125 N126 | E118-L122 WeakPolarHBondContact O-CB 3.12Å; E118-L122 PolarHBondContact O-N 3.38Å; G119-L122 PolarHBondContact O-N 2.86Å; L122-L125 PolarHBondContact O-N 3.03Å; L122-N126 PolarHBondContact O-N 2.79Å |
| 123 | N | 97.4 | Very high | 95.4 | Very high | 91 Ų | 91 | 95.5 Ų | 95.5 | 49% | 0.487 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.1 | -39.8 | 176 | -167.4 | 76.8 | 0 | 0 | 0 | 111.7 | G119 G120 L121 L125 N126 D127 | G119-N123 WeakPolarHBondContact O-CB 3.45Å; G119-N123 PolarHBondContact O-N 2.94Å; G120-N123 PolarHBondContact O-N 3.49Å; L121-N123 VanDerWaalsContact C-N 3.33Å; N123-L125 VanDerWaalsContact C-N 3.34Å; N123-L125 PolarHBondContact O-N 3.34Å; N123-N126 WeakPolarHBondContact O-CB 3.36Å; N123-N126 PolarHBondContact O-N 3.13Å; N123-N126 VanDerWaalsContact O-N 3.13Å; N123-D127 PolarHBondContact ND2-OD2 3.03Å; N123-D127 PolarHBondContact O-N 2.95Å |
| 124 | L | 97.1 | Very high | 95 | Very high | 87 Ų | 87 | 98.6 Ų | 98.6 | 46% | 0.455 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.8 | -40.5 | 174.9 | -171.4 | 64.4 | 0 | 0 | 0 | 112 | G120 L121 N126 D127 F128 L133 | G120-L124 WeakPolarHBondContact O-CB 3.37Å; G120-L124 PolarHBondContact O-N 3.47Å; L121-L124 PolarHBondContact O-N 3.31Å; L124-N126 VanDerWaalsContact C-N 3.31Å; L124-N126 PolarHBondContact O-N 3.44Å; L124-D127 PolarHBondContact O-N 3.33Å; L124-F128 PolarHBondContact O-N 2.98Å; L124-L133 HydrophobicContact CD1-CD1 4.17Å; L124-L133 HydrophobicContact CD1-CD2 3.65Å; L124-L133 HydrophobicContact CG-CD2 4.44Å |
| 125 | L | 97.1 | Very high | 94.3 | Very high | 93 Ų | 93 | 99.5 Ų | 99.5 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63 | -37.9 | 172.1 | -79.3 | 168.7 | 0 | 0 | 0 | 112 | L121 L122 N123 F128 H129 | L121-L125 PolarHBondContact O-N 2.97Å; L122-L125 PolarHBondContact O-N 3.03Å; N123-L125 VanDerWaalsContact C-N 3.34Å; N123-L125 PolarHBondContact O-N 3.34Å; L125-F128 PolarHBondContact O-N 3.31Å; L125-H129 PolarHBondContact O-N 3.16Å; L125-H129 PolarHBondContact O-ND1 2.99Å |
| 126 | N | 97.1 | Very high | 93.5 | Very high | 101 Ų | 101 | 96.3 Ų | 96.3 | 54% | 0.54 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.1 | -45.3 | 175.5 | -166.1 | -84 | 0 | 0 | 0 | 111.7 | L122 N123 L124 F128 H129 S130 | L122-N126 PolarHBondContact O-N 2.79Å; N123-N126 WeakPolarHBondContact O-CB 3.36Å; N123-N126 PolarHBondContact O-N 3.13Å; N123-N126 VanDerWaalsContact O-N 3.13Å; L124-N126 VanDerWaalsContact C-N 3.31Å; L124-N126 PolarHBondContact O-N 3.44Å; N126-F128 PolarHBondContact O-N 3.15Å; N126-H129 PolarHBondContact O-N 3.24Å; N126-S130 WeakPolarHBondContact O-CB 3.47Å; N126-S130 PolarHBondContact O-N 2.9Å; N126-S130 PolarHBondContact O-OG 3.31Å |
| 127 | D | 96.7 | Very high | 92.3 | Very high | 22 Ų | 22 | 91.1 Ų | 91.1 | 12% | 0.118 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -60.5 | -33.8 | 174.5 | -75.7 | -27.3 | 0 | 0 | 0 | 111.5 | N123 L124 S130 G131 K132 L133 | N123-D127 PolarHBondContact ND2-OD2 3.03Å; N123-D127 PolarHBondContact O-N 2.95Å; L124-D127 PolarHBondContact O-N 3.33Å; D127-S130 WeakPolarHBondContact CA-OG 3.4Å; D127-S130 PolarHBondContact O-OG 3.44Å; D127-G131 PolarHBondContact O-N 2.91Å; D127-K132 PolarHBondContact O-N 3.31Å; D127-K132 WeakPolarHBondContact OD1-CD 3.34Å; D127-K132 IonicContact OD1-NZ 3.47Å; D127-K132 PolarHBondContact OD1-NZ 2.98Å; D127-K132 IonicContact OD2-NZ 3.45Å; D127-K132 PolarHBondContact OD2-NZ 3.43Å; D127-L133 HydrophobicContact CB-CB 4.19Å; D127-L133 PolarHBondContact O-N 2.81Å |
| 128 | F | 95.6 | Very high | 91.1 | Very high | 135 Ų | 135 | 95.5 Ų | 95.5 | 59% | 0.592 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.4 | -49 | 175 | -163.7 | -96.7 | 0 | 0 | 0 | 112.5 | L124 L125 N126 S130 G131 L133 | L124-F128 PolarHBondContact O-N 2.98Å; L125-F128 PolarHBondContact O-N 3.31Å; N126-F128 PolarHBondContact O-N 3.15Å; F128-S130 VanDerWaalsContact C-N 3.33Å; F128-S130 PolarHBondContact O-N 2.82Å; F128-G131 PolarHBondContact O-N 3.35Å; F128-G131 VanDerWaalsContact O-N 3.13Å; F128-L133 HydrophobicContact CD2-CD2 4.38Å |
| 129 | H | 95.4 | Very high | 89.7 | Confident | 157 Ų | 157 | 92.1 Ų | 92.1 | 73% | 0.727 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.8 | -32.6 | 179 | -68.9 | 153.4 | 0 | 0 | 0 | 113.4 | L125 N126 G131 | L125-H129 PolarHBondContact O-N 3.16Å; L125-H129 PolarHBondContact O-ND1 2.99Å; N126-H129 PolarHBondContact O-N 3.24Å; H129-G131 PolarHBondContact O-N 2.6Å |
| 130 | S | 95.1 | Very high | 88.5 | Confident | 74 Ų | 74 | 92 Ų | 92 | 52% | 0.517 | 51% | 0.508 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | -8.1 | 175.5 | 59.2 | 0 | 0 | 0 | 0 | 113.1 | N126 D127 F128 K132 | N126-S130 WeakPolarHBondContact O-CB 3.47Å; N126-S130 PolarHBondContact O-N 2.9Å; N126-S130 PolarHBondContact O-OG 3.31Å; D127-S130 WeakPolarHBondContact CA-OG 3.4Å; D127-S130 PolarHBondContact O-OG 3.44Å; F128-S130 VanDerWaalsContact C-N 3.33Å; F128-S130 PolarHBondContact O-N 2.82Å; S130-K132 PolarHBondContact O-N 3.45Å |
| 131 | G | 89.9 | Confident | 87.9 | Confident | 51 Ų | 51 | 91.5 Ų | 91.5 | 53% | 0.526 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.7 | 6.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | D127 F128 H129 L133 | D127-G131 PolarHBondContact O-N 2.91Å; F128-G131 PolarHBondContact O-N 3.35Å; F128-G131 VanDerWaalsContact O-N 3.13Å; H129-G131 PolarHBondContact O-N 2.6Å; G131-L133 VanDerWaalsContact C-N 3.28Å |
| 132 | K | 92.3 | Very high | 87.4 | Confident | 149 Ų | 149 | 92.1 Ų | 92.1 | 65% | 0.648 | 50% | 0.496 | S | S | * | . | trans | -66.8 | -32.7 | 174.9 | 179.2 | 174.7 | 152.8 | -138.1 | 0 | 111.4 | D127 S130 Q134 | D127-K132 PolarHBondContact O-N 3.31Å; D127-K132 WeakPolarHBondContact OD1-CD 3.34Å; D127-K132 IonicContact OD1-NZ 3.47Å; D127-K132 PolarHBondContact OD1-NZ 2.98Å; D127-K132 IonicContact OD2-NZ 3.45Å; D127-K132 PolarHBondContact OD2-NZ 3.43Å; S130-K132 PolarHBondContact O-N 3.45Å; K132-Q134 PolarHBondContact O-N 3.32Å | ||
| 133 | L | 90.1 | Very high | 87.1 | Confident | 84 Ų | 84 | 94 Ų | 94 | 44% | 0.44 | 50% | 0.502 | S | S | . | . | trans | -87.4 | 100 | 171.7 | -149.9 | 79.6 | 0 | 0 | 0 | 109.6 | L124 D127 F128 G131 | L124-L133 HydrophobicContact CD1-CD1 4.17Å; L124-L133 HydrophobicContact CD1-CD2 3.65Å; L124-L133 HydrophobicContact CG-CD2 4.44Å; D127-L133 HydrophobicContact CB-CB 4.19Å; D127-L133 PolarHBondContact O-N 2.81Å; F128-L133 HydrophobicContact CD2-CD2 4.38Å; G131-L133 VanDerWaalsContact C-N 3.28Å | ||
