| 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 | 40.2 | Very low | 45.7 | Very low | 243 Ų | 243 | 161.2 Ų | 161.2 | 100% | 1.197 | 83% | 0.825 | S | S | * | * | 0 | 101 | 0 | -77.8 | 175.1 | 174.5 | 0 | 0 | 108.5 | |||||
| 2 | A | 50.8 | Low | 46.1 | Very low | 105 Ų | 105 | 161.5 Ų | 161.5 | 87% | 0.868 | 82% | 0.821 | S | S | * | * | trans | -158.7 | 97.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 3 | Y | 40.3 | Very low | 46.6 | Very low | 228 Ų | 228 | 160.9 Ų | 160.9 | 89% | 0.894 | 82% | 0.821 | S | S | * | * | trans | -98.8 | 139.7 | 169 | -76.5 | -88.9 | 0 | 0 | 0 | 108 | ||||
| 4 | R | 55.8 | Low | 46.5 | Very low | 235 Ų | 235 | 162.9 Ų | 162.9 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | trans | -148.7 | 100.6 | 155.6 | -157.4 | 177 | -165.8 | 171.5 | 4.1 | 109.4 | ||||
| 5 | E | 44.6 | Very low | 46.7 | Very low | 173 Ų | 173 | 159.7 Ų | 159.7 | 81% | 0.808 | 82% | 0.824 | S | S | * | * | trans | -72.6 | 139.8 | 157.6 | -74.9 | 179.3 | 142.5 | 0 | 0 | 109.3 | ||||
| 6 | V | 57.2 | Low | 46.9 | Very low | 133 Ų | 133 | 155.4 Ų | 155.4 | 81% | 0.806 | 81% | 0.812 | S | S | * | * | trans | -143.7 | 129.9 | 142.8 | -177.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 7 | L | 43.4 | Very low | 46.8 | Very low | 142 Ų | 142 | 151.6 Ų | 151.6 | 74% | 0.743 | 80% | 0.802 | S | S | * | * | trans | -70.8 | 156.1 | -177.9 | -85.7 | 119.7 | 0 | 0 | 0 | 115.5 | ||||
| 8 | R | 44.8 | Very low | 47.2 | Very low | 223 Ų | 223 | 150.7 Ų | 150.7 | 84% | 0.842 | 80% | 0.797 | S | S | * | * | trans | 98.5 | 119.3 | 130.1 | -108.1 | -173.9 | 168.6 | -164.4 | -3.8 | 120.7 | ||||
| 9 | S | 40.7 | Very low | 47.4 | Very low | 96 Ų | 96 | 149.9 Ų | 149.9 | 67% | 0.671 | 79% | 0.794 | S | S | * | * | 109.2 | 110.9 | 127.1 | -68.9 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 10 | S | 41.3 | Very low | 47.7 | Very low | 106 Ų | 106 | 150 Ų | 150 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | 86.4 | 114.5 | 130.5 | -155.4 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 11 | S | 43.6 | Very low | 47.7 | Very low | 89 Ų | 89 | 149.5 Ų | 149.5 | 62% | 0.622 | 79% | 0.791 | S | S | * | * | trans | 73.4 | 142.7 | 132.7 | 64.5 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 12 | E | 50.8 | Low | 48.2 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 77% | 0.771 | 77% | 0.767 | S | S | * | * | trans | 100.5 | 92.4 | 159.2 | -55.9 | 174.5 | -173 | 0 | 0 | 116.5 | ||||
| 13 | D | 52.7 | Low | 47.8 | Very low | 154 Ų | 154 | 149.4 Ų | 149.4 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | 55.1 | 95 | 127.1 | -53.6 | -34.4 | 0 | 0 | 0 | 119.6 | S15 | D13-S15 PolarHBondContact O-N 3.3Å; D13-S15 VanDerWaalsContact O-N 3.15Å | |||
| 14 | E | 45.5 | Very low | 48.4 | Very low | 188 Ų | 188 | 147.3 Ų | 147.3 | 88% | 0.879 | 77% | 0.765 | S | S | * | * | trans | -75.9 | 94 | 166 | -72.7 | -69.9 | 144.7 | 0 | 0 | 111.2 | S16 | E14-S16 PolarHBondContact O-N 3.02Š| ||
| 15 | S | 48.1 | Very low | 48.4 | Very low | 115 Ų | 115 | 147.6 Ų | 147.6 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | trans | -82.6 | 90 | 163.8 | -167.3 | 0 | 0 | 0 | 0 | 109.8 | D13 S17 | D13-S15 PolarHBondContact O-N 3.3Å; D13-S15 VanDerWaalsContact O-N 3.15Å; S15-S17 PolarHBondContact O-N 3.02Å; S15-S17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | S | 50.4 | Low | 48.8 | Very low | 91 Ų | 91 | 150.5 Ų | 150.5 | 64% | 0.636 | 77% | 0.77 | S | S | * | * | trans | -81.6 | 89.9 | 174.6 | -172.6 | 0 | 0 | 0 | 0 | 110.9 | E14 N18 | E14-S16 PolarHBondContact O-N 3.02Å; S16-N18 PolarHBondContact O-N 3.08Å; S16-N18 PolarHBondContact OG-ND2 3.44Å | ||
| 17 | S | 45 | Very low | 48.8 | Very low | 92 Ų | 92 | 153.5 Ų | 153.5 | 64% | 0.643 | 77% | 0.772 | S | S | * | * | trans | -57.4 | 108.3 | 165.5 | 179.4 | 0 | 0 | 0 | 0 | 110.6 | S15 | S15-S17 PolarHBondContact O-N 3.02Å; S15-S17 VanDerWaalsContact O-N 3.14Å | ||
| 18 | N | 53.6 | Low | 49.6 | Very low | 134 Ų | 134 | 151.2 Ų | 151.2 | 72% | 0.717 | 77% | 0.768 | S | S | * | * | trans | -110.5 | 107.1 | 164.2 | -78 | -75.3 | 0 | 0 | 0 | 108.3 | S16 D20 | S16-N18 PolarHBondContact O-N 3.08Å; S16-N18 PolarHBondContact OG-ND2 3.44Å; N18-D20 PolarHBondContact O-N 2.95Å; N18-D20 VanDerWaalsContact O-N 3.15Å | ||
| 19 | D | 51.7 | Low | 50.1 | Low | 136 Ų | 136 | 148.1 Ų | 148.1 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -54.4 | 112.6 | 178.5 | -68.6 | -63.9 | 0 | 0 | 0 | 111.7 | I21 | D19-I21 PolarHBondContact O-N 2.87Š| ||
| 20 | D | 53.6 | Low | 50.7 | Low | 151 Ų | 151 | 150.4 Ų | 150.4 | 81% | 0.807 | 77% | 0.771 | S | S | * | * | trans | -63.5 | 101.6 | 165 | -86.1 | -44 | 0 | 0 | 0 | 109.1 | N18 C22 | N18-D20 PolarHBondContact O-N 2.95Å; N18-D20 VanDerWaalsContact O-N 3.15Å; D20-C22 PolarHBondContact O-N 3.1Å | ||
| 21 | I | 48.3 | Very low | 51.2 | Low | 141 Ų | 141 | 156.7 Ų | 156.7 | 72% | 0.723 | 78% | 0.779 | S | S | * | * | trans | -65.8 | 83.8 | 170.2 | -63.2 | 153.6 | 0 | 0 | 0 | 108.5 | D19 W23 | D19-I21 PolarHBondContact O-N 2.87Å; I21-W23 PolarHBondContact O-N 2.95Å | ||
| 22 | C | 50 | Low | 51.4 | Low | 103 Ų | 103 | 156.9 Ų | 156.9 | 70% | 0.696 | 79% | 0.786 | S | S | * | * | trans | -78.9 | 106 | 174.3 | -92.8 | 0 | 0 | 0 | 0 | 110.1 | D20 K24 | D20-C22 PolarHBondContact O-N 3.1Å; C22-K24 PolarHBondContact O-N 3.28Å | ||
| 23 | W | 42.5 | Very low | 51.3 | Low | 242 Ų | 242 | 154 Ų | 154 | 92% | 0.917 | 78% | 0.783 | S | S | * | * | trans | -68.7 | 41.4 | 174.2 | -70.5 | 88.8 | 0 | 0 | 0 | 114.9 | I21 R25 | I21-W23 PolarHBondContact O-N 2.95Å; W23-R25 PolarHBondContact O-N 3.1Å | ||
| 24 | K | 53.2 | Low | 51.3 | Low | 185 Ų | 185 | 152.3 Ų | 152.3 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -81.4 | 103.1 | 168.1 | -90.3 | -178.9 | 175.8 | 169.6 | 0 | 109.2 | C22 R26 | C22-K24 PolarHBondContact O-N 3.28Å; K24-R26 PolarHBondContact O-N 3.1Å | ||
| 25 | R | 55.7 | Low | 51.6 | Low | 240 Ų | 240 | 151.7 Ų | 151.7 | 91% | 0.906 | 78% | 0.78 | S | S | * | * | trans | -46.8 | 109.7 | 167.9 | -172 | -179.7 | -65.6 | -145.8 | -0.3 | 109.3 | W23 K27 | W23-R25 PolarHBondContact O-N 3.1Å; R25-K27 PolarHBondContact O-N 2.98Å | ||
| 26 | R | 52.7 | Low | 52 | Low | 235 Ų | 235 | 155.8 Ų | 155.8 | 89% | 0.887 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 128.2 | 167.6 | -69 | -172.3 | 86.6 | 159.9 | 4.5 | 107.2 | K24 S28 | K24-R26 PolarHBondContact O-N 3.1Å; R26-S28 PolarHBondContact O-N 3.1Å |
| 27 | K | 57.9 | Low | 51.6 | Low | 195 Ų | 195 | 160.3 Ų | 160.3 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 122.7 | 163.9 | -77.6 | 176 | 169.2 | 178.3 | 0 | 106.4 | R25 D29 | R25-K27 PolarHBondContact O-N 2.98Å; K27-D29 PolarHBondContact O-N 2.94Å |
| 28 | S | 58.5 | Low | 51.7 | Low | 94 Ų | 94 | 162.9 Ų | 162.9 | 66% | 0.657 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 117.2 | 166.8 | 41.3 | 0 | 0 | 0 | 0 | 107.9 | R26 I30 | R26-S28 PolarHBondContact O-N 3.1Å; S28-I30 PolarHBondContact O-N 3.35Å |