| 134 | Q | 84.3 | Confident | 86.8 | Confident | 129 Ų | 129 | 93.4 Ų | 93.4 | 60% | 0.603 | 50% | 0.496 | S | S | * | . | trans | -114.3 | 121.1 | 175.8 | -155.6 | -174.4 | 1.1 | 0 | 0 | 109.4 | K132 F136 | K132-Q134 PolarHBondContact O-N 3.32Å; Q134-F136 WeakPolarHBondContact CG-O 3.13Å; Q134-F136 PolarHBondContact NE2-O 3.44Å | ||
| 135 | A | 79.6 | Confident | 86.5 | Confident | 91 Ų | 91 | 92.5 Ų | 92.5 | 75% | 0.752 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -76.5 | -25.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 136 | F | 77.2 | Confident | 86.4 | Confident | 89 Ų | 89 | 90.9 Ų | 90.9 | 39% | 0.39 | 48% | 0.482 | S | S | . | . | S | Bend | trans | -126.7 | 127.3 | -179.3 | -55.4 | -71.1 | 0 | 0 | 0 | 109.2 | Q134 F142 L145 | Q134-F136 WeakPolarHBondContact CG-O 3.13Å; Q134-F136 PolarHBondContact NE2-O 3.44Å; F136-F142 HydrophobicContact CB-CB 4.49Å; F136-F142 HydrophobicContact CD1-CB 4.38Å; F136-F142 HydrophobicContact CD2-CB 3.88Å; F136-F142 HydrophobicContact CD2-CD2 4.22Å; F136-F142 HydrophobicContact CD2-CG 4.43Å; F136-F142 HydrophobicContact CE1-CD2 4.02Å; F136-F142 HydrophobicContact CE2-CB 4.19Å; F136-F142 AromaticContact CE2-CD2 3.65Å; F136-F142 HydrophobicContact CE2-CD2 3.65Å; F136-F142 HydrophobicContact CE2-CE2 4.49Å; F136-F142 HydrophobicContact CE2-CG 4.25Å; F136-F142 HydrophobicContact CG-CB 3.99Å; F136-F142 AromaticContact CZ-CD2 3.55Å; F136-F142 HydrophobicContact CZ-CD2 3.55Å; F136-F142 HydrophobicContact CZ-CE2 4.24Å; F136-F142 HydrophobicContact CZ-CG 4.48Å; F136-L145 HydrophobicContact CD1-CD1 3.94Å; F136-L145 HydrophobicContact CE1-CD1 4.07Å |
| 137 | G | 72.4 | Confident | 86.3 | Confident | 40 Ų | 40 | 90.1 Ų | 90.1 | 41% | 0.412 | 48% | 0.475 | S | S | . | . | trans | -72.1 | 169.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V139 C140 | G137-V139 VanDerWaalsContact C-N 3.26Å; G137-V139 PolarHBondContact O-N 3.13Å; G137-C140 CarbonylContact O-C 3.54Å | ||
| 138 | K | 69.8 | Low | 86.3 | Confident | 191 Ų | 191 | 89.7 Ų | 89.7 | 83% | 0.83 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -64.5 | -28.3 | 175.6 | -79.6 | -172.7 | 177 | -178.4 | 0 | 113.9 | ||
| 139 | V | 65.4 | Low | 86.4 | Confident | 49 Ų | 49 | 89.8 Ų | 89.8 | 30% | 0.297 | 47% | 0.469 | S | S | . | . | S | Bend | trans | -104.8 | -14.2 | -172.9 | -112.6 | 0 | 0 | 0 | 0 | 114 | G137 Q144 A202 | G137-V139 VanDerWaalsContact C-N 3.26Å; G137-V139 PolarHBondContact O-N 3.13Å; V139-Q144 PolarHBondContact O-OE1 3.38Å; V139-A202 HydrophobicContact CB-CB 3.95Å; V139-A202 WeakPolarHBondContact CB-O 3.15Å; V139-A202 HydrophobicContact CG1-CB 3.78Å; V139-A202 WeakPolarHBondContact CG1-O 3.48Å; V139-A202 VanDerWaalsContact O-CB 3.25Å; V139-A202 WeakPolarHBondContact O-CB 3.46Å |
| 140 | C | 72.3 | Confident | 86.5 | Confident | 39 Ų | 39 | 87.3 Ų | 87.3 | 26% | 0.264 | 46% | 0.458 | S | S | . | . | S | Bend | trans | -125 | 81 | 168.9 | -172.1 | 0 | 0 | 0 | 0 | 107.5 | G137 L199 | G137-C140 CarbonylContact O-C 3.54Å; C140-L199 HydrophobicContact CB-CD2 4.48Å |
| 141 | S | 85.1 | Confident | 86.6 | Confident | 35 Ų | 35 | 84.6 Ų | 84.6 | 25% | 0.245 | 44% | 0.438 | C | S | . | . | trans | -74.9 | 154.9 | -174.6 | 82.2 | 0 | 0 | 0 | 0 | 110.9 | E143 Q144 L145 | S141-E143 PolarHBondContact O-N 2.96Å; S141-E143 PolarHBondContact OG-N 3.31Å; S141-Q144 PolarHBondContact O-N 3.48Å; S141-Q144 VanDerWaalsContact O-N 3.12Å; S141-Q144 WeakPolarHBondContact OG-CG 3.12Å; S141-Q144 PolarHBondContact OG-N 2.84Å; S141-L145 PolarHBondContact O-N 2.94Å | ||
| 142 | F | 88.1 | Confident | 87 | Confident | 111 Ų | 111 | 87 Ų | 87 | 49% | 0.487 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -52.4 | -41.4 | 172.7 | 175.1 | -103.8 | 0 | 0 | 0 | 112.1 | F136 Q144 L145 E146 | F136-F142 HydrophobicContact CB-CB 4.49Å; F136-F142 HydrophobicContact CD1-CB 4.38Å; F136-F142 HydrophobicContact CD2-CB 3.88Å; F136-F142 HydrophobicContact CD2-CD2 4.22Å; F136-F142 HydrophobicContact CD2-CG 4.43Å; F136-F142 HydrophobicContact CE1-CD2 4.02Å; F136-F142 HydrophobicContact CE2-CB 4.19Å; F136-F142 AromaticContact CE2-CD2 3.65Å; F136-F142 HydrophobicContact CE2-CD2 3.65Å; F136-F142 HydrophobicContact CE2-CE2 4.49Å; F136-F142 HydrophobicContact CE2-CG 4.25Å; F136-F142 HydrophobicContact CG-CB 3.99Å; F136-F142 AromaticContact CZ-CD2 3.55Å; F136-F142 HydrophobicContact CZ-CD2 3.55Å; F136-F142 HydrophobicContact CZ-CE2 4.24Å; F136-F142 HydrophobicContact CZ-CG 4.48Å; F142-Q144 VanDerWaalsContact C-N 3.33Å; F142-Q144 PolarHBondContact O-N 3.25Å; F142-L145 PolarHBondContact O-N 3.42Å; F142-E146 WeakPolarHBondContact CE1-OE2 3.49Å; F142-E146 WeakPolarHBondContact CZ-OE2 3.49Å; F142-E146 WeakPolarHBondContact O-CB 3.34Å; F142-E146 PolarHBondContact O-N 3.24Å |
| 143 | E | 90.4 | Very high | 87.2 | Confident | 156 Ų | 156 | 83.3 Ų | 83.3 | 73% | 0.729 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -62.8 | -38.3 | 179.8 | -173.1 | 175 | -162.6 | 0 | 0 | 112.3 | S141 E146 H147 | S141-E143 PolarHBondContact O-N 2.96Å; S141-E143 PolarHBondContact OG-N 3.31Å; E143-E146 PolarHBondContact O-N 3.17Å; E143-H147 WeakPolarHBondContact O-CB 3.36Å; E143-H147 PolarHBondContact O-N 3.27Å |
| 144 | Q | 90.9 | Very high | 87.6 | Confident | 78 Ų | 78 | 84.6 Ų | 84.6 | 36% | 0.364 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -69.6 | -38.1 | 177 | -64.8 | 167.1 | -45.1 | 0 | 0 | 111.9 | V139 S141 F142 H147 V148 L199 | V139-Q144 PolarHBondContact O-OE1 3.38Å; S141-Q144 PolarHBondContact O-N 3.48Å; S141-Q144 VanDerWaalsContact O-N 3.12Å; S141-Q144 WeakPolarHBondContact OG-CG 3.12Å; S141-Q144 PolarHBondContact OG-N 2.84Å; F142-Q144 VanDerWaalsContact C-N 3.33Å; F142-Q144 PolarHBondContact O-N 3.25Å; Q144-H147 PolarHBondContact O-N 3.12Å; Q144-V148 WeakPolarHBondContact O-CG2 3.44Å; Q144-V148 PolarHBondContact O-N 3.47Å; Q144-L199 HydrophobicContact CB-CD2 3.47Å; Q144-L199 VanDerWaalsContact CB-CD2 3.47Å; Q144-L199 HydrophobicContact CG-CD2 4.14Å |
| 145 | L | 92.7 | Very high | 88.2 | Confident | 69 Ų | 69 | 79.9 Ų | 79.9 | 36% | 0.361 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -68.3 | -40.4 | 174.9 | -69.3 | 175.2 | 0 | 0 | 0 | 112 | F136 S141 F142 H147 V148 R149 L199 | F136-L145 HydrophobicContact CD1-CD1 3.94Å; F136-L145 HydrophobicContact CE1-CD1 4.07Å; S141-L145 PolarHBondContact O-N 2.94Å; F142-L145 PolarHBondContact O-N 3.42Å; L145-H147 VanDerWaalsContact C-N 3.3Å; L145-H147 PolarHBondContact O-N 3.48Å; L145-V148 PolarHBondContact O-N 2.85Å; L145-R149 WeakPolarHBondContact O-CB 3.44Å; L145-R149 PolarHBondContact O-N 3.37Å; L145-L199 HydrophobicContact CD2-CD1 3.97Å |
| 146 | E | 93.7 | Very high | 89.1 | Confident | 59 Ų | 59 | 77.9 Ų | 77.9 | 28% | 0.276 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -58.9 | -44.3 | 172.4 | -171.3 | 87.6 | -111.7 | 0 | 0 | 110.1 | F142 E143 V148 R149 E150 | F142-E146 WeakPolarHBondContact CE1-OE2 3.49Å; F142-E146 WeakPolarHBondContact CZ-OE2 3.49Å; F142-E146 WeakPolarHBondContact O-CB 3.34Å; F142-E146 PolarHBondContact O-N 3.24Å; E143-E146 PolarHBondContact O-N 3.17Å; E146-V148 PolarHBondContact O-N 3.42Å; E146-R149 CarbonylContact O-C 3.59Å; E146-R149 WeakPolarHBondContact O-CA 3.45Å; E146-R149 WeakPolarHBondContact O-CB 3.4Å; E146-R149 PolarHBondContact O-N 3.19Å; E146-R149 VanDerWaalsContact O-N 3.13Å; E146-R149 IonicContact OE1-NH1 2.79Å; E146-R149 PolarHBondContact OE1-NH1 3.32Å; E146-E150 WeakPolarHBondContact O-CG 3.05Å; E146-E150 PolarHBondContact O-N 3.2Å |
| 147 | H | 95.4 | Very high | 90 | Very high | 85 Ų | 85 | 80.7 Ų | 80.7 | 39% | 0.394 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 177 | -176.7 | 55.9 | 0 | 0 | 0 | 112.8 | E143 Q144 L145 R149 E150 M151 | E143-H147 WeakPolarHBondContact O-CB 3.36Å; E143-H147 PolarHBondContact O-N 3.27Å; Q144-H147 PolarHBondContact O-N 3.12Å; L145-H147 VanDerWaalsContact C-N 3.3Å; L145-H147 PolarHBondContact O-N 3.48Å; H147-R149 VanDerWaalsContact C-N 3.31Å; H147-R149 PolarHBondContact O-N 2.93Å; H147-E150 PolarHBondContact O-N 3.4Å; H147-M151 WeakPolarHBondContact O-CG 3.24Å; H147-M151 PolarHBondContact O-N 3.48Å |
| 148 | V | 96.2 | Very high | 91.2 | Very high | 13 Ų | 13 | 80.1 Ų | 80.1 | 8% | 0.079 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 173.9 | 168.3 | 0 | 0 | 0 | 0 | 111.1 | Q144 L145 E146 M151 Q152 L192 I196 L199 | Q144-V148 WeakPolarHBondContact O-CG2 3.44Å; Q144-V148 PolarHBondContact O-N 3.47Å; L145-V148 PolarHBondContact O-N 2.85Å; E146-V148 PolarHBondContact O-N 3.42Å; V148-M151 PolarHBondContact O-N 3.26Å; V148-Q152 WeakPolarHBondContact O-CG 3.41Å; V148-Q152 PolarHBondContact O-N 3.34Å; V148-L192 HydrophobicContact CG1-CD1 3.92Å; V148-I196 HydrophobicContact CG1-CD1 4.22Å; V148-I196 HydrophobicContact CG1-CG1 3.9Å; V148-I196 HydrophobicContact CG2-CG1 4.16Å; V148-L199 HydrophobicContact CG2-CD1 3.79Å |
| 149 | R | 97.2 | Very high | 92.4 | Very high | 136 Ų | 136 | 75.5 Ų | 75.5 | 51% | 0.513 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.7 | -44.4 | 175.6 | 175.6 | -177.5 | 174.9 | -88.8 | -17.9 | 111.5 | L145 E146 H147 Q152 E153 | L145-R149 WeakPolarHBondContact O-CB 3.44Å; L145-R149 PolarHBondContact O-N 3.37Å; E146-R149 CarbonylContact O-C 3.59Å; E146-R149 WeakPolarHBondContact O-CA 3.45Å; E146-R149 WeakPolarHBondContact O-CB 3.4Å; E146-R149 PolarHBondContact O-N 3.19Å; E146-R149 VanDerWaalsContact O-N 3.13Å; E146-R149 IonicContact OE1-NH1 2.79Å; E146-R149 PolarHBondContact OE1-NH1 3.32Å; H147-R149 VanDerWaalsContact C-N 3.31Å; H147-R149 PolarHBondContact O-N 2.93Å; R149-Q152 PolarHBondContact O-N 2.98Å; R149-E153 PolarHBondContact O-N 3.17Å |
| 150 | E | 97.7 | Very high | 93.8 | Very high | 106 Ų | 106 | 80.1 Ų | 80.1 | 50% | 0.495 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 176.4 | -73.5 | 178.8 | 168.9 | 0 | 0 | 112.1 | E146 H147 Q152 E153 K154 | E146-E150 WeakPolarHBondContact O-CG 3.05Å; E146-E150 PolarHBondContact O-N 3.2Å; H147-E150 PolarHBondContact O-N 3.4Å; E150-Q152 VanDerWaalsContact C-N 3.34Å; E150-Q152 PolarHBondContact O-N 2.85Å; E150-E153 PolarHBondContact O-N 3.48Å; E150-K154 WeakPolarHBondContact O-CB 3.36Å; E150-K154 PolarHBondContact O-N 3.44Å |
| 151 | M | 97.8 | Very high | 94.9 | Very high | 17 Ų | 17 | 81.9 Ų | 81.9 | 8% | 0.084 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.4 | -42.1 | 176.2 | -73.5 | -163.5 | 78.6 | 0 | 0 | 112 | H147 V148 K154 L155 E191 L192 | H147-M151 WeakPolarHBondContact O-CG 3.24Å; H147-M151 PolarHBondContact O-N 3.48Å; V148-M151 PolarHBondContact O-N 3.26Å; M151-K154 PolarHBondContact O-N 2.95Å; M151-L155 WeakPolarHBondContact O-CB 3.32Å; M151-L155 PolarHBondContact O-N 3.3Å; M151-E191 HydrophobicContact CE-CB 3.72Å; M151-E191 HydrophobicContact CE-CG 3.52Å; M151-E191 WeakPolarHBondContact CE-OE2 3.36Å; M151-L192 HydrophobicContact CB-CD1 3.83Å; M151-L192 HydrophobicContact CE-CB 4.07Å; M151-L192 HydrophobicContact SD-CB 4.46Å; M151-L192 HydrophobicContact SD-CD1 4.4Å |
| 152 | Q | 98.1 | Very high | 95.3 | Very high | 100 Ų | 100 | 81.6 Ų | 81.6 | 47% | 0.467 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 174.4 | -71.4 | 172.7 | -11.8 | 0 | 0 | 111.8 | V148 R149 E150 L155 A156 L192 | V148-Q152 WeakPolarHBondContact O-CG 3.41Å; V148-Q152 PolarHBondContact O-N 3.34Å; R149-Q152 PolarHBondContact O-N 2.98Å; E150-Q152 VanDerWaalsContact C-N 3.34Å; E150-Q152 PolarHBondContact O-N 2.85Å; Q152-L155 PolarHBondContact O-N 2.99Å; Q152-A156 PolarHBondContact O-N 3.33Å; Q152-L192 HydrophobicContact CG-CD1 4.11Å; Q152-L192 HydrophobicContact CG-CD2 3.76Å |
| 153 | E | 97.9 | Very high | 95.4 | Very high | 73 Ų | 73 | 80.5 Ų | 80.5 | 34% | 0.341 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.5 | -43.6 | 177.8 | 179.9 | 167.9 | -160.3 | 0 | 0 | 112 | R149 E150 L155 A156 R157 | R149-E153 PolarHBondContact O-N 3.17Å; E150-E153 PolarHBondContact O-N 3.48Å; E153-L155 VanDerWaalsContact C-N 3.28Å; E153-L155 PolarHBondContact O-N 2.91Å; E153-A156 PolarHBondContact O-N 2.96Å; E153-R157 WeakPolarHBondContact O-CG 3.35Å; E153-R157 PolarHBondContact O-N 2.81Å; E153-R157 IonicContact OE1-CZ 3.75Å; E153-R157 IonicContact OE1-NE 2.72Å; E153-R157 PolarHBondContact OE1-NE 3.14Å; E153-R157 IonicContact OE1-NH2 3.72Å; E153-R157 PolarHBondContact OE1-NH2 3.34Å; E153-R157 IonicContact OE2-NH2 2.99Å |
| 154 | K | 97.1 | Very high | 95.4 | Very high | 111 Ų | 111 | 77 Ų | 77 | 48% | 0.483 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -57.4 | -43.8 | 174 | -178.2 | -170.6 | 172 | -155.4 | 0 | 110.7 | E150 M151 R157 L158 N188 | E150-K154 WeakPolarHBondContact O-CB 3.36Å; E150-K154 PolarHBondContact O-N 3.44Å; M151-K154 PolarHBondContact O-N 2.95Å; K154-R157 PolarHBondContact O-N 3.25Å; K154-L158 VanDerWaalsContact O-CB 3.24Å; K154-L158 WeakPolarHBondContact O-CB 3.5Å; K154-L158 PolarHBondContact O-N 3.33Å; K154-N188 PolarHBondContact NZ-OD1 3.31Å; K154-N188 VanDerWaalsContact NZ-OD1 3.1Å |