| 29 | D | 57.1 | Low | 51.3 | Low | 158 Ų | 158 | 166.1 Ų | 166.1 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | trans | -73.6 | 77.7 | 165.4 | -66.9 | -40.8 | 0 | 0 | 0 | 107.9 | K27 R31 | K27-D29 PolarHBondContact O-N 2.94Å; D29-R31 PolarHBondContact O-N 3.17Å; D29-R31 VanDerWaalsContact O-N 3.1Å | ||
| 30 | I | 53.1 | Low | 50.9 | Low | 144 Ų | 144 | 165.3 Ų | 165.3 | 74% | 0.738 | 82% | 0.815 | S | S | * | * | trans | -73.9 | 100.2 | 165.4 | -58.6 | 175.3 | 0 | 0 | 0 | 105.7 | S28 A32 | S28-I30 PolarHBondContact O-N 3.35Å; I30-A32 PolarHBondContact O-N 3.33Å; I30-A32 VanDerWaalsContact O-N 3.1Å | ||
| 31 | R | 50.1 | Low | 50.8 | Low | 238 Ų | 238 | 163.7 Ų | 163.7 | 90% | 0.898 | 81% | 0.81 | S | S | * | * | trans | -55.7 | 113.3 | 165.6 | -87.3 | -177.8 | 178.7 | -174.9 | -0.4 | 108 | D29 S33 | D29-R31 PolarHBondContact O-N 3.17Å; D29-R31 VanDerWaalsContact O-N 3.1Å; R31-S33 PolarHBondContact O-N 3.35Å | ||
| 32 | A | 49.5 | Very low | 50.6 | Low | 93 Ų | 93 | 165 Ų | 165 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | trans | -64 | 120.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | I30 | I30-A32 PolarHBondContact O-N 3.33Å; I30-A32 VanDerWaalsContact O-N 3.1Å | ||
| 33 | S | 47.9 | Very low | 50.8 | Low | 104 Ų | 104 | 165.9 Ų | 165.9 | 73% | 0.727 | 82% | 0.815 | S | S | * | * | trans | -64.8 | 131 | 168.1 | -173.8 | 0 | 0 | 0 | 0 | 108.9 | R31 M35 | R31-S33 PolarHBondContact O-N 3.35Å; S33-M35 PolarHBondContact O-N 3.49Å; S33-M35 VanDerWaalsContact O-N 3.1Å | ||
| 34 | P | 53.2 | Low | 50.9 | Low | 119 Ų | 119 | 160 Ų | 160 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | -73.1 | 102.7 | 173.5 | 28.3 | -28.8 | 0 | 0 | 0 | 108.9 | ||||
| 35 | M | 51.2 | Low | 50.7 | Low | 176 Ų | 176 | 160.3 Ų | 160.3 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68 | 133.6 | 161.6 | -89.6 | 180 | 70.5 | 0 | 0 | 108.7 | S33 E37 | S33-M35 PolarHBondContact O-N 3.49Å; S33-M35 VanDerWaalsContact O-N 3.1Å; M35-E37 PolarHBondContact O-N 3.4Å |
| 36 | K | 56.1 | Low | 50.7 | Low | 200 Ų | 200 | 156.2 Ų | 156.2 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 128.7 | 177.5 | -65 | 176.3 | 176.4 | 179.4 | 0 | 109.9 | ||
| 37 | E | 43.5 | Very low | 50.6 | Low | 186 Ų | 186 | 150.6 Ų | 150.6 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 123.2 | 170 | -67.2 | 178.2 | 153 | 0 | 0 | 108.9 | M35 | M35-E37 PolarHBondContact O-N 3.4Š|
| 38 | D | 46.1 | Very low | 50.6 | Low | 147 Ų | 147 | 150.6 Ų | 150.6 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | -153.6 | 147.1 | 149.7 | -81.5 | -42.4 | 0 | 0 | 0 | 105.9 | ||||
| 39 | F | 45.7 | Very low | 50.7 | Low | 201 Ų | 201 | 155.9 Ų | 155.9 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | trans | 92.3 | 83.1 | -169.9 | -60.7 | -78.7 | 0 | 0 | 0 | 115.8 | V41 | F39-V41 PolarHBondContact O-N 3.28Š| ||
| 40 | S | 43.9 | Very low | 50.9 | Low | 120 Ų | 120 | 157.8 Ų | 157.8 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -62.6 | 107.9 | 159.1 | 43.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 41 | V | 49.5 | Very low | 51.4 | Low | 117 Ų | 117 | 156.7 Ų | 156.7 | 71% | 0.709 | 80% | 0.798 | S | S | * | * | trans | -122.8 | 115.1 | 153.8 | -178.9 | 0 | 0 | 0 | 0 | 106.8 | F39 I43 | F39-V41 PolarHBondContact O-N 3.28Å; V41-I43 HydrophobicContact CG1-CG1 4.3Å; V41-I43 PolarHBondContact O-N 3.38Å | ||
| 42 | N | 44.5 | Very low | 52.1 | Low | 167 Ų | 167 | 156.3 Ų | 156.3 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | trans | -64.5 | 101.2 | 176 | -107.1 | -66.5 | 0 | 0 | 0 | 109.1 | ||||
| 43 | I | 54.2 | Low | 52.9 | Low | 123 Ų | 123 | 159 Ų | 159 | 63% | 0.631 | 80% | 0.797 | S | S | * | * | trans | -113 | 126.2 | 163.7 | -58.7 | 171.3 | 0 | 0 | 0 | 106.2 | V41 K45 | V41-I43 HydrophobicContact CG1-CG1 4.3Å; V41-I43 PolarHBondContact O-N 3.38Å; I43-K45 PolarHBondContact O-N 2.85Å | ||
| 44 | P | 46 | Very low | 54 | Low | 117 Ų | 117 | 156.3 Ų | 156.3 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -58.5 | 113.4 | 175.1 | -17.2 | 28.8 | 0 | 0 | 0 | 109.2 | E46 | P44-E46 PolarHBondContact O-N 3.48Å; P44-E46 VanDerWaalsContact O-N 3.08Å | ||
| 45 | K | 48.9 | Very low | 55 | Low | 192 Ų | 192 | 155.6 Ų | 155.6 | 84% | 0.835 | 77% | 0.772 | S | S | * | * | trans | -75.3 | 91.7 | 173.2 | -69.5 | 179.3 | -179.7 | 174.1 | 0 | 108.3 | I43 | I43-K45 PolarHBondContact O-N 2.85Š| ||
| 46 | E | 55.2 | Low | 56.3 | Low | 155 Ų | 155 | 156.1 Ų | 156.1 | 72% | 0.724 | 76% | 0.764 | S | S | * | * | trans | -64.4 | 136.4 | 158.9 | -84.1 | -160.9 | 160.6 | 0 | 0 | 109 | P44 Y48 | P44-E46 PolarHBondContact O-N 3.48Å; P44-E46 VanDerWaalsContact O-N 3.08Å; E46-Y48 PolarHBondContact O-N 2.9Å | ||
| 47 | P | 49.4 | Very low | 57.3 | Low | 117 Ų | 117 | 150 Ų | 150 | 76% | 0.76 | 74% | 0.743 | S | S | * | * | trans | -68.7 | 103.1 | 177.6 | 28 | -32.5 | 0 | 0 | 0 | 109 | K49 | P47-K49 PolarHBondContact O-N 3.15Š| ||
| 48 | Y | 58.4 | Low | 59 | Low | 195 Ų | 195 | 145.9 Ų | 145.9 | 77% | 0.765 | 73% | 0.727 | S | S | * | * | trans | -58.1 | 103.4 | 171.8 | -42.7 | -82 | 0 | 0 | 0 | 108.9 | E46 K50 | E46-Y48 PolarHBondContact O-N 2.9Å; Y48-K50 PolarHBondContact O-N 3.33Å | ||
| 49 | K | 60.8 | Low | 60.8 | Low | 205 Ų | 205 | 141.7 Ų | 141.7 | 89% | 0.891 | 71% | 0.707 | S | S | * | * | trans | -62.3 | 105.1 | 170.8 | -73.8 | -179.4 | -179.9 | 174.8 | 0 | 107.3 | P47 N51 | P47-K49 PolarHBondContact O-N 3.15Å; K49-N51 PolarHBondContact O-N 3.37Å | ||
| 50 | K | 62.5 | Low | 62.5 | Low | 198 Ų | 198 | 136.4 Ų | 136.4 | 86% | 0.861 | 69% | 0.687 | S | S | * | * | trans | -53.9 | 111 | 171.3 | -68.9 | 178.5 | 179.7 | 176.6 | 0 | 108.1 | Y48 R52 | Y48-K50 PolarHBondContact O-N 3.33Å; K50-R52 PolarHBondContact O-N 3.37Å; K50-R52 VanDerWaalsContact O-N 3.1Å | ||
| 51 | N | 62 | Low | 64.5 | Low | 121 Ų | 121 | 134.9 Ų | 134.9 | 65% | 0.647 | 67% | 0.669 | S | S | * | * | trans | -60.2 | 115.5 | 178.6 | -165.4 | -1.4 | 0 | 0 | 0 | 108.4 | K49 C54 | K49-N51 PolarHBondContact O-N 3.37Å; N51-C54 PolarHBondContact O-SG 3.02Å | ||
| 52 | R | 65.4 | Low | 66.2 | Low | 230 Ų | 230 | 135 Ų | 135 | 87% | 0.868 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | 139.4 | 177.2 | -65.7 | -176.9 | -177 | -176.1 | 1.2 | 107.6 | K50 | K50-R52 PolarHBondContact O-N 3.37Å; K50-R52 VanDerWaalsContact O-N 3.1Å |
| 53 | N | 65.7 | Low | 68 | Low | 148 Ų | 148 | 135 Ų | 135 | 79% | 0.791 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.8 | 33.8 | -178.7 | -59.1 | -4 | 0 | 0 | 0 | 117.1 | V55 | N53-V55 PolarHBondContact O-N 3.43Š|
| 54 | C | 71.4 | Confident | 69.5 | Low | 48 Ų | 48 | 135.6 Ų | 135.6 | 32% | 0.324 | 65% | 0.649 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.1 | 14.3 | 172 | 46.9 | 0 | 0 | 0 | 0 | 115.5 | N51 W56 V57 N58 | N51-C54 PolarHBondContact O-SG 3.02Å; C54-W56 PolarHBondContact O-N 2.86Å; C54-V57 HydrophobicContact CB-CB 4.04Å; C54-V57 HydrophobicContact CB-CG2 4.27Å; C54-V57 PolarHBondContact O-N 3.24Å; C54-N58 PolarHBondContact O-N 3.01Å |
| 55 | V | 73.5 | Confident | 71.2 | Confident | 104 Ų | 104 | 134.8 Ų | 134.8 | 63% | 0.63 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -55.1 | -42.5 | 177.9 | -179.7 | 0 | 0 | 0 | 0 | 110.9 | N53 V59 | N53-V55 PolarHBondContact O-N 3.43Å; V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.06Å |