| 155 | L | 97.4 | Very high | 95.2 | Very high | 30 Ų | 30 | 77.8 Ų | 77.8 | 16% | 0.157 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 179.1 | -174.8 | 63.1 | 0 | 0 | 0 | 112.1 | M151 Q152 E153 L158 H159 L185 N188 L189 | M151-L155 WeakPolarHBondContact O-CB 3.32Å; M151-L155 PolarHBondContact O-N 3.3Å; Q152-L155 PolarHBondContact O-N 2.99Å; E153-L155 VanDerWaalsContact C-N 3.28Å; E153-L155 PolarHBondContact O-N 2.91Å; L155-L158 PolarHBondContact O-N 3.46Å; L155-H159 PolarHBondContact O-N 3.41Å; L155-L185 HydrophobicContact CD1-CD2 3.68Å; L155-N188 HydrophobicContact CD1-CB 3.94Å; L155-L189 HydrophobicContact CD2-CD1 4.07Å |
| 156 | A | 97.6 | Very high | 95 | Very high | 48 Ų | 48 | 75.7 Ų | 75.7 | 40% | 0.397 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.8 | -46.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q152 E153 L158 H159 F160 | Q152-A156 PolarHBondContact O-N 3.33Å; E153-A156 PolarHBondContact O-N 2.96Å; A156-L158 VanDerWaalsContact C-N 3.35Å; A156-L158 PolarHBondContact O-N 3.33Å; A156-H159 PolarHBondContact O-N 3.47Å; A156-F160 WeakPolarHBondContact O-CD2 3.24Å; A156-F160 PolarHBondContact O-N 3.07Å |
| 157 | R | 97.1 | Very high | 94.6 | Very high | 149 Ų | 149 | 79.8 Ų | 79.8 | 56% | 0.562 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -60.6 | -44.6 | 175.6 | -70.4 | 174.8 | -175.5 | 164.9 | -3.5 | 111.5 | E153 K154 H159 F160 S161 | E153-R157 WeakPolarHBondContact O-CG 3.35Å; E153-R157 PolarHBondContact O-N 2.81Å; E153-R157 IonicContact OE1-CZ 3.75Å; E153-R157 IonicContact OE1-NE 2.72Å; E153-R157 PolarHBondContact OE1-NE 3.14Å; E153-R157 IonicContact OE1-NH2 3.72Å; E153-R157 PolarHBondContact OE1-NH2 3.34Å; E153-R157 IonicContact OE2-NH2 2.99Å; K154-R157 PolarHBondContact O-N 3.25Å; R157-H159 VanDerWaalsContact C-N 3.35Å; R157-H159 PolarHBondContact O-N 3.47Å; R157-F160 PolarHBondContact O-N 3.2Å; R157-S161 PolarHBondContact O-N 3.3Å; R157-S161 PolarHBondContact O-OG 3.03Å; R157-S161 VanDerWaalsContact O-OG 3.14Å |
| 158 | L | 96.6 | Very high | 94.1 | Very high | 28 Ų | 28 | 83.7 Ų | 83.7 | 15% | 0.147 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 178.2 | 178 | 64.2 | 0 | 0 | 0 | 111.2 | K154 L155 A156 F160 S161 L162 H184 L185 | K154-L158 VanDerWaalsContact O-CB 3.24Å; K154-L158 WeakPolarHBondContact O-CB 3.5Å; K154-L158 PolarHBondContact O-N 3.33Å; L155-L158 PolarHBondContact O-N 3.46Å; A156-L158 VanDerWaalsContact C-N 3.35Å; A156-L158 PolarHBondContact O-N 3.33Å; L158-F160 VanDerWaalsContact C-N 3.34Å; L158-F160 PolarHBondContact O-N 3.18Å; L158-S161 PolarHBondContact O-N 3.17Å; L158-S161 VanDerWaalsContact O-N 3.17Å; L158-L162 HydrophobicContact CD1-CD1 3.94Å; L158-L162 HydrophobicContact CD1-CD2 4.18Å; L158-L162 HydrophobicContact CD1-CG 3.85Å; L158-L162 HydrophobicContact CD2-CD1 4.41Å; L158-L162 HydrophobicContact CG-CD1 3.81Å; L158-L162 HydrophobicContact CG-CG 4.13Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 VanDerWaalsContact O-CG 3.26Å; L158-L162 WeakPolarHBondContact O-CG 3.38Å; L158-L162 PolarHBondContact O-N 2.95Å; L158-H184 VanDerWaalsContact CD2-CE1 3.5Å; L158-H184 WeakPolarHBondContact CD2-CE1 3.39Å; L158-H184 WeakPolarHBondContact CD2-ND1 3.22Å; L158-L185 HydrophobicContact CD2-CD2 4.27Å; L158-L185 HydrophobicContact CG-CD2 4.41Å |
| 159 | H | 95.8 | Very high | 93.8 | Very high | 94 Ų | 94 | 85.1 Ų | 85.1 | 44% | 0.435 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -55.8 | -48.3 | 177.3 | -178.3 | -76.7 | 0 | 0 | 0 | 111.5 | L155 A156 R157 S161 L162 D163 L185 | L155-H159 PolarHBondContact O-N 3.41Å; A156-H159 PolarHBondContact O-N 3.47Å; R157-H159 VanDerWaalsContact C-N 3.35Å; R157-H159 PolarHBondContact O-N 3.47Å; H159-S161 PolarHBondContact O-N 3.28Å; H159-L162 PolarHBondContact O-N 2.95Å; H159-D163 VanDerWaalsContact O-CB 3.29Å; H159-D163 WeakPolarHBondContact O-CB 3.25Å; H159-D163 PolarHBondContact O-N 3.48Å; H159-L185 HydrophobicContact CB-CD2 4.33Å |
| 160 | F | 95.4 | Very high | 93.2 | Very high | 145 Ų | 145 | 81.7 Ų | 81.7 | 64% | 0.636 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -62.8 | -40.9 | 176.6 | -68 | -59.3 | 0 | 0 | 0 | 112.9 | A156 R157 L158 S164 | A156-F160 WeakPolarHBondContact O-CD2 3.24Å; A156-F160 PolarHBondContact O-N 3.07Å; R157-F160 PolarHBondContact O-N 3.2Å; L158-F160 VanDerWaalsContact C-N 3.34Å; L158-F160 PolarHBondContact O-N 3.18Å; F160-S164 WeakPolarHBondContact O-CB 3.29Å; F160-S164 PolarHBondContact O-N 3.14Å |
| 161 | S | 94.6 | Very high | 92.5 | Very high | 77 Ų | 77 | 83.5 Ų | 83.5 | 54% | 0.538 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 177.3 | -63.1 | 0 | 0 | 0 | 0 | 112.4 | R157 L158 H159 H165 | R157-S161 PolarHBondContact O-N 3.3Å; R157-S161 PolarHBondContact O-OG 3.03Å; R157-S161 VanDerWaalsContact O-OG 3.14Å; L158-S161 PolarHBondContact O-N 3.17Å; L158-S161 VanDerWaalsContact O-N 3.17Å; H159-S161 PolarHBondContact O-N 3.28Å; S161-H165 PolarHBondContact O-N 3.31Å; S161-H165 VanDerWaalsContact O-N 3.08Å |
| 162 | L | 93.4 | Very high | 91.9 | Very high | 28 Ų | 28 | 90.2 Ų | 90.2 | 15% | 0.147 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -68 | -41.8 | 179.1 | -66.6 | 178.7 | 0 | 0 | 0 | 111.2 | L158 H159 H165 V166 N181 L185 | L158-L162 HydrophobicContact CD1-CD1 3.94Å; L158-L162 HydrophobicContact CD1-CD2 4.18Å; L158-L162 HydrophobicContact CD1-CG 3.85Å; L158-L162 HydrophobicContact CD2-CD1 4.41Å; L158-L162 HydrophobicContact CG-CD1 3.81Å; L158-L162 HydrophobicContact CG-CG 4.13Å; L158-L162 WeakPolarHBondContact O-CB 3.35Å; L158-L162 VanDerWaalsContact O-CG 3.26Å; L158-L162 WeakPolarHBondContact O-CG 3.38Å; L158-L162 PolarHBondContact O-N 2.95Å; H159-L162 PolarHBondContact O-N 2.95Å; L162-H165 PolarHBondContact O-N 3.32Å; L162-V166 WeakPolarHBondContact O-CG2 3.26Å; L162-V166 PolarHBondContact O-N 3.38Å; L162-N181 HydrophobicContact CB-CB 4.4Å; L162-N181 HydrophobicContact CD1-CB 4.03Å; L162-L185 HydrophobicContact CD1-CD1 4.39Å; L162-L185 HydrophobicContact CD1-CD2 4.22Å; L162-L185 HydrophobicContact CD1-CG 3.97Å |
| 163 | D | 90.3 | Very high | 91.5 | Very high | 89 Ų | 89 | 91.7 Ų | 91.7 | 48% | 0.476 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 175.8 | -163.6 | 61.9 | 0 | 0 | 0 | 111.1 | H159 H165 V166 E167 | H159-D163 VanDerWaalsContact O-CB 3.29Å; H159-D163 WeakPolarHBondContact O-CB 3.25Å; H159-D163 PolarHBondContact O-N 3.48Å; D163-H165 VanDerWaalsContact C-N 3.29Å; D163-H165 PolarHBondContact O-N 3.39Å; D163-V166 PolarHBondContact O-N 2.83Å; D163-E167 PolarHBondContact O-N 2.86Å; D163-E167 VanDerWaalsContact O-N 3.14Å |
| 164 | S | 90.1 | Very high | 91.2 | Very high | 82 Ų | 82 | 92.1 Ų | 92.1 | 57% | 0.573 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -57.9 | -38.8 | 174.2 | -175.7 | 0 | 0 | 0 | 0 | 112.8 | F160 | F160-S164 WeakPolarHBondContact O-CB 3.29Å; F160-S164 PolarHBondContact O-N 3.14Å |
| 165 | H | 86.6 | Confident | 90.8 | Very high | 95 Ų | 95 | 93.8 Ų | 93.8 | 44% | 0.44 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -73.3 | -34.2 | 179 | -175 | -90.3 | 0 | 0 | 0 | 112.2 | S161 L162 D163 E167 E168 L169 | S161-H165 PolarHBondContact O-N 3.31Å; S161-H165 VanDerWaalsContact O-N 3.08Å; L162-H165 PolarHBondContact O-N 3.32Å; D163-H165 VanDerWaalsContact C-N 3.29Å; D163-H165 PolarHBondContact O-N 3.39Å; H165-E167 VanDerWaalsContact C-N 3.35Å; H165-E168 PolarHBondContact O-N 3.05Å; H165-L169 WeakPolarHBondContact O-CG 3.41Å; H165-L169 PolarHBondContact O-N 3.02Å |
| 166 | V | 88.4 | Confident | 90.4 | Very high | 24 Ų | 24 | 97 Ų | 97 | 15% | 0.145 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 111.5 | L162 D163 E168 L169 R174 N181 | L162-V166 WeakPolarHBondContact O-CG2 3.26Å; L162-V166 PolarHBondContact O-N 3.38Å; D163-V166 PolarHBondContact O-N 2.83Å; V166-E168 PolarHBondContact O-N 3.25Å; V166-L169 PolarHBondContact O-N 3.08Å; V166-R174 HydrophobicContact CG1-CG 4.24Å; V166-N181 WeakPolarHBondContact CG2-ND2 3.47Å |
| 167 | E | 85 | Confident | 90.1 | Very high | 146 Ų | 146 | 95.7 Ų | 95.7 | 68% | 0.682 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.9 | -26.4 | 177.6 | -71.1 | -64 | 100.3 | 0 | 0 | 112.9 | D163 H165 | D163-E167 PolarHBondContact O-N 2.86Å; D163-E167 VanDerWaalsContact O-N 3.14Å; H165-E167 VanDerWaalsContact C-N 3.35Å |
| 168 | E | 86.8 | Confident | 89.9 | Confident | 167 Ų | 167 | 91.5 Ų | 91.5 | 78% | 0.78 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -85.2 | -17.9 | 179.1 | -164.7 | 167.2 | -132.5 | 0 | 0 | 113.2 | H165 V166 | H165-E168 PolarHBondContact O-N 3.05Å; V166-E168 PolarHBondContact O-N 3.25Å |
| 169 | L | 88.1 | Confident | 89.7 | Confident | 43 Ų | 43 | 94.1 Ų | 94.1 | 23% | 0.225 | 49% | 0.488 | C | S | . | . | S | Bend | trans | -82 | 147.1 | -178 | -72.8 | 178.2 | 0 | 0 | 0 | 113.7 | H165 V166 R174 A177 | H165-L169 WeakPolarHBondContact O-CG 3.41Å; H165-L169 PolarHBondContact O-N 3.02Å; V166-L169 PolarHBondContact O-N 3.08Å; L169-R174 HydrophobicContact CB-CG 4.11Å; L169-A177 HydrophobicContact CD1-CB 3.38Å |
| 170 | S | 85.3 | Confident | 89.6 | Confident | 64 Ų | 64 | 95.9 Ų | 95.9 | 45% | 0.448 | 50% | 0.496 | S | S | . | . | trans | -63 | 151.3 | 170.9 | 67 | 0 | 0 | 0 | 0 | 111.8 | D172 K173 R174 | S170-D172 VanDerWaalsContact C-N 3.28Å; S170-D172 PolarHBondContact O-N 3.39Å; S170-D172 VanDerWaalsContact O-N 3.14Å; S170-K173 PolarHBondContact O-N 3Å; S170-R174 PolarHBondContact O-N 3.37Å | ||
| 171 | E | 83.3 | Confident | 89.5 | Confident | 144 Ų | 144 | 89.9 Ų | 89.9 | 67% | 0.673 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -54.6 | -41.2 | -171.8 | -43 | -151.7 | 116.6 | 0 | 0 | 113.6 | K173 R174 | E171-K173 PolarHBondContact O-N 3.17Å; E171-R174 VanDerWaalsContact CA-CZ 3.48Å; E171-R174 VanDerWaalsContact CB-NH2 3.29Å; E171-R174 PolarHBondContact O-N 2.9Å; E171-R174 IonicContact OE1-CZ 3.21Å; E171-R174 IonicContact OE1-NH1 3.85Å; E171-R174 IonicContact OE1-NH2 2.6Å; E171-R174 PolarHBondContact OE1-NH2 3.23Å |
| 172 | D | 85.9 | Confident | 89.6 | Confident | 157 Ų | 157 | 91 Ų | 91 | 84% | 0.84 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.6 | -25.3 | -179.5 | -62.6 | -51.1 | 0 | 0 | 0 | 113.9 | S170 | S170-D172 VanDerWaalsContact C-N 3.28Å; S170-D172 PolarHBondContact O-N 3.39Å; S170-D172 VanDerWaalsContact O-N 3.14Å |
| 173 | K | 89.3 | Confident | 89.7 | Confident | 132 Ų | 132 | 95.5 Ų | 95.5 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -95 | -19.2 | -178.6 | -66.9 | -176 | 179.7 | -176 | 0 | 112.9 | S170 E171 K175 C176 A177 | S170-K173 PolarHBondContact O-N 3Å; E171-K173 PolarHBondContact O-N 3.17Å; K173-K175 VanDerWaalsContact C-N 3.28Å; K173-K175 PolarHBondContact O-N 2.95Å; K173-C176 PolarHBondContact O-N 2.92Å; K173-A177 PolarHBondContact O-N 3.44Å |
| 174 | R | 90.3 | Very high | 90 | Very high | 82 Ų | 82 | 95 Ų | 95 | 31% | 0.309 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.6 | -36.4 | -176.9 | -73.9 | -166.6 | -63.6 | -116.7 | 8.7 | 112.8 | V166 L169 S170 E171 S178 | V166-R174 HydrophobicContact CG1-CG 4.24Å; L169-R174 HydrophobicContact CB-CG 4.11Å; S170-R174 PolarHBondContact O-N 3.37Å; E171-R174 VanDerWaalsContact CA-CZ 3.48Å; E171-R174 VanDerWaalsContact CB-NH2 3.29Å; E171-R174 PolarHBondContact O-N 2.9Å; E171-R174 IonicContact OE1-CZ 3.21Å; E171-R174 IonicContact OE1-NH1 3.85Å; E171-R174 IonicContact OE1-NH2 2.6Å; E171-R174 PolarHBondContact OE1-NH2 3.23Å; R174-S178 WeakPolarHBondContact O-CB 3.5Å; R174-S178 PolarHBondContact O-N 3.46Å |
| 175 | K | 88.8 | Confident | 90.3 | Very high | 146 Ų | 146 | 92.9 Ų | 92.9 | 64% | 0.635 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.2 | -51.2 | 179.2 | -171 | -175.1 | 178.4 | -59.8 | 0 | 111.8 | K173 A177 S178 D179 | K173-K175 VanDerWaalsContact C-N 3.28Å; K173-K175 PolarHBondContact O-N 2.95Å; K175-A177 VanDerWaalsContact C-N 3.35Å; K175-A177 PolarHBondContact O-N 3.45Å; K175-S178 PolarHBondContact O-N 3.02Å; K175-D179 IonicContact NZ-OD2 2.78Å; K175-D179 PolarHBondContact NZ-OD2 3.4Å; K175-D179 VanDerWaalsContact O-CG 3.26Å; K175-D179 PolarHBondContact O-N 3.21Å |
| 176 | C | 89.7 | Confident | 90.8 | Very high | 98 Ų | 98 | 92.5 Ų | 92.5 | 66% | 0.662 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.2 | -42.1 | 179.8 | -174.6 | 0 | 0 | 0 | 0 | 111.6 | K173 D179 H180 | K173-C176 PolarHBondContact O-N 2.92Å; C176-D179 PolarHBondContact O-N 3.39Å; C176-H180 PolarHBondContact O-N 3.34Å; C176-H180 VanDerWaalsContact O-N 3.15Å |