| 56 | W | 78.9 | Confident | 72.7 | Confident | 188 Ų | 188 | 130.3 Ų | 130.3 | 71% | 0.712 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -78.1 | -27.9 | 177.8 | -58.5 | 108.9 | 0 | 0 | 0 | 113.3 | C54 V59 I60 | C54-W56 PolarHBondContact O-N 2.86Å; W56-V59 PolarHBondContact O-N 2.98Å; W56-I60 WeakPolarHBondContact O-CB 3.29Å; W56-I60 WeakPolarHBondContact O-CD1 3.27Å; W56-I60 WeakPolarHBondContact O-CG1 3.37Å; W56-I60 PolarHBondContact O-N 3.04Å |
| 57 | V | 76.8 | Confident | 74.1 | Confident | 70 Ų | 70 | 128.2 Ų | 128.2 | 42% | 0.424 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -66.6 | -42.2 | 177.1 | 177.6 | 0 | 0 | 0 | 0 | 110.2 | C54 I60 N61 | C54-V57 HydrophobicContact CB-CB 4.04Å; C54-V57 HydrophobicContact CB-CG2 4.27Å; C54-V57 PolarHBondContact O-N 3.24Å; V57-I60 PolarHBondContact O-N 3.25Å; V57-N61 WeakPolarHBondContact O-CB 3.41Å; V57-N61 PolarHBondContact O-N 2.9Å |
| 58 | N | 80.2 | Confident | 75.8 | Confident | 100 Ų | 100 | 125.6 Ų | 125.6 | 54% | 0.535 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.9 | -46.3 | 174 | -75.1 | 6.2 | 0 | 0 | 0 | 110.9 | C54 I60 N61 E62 | C54-N58 PolarHBondContact O-N 3.01Å; N58-I60 VanDerWaalsContact C-N 3.33Å; N58-I60 PolarHBondContact O-N 3.29Å; N58-N61 PolarHBondContact O-N 2.97Å; N58-N61 VanDerWaalsContact O-N 3.15Å; N58-E62 VanDerWaalsContact O-CG 3.29Å; N58-E62 WeakPolarHBondContact O-CG 3.39Å; N58-E62 PolarHBondContact O-N 2.84Å |
| 59 | V | 84.7 | Confident | 76.8 | Confident | 60 Ų | 60 | 121.2 Ų | 121.2 | 36% | 0.364 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -58.9 | -44.3 | 177.4 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | V55 W56 N61 E62 Y63 | V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.06Å; W56-V59 PolarHBondContact O-N 2.98Å; V59-N61 PolarHBondContact O-N 3.38Å; V59-E62 PolarHBondContact O-N 3.48Å; V59-Y63 HydrophobicContact CG1-CD2 3.75Å; V59-Y63 HydrophobicContact CG1-CE2 3.75Å; V59-Y63 VanDerWaalsContact O-CD2 3.25Å; V59-Y63 WeakPolarHBondContact O-CD2 3.26Å; V59-Y63 PolarHBondContact O-N 2.98Å |
| 60 | I | 81.4 | Confident | 77.5 | Confident | 90 Ų | 90 | 115.6 Ų | 115.6 | 46% | 0.462 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.8 | -37.8 | 177.7 | -69 | 164.5 | 0 | 0 | 0 | 111.5 | W56 V57 N58 Y63 K64 | W56-I60 WeakPolarHBondContact O-CB 3.29Å; W56-I60 WeakPolarHBondContact O-CD1 3.27Å; W56-I60 WeakPolarHBondContact O-CG1 3.37Å; W56-I60 PolarHBondContact O-N 3.04Å; V57-I60 PolarHBondContact O-N 3.25Å; N58-I60 VanDerWaalsContact C-N 3.33Å; N58-I60 PolarHBondContact O-N 3.29Å; I60-Y63 PolarHBondContact O-N 2.96Å; I60-K64 HydrophobicContact CG2-CD 4.39Å; I60-K64 WeakPolarHBondContact O-CG 3.47Å; I60-K64 PolarHBondContact O-N 3.4Å |
| 61 | N | 85.2 | Confident | 78.1 | Confident | 87 Ų | 87 | 111.2 Ų | 111.2 | 47% | 0.465 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.8 | -41.5 | 176 | -82.7 | 0.8 | 0 | 0 | 0 | 111.9 | V57 N58 V59 K64 L65 | V57-N61 WeakPolarHBondContact O-CB 3.41Å; V57-N61 PolarHBondContact O-N 2.9Å; N58-N61 PolarHBondContact O-N 2.97Å; N58-N61 VanDerWaalsContact O-N 3.15Å; V59-N61 PolarHBondContact O-N 3.38Å; N61-K64 PolarHBondContact O-N 3Å; N61-L65 WeakPolarHBondContact O-CB 3.34Å; N61-L65 PolarHBondContact O-N 3.05Å |
| 62 | E | 84.6 | Confident | 78.5 | Confident | 119 Ų | 119 | 107.7 Ų | 107.7 | 56% | 0.556 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -59.6 | -47 | 173 | -66.5 | -70.8 | 146.2 | 0 | 0 | 110.4 | N58 V59 K64 L65 D66 | N58-E62 VanDerWaalsContact O-CG 3.29Å; N58-E62 WeakPolarHBondContact O-CG 3.39Å; N58-E62 PolarHBondContact O-N 2.84Å; V59-E62 PolarHBondContact O-N 3.48Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.25Å; E62-L65 PolarHBondContact O-N 2.92Å; E62-D66 PolarHBondContact O-N 2.99Å |
| 63 | Y | 83.3 | Confident | 78.1 | Confident | 168 Ų | 168 | 104.9 Ų | 104.9 | 66% | 0.659 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -58.2 | -40.6 | 175 | -91.7 | -76.6 | 0 | 0 | 0 | 112.7 | V59 I60 L65 D67 | V59-Y63 HydrophobicContact CG1-CD2 3.75Å; V59-Y63 HydrophobicContact CG1-CE2 3.75Å; V59-Y63 VanDerWaalsContact O-CD2 3.25Å; V59-Y63 WeakPolarHBondContact O-CD2 3.26Å; V59-Y63 PolarHBondContact O-N 2.98Å; I60-Y63 PolarHBondContact O-N 2.96Å; Y63-L65 VanDerWaalsContact C-N 3.33Å; Y63-D67 WeakPolarHBondContact O-CB 3.44Å; Y63-D67 PolarHBondContact O-N 3.31Å |
| 64 | K | 84.5 | Confident | 77.9 | Confident | 136 Ų | 136 | 103.8 Ų | 103.8 | 59% | 0.591 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.6 | -33.5 | 176 | -74.3 | 176.1 | 179.5 | -177.2 | 0 | 112.6 | I60 N61 E62 A68 | I60-K64 HydrophobicContact CG2-CD 4.39Å; I60-K64 WeakPolarHBondContact O-CG 3.47Å; I60-K64 PolarHBondContact O-N 3.4Å; N61-K64 PolarHBondContact O-N 3Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.25Å; K64-A68 WeakPolarHBondContact O-CB 3.3Å; K64-A68 PolarHBondContact O-N 3.04Å |
| 65 | L | 82.7 | Confident | 77 | Confident | 99 Ų | 99 | 109.3 Ų | 109.3 | 52% | 0.518 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -74.5 | -42.2 | 179.3 | -144.4 | 153.2 | 0 | 0 | 0 | 110.1 | N61 E62 Y63 A68 L69 | N61-L65 WeakPolarHBondContact O-CB 3.34Å; N61-L65 PolarHBondContact O-N 3.05Å; E62-L65 PolarHBondContact O-N 2.92Å; Y63-L65 VanDerWaalsContact C-N 3.33Å; L65-A68 PolarHBondContact O-N 3.23Å; L65-L69 HydrophobicContact CD2-CD1 3.63Å; L65-L69 HydrophobicContact CD2-CG 4.04Å; L65-L69 WeakPolarHBondContact O-CB 3.42Å; L65-L69 VanDerWaalsContact O-CG 3.3Å; L65-L69 WeakPolarHBondContact O-CG 3.18Å; L65-L69 PolarHBondContact O-N 2.8Å |
| 66 | D | 80.4 | Confident | 76.2 | Confident | 99 Ų | 99 | 112.1 Ų | 112.1 | 53% | 0.529 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.9 | -42.2 | 171 | -80.1 | -16.8 | 0 | 0 | 0 | 111.7 | E62 L69 S70 | E62-D66 PolarHBondContact O-N 2.99Å; D66-L69 PolarHBondContact O-N 2.94Å; D66-S70 WeakPolarHBondContact O-CB 3.33Å; D66-S70 PolarHBondContact O-N 2.81Å |
| 67 | D | 84.8 | Confident | 75 | Confident | 111 Ų | 111 | 112.6 Ų | 112.6 | 59% | 0.594 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -65.1 | -40.2 | 175.3 | -130.4 | 20.4 | 0 | 0 | 0 | 111.2 | Y63 S70 V71 | Y63-D67 WeakPolarHBondContact O-CB 3.44Å; Y63-D67 PolarHBondContact O-N 3.31Å; D67-S70 WeakPolarHBondContact O-CB 3.2Å; D67-S70 PolarHBondContact O-N 3.23Å; D67-V71 VanDerWaalsContact O-CG2 3.26Å; D67-V71 WeakPolarHBondContact O-CG2 3.39Å; D67-V71 PolarHBondContact O-N 3.48Å |
| 68 | A | 83.5 | Confident | 73.8 | Confident | 61 Ų | 61 | 114.5 Ų | 114.5 | 50% | 0.504 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67 | -38 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | K64 L65 V71 A72 | K64-A68 WeakPolarHBondContact O-CB 3.3Å; K64-A68 PolarHBondContact O-N 3.04Å; L65-A68 PolarHBondContact O-N 3.23Å; A68-V71 PolarHBondContact O-N 2.68Å; A68-A72 WeakPolarHBondContact O-CB 3.25Å; A68-A72 PolarHBondContact O-N 2.95Å |