| 177 | A | 91.9 | Very high | 91.2 | Very high | 19 Ų | 19 | 94.8 Ų | 94.8 | 16% | 0.157 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L169 K173 K175 D179 H180 N181 | L169-A177 HydrophobicContact CD1-CB 3.38Å; K173-A177 PolarHBondContact O-N 3.44Å; K175-A177 VanDerWaalsContact C-N 3.35Å; K175-A177 PolarHBondContact O-N 3.45Å; A177-D179 VanDerWaalsContact C-N 3.34Å; A177-D179 PolarHBondContact O-N 3.15Å; A177-H180 PolarHBondContact O-N 3.24Å; A177-N181 WeakPolarHBondContact O-CB 3.47Å; A177-N181 PolarHBondContact O-N 3.33Å; A177-N181 PolarHBondContact O-OD1 3.08Å |
| 178 | S | 91.4 | Very high | 91.8 | Very high | 61 Ų | 61 | 88.4 Ų | 88.4 | 43% | 0.427 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 177.8 | -175 | 0 | 0 | 0 | 0 | 112.2 | R174 K175 N181 L182 | R174-S178 WeakPolarHBondContact O-CB 3.5Å; R174-S178 PolarHBondContact O-N 3.46Å; K175-S178 PolarHBondContact O-N 3.02Å; S178-N181 PolarHBondContact O-N 3.18Å; S178-L182 WeakPolarHBondContact O-CB 3.42Å; S178-L182 PolarHBondContact O-N 2.81Å |
| 179 | D | 92.8 | Very high | 92.3 | Very high | 84 Ų | 84 | 85 Ų | 85 | 45% | 0.449 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.6 | -44 | 177.4 | -68.6 | -18.2 | 0 | 0 | 0 | 110 | K175 C176 A177 L182 E183 | K175-D179 IonicContact NZ-OD2 2.78Å; K175-D179 PolarHBondContact NZ-OD2 3.4Å; K175-D179 VanDerWaalsContact O-CG 3.26Å; K175-D179 PolarHBondContact O-N 3.21Å; C176-D179 PolarHBondContact O-N 3.39Å; A177-D179 VanDerWaalsContact C-N 3.34Å; A177-D179 PolarHBondContact O-N 3.15Å; D179-L182 PolarHBondContact O-N 2.89Å; D179-E183 PolarHBondContact O-N 3.1Å |
| 180 | H | 93.7 | Very high | 92.7 | Very high | 131 Ų | 131 | 89.5 Ų | 89.5 | 61% | 0.606 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -66.9 | -38.3 | 175.2 | -172.4 | 60.5 | 0 | 0 | 0 | 113.2 | C176 A177 E183 H184 | C176-H180 PolarHBondContact O-N 3.34Å; C176-H180 VanDerWaalsContact O-N 3.15Å; A177-H180 PolarHBondContact O-N 3.24Å; H180-E183 WeakPolarHBondContact O-CB 3.37Å; H180-E183 PolarHBondContact O-N 3.41Å; H180-H184 PolarHBondContact O-N 3.34Å |
| 181 | N | 94.9 | Very high | 93.3 | Very high | 19 Ų | 19 | 91.3 Ų | 91.3 | 10% | 0.102 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 178 | -70.1 | -2.4 | 0 | 0 | 0 | 111.4 | L162 V166 A177 S178 H184 L185 | L162-N181 HydrophobicContact CB-CB 4.4Å; L162-N181 HydrophobicContact CD1-CB 4.03Å; V166-N181 WeakPolarHBondContact CG2-ND2 3.47Å; A177-N181 WeakPolarHBondContact O-CB 3.47Å; A177-N181 PolarHBondContact O-N 3.33Å; A177-N181 PolarHBondContact O-OD1 3.08Å; S178-N181 PolarHBondContact O-N 3.18Å; N181-H184 PolarHBondContact O-N 3.03Å; N181-L185 WeakPolarHBondContact O-CG 3.48Å; N181-L185 PolarHBondContact O-N 3.34Å |
| 182 | L | 95.2 | Very high | 94 | Very high | 99 Ų | 99 | 85.3 Ų | 85.3 | 52% | 0.518 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 177 | -179.9 | 60.7 | 0 | 0 | 0 | 110.8 | S178 D179 H184 L185 L186 | S178-L182 WeakPolarHBondContact O-CB 3.42Å; S178-L182 PolarHBondContact O-N 2.81Å; D179-L182 PolarHBondContact O-N 2.89Å; L182-H184 VanDerWaalsContact C-N 3.31Å; L182-H184 PolarHBondContact O-N 3.1Å; L182-L185 PolarHBondContact O-N 3.25Å; L182-L186 HydrophobicContact CD1-CD1 4.15Å; L182-L186 HydrophobicContact CD1-CG 4.09Å; L182-L186 HydrophobicContact CG-CD1 3.9Å; L182-L186 HydrophobicContact CG-CG 4.29Å; L182-L186 WeakPolarHBondContact O-CB 3.44Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.43Å; L182-L186 PolarHBondContact O-N 2.72Å |
| 183 | E | 96.3 | Very high | 94.5 | Very high | 123 Ų | 123 | 80.2 Ų | 80.2 | 58% | 0.575 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -56.9 | -46.2 | 176.2 | -169.2 | 64.4 | -134.8 | 0 | 0 | 111.3 | D179 H180 L185 L186 C187 | D179-E183 PolarHBondContact O-N 3.1Å; H180-E183 WeakPolarHBondContact O-CB 3.37Å; H180-E183 PolarHBondContact O-N 3.41Å; E183-L185 PolarHBondContact O-N 3.5Å; E183-L186 PolarHBondContact O-N 2.86Å; E183-C187 WeakPolarHBondContact O-CB 3.45Å; E183-C187 PolarHBondContact O-N 3.24Å |
| 184 | H | 95.7 | Very high | 94.8 | Very high | 78 Ų | 78 | 76.2 Ų | 76.2 | 36% | 0.361 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.6 | -37.9 | -179.8 | -166.8 | -130 | 0 | 0 | 0 | 112.6 | L158 H180 N181 L182 N188 | L158-H184 VanDerWaalsContact CD2-CE1 3.5Å; L158-H184 WeakPolarHBondContact CD2-CE1 3.39Å; L158-H184 WeakPolarHBondContact CD2-ND1 3.22Å; H180-H184 PolarHBondContact O-N 3.34Å; N181-H184 PolarHBondContact O-N 3.03Å; L182-H184 VanDerWaalsContact C-N 3.31Å; L182-H184 PolarHBondContact O-N 3.1Å; H184-N188 PolarHBondContact O-N 3.27Å; H184-N188 PolarHBondContact O-ND2 2.95Å |
| 185 | L | 96.6 | Very high | 95 | Very high | 38 Ų | 38 | 73.3 Ų | 73.3 | 20% | 0.199 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.5 | -44.5 | 174.1 | -73 | 170.1 | 0 | 0 | 0 | 111.8 | L155 L158 H159 L162 N181 L182 E183 C187 N188 L189 | L155-L185 HydrophobicContact CD1-CD2 3.68Å; L158-L185 HydrophobicContact CD2-CD2 4.27Å; L158-L185 HydrophobicContact CG-CD2 4.41Å; H159-L185 HydrophobicContact CB-CD2 4.33Å; L162-L185 HydrophobicContact CD1-CD1 4.39Å; L162-L185 HydrophobicContact CD1-CD2 4.22Å; L162-L185 HydrophobicContact CD1-CG 3.97Å; N181-L185 WeakPolarHBondContact O-CG 3.48Å; N181-L185 PolarHBondContact O-N 3.34Å; L182-L185 PolarHBondContact O-N 3.25Å; E183-L185 PolarHBondContact O-N 3.5Å; L185-C187 VanDerWaalsContact C-N 3.34Å; L185-C187 PolarHBondContact O-N 3.39Å; L185-N188 PolarHBondContact O-N 2.97Å; L185-L189 VanDerWaalsContact O-CB 3.26Å; L185-L189 WeakPolarHBondContact O-CB 3.36Å; L185-L189 PolarHBondContact O-N 3.43Å |
| 186 | L | 97.1 | Very high | 95.2 | Very high | 88 Ų | 88 | 68.9 Ų | 68.9 | 46% | 0.461 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.1 | -43.2 | 178.2 | -72.4 | 173.1 | 0 | 0 | 0 | 111.2 | L182 E183 L189 E190 | L182-L186 HydrophobicContact CD1-CD1 4.15Å; L182-L186 HydrophobicContact CD1-CG 4.09Å; L182-L186 HydrophobicContact CG-CD1 3.9Å; L182-L186 HydrophobicContact CG-CG 4.29Å; L182-L186 WeakPolarHBondContact O-CB 3.44Å; L182-L186 VanDerWaalsContact O-CG 3.28Å; L182-L186 WeakPolarHBondContact O-CG 3.43Å; L182-L186 PolarHBondContact O-N 2.72Å; E183-L186 PolarHBondContact O-N 2.86Å; L186-L189 PolarHBondContact O-N 2.85Å; L186-E190 WeakPolarHBondContact O-CB 3.33Å; L186-E190 PolarHBondContact O-N 3.02Å |
| 187 | C | 97.3 | Very high | 95.2 | Very high | 71 Ų | 71 | 69.5 Ų | 69.5 | 48% | 0.48 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59 | -49.9 | 176.6 | -172.7 | 0 | 0 | 0 | 0 | 112.3 | E183 L185 L189 E190 E191 | E183-C187 WeakPolarHBondContact O-CB 3.45Å; E183-C187 PolarHBondContact O-N 3.24Å; L185-C187 VanDerWaalsContact C-N 3.34Å; L185-C187 PolarHBondContact O-N 3.39Å; C187-L189 VanDerWaalsContact C-N 3.3Å; C187-L189 PolarHBondContact O-N 3.19Å; C187-E190 PolarHBondContact O-N 3.36Å; C187-E191 PolarHBondContact O-N 3.03Å; C187-E191 VanDerWaalsContact O-N 3.09Å |