| 69 | L | 79.9 | Confident | 72.6 | Confident | 104 Ų | 104 | 116.1 Ų | 116.1 | 55% | 0.545 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -73.1 | -32 | 175.3 | -71.8 | 173.8 | 0 | 0 | 0 | 112.3 | L65 D66 | L65-L69 HydrophobicContact CD2-CD1 3.63Å; L65-L69 HydrophobicContact CD2-CG 4.04Å; L65-L69 WeakPolarHBondContact O-CB 3.42Å; L65-L69 VanDerWaalsContact O-CG 3.3Å; L65-L69 WeakPolarHBondContact O-CG 3.18Å; L65-L69 PolarHBondContact O-N 2.8Å; D66-L69 PolarHBondContact O-N 2.94Å |
| 70 | S | 75.4 | Confident | 71.4 | Confident | 86 Ų | 86 | 118.3 Ų | 118.3 | 60% | 0.601 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -64.7 | -41.6 | 171.1 | 160.7 | 0 | 0 | 0 | 0 | 111.6 | D66 D67 | D66-S70 WeakPolarHBondContact O-CB 3.33Å; D66-S70 PolarHBondContact O-N 2.81Å; D67-S70 WeakPolarHBondContact O-CB 3.2Å; D67-S70 PolarHBondContact O-N 3.23Å |
| 71 | V | 76.8 | Confident | 70.6 | Confident | 106 Ų | 106 | 118 Ų | 118 | 64% | 0.642 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.9 | -36 | 177.2 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | D67 A68 H73 | D67-V71 VanDerWaalsContact O-CG2 3.26Å; D67-V71 WeakPolarHBondContact O-CG2 3.39Å; D67-V71 PolarHBondContact O-N 3.48Å; A68-V71 PolarHBondContact O-N 2.68Å; V71-H73 VanDerWaalsContact C-N 3.35Å; V71-H73 PolarHBondContact O-N 2.79Å; V71-H73 PolarHBondContact O-ND1 2.76Å; V71-H73 VanDerWaalsContact O-ND1 3.08Å |
| 72 | A | 68.7 | Low | 69.4 | Low | 48 Ų | 48 | 124.8 Ų | 124.8 | 40% | 0.397 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -66.6 | 95.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | A68 V74 | A68-A72 WeakPolarHBondContact O-CB 3.25Å; A68-A72 PolarHBondContact O-N 2.95Å; A72-V74 HydrophobicContact CB-CG2 4.26Å; A72-V74 PolarHBondContact O-N 2.8Å |
| 73 | H | 58.2 | Low | 68.5 | Low | 171 Ų | 171 | 121.3 Ų | 121.3 | 79% | 0.792 | 65% | 0.649 | S | S | * | * | trans | -64.3 | 72.8 | 171.2 | -77.1 | 61.9 | 0 | 0 | 0 | 110.1 | V71 H75 | V71-H73 VanDerWaalsContact C-N 3.35Å; V71-H73 PolarHBondContact O-N 2.79Å; V71-H73 PolarHBondContact O-ND1 2.76Å; V71-H73 VanDerWaalsContact O-ND1 3.08Å; H73-H75 PolarHBondContact O-N 3.4Å | ||
| 74 | V | 60.6 | Low | 67.6 | Low | 124 Ų | 124 | 120.3 Ų | 120.3 | 75% | 0.752 | 66% | 0.66 | S | S | * | * | trans | -78.6 | 48.5 | 163.4 | -164.6 | 0 | 0 | 0 | 0 | 107.8 | A72 E76 | A72-V74 HydrophobicContact CB-CG2 4.26Å; A72-V74 PolarHBondContact O-N 2.8Å; V74-E76 PolarHBondContact O-N 3.21Å | ||
| 75 | H | 53.4 | Low | 66.3 | Low | 164 Ų | 164 | 122.2 Ų | 122.2 | 76% | 0.759 | 67% | 0.671 | S | S | * | * | trans | -79.8 | 84.8 | 144.8 | -107.6 | -75.4 | 0 | 0 | 0 | 104.3 | H73 K77 | H73-H75 PolarHBondContact O-N 3.4Å; H75-K77 PolarHBondContact O-N 3.38Å | ||
| 76 | E | 56 | Low | 65.3 | Low | 163 Ų | 163 | 121.7 Ų | 121.7 | 76% | 0.762 | 68% | 0.676 | S | S | * | * | trans | -45 | 118.8 | 144.8 | -167.5 | 168.3 | -154.8 | 0 | 0 | 104.6 | V74 C78 | V74-E76 PolarHBondContact O-N 3.21Å; E76-C78 PolarHBondContact O-N 3.48Å | ||
| 77 | K | 55 | Low | 64.4 | Low | 198 Ų | 198 | 126.9 Ų | 126.9 | 86% | 0.861 | 69% | 0.69 | S | S | * | * | trans | -64.3 | 80.6 | 172.5 | -70.7 | -173.3 | 177.3 | -177.3 | 0 | 105.7 | H75 D79 | H75-K77 PolarHBondContact O-N 3.38Å; K77-D79 PolarHBondContact O-N 3.25Å | ||
| 78 | C | 51.2 | Low | 63.1 | Low | 111 Ų | 111 | 129.2 Ų | 129.2 | 75% | 0.75 | 70% | 0.701 | S | S | * | * | trans | -66.4 | 100.9 | 161.6 | -156.6 | 0 | 0 | 0 | 0 | 103.1 | E76 S80 | E76-C78 PolarHBondContact O-N 3.48Å; C78-S80 PolarHBondContact O-N 2.96Å | ||
| 79 | D | 54.4 | Low | 61.5 | Low | 133 Ų | 133 | 131.6 Ų | 131.6 | 71% | 0.711 | 71% | 0.709 | S | S | * | * | trans | -64 | 84.3 | 178.5 | -156.5 | -20.4 | 0 | 0 | 0 | 107 | K77 S81 | K77-D79 PolarHBondContact O-N 3.25Å; D79-S81 PolarHBondContact O-N 3.38Å; D79-S81 VanDerWaalsContact O-N 3.15Å; D79-S81 WeakPolarHBondContact OD1-CB 3.35Å; D79-S81 PolarHBondContact OD1-OG 3.08Å | ||
| 80 | S | 60.2 | Low | 60.1 | Low | 106 Ų | 106 | 132.6 Ų | 132.6 | 74% | 0.741 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | 16.5 | -176.3 | -162.9 | 0 | 0 | 0 | 0 | 111.6 | C78 R82 | C78-S80 PolarHBondContact O-N 2.96Å; S80-R82 PolarHBondContact O-N 2.66Å; S80-R82 VanDerWaalsContact O-N 3.12Å |
| 81 | S | 63.3 | Low | 58.7 | Low | 84 Ų | 84 | 133.6 Ų | 133.6 | 59% | 0.587 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -5.6 | -177 | 56.7 | 0 | 0 | 0 | 0 | 113.9 | D79 | D79-S81 PolarHBondContact O-N 3.38Å; D79-S81 VanDerWaalsContact O-N 3.15Å; D79-S81 WeakPolarHBondContact OD1-CB 3.35Å; D79-S81 PolarHBondContact OD1-OG 3.08Å |
| 82 | R | 60.7 | Low | 57.4 | Low | 229 Ų | 229 | 135.7 Ų | 135.7 | 86% | 0.864 | 73% | 0.726 | S | S | * | * | trans | -132.1 | 77.9 | 179.4 | -68.5 | 177.6 | 171.7 | -114.6 | -1.8 | 110.7 | S80 | S80-R82 PolarHBondContact O-N 2.66Å; S80-R82 VanDerWaalsContact O-N 3.12Å | ||
| 83 | G | 66.3 | Low | 56.7 | Low | 46 Ų | 46 | 138.6 Ų | 138.6 | 47% | 0.474 | 74% | 0.739 | S | S | . | * | trans | -78.9 | 152.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | E85 S86 | G83-E85 PolarHBondContact O-N 2.69Å; G83-S86 PolarHBondContact O-N 2.74Å | ||
| 84 | V | 63.9 | Low | 56.2 | Low | 147 Ų | 147 | 137.8 Ų | 137.8 | 89% | 0.891 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -7.7 | -177.1 | 173.1 | 0 | 0 | 0 | 0 | 113.3 | ||
| 85 | E | 58 | Low | 55.6 | Low | 176 Ų | 176 | 139 Ų | 139 | 82% | 0.822 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.2 | 27.6 | -173.3 | -58.4 | -178 | 158.8 | 0 | 0 | 113.6 | G83 Y87 | G83-E85 PolarHBondContact O-N 2.69Å; E85-Y87 VanDerWaalsContact C-N 3.3Å; E85-Y87 PolarHBondContact O-N 3.15Å |
| 86 | S | 61.1 | Low | 55.4 | Low | 89 Ų | 89 | 139.9 Ų | 139.9 | 62% | 0.622 | 75% | 0.747 | S | S | * | * | trans | -81 | 72.3 | 175.8 | 70 | 0 | 0 | 0 | 0 | 112.2 | G83 | G83-S86 PolarHBondContact O-N 2.74Š| ||
| 87 | Y | 60.4 | Low | 55.1 | Low | 207 Ų | 207 | 142.7 Ų | 142.7 | 81% | 0.812 | 75% | 0.751 | S | S | * | * | trans | -104.4 | 104.6 | 162.3 | -69.3 | -80.1 | 0 | 0 | 0 | 109.2 | E85 V89 | E85-Y87 VanDerWaalsContact C-N 3.3Å; E85-Y87 PolarHBondContact O-N 3.15Å; Y87-V89 PolarHBondContact O-N 2.96Å | ||
| 88 | L | 58.5 | Low | 54.5 | Low | 160 Ų | 160 | 142.7 Ų | 142.7 | 84% | 0.838 | 75% | 0.75 | S | S | * | * | trans | -75.6 | 102.4 | 159.6 | -91.9 | 158.3 | 0 | 0 | 0 | 107.2 | N90 | L88-N90 PolarHBondContact O-N 3.17Š| ||
| 89 | V | 49.6 | Very low | 53.9 | Low | 111 Ų | 111 | 143.7 Ų | 143.7 | 67% | 0.673 | 75% | 0.753 | S | S | * | * | trans | -87.9 | 88.9 | 166.4 | 178 | 0 | 0 | 0 | 0 | 106.8 | Y87 T91 | Y87-V89 PolarHBondContact O-N 2.96Å; V89-T91 HydrophobicContact CG1-CG2 3.71Å; V89-T91 PolarHBondContact O-N 3.15Å | ||
| 90 | N | 50.5 | Low | 53.4 | Low | 125 Ų | 125 | 143.6 Ų | 143.6 | 67% | 0.668 | 76% | 0.758 | S | S | * | * | trans | -79.5 | 96.8 | 157.2 | -67.2 | -10.8 | 0 | 0 | 0 | 105.6 | L88 D92 | L88-N90 PolarHBondContact O-N 3.17Å; N90-D92 VanDerWaalsContact C-N 3.35Å; N90-D92 PolarHBondContact O-N 3.49Å | ||
| 91 | T | 45.8 | Very low | 52.7 | Low | 107 Ų | 107 | 147.2 Ų | 147.2 | 66% | 0.656 | 76% | 0.763 | S | S | * | * | trans | -79 | 96.5 | 161.6 | 41.9 | 0 | 0 | 0 | 0 | 107.1 | V89 T93 | V89-T91 HydrophobicContact CG1-CG2 3.71Å; V89-T91 PolarHBondContact O-N 3.15Å; T91-T93 VanDerWaalsContact C-N 3.29Å; T91-T93 PolarHBondContact O-N 3.02Å | ||
| 92 | D | 50.4 | Low | 51.6 | Low | 151 Ų | 151 | 149.2 Ų | 149.2 | 81% | 0.807 | 77% | 0.771 | S | S | * | * | trans | -61.9 | 94.2 | 158.8 | -62.6 | -39.1 | 0 | 0 | 0 | 107.6 | N90 | N90-D92 VanDerWaalsContact C-N 3.35Å; N90-D92 PolarHBondContact O-N 3.49Å | ||
| 93 | T | 52.8 | Low | 50.1 | Low | 109 Ų | 109 | 143.3 Ų | 143.3 | 67% | 0.669 | 76% | 0.764 | S | S | * | * | trans | -137.1 | 94.9 | 163.6 | 53.3 | 0 | 0 | 0 | 0 | 108.1 | T91 | T91-T93 VanDerWaalsContact C-N 3.29Å; T91-T93 PolarHBondContact O-N 3.02Å | ||
| 94 | D | 47.4 | Very low | 48.9 | Very low | 153 Ų | 153 | 146.8 Ų | 146.8 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | 25.8 | 104.5 | 140 | -53.4 | -37.9 | 0 | 0 | 0 | 117.3 | ||||
| 95 | D | 49.8 | Very low | 47.8 | Very low | 150 Ų | 150 | 147.5 Ų | 147.5 | 80% | 0.802 | 77% | 0.77 | S | S | * | * | trans | -142.2 | 90.5 | 144.9 | -103.8 | -36.1 | 0 | 0 | 0 | 109.2 | R97 | D95-R97 PolarHBondContact O-N 3.15Å; D95-R97 VanDerWaalsContact O-N 3.13Å | ||
| 96 | E | 47.5 | Very low | 47.2 | Very low | 183 Ų | 183 | 143.5 Ų | 143.5 | 86% | 0.855 | 76% | 0.759 | S | S | * | * | trans | -65.4 | 101.7 | 164.6 | -73.5 | -128.9 | 140.7 | 0 | 0 | 109.7 | ||||
| 97 | R | 49.8 | Very low | 46.1 | Very low | 222 Ų | 222 | 147.5 Ų | 147.5 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | trans | -132.9 | 98.6 | 156.1 | -68 | -169.8 | -173.7 | -171.2 | 3.2 | 110.4 | D95 T99 | D95-R97 PolarHBondContact O-N 3.15Å; D95-R97 VanDerWaalsContact O-N 3.13Å; R97-T99 PolarHBondContact O-N 3.34Å | ||
| 98 | K | 43.1 | Very low | 45.1 | Very low | 197 Ų | 197 | 143.2 Ų | 143.2 | 86% | 0.857 | 76% | 0.758 | S | S | * | * | trans | -54.1 | 115 | 160.1 | -83.4 | 169.6 | 173 | 166.5 | 0 | 110.1 | ||||
| 99 | T | 38.5 | Very low | 44.5 | Very low | 133 Ų | 133 | 140 Ų | 140 | 82% | 0.816 | 75% | 0.75 | S | S | * | * | trans | -144.3 | 107.6 | 142 | 37 | 0 | 0 | 0 | 0 | 108.6 | R97 | R97-T99 PolarHBondContact O-N 3.34Š| ||
| 100 | T | 43.9 | Very low | 44.4 | Very low | 131 Ų | 131 | 139.9 Ų | 139.9 | 80% | 0.804 | 75% | 0.749 | S | S | * | * | trans | -34.8 | 130 | 161 | -23.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 101 | E | 45.2 | Very low | 44.3 | Very low | 182 Ų | 182 | 143.3 Ų | 143.3 | 85% | 0.85 | 75% | 0.753 | S | S | * | * | trans | -179.9 | 107.8 | 132.2 | -97 | 167 | -153.2 | 0 | 0 | 111.6 | ||||
| 102 | V | 39.9 | Very low | 44.7 | Very low | 126 Ų | 126 | 144.4 Ų | 144.4 | 76% | 0.764 | 75% | 0.753 | S | S | * | * | trans | 40.5 | 93.3 | 147 | -165 | 0 | 0 | 0 | 0 | 117.8 | T104 | V102-T104 PolarHBondContact O-N 2.91Š| ||
| 103 | C | 30.3 | Very low | 44.8 | Very low | 104 Ų | 104 | 144 Ų | 144 | 70% | 0.703 | 75% | 0.75 | S | S | * | * | trans | -75.3 | 112.6 | 159.1 | -177.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 104 | T | 40.8 | Very low | 45 | Very low | 119 Ų | 119 | 147.6 Ų | 147.6 | 73% | 0.73 | 76% | 0.756 | S | S | * | * | trans | -122.5 | 98.3 | 157.9 | -30.9 | 0 | 0 | 0 | 0 | 106.6 | V102 P106 | V102-T104 PolarHBondContact O-N 2.91Å; T104-P106 VanDerWaalsContact O-CD 3.3Å; T104-P106 WeakPolarHBondContact O-CD 3.34Å | ||
| 105 | Q | 39.7 | Very low | 45.6 | Very low | 162 Ų | 162 | 147 Ų | 147 | 76% | 0.757 | 75% | 0.746 | S | S | * | * | trans | -70.9 | 122.4 | 173.7 | -67.2 | -75.6 | -34.8 | 0 | 0 | 109 | ||||
| 106 | P | 45.6 | Very low | 45.9 | Very low | 92 Ų | 92 | 143.7 Ų | 143.7 | 60% | 0.597 | 74% | 0.735 | S | S | * | * | trans | -91.5 | 119.5 | 154.5 | 30.3 | -17.4 | 0 | 0 | 0 | 108 | T104 L108 | T104-P106 VanDerWaalsContact O-CD 3.3Å; T104-P106 WeakPolarHBondContact O-CD 3.34Å; P106-L108 WeakPolarHBondContact O-CG 3.4Å; P106-L108 PolarHBondContact O-N 3.5Å | ||
| 107 | E | 38.7 | Very low | 46.7 | Very low | 174 Ų | 174 | 142.4 Ų | 142.4 | 81% | 0.813 | 73% | 0.734 | S | S | * | * | trans | -31.6 | 86.2 | 159.3 | -67.7 | -90.1 | 147.5 | 0 | 0 | 113.4 | ||||
| 108 | L | 38.8 | Very low | 47.5 | Very low | 117 Ų | 117 | 135.5 Ų | 135.5 | 61% | 0.613 | 71% | 0.713 | S | S | * | * | trans | -119.3 | 37.5 | 175.6 | -66.5 | -173.3 | 0 | 0 | 0 | 111.9 | P106 | P106-L108 WeakPolarHBondContact O-CG 3.4Å; P106-L108 PolarHBondContact O-N 3.5Å | ||
| 109 | S | 45.5 | Very low | 48.8 | Very low | 93 Ų | 93 | 129.2 Ų | 129.2 | 65% | 0.65 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -102 | -3 | -178 | 71.6 | 0 | 0 | 0 | 0 | 115.7 | ||
| 110 | T | 48.5 | Very low | 50 | Low | 107 Ų | 107 | 128.8 Ų | 128.8 | 66% | 0.656 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -126.1 | -3.8 | -176.6 | 56.5 | 0 | 0 | 0 | 0 | 116.5 | ||
| 111 | R | 48.9 | Very low | 51 | Low | 198 Ų | 198 | 129.1 Ų | 129.1 | 75% | 0.747 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -85.6 | -14.7 | 177.8 | -70 | -174.7 | -177.6 | 179.6 | 1.8 | 114.7 | L113 | R111-L113 VanDerWaalsContact C-N 3.32Å; R111-L113 PolarHBondContact O-N 3.15Å |
| 112 | I | 54.4 | Low | 51.8 | Low | 129 Ų | 129 | 126.4 Ų | 126.4 | 66% | 0.662 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -72.1 | -27.6 | -173 | -60.5 | 173.5 | 0 | 0 | 0 | 111.6 | K114 | I112-K114 PolarHBondContact O-N 3.23Š|
| 113 | L | 52.4 | Low | 52.8 | Low | 143 Ų | 143 | 128.3 Ų | 128.3 | 75% | 0.749 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -76.4 | -12.4 | -173.9 | -67 | 169.3 | 0 | 0 | 0 | 115.2 | R111 S116 | R111-L113 VanDerWaalsContact C-N 3.32Å; R111-L113 PolarHBondContact O-N 3.15Å; L113-S116 PolarHBondContact O-OG 3.4Å |
| 114 | K | 57.2 | Low | 54.5 | Low | 184 Ų | 184 | 129.9 Ų | 129.9 | 80% | 0.8 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -87.6 | -12.9 | 178 | -66.6 | -173.5 | -179.4 | -179.5 | 0 | 114.1 | I112 | I112-K114 PolarHBondContact O-N 3.23Š|
| 115 | K | 58.1 | Low | 55.6 | Low | 140 Ų | 140 | 125.7 Ų | 125.7 | 61% | 0.609 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -89 | -8.2 | -175.2 | -68.6 | -176.7 | 177.3 | -177.6 | 0 | 114.1 | N117 L118 | K115-N117 VanDerWaalsContact C-N 3.33Å; K115-N117 PolarHBondContact O-N 3.01Å; K115-L118 PolarHBondContact O-N 3.1Å |
| 116 | S | 58 | Low | 57 | Low | 82 Ų | 82 | 122.4 Ų | 122.4 | 57% | 0.573 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | -28.9 | -175.9 | 52.6 | 0 | 0 | 0 | 0 | 113.6 | L113 L118 | L113-S116 PolarHBondContact O-OG 3.4Å; S116-L118 VanDerWaalsContact C-N 3.31Å; S116-L118 PolarHBondContact O-N 3.47Å |
| 117 | N | 63.1 | Low | 58.3 | Low | 155 Ų | 155 | 123 Ų | 123 | 83% | 0.829 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -2.1 | 179.4 | -68.1 | -29.4 | 0 | 0 | 0 | 114.1 | K115 | K115-N117 VanDerWaalsContact C-N 3.33Å; K115-N117 PolarHBondContact O-N 3.01Å |
| 118 | L | 66.6 | Low | 60.5 | Low | 77 Ų | 77 | 121 Ų | 121 | 40% | 0.403 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -79.3 | 138.1 | 175 | -64.6 | 177.1 | 0 | 0 | 0 | 109.2 | K115 S116 I120 Q122 R123 | K115-L118 PolarHBondContact O-N 3.1Å; S116-L118 VanDerWaalsContact C-N 3.31Å; S116-L118 PolarHBondContact O-N 3.47Å; L118-I120 PolarHBondContact O-N 3.12Å; L118-Q122 HydrophobicContact CB-CB 3.97Å; L118-R123 HydrophobicContact CB-CG 4.07Å |