| 188 | N | 97.4 | Very high | 95.1 | Very high | 13 Ų | 13 | 75.5 Ų | 75.5 | 7% | 0.07 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -66.2 | -33.1 | 178 | -78.3 | -98.5 | 0 | 0 | 0 | 111.8 | K154 L155 H184 L185 L192 | K154-N188 PolarHBondContact NZ-OD1 3.31Å; K154-N188 VanDerWaalsContact NZ-OD1 3.1Å; L155-N188 HydrophobicContact CD1-CB 3.94Å; H184-N188 PolarHBondContact O-N 3.27Å; H184-N188 PolarHBondContact O-ND2 2.95Å; L185-N188 PolarHBondContact O-N 2.97Å; N188-L192 WeakPolarHBondContact O-CB 3.45Å; N188-L192 PolarHBondContact O-N 3.31Å |
| 189 | L | 97.7 | Very high | 94.8 | Very high | 96 Ų | 96 | 73.4 Ų | 73.4 | 50% | 0.503 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -71.1 | -37.9 | 178.1 | -168.7 | 122.9 | 0 | 0 | 0 | 112 | L155 L185 L186 C187 L192 S193 | L155-L189 HydrophobicContact CD2-CD1 4.07Å; L185-L189 VanDerWaalsContact O-CB 3.26Å; L185-L189 WeakPolarHBondContact O-CB 3.36Å; L185-L189 PolarHBondContact O-N 3.43Å; L186-L189 PolarHBondContact O-N 2.85Å; C187-L189 VanDerWaalsContact C-N 3.3Å; C187-L189 PolarHBondContact O-N 3.19Å; L189-L192 PolarHBondContact O-N 3.42Å; L189-S193 WeakPolarHBondContact O-CB 3.44Å; L189-S193 PolarHBondContact O-N 2.86Å |
| 190 | E | 97.4 | Very high | 94 | Very high | 136 Ų | 136 | 74.6 Ų | 74.6 | 64% | 0.636 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64.7 | -41.7 | 173.7 | -175.7 | 174.2 | -159.9 | 0 | 0 | 111.7 | L186 C187 S193 S194 | L186-E190 WeakPolarHBondContact O-CB 3.33Å; L186-E190 PolarHBondContact O-N 3.02Å; C187-E190 PolarHBondContact O-N 3.36Å; E190-S193 PolarHBondContact O-N 2.89Å; E190-S194 WeakPolarHBondContact O-CB 3.47Å; E190-S194 PolarHBondContact O-N 2.86Å; E190-S194 PolarHBondContact O-OG 3.4Å |
| 191 | E | 96.8 | Very high | 93.3 | Very high | 102 Ų | 102 | 74 Ų | 74 | 48% | 0.477 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.1 | -46.6 | 174.9 | -166.7 | -171.3 | -172.5 | 0 | 0 | 111.2 | M151 C187 S194 S195 | M151-E191 HydrophobicContact CE-CB 3.72Å; M151-E191 HydrophobicContact CE-CG 3.52Å; M151-E191 WeakPolarHBondContact CE-OE2 3.36Å; C187-E191 PolarHBondContact O-N 3.03Å; C187-E191 VanDerWaalsContact O-N 3.09Å; E191-S194 WeakPolarHBondContact O-CB 3.14Å; E191-S194 PolarHBondContact O-N 3.24Å; E191-S195 PolarHBondContact O-N 2.94Å |
| 192 | L | 97 | Very high | 91.8 | Very high | 18 Ų | 18 | 74 Ų | 74 | 9% | 0.094 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.9 | -46.4 | 176.1 | 172.3 | 61.1 | 0 | 0 | 0 | 111.6 | V148 M151 Q152 N188 L189 S194 S195 I196 | V148-L192 HydrophobicContact CG1-CD1 3.92Å; M151-L192 HydrophobicContact CB-CD1 3.83Å; M151-L192 HydrophobicContact CE-CB 4.07Å; M151-L192 HydrophobicContact SD-CB 4.46Å; M151-L192 HydrophobicContact SD-CD1 4.4Å; Q152-L192 HydrophobicContact CG-CD1 4.11Å; Q152-L192 HydrophobicContact CG-CD2 3.76Å; N188-L192 WeakPolarHBondContact O-CB 3.45Å; N188-L192 PolarHBondContact O-N 3.31Å; L189-L192 PolarHBondContact O-N 3.42Å; L192-S194 VanDerWaalsContact C-N 3.28Å; L192-S194 PolarHBondContact O-N 3.09Å; L192-S195 WeakPolarHBondContact O-CB 3.35Å; L192-S195 PolarHBondContact O-N 3.49Å; L192-S195 VanDerWaalsContact O-N 3.17Å; L192-I196 HydrophobicContact CD1-CD1 3.92Å; L192-I196 HydrophobicContact CD1-CG1 4.25Å; L192-I196 HydrophobicContact CG-CD1 4.04Å; L192-I196 WeakPolarHBondContact O-CG1 3.28Å; L192-I196 PolarHBondContact O-N 2.92Å |
| 193 | S | 96.8 | Very high | 90.2 | Very high | 50 Ų | 50 | 75.7 Ų | 75.7 | 35% | 0.35 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -57.2 | -44.1 | 175.9 | 175.6 | 0 | 0 | 0 | 0 | 111.2 | L189 E190 S195 I196 Q197 | L189-S193 WeakPolarHBondContact O-CB 3.44Å; L189-S193 PolarHBondContact O-N 2.86Å; E190-S193 PolarHBondContact O-N 2.89Å; S193-S195 VanDerWaalsContact C-N 3.34Å; S193-S195 PolarHBondContact O-N 3.35Å; S193-I196 PolarHBondContact O-N 3.14Å; S193-Q197 WeakPolarHBondContact O-CG 3.35Å; S193-Q197 PolarHBondContact O-N 3.31Å |
| 194 | S | 95.6 | Very high | 88.4 | Confident | 48 Ų | 48 | 75.2 Ų | 75.2 | 34% | 0.336 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.1 | -39.5 | 177.2 | -60.6 | 0 | 0 | 0 | 0 | 112.3 | E190 E191 L192 Q197 K198 | E190-S194 WeakPolarHBondContact O-CB 3.47Å; E190-S194 PolarHBondContact O-N 2.86Å; E190-S194 PolarHBondContact O-OG 3.4Å; E191-S194 WeakPolarHBondContact O-CB 3.14Å; E191-S194 PolarHBondContact O-N 3.24Å; L192-S194 VanDerWaalsContact C-N 3.28Å; L192-S194 PolarHBondContact O-N 3.09Å; S194-Q197 PolarHBondContact O-N 3.27Å; S194-K198 WeakPolarHBondContact O-CG 3.26Å; S194-K198 PolarHBondContact O-N 3.49Å |
| 195 | S | 94.2 | Very high | 86.6 | Confident | 22 Ų | 22 | 79.4 Ų | 79.4 | 15% | 0.154 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -63.8 | -43.9 | 176.3 | -165.8 | 0 | 0 | 0 | 0 | 112 | E191 L192 S193 K198 L199 | E191-S195 PolarHBondContact O-N 2.94Å; L192-S195 WeakPolarHBondContact O-CB 3.35Å; L192-S195 PolarHBondContact O-N 3.49Å; L192-S195 VanDerWaalsContact O-N 3.17Å; S193-S195 VanDerWaalsContact C-N 3.34Å; S193-S195 PolarHBondContact O-N 3.35Å; S195-K198 WeakPolarHBondContact O-CB 3.36Å; S195-K198 PolarHBondContact O-N 3.26Å; S195-L199 PolarHBondContact O-N 2.96Å |
| 196 | I | 93.1 | Very high | 84.4 | Confident | 52 Ų | 52 | 83.4 Ų | 83.4 | 27% | 0.267 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.1 | -41.9 | 176.4 | -65.2 | 167 | 0 | 0 | 0 | 111.2 | V148 L192 S193 K198 L199 H200 | V148-I196 HydrophobicContact CG1-CD1 4.22Å; V148-I196 HydrophobicContact CG1-CG1 3.9Å; V148-I196 HydrophobicContact CG2-CG1 4.16Å; L192-I196 HydrophobicContact CD1-CD1 3.92Å; L192-I196 HydrophobicContact CD1-CG1 4.25Å; L192-I196 HydrophobicContact CG-CD1 4.04Å; L192-I196 WeakPolarHBondContact O-CG1 3.28Å; L192-I196 PolarHBondContact O-N 2.92Å; S193-I196 PolarHBondContact O-N 3.14Å; I196-K198 VanDerWaalsContact C-N 3.3Å; I196-K198 PolarHBondContact O-N 2.98Å; I196-L199 WeakPolarHBondContact O-CB 3.43Å; I196-L199 PolarHBondContact O-N 3.31Å; I196-L199 VanDerWaalsContact O-N 3.15Å; I196-H200 PolarHBondContact O-N 3.34Å |