| 119 | S | 69.9 | Low | 62.8 | Low | 65 Ų | 65 | 117 Ų | 117 | 46% | 0.455 | 60% | 0.599 | S | S | . | * | trans | -50.3 | 142.8 | 172.6 | -178.7 | 0 | 0 | 0 | 0 | 109.1 | K121 Q122 R123 | S119-K121 PolarHBondContact O-N 3.22Å; S119-Q122 VanDerWaalsContact N-OE1 3.1Å; S119-Q122 WeakPolarHBondContact O-CA 3.37Å; S119-Q122 WeakPolarHBondContact O-CB 3.42Å; S119-Q122 PolarHBondContact O-N 3.14Å; S119-R123 PolarHBondContact O-N 3.15Å; S119-R123 VanDerWaalsContact O-N 3.14Å | ||
| 120 | I | 63.8 | Low | 64.9 | Low | 124 Ų | 124 | 116.8 Ų | 116.8 | 64% | 0.636 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -45.9 | -36.6 | 177.5 | -65.8 | 170.2 | 0 | 0 | 0 | 111 | L118 Q122 R123 L124 | L118-I120 PolarHBondContact O-N 3.12Å; I120-Q122 PolarHBondContact O-N 3.49Å; I120-R123 WeakPolarHBondContact O-CB 3.37Å; I120-R123 PolarHBondContact O-N 2.95Å; I120-L124 HydrophobicContact CG2-CD1 4.19Å; I120-L124 WeakPolarHBondContact O-CG 3.31Å; I120-L124 PolarHBondContact O-N 3.05Å |
| 121 | K | 64.5 | Low | 66.8 | Low | 138 Ų | 138 | 119.2 Ų | 119.2 | 60% | 0.6 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64 | -36.5 | 176.9 | -59.2 | -174.9 | 178 | -171.5 | 0 | 114.3 | S119 R123 | S119-K121 PolarHBondContact O-N 3.22Å; K121-R123 VanDerWaalsContact C-N 3.34Å |
| 122 | Q | 62.9 | Low | 68.6 | Low | 126 Ų | 126 | 118.9 Ų | 118.9 | 59% | 0.589 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -76.7 | -24.5 | 176.4 | -69.9 | 171.7 | -37.6 | 0 | 0 | 111.8 | L118 S119 I120 | L118-Q122 HydrophobicContact CB-CB 3.97Å; S119-Q122 VanDerWaalsContact N-OE1 3.1Å; S119-Q122 WeakPolarHBondContact O-CA 3.37Å; S119-Q122 WeakPolarHBondContact O-CB 3.42Å; S119-Q122 PolarHBondContact O-N 3.14Å; I120-Q122 PolarHBondContact O-N 3.49Å |
| 123 | R | 61.6 | Low | 70.2 | Confident | 165 Ų | 165 | 115.5 Ų | 115.5 | 62% | 0.623 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -73.8 | -32.2 | 177.2 | -68.4 | 178.2 | 57.6 | -166.1 | -3.2 | 113.1 | L118 S119 I120 K121 G125 | L118-R123 HydrophobicContact CB-CG 4.07Å; S119-R123 PolarHBondContact O-N 3.15Å; S119-R123 VanDerWaalsContact O-N 3.14Å; I120-R123 WeakPolarHBondContact O-CB 3.37Å; I120-R123 PolarHBondContact O-N 2.95Å; K121-R123 VanDerWaalsContact C-N 3.34Å; R123-G125 VanDerWaalsContact C-N 3.28Å; R123-G125 PolarHBondContact O-N 3.39Å |
| 124 | L | 65.5 | Low | 71.8 | Confident | 137 Ų | 137 | 114 Ų | 114 | 72% | 0.717 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.7 | -0 | -175.7 | -64.7 | 175.4 | 0 | 0 | 0 | 113.9 | I120 | I120-L124 HydrophobicContact CG2-CD1 4.19Å; I120-L124 WeakPolarHBondContact O-CG 3.31Å; I120-L124 PolarHBondContact O-N 3.05Å |
| 125 | G | 64.7 | Low | 73.3 | Confident | 31 Ų | 31 | 106.6 Ų | 106.6 | 32% | 0.32 | 56% | 0.555 | S | S | . | * | trans | 69.1 | 177.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R123 L127 | R123-G125 VanDerWaalsContact C-N 3.28Å; R123-G125 PolarHBondContact O-N 3.39Å; G125-L127 PolarHBondContact O-N 3.21Å | ||
| 126 | P | 67.6 | Low | 74.6 | Confident | 93 Ų | 93 | 105.3 Ų | 105.3 | 60% | 0.604 | 56% | 0.564 | S | S | * | * | trans | -61.5 | 122.1 | 170.5 | 27.3 | -34.5 | 0 | 0 | 0 | 110.2 | L128 Y216 | P126-L128 PolarHBondContact O-N 2.99Å; P126-L128 VanDerWaalsContact O-N 3.15Å; P126-Y216 VanDerWaalsContact CA-OH 3.25Å; P126-Y216 WeakPolarHBondContact CA-OH 3.46Å; P126-Y216 HydrophobicContact CB-CE1 4.06Å; P126-Y216 HydrophobicContact CB-CE2 4.41Å; P126-Y216 WeakPolarHBondContact CB-OH 3.33Å | ||
| 127 | L | 73 | Confident | 76.1 | Confident | 106 Ų | 106 | 105.6 Ų | 105.6 | 56% | 0.555 | 56% | 0.556 | S | S | * | * | trans | -68.7 | 112.9 | 170.5 | -72.9 | 97.3 | 0 | 0 | 0 | 108.3 | G125 L183 I187 | G125-L127 PolarHBondContact O-N 3.21Å; L127-L183 HydrophobicContact CB-CD1 4.22Å; L127-L183 HydrophobicContact CB-CD2 3.95Å; L127-I187 HydrophobicContact CD2-CD1 4.5Å | ||
| 128 | L | 84.4 | Confident | 77.4 | Confident | 130 Ų | 130 | 99.1 Ų | 99.1 | 68% | 0.681 | 52% | 0.521 | S | S | * | . | trans | -107.2 | 150.7 | 170.9 | -169.9 | 65.9 | 0 | 0 | 0 | 108.2 | P126 | P126-L128 PolarHBondContact O-N 2.99Å; P126-L128 VanDerWaalsContact O-N 3.15Å | ||
| 129 | W | 88.6 | Confident | 78.5 | Confident | 34 Ų | 34 | 102.7 Ų | 102.7 | 13% | 0.129 | 54% | 0.541 | C | S | . | . | trans | -75.8 | 148.5 | 171.4 | 57.8 | -85.2 | 0 | 0 | 0 | 109.8 | Q131 Y182 L183 D186 | W129-Q131 HydrophobicContact CE3-CB 4.3Å; W129-Q131 HydrophobicContact CH2-CB 4.09Å; W129-Q131 HydrophobicContact CH2-CG 3.64Å; W129-Q131 HydrophobicContact CZ2-CG 4.5Å; W129-Q131 VanDerWaalsContact CZ3-CA 3.49Å; W129-Q131 HydrophobicContact CZ3-CB 3.83Å; W129-Q131 HydrophobicContact CZ3-CG 3.76Å; W129-Q131 PolarHBondContact O-N 2.93Å; W129-Y182 HydrophobicContact CD2-CD2 4.06Å; W129-Y182 HydrophobicContact CE3-CD2 4Å; W129-Y182 HydrophobicContact CH2-CD2 4.43Å; W129-Y182 HydrophobicContact CZ3-CD2 4.16Å; W129-L183 HydrophobicContact CB-CB 4.2Å; W129-D186 VanDerWaalsContact CA-OD2 3.31Å; W129-D186 WeakPolarHBondContact CA-OD2 3.08Å | ||
| 130 | D | 88.6 | Confident | 79.5 | Confident | 89 Ų | 89 | 99.9 Ų | 99.9 | 48% | 0.476 | 52% | 0.521 | S | S | . | . | trans | -77.9 | 112.7 | -178.1 | -72.5 | -20.3 | 0 | 0 | 0 | 109.6 | E132 V133 R135 D186 | D130-E132 VanDerWaalsContact C-N 3.27Å; D130-E132 PolarHBondContact O-N 3.45Å; D130-V133 HydrophobicContact CB-CG2 3.92Å; D130-V133 PolarHBondContact O-N 3.07Å; D130-R135 PolarHBondContact O-NH1 3.19Å; D130-R135 PolarHBondContact O-NH2 3.33Å; D130-D186 PolarHBondContact N-OD2 3.3Å | ||
| 131 | Q | 88.5 | Confident | 80.9 | Confident | 157 Ų | 157 | 98 Ų | 98 | 73% | 0.734 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -16.2 | -175.7 | -166 | 163.4 | 37.3 | 0 | 0 | 113.5 | W129 V133 | W129-Q131 HydrophobicContact CE3-CB 4.3Å; W129-Q131 HydrophobicContact CH2-CB 4.09Å; W129-Q131 HydrophobicContact CH2-CG 3.64Å; W129-Q131 HydrophobicContact CZ2-CG 4.5Å; W129-Q131 VanDerWaalsContact CZ3-CA 3.49Å; W129-Q131 HydrophobicContact CZ3-CB 3.83Å; W129-Q131 HydrophobicContact CZ3-CG 3.76Å; W129-Q131 PolarHBondContact O-N 2.93Å; Q131-V133 VanDerWaalsContact C-N 3.31Å |
| 132 | E | 87.2 | Confident | 82.3 | Confident | 192 Ų | 192 | 95 Ų | 95 | 90% | 0.897 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.2 | -18.5 | 178.4 | -59.9 | -177.7 | 179.6 | 0 | 0 | 112.9 | D130 S134 | D130-E132 VanDerWaalsContact C-N 3.27Å; D130-E132 PolarHBondContact O-N 3.45Å; E132-S134 PolarHBondContact O-N 3.49Å |
| 133 | V | 88.1 | Confident | 83.8 | Confident | 57 Ų | 57 | 96.5 Ų | 96.5 | 35% | 0.345 | 51% | 0.514 | S | S | . | . | S | Bend | trans | -78.9 | 116.5 | -178.9 | -177.7 | 0 | 0 | 0 | 0 | 110 | D130 Q131 R135 | D130-V133 HydrophobicContact CB-CG2 3.92Å; D130-V133 PolarHBondContact O-N 3.07Å; Q131-V133 VanDerWaalsContact C-N 3.31Å; V133-R135 PolarHBondContact O-N 3.48Å; V133-R135 PolarHBondContact O-NH1 3.47Å |
| 134 | S | 86.7 | Confident | 85.3 | Confident | 111 Ų | 111 | 89.8 Ų | 89.8 | 78% | 0.776 | 49% | 0.493 | S | S | * | . | trans | -68.4 | 114.6 | 175.8 | -63.1 | 0 | 0 | 0 | 0 | 111.6 | E132 | E132-S134 PolarHBondContact O-N 3.49Š| ||
| 135 | R | 88.3 | Confident | 86.8 | Confident | 30 Ų | 30 | 86.8 Ų | 86.8 | 11% | 0.113 | 48% | 0.482 | C | S | . | . | trans | -106.4 | 54.4 | -178.6 | -62.7 | 178.9 | -175.5 | 82.6 | -6.2 | 112.2 | D130 V133 H137 I138 E185 D186 | D130-R135 PolarHBondContact O-NH1 3.19Å; D130-R135 PolarHBondContact O-NH2 3.33Å; V133-R135 PolarHBondContact O-N 3.48Å; V133-R135 PolarHBondContact O-NH1 3.47Å; R135-H137 PolarHBondContact O-N 3.41Å; R135-I138 HydrophobicContact CB-CD1 3.96Å; R135-E185 VanDerWaalsContact CD-OE2 3.28Å; R135-E185 WeakPolarHBondContact CD-OE2 3.26Å; R135-E185 WeakPolarHBondContact CG-OE2 3.37Å; R135-E185 IonicContact NE-OE2 2.65Å; R135-E185 PolarHBondContact NE-OE2 2.94Å; R135-D186 IonicContact CZ-OD1 2.77Å; R135-D186 VanDerWaalsContact NH2-CG 3.3Å; R135-D186 IonicContact NH2-OD1 3.3Å; R135-D186 PolarHBondContact NH2-OD1 3.29Å; R135-D186 IonicContact NH2-OD2 3.76Å; R135-D186 PolarHBondContact NH2-OD2 3.3Å | ||
| 136 | S | 85.7 | Confident | 88.3 | Confident | 113 Ų | 113 | 88 Ų | 88 | 79% | 0.79 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | -5.9 | -177.7 | 63.3 | 0 | 0 | 0 | 0 | 114.5 | I138 | S136-I138 VanDerWaalsContact C-N 3.27Š|
| 137 | H | 88.5 | Confident | 89.6 | Confident | 87 Ų | 87 | 88.2 Ų | 88.2 | 40% | 0.403 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | 0.2 | -179 | 72.6 | -81.7 | 0 | 0 | 0 | 113.4 | R135 Y181 E185 | R135-H137 PolarHBondContact O-N 3.41Å; H137-Y181 PolarHBondContact NE2-OH 3.21Å; H137-E185 VanDerWaalsContact CE1-CD 3.49Å; H137-E185 IonicContact CE1-OE1 2.91Å; H137-E185 PolarHBondContact CE1-OE1 2.75Å; H137-E185 IonicContact CE1-OE2 3.52Å; H137-E185 IonicContact ND1-OE1 3.7Å; H137-E185 IonicContact NE2-OE1 3.69Å |
| 138 | I | 91.2 | Very high | 90.7 | Very high | 19 Ų | 19 | 86.9 Ų | 86.9 | 10% | 0.097 | 47% | 0.473 | C | S | . | . | trans | -114.4 | 115.8 | -175.3 | -51.5 | 165.5 | 0 | 0 | 0 | 107.2 | R135 S136 V140 L156 Y181 Y182 | R135-I138 HydrophobicContact CB-CD1 3.96Å; S136-I138 VanDerWaalsContact C-N 3.27Å; I138-V140 HydrophobicContact CG2-CB 4.18Å; I138-V140 PolarHBondContact O-N 2.91Å; I138-L156 HydrophobicContact CG1-CD1 4.39Å; I138-L156 HydrophobicContact CG2-CD1 4.35Å; I138-Y181 HydrophobicContact CD1-CD1 3.97Å; I138-Y181 HydrophobicContact CD1-CE1 3.37Å; I138-Y181 HydrophobicContact CG1-CE1 4.16Å; I138-Y182 HydrophobicContact CD1-CD1 4.03Å; I138-Y182 HydrophobicContact CD1-CE1 3.46Å; I138-Y182 VanDerWaalsContact CD1-CE1 3.46Å | ||
| 139 | D | 89.2 | Confident | 91.3 | Very high | 152 Ų | 152 | 80.7 Ų | 80.7 | 81% | 0.813 | 44% | 0.44 | S | S | * | . | trans | -78.8 | 15.1 | -175.6 | -58.9 | -34.1 | 0 | 0 | 0 | 113.4 | ||||
| 140 | V | 91.7 | Very high | 91.7 | Very high | 6 Ų | 6 | 79.1 Ų | 79.1 | 4% | 0.036 | 43% | 0.434 | C | S | . | . | trans | -126.6 | 133.4 | -168.3 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | I138 L148 V149 T152 | I138-V140 HydrophobicContact CG2-CB 4.18Å; I138-V140 PolarHBondContact O-N 2.91Å; V140-L148 HydrophobicContact CG2-CD2 4.43Å; V140-L148 HydrophobicContact CG2-CG 4.29Å; V140-V149 HydrophobicContact CG1-CB 4.1Å; V140-V149 HydrophobicContact CG1-CG1 4.39Å; V140-V149 HydrophobicContact CG1-CG2 3.34Å; V140-T152 HydrophobicContact CG2-CG2 3.57Å; V140-T152 WeakPolarHBondContact CG2-OG1 3.48Å | ||
| 141 | T | 92.6 | Very high | 92.1 | Very high | 85 Ų | 85 | 79.2 Ų | 79.2 | 52% | 0.521 | 43% | 0.432 | S | S | . | . | trans | -109.2 | 168.4 | -179.9 | -51.1 | 0 | 0 | 0 | 0 | 110.1 | D143 S144 | T141-D143 PolarHBondContact O-N 3.5Å; T141-S144 PolarHBondContact N-OG 3.17Å; T141-S144 VanDerWaalsContact O-CB 3.28Å; T141-S144 WeakPolarHBondContact O-CB 3.24Å; T141-S144 PolarHBondContact O-N 3.45Å; T141-S144 VanDerWaalsContact O-N 3.12Å; T141-S144 PolarHBondContact O-OG 2.85Å | ||
| 142 | F | 93.7 | Very high | 92.4 | Very high | 76 Ų | 76 | 73.2 Ų | 73.2 | 33% | 0.333 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -24.6 | 177.5 | -60.2 | -68.3 | 0 | 0 | 0 | 114.7 | V174 Q175 L178 Y182 | F142-V174 VanDerWaalsContact O-CG1 3.29Å; F142-V174 WeakPolarHBondContact O-CG1 3.38Å; F142-Q175 HydrophobicContact CD1-CB 4.43Å; F142-Q175 HydrophobicContact CD1-CG 4.13Å; F142-Q175 HydrophobicContact CE1-CG 4.43Å; F142-L178 HydrophobicContact CD1-CB 4.26Å; F142-L178 HydrophobicContact CD1-CD1 3.82Å; F142-L178 HydrophobicContact CE1-CB 4.03Å; F142-L178 HydrophobicContact CE1-CD1 4.29Å; F142-Y182 HydrophobicContact CE1-CE2 4.05Å; F142-Y182 AromaticContact CZ-CE2 3.77Å; F142-Y182 HydrophobicContact CZ-CE2 3.77Å |
| 143 | D | 93.9 | Very high | 92.9 | Very high | 156 Ų | 156 | 64.1 Ų | 64.1 | 83% | 0.834 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.9 | 0.8 | 179.7 | -58.3 | -42.3 | 0 | 0 | 0 | 113.6 | T141 | T141-D143 PolarHBondContact O-N 3.5Š|
| 144 | S | 94.2 | Very high | 93.3 | Very high | 25 Ų | 25 | 61.6 Ų | 61.6 | 18% | 0.175 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -69.4 | 153.8 | 179.3 | -63 | 0 | 0 | 0 | 0 | 111.8 | T141 | T141-S144 PolarHBondContact N-OG 3.17Å; T141-S144 VanDerWaalsContact O-CB 3.28Å; T141-S144 WeakPolarHBondContact O-CB 3.24Å; T141-S144 PolarHBondContact O-N 3.45Å; T141-S144 VanDerWaalsContact O-N 3.12Å; T141-S144 PolarHBondContact O-OG 2.85Å |
| 145 | P | 95.9 | Very high | 93.7 | Very high | 74 Ų | 74 | 61.9 Ų | 61.9 | 48% | 0.481 | 34% | 0.341 | S | S | . | . | trans | -62.1 | 143.2 | 179.6 | 25 | -33.2 | 0 | 0 | 0 | 111.5 | D147 L148 V149 | P145-D147 VanDerWaalsContact C-N 3.27Å; P145-D147 PolarHBondContact O-N 3.14Å; P145-L148 HydrophobicContact CG-CB 3.9Å; P145-L148 HydrophobicContact CG-CD2 4.41Å; P145-L148 PolarHBondContact O-N 3.39Å; P145-V149 VanDerWaalsContact O-CG2 3.26Å; P145-V149 WeakPolarHBondContact O-CG2 3.31Å; P145-V149 PolarHBondContact O-N 3.2Å | ||
| 146 | P | 96.2 | Very high | 94.1 | Very high | 55 Ų | 55 | 63.4 Ų | 63.4 | 36% | 0.357 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.2 | -32.6 | -173.4 | 24 | -34.2 | 0 | 0 | 0 | 113.5 | V149 A150 V169 V174 | P146-V149 PolarHBondContact O-N 2.92Å; P146-A150 WeakPolarHBondContact O-CB 3.44Å; P146-A150 PolarHBondContact O-N 2.98Å; P146-V169 HydrophobicContact CB-CG1 3.8Å; P146-V174 HydrophobicContact CB-CG2 3.83Å |
| 147 | D | 96.4 | Very high | 94.5 | Very high | 99 Ų | 99 | 58.2 Ų | 58.2 | 53% | 0.529 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.4 | -46.3 | 178.7 | -63.3 | -44.8 | 0 | 0 | 0 | 111.9 | P145 V149 A150 E151 | P145-D147 VanDerWaalsContact C-N 3.27Å; P145-D147 PolarHBondContact O-N 3.14Å; D147-V149 VanDerWaalsContact C-N 3.33Å; D147-V149 PolarHBondContact O-N 3.02Å; D147-A150 PolarHBondContact O-N 3.25Å; D147-E151 WeakPolarHBondContact O-CG 3.46Å; D147-E151 PolarHBondContact O-N 3.42Å |