| 197 | Q | 91.3 | Very high | 82.1 | Confident | 111 Ų | 111 | 85.9 Ų | 85.9 | 52% | 0.519 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.2 | -38.7 | 176.4 | -74.9 | 178.3 | 13.4 | 0 | 0 | 112.1 | S193 S194 L199 H200 L201 | S193-Q197 WeakPolarHBondContact O-CG 3.35Å; S193-Q197 PolarHBondContact O-N 3.31Å; S194-Q197 PolarHBondContact O-N 3.27Å; Q197-L199 VanDerWaalsContact C-N 3.28Å; Q197-L199 PolarHBondContact O-N 2.8Å; Q197-H200 PolarHBondContact O-N 3.07Å; Q197-L201 WeakPolarHBondContact O-CG 3.35Å; Q197-L201 PolarHBondContact O-N 3.28Å |
| 198 | K | 88.8 | Confident | 79.8 | Confident | 146 Ų | 146 | 87.5 Ų | 87.5 | 64% | 0.635 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59.6 | -38.3 | 174.3 | -76.2 | 172.3 | -176.2 | 175.5 | 0 | 112 | S194 S195 I196 L201 A202 | S194-K198 WeakPolarHBondContact O-CG 3.26Å; S194-K198 PolarHBondContact O-N 3.49Å; S195-K198 WeakPolarHBondContact O-CB 3.36Å; S195-K198 PolarHBondContact O-N 3.26Å; I196-K198 VanDerWaalsContact C-N 3.3Å; I196-K198 PolarHBondContact O-N 2.98Å; K198-L201 PolarHBondContact O-N 3.45Å; K198-A202 WeakPolarHBondContact O-CB 3.37Å; K198-A202 PolarHBondContact O-N 3.44Å; K198-A202 VanDerWaalsContact O-N 3.1Å |
| 199 | L | 85.8 | Confident | 77.4 | Confident | 17 Ų | 17 | 96.4 Ų | 96.4 | 9% | 0.089 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 174.5 | -71.9 | 176.2 | 0 | 0 | 0 | 112.3 | C140 Q144 L145 V148 S195 I196 Q197 A202 E203 | C140-L199 HydrophobicContact CB-CD2 4.48Å; Q144-L199 HydrophobicContact CB-CD2 3.47Å; Q144-L199 VanDerWaalsContact CB-CD2 3.47Å; Q144-L199 HydrophobicContact CG-CD2 4.14Å; L145-L199 HydrophobicContact CD2-CD1 3.97Å; V148-L199 HydrophobicContact CG2-CD1 3.79Å; S195-L199 PolarHBondContact O-N 2.96Å; I196-L199 WeakPolarHBondContact O-CB 3.43Å; I196-L199 PolarHBondContact O-N 3.31Å; I196-L199 VanDerWaalsContact O-N 3.15Å; Q197-L199 VanDerWaalsContact C-N 3.28Å; Q197-L199 PolarHBondContact O-N 2.8Å; L199-A202 PolarHBondContact O-N 3.31Å; L199-E203 PolarHBondContact O-N 3.47Å |
| 200 | H | 76.1 | Confident | 75 | Confident | 108 Ų | 108 | 98 Ų | 98 | 50% | 0.5 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.6 | -35.3 | 178.5 | -62.7 | 174.3 | 0 | 0 | 0 | 112.8 | I196 Q197 N204 | I196-H200 PolarHBondContact O-N 3.34Å; Q197-H200 PolarHBondContact O-N 3.07Å; H200-N204 PolarHBondContact O-ND2 3.15Å |
| 201 | L | 77.5 | Confident | 72.6 | Confident | 118 Ų | 118 | 97 Ų | 97 | 62% | 0.618 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.4 | -36.5 | 178.2 | -73.8 | 162.5 | 0 | 0 | 0 | 112.3 | Q197 K198 E203 N204 Q205 | Q197-L201 WeakPolarHBondContact O-CG 3.35Å; Q197-L201 PolarHBondContact O-N 3.28Å; K198-L201 PolarHBondContact O-N 3.45Å; L201-E203 VanDerWaalsContact C-N 3.33Å; L201-N204 PolarHBondContact O-N 2.83Å; L201-Q205 WeakPolarHBondContact O-CG 3.42Å |
| 202 | A | 64.6 | Low | 70.2 | Confident | 21 Ų | 21 | 95.2 Ų | 95.2 | 17% | 0.174 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | V139 K198 L199 N204 | V139-A202 HydrophobicContact CB-CB 3.95Å; V139-A202 WeakPolarHBondContact CB-O 3.15Å; V139-A202 HydrophobicContact CG1-CB 3.78Å; V139-A202 WeakPolarHBondContact CG1-O 3.48Å; V139-A202 VanDerWaalsContact O-CB 3.25Å; V139-A202 WeakPolarHBondContact O-CB 3.46Å; K198-A202 WeakPolarHBondContact O-CB 3.37Å; K198-A202 PolarHBondContact O-N 3.44Å; K198-A202 VanDerWaalsContact O-N 3.1Å; L199-A202 PolarHBondContact O-N 3.31Å; A202-N204 VanDerWaalsContact C-N 3.26Å; A202-N204 PolarHBondContact O-N 3.27Å |
| 203 | E | 61.7 | Low | 67.8 | Low | 134 Ų | 134 | 104.2 Ų | 104.2 | 63% | 0.626 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -60.8 | -30.5 | 177 | -175.1 | 178.5 | -136 | 0 | 0 | 113.7 | L199 L201 | L199-E203 PolarHBondContact O-N 3.47Å; L201-E203 VanDerWaalsContact C-N 3.33Å |
| 204 | N | 58.4 | Low | 66.4 | Low | 112 Ų | 112 | 107 Ų | 107 | 60% | 0.599 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | -2.5 | -170.8 | -74.4 | -82.4 | 0 | 0 | 0 | 115.1 | H200 L201 A202 | H200-N204 PolarHBondContact O-ND2 3.15Å; L201-N204 PolarHBondContact O-N 2.83Å; A202-N204 VanDerWaalsContact C-N 3.26Å; A202-N204 PolarHBondContact O-N 3.27Å |
| 205 | Q | 57.5 | Low | 64.9 | Low | 166 Ų | 166 | 110.1 Ų | 110.1 | 78% | 0.776 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -89.6 | -8.1 | -176.3 | -71.1 | -96.2 | 54.9 | 0 | 0 | 114.3 | L201 | L201-Q205 WeakPolarHBondContact O-CG 3.42Š|
| 206 | D | 51.4 | Low | 63.2 | Low | 122 Ų | 122 | 114.9 Ų | 114.9 | 65% | 0.652 | 63% | 0.631 | S | S | * | * | trans | -105.8 | 25.6 | -175.4 | -113.6 | -67.8 | 0 | 0 | 0 | 113.4 | P208 | D206-P208 VanDerWaalsContact O-CD 3.24Å; D206-P208 WeakPolarHBondContact O-CD 3.49Å | ||
| 207 | L | 48.2 | Very low | 61.5 | Low | 141 Ų | 141 | 118.6 Ų | 118.6 | 74% | 0.738 | 65% | 0.652 | S | S | * | * | trans | -77.7 | 114.6 | 165.2 | -106.5 | 75.7 | 0 | 0 | 0 | 108.9 | K209 | L207-K209 PolarHBondContact O-N 3.35Å; L207-K209 VanDerWaalsContact O-N 3.08Å | ||
| 208 | P | 49.1 | Very low | 59.6 | Low | 105 Ų | 105 | 119.1 Ų | 119.1 | 68% | 0.682 | 66% | 0.661 | S | S | * | * | trans | -64.6 | 118.4 | 171.1 | 26.7 | -30.5 | 0 | 0 | 0 | 107.6 | D206 T210 | D206-P208 VanDerWaalsContact O-CD 3.24Å; D206-P208 WeakPolarHBondContact O-CD 3.49Å; P208-T210 PolarHBondContact O-N 3.21Å | ||
| 209 | K | 47.5 | Very low | 57.7 | Low | 200 Ų | 200 | 117.3 Ų | 117.3 | 87% | 0.87 | 66% | 0.662 | S | S | * | * | trans | -59.1 | 93.2 | 158.3 | -71.7 | 178.1 | -179.3 | 173 | 0 | 106.5 | L207 S211 | L207-K209 PolarHBondContact O-N 3.35Å; L207-K209 VanDerWaalsContact O-N 3.08Å; K209-S211 PolarHBondContact O-N 2.78Å | ||
| 210 | T | 47.3 | Very low | 55.7 | Low | 128 Ų | 128 | 124.5 Ų | 124.5 | 79% | 0.785 | 70% | 0.703 | S | S | * | * | trans | -70.8 | 82.8 | 162.5 | 58.7 | 0 | 0 | 0 | 0 | 106.5 | P208 G212 | P208-T210 PolarHBondContact O-N 3.21Å; T210-G212 PolarHBondContact O-N 3.48Å | ||
| 211 | S | 46.5 | Very low | 54.1 | Low | 116 Ų | 116 | 125.8 Ų | 125.8 | 81% | 0.811 | 72% | 0.719 | S | S | * | * | trans | -73.5 | 106.9 | 160.9 | 55.7 | 0 | 0 | 0 | 0 | 107.4 | K209 | K209-S211 PolarHBondContact O-N 2.78Š| ||
| 212 | G | 46.2 | Very low | 52.1 | Low | 65 Ų | 65 | 126.4 Ų | 126.4 | 67% | 0.67 | 73% | 0.727 | S | S | * | * | trans | -142 | 160.6 | 155.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | T210 | T210-G212 PolarHBondContact O-N 3.48Š| ||
| 213 | P | 47.4 | Very low | 51 | Low | 207 Ų | 207 | 136 Ų | 136 | 100% | 1.344 | 78% | 0.778 | S | S | * | * | cis | -100.2 | 0 | 0.7 | 36.9 | -27.1 | 0 | 0 | 0 | 114.1 |
Retrieved 213 of 213 residues in 44.8 ms
(Link to these results)