| 148 | L | 96 | Very high | 94.8 | Very high | 77 Ų | 77 | 62.9 Ų | 62.9 | 40% | 0.403 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.4 | -40.9 | 177.3 | -177.1 | 67.4 | 0 | 0 | 0 | 111 | V140 P145 A150 E151 T152 | V140-L148 HydrophobicContact CG2-CD2 4.43Å; V140-L148 HydrophobicContact CG2-CG 4.29Å; P145-L148 HydrophobicContact CG-CB 3.9Å; P145-L148 HydrophobicContact CG-CD2 4.41Å; P145-L148 PolarHBondContact O-N 3.39Å; L148-A150 VanDerWaalsContact C-N 3.31Å; L148-A150 PolarHBondContact O-N 3.15Å; L148-E151 PolarHBondContact O-N 3.34Å; L148-T152 HydrophobicContact CD1-CG2 4.47Å; L148-T152 WeakPolarHBondContact O-CB 3.41Å; L148-T152 VanDerWaalsContact O-CG2 3.3Å; L148-T152 WeakPolarHBondContact O-CG2 3.42Å; L148-T152 PolarHBondContact O-N 2.7Å; L148-T152 PolarHBondContact O-OG1 3.36Å |
| 149 | V | 97 | Very high | 94.8 | Very high | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 175.9 | 178.5 | 0 | 0 | 0 | 0 | 110.3 | V140 P145 P146 D147 T152 I153 V174 L178 | V140-V149 HydrophobicContact CG1-CB 4.1Å; V140-V149 HydrophobicContact CG1-CG1 4.39Å; V140-V149 HydrophobicContact CG1-CG2 3.34Å; P145-V149 VanDerWaalsContact O-CG2 3.26Å; P145-V149 WeakPolarHBondContact O-CG2 3.31Å; P145-V149 PolarHBondContact O-N 3.2Å; P146-V149 PolarHBondContact O-N 2.92Å; D147-V149 VanDerWaalsContact C-N 3.33Å; D147-V149 PolarHBondContact O-N 3.02Å; V149-T152 WeakPolarHBondContact CA-OG1 3.34Å; V149-T152 PolarHBondContact O-OG1 3.43Å; V149-I153 HydrophobicContact CG1-CD1 3.65Å; V149-I153 HydrophobicContact CG1-CG1 4.34Å; V149-I153 WeakPolarHBondContact O-CB 3.42Å; V149-I153 WeakPolarHBondContact O-CG1 3.27Å; V149-I153 PolarHBondContact O-N 2.87Å; V149-V174 HydrophobicContact CB-CG1 4.41Å; V149-V174 HydrophobicContact CG1-CG1 4.22Å; V149-V174 HydrophobicContact CG2-CG1 3.6Å; V149-V174 HydrophobicContact CG2-CG2 4.26Å; V149-L178 HydrophobicContact CG1-CD1 4.47Å; V149-L178 HydrophobicContact CG1-CD2 4.03Å; V149-L178 HydrophobicContact CG1-CG 4.01Å |
| 150 | A | 96.8 | Very high | 95 | Very high | 1 Ų | 1 | 62.1 Ų | 62.1 | 1% | 0.008 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.4 | -43.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | P146 D147 L148 T154 I165 K166 V169 | P146-A150 WeakPolarHBondContact O-CB 3.44Å; P146-A150 PolarHBondContact O-N 2.98Å; D147-A150 PolarHBondContact O-N 3.25Å; L148-A150 VanDerWaalsContact C-N 3.31Å; L148-A150 PolarHBondContact O-N 3.15Å; A150-T154 VanDerWaalsContact O-CB 3.29Å; A150-T154 WeakPolarHBondContact O-CB 3.25Å; A150-T154 PolarHBondContact O-N 2.9Å; A150-T154 PolarHBondContact O-OG1 3.11Å; A150-I165 HydrophobicContact CB-CG2 4.43Å; A150-K166 HydrophobicContact CB-CB 4.33Å; A150-K166 HydrophobicContact CB-CG 3.66Å; A150-V169 HydrophobicContact CB-CB 4.42Å; A150-V169 HydrophobicContact CB-CG2 3.98Å |
| 151 | E | 96.3 | Very high | 94.9 | Very high | 91 Ų | 91 | 64.1 Ų | 64.1 | 43% | 0.425 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.7 | -45 | 177.6 | -73 | 177.4 | -173 | 0 | 0 | 111.8 | D147 L148 T154 N155 | D147-E151 WeakPolarHBondContact O-CG 3.46Å; D147-E151 PolarHBondContact O-N 3.42Å; L148-E151 PolarHBondContact O-N 3.34Å; E151-T154 PolarHBondContact O-N 3.43Å; E151-N155 WeakPolarHBondContact O-CB 3.39Å; E151-N155 VanDerWaalsContact O-CG 3.28Å; E151-N155 PolarHBondContact O-N 2.89Å; E151-N155 PolarHBondContact O-ND2 3.48Å |
| 152 | T | 96.1 | Very high | 94.9 | Very high | 31 Ų | 31 | 64.9 Ų | 64.9 | 19% | 0.19 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.8 | -46.8 | 178.3 | 51.9 | 0 | 0 | 0 | 0 | 112.2 | V140 L148 V149 T154 N155 L156 | V140-T152 HydrophobicContact CG2-CG2 3.57Å; V140-T152 WeakPolarHBondContact CG2-OG1 3.48Å; L148-T152 HydrophobicContact CD1-CG2 4.47Å; L148-T152 WeakPolarHBondContact O-CB 3.41Å; L148-T152 VanDerWaalsContact O-CG2 3.3Å; L148-T152 WeakPolarHBondContact O-CG2 3.42Å; L148-T152 PolarHBondContact O-N 2.7Å; L148-T152 PolarHBondContact O-OG1 3.36Å; V149-T152 WeakPolarHBondContact CA-OG1 3.34Å; V149-T152 PolarHBondContact O-OG1 3.43Å; T152-T154 VanDerWaalsContact C-N 3.28Å; T152-T154 PolarHBondContact O-N 3.14Å; T152-N155 PolarHBondContact O-N 3.29Å; T152-L156 WeakPolarHBondContact O-CB 3.4Å; T152-L156 WeakPolarHBondContact O-CD1 3.39Å; T152-L156 WeakPolarHBondContact O-CG 3.42Å; T152-L156 PolarHBondContact O-N 2.89Å |
| 153 | I | 96.7 | Very high | 95 | Very high | 1 Ų | 1 | 66.3 Ų | 66.3 | 1% | 0.005 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -59.2 | -41.7 | 174.7 | -69.3 | 172.7 | 0 | 0 | 0 | 110.8 | V149 N155 L156 L157 I165 V169 A177 L178 Y181 | V149-I153 HydrophobicContact CG1-CD1 3.65Å; V149-I153 HydrophobicContact CG1-CG1 4.34Å; V149-I153 WeakPolarHBondContact O-CB 3.42Å; V149-I153 WeakPolarHBondContact O-CG1 3.27Å; V149-I153 PolarHBondContact O-N 2.87Å; I153-N155 PolarHBondContact O-N 3.35Å; I153-L156 PolarHBondContact O-N 3.43Å; I153-L157 HydrophobicContact CG2-CD1 3.5Å; I153-L157 HydrophobicContact CG2-CG 4.1Å; I153-L157 WeakPolarHBondContact O-CB 3.43Å; I153-L157 VanDerWaalsContact O-CG 3.27Å; I153-L157 WeakPolarHBondContact O-CG 3.27Å; I153-L157 PolarHBondContact O-N 3.46Å; I153-I165 HydrophobicContact CB-CG2 4.09Å; I153-I165 HydrophobicContact CG2-CG2 3.78Å; I153-V169 HydrophobicContact CD1-CG2 4.45Å; I153-A177 HydrophobicContact CD1-CB 4.33Å; I153-L178 HydrophobicContact CD1-CD2 4.29Å; I153-Y181 HydrophobicContact CG1-CD2 4.46Å; I153-Y181 HydrophobicContact CG1-CG 4.47Å; I153-Y181 HydrophobicContact CG2-CD2 4.35Å |
| 154 | T | 96.6 | Very high | 95 | Very high | 5 Ų | 5 | 59.3 Ų | 59.3 | 3% | 0.031 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.6 | -45.8 | 178.9 | -60.4 | 0 | 0 | 0 | 0 | 111.5 | A150 E151 T152 K158 E159 E162 I165 | A150-T154 VanDerWaalsContact O-CB 3.29Å; A150-T154 WeakPolarHBondContact O-CB 3.25Å; A150-T154 PolarHBondContact O-N 2.9Å; A150-T154 PolarHBondContact O-OG1 3.11Å; E151-T154 PolarHBondContact O-N 3.43Å; T152-T154 VanDerWaalsContact C-N 3.28Å; T152-T154 PolarHBondContact O-N 3.14Å; T154-K158 PolarHBondContact O-N 2.74Å; T154-E159 PolarHBondContact O-N 2.92Å; T154-E162 HydrophobicContact CG2-CB 4.07Å; T154-E162 HydrophobicContact CG2-CG 3.81Å; T154-I165 WeakPolarHBondContact OG1-CB 3.5Å; T154-I165 WeakPolarHBondContact OG1-CG2 3.48Å |
| 155 | N | 95.8 | Very high | 95.2 | Very high | 116 Ų | 116 | 58.1 Ų | 58.1 | 62% | 0.62 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 177.5 | -72.1 | -29.7 | 0 | 0 | 0 | 112.1 | E151 T152 I153 K158 | E151-N155 WeakPolarHBondContact O-CB 3.39Å; E151-N155 VanDerWaalsContact O-CG 3.28Å; E151-N155 PolarHBondContact O-N 2.89Å; E151-N155 PolarHBondContact O-ND2 3.48Å; T152-N155 PolarHBondContact O-N 3.29Å; I153-N155 PolarHBondContact O-N 3.35Å; N155-K158 PolarHBondContact O-N 2.85Å |
| 156 | L | 94.9 | Very high | 95.2 | Very high | 62 Ų | 62 | 57.4 Ų | 57.4 | 33% | 0.325 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -66.8 | -43.2 | -179.7 | -69.1 | 164.6 | 0 | 0 | 0 | 112 | I138 T152 I153 K158 Y181 | I138-L156 HydrophobicContact CG1-CD1 4.39Å; I138-L156 HydrophobicContact CG2-CD1 4.35Å; T152-L156 WeakPolarHBondContact O-CB 3.4Å; T152-L156 WeakPolarHBondContact O-CD1 3.39Å; T152-L156 WeakPolarHBondContact O-CG 3.42Å; T152-L156 PolarHBondContact O-N 2.89Å; I153-L156 PolarHBondContact O-N 3.43Å; L156-K158 VanDerWaalsContact C-N 3.3Å; L156-K158 PolarHBondContact O-N 3.39Å; L156-Y181 HydrophobicContact CB-CE2 3.56Å; L156-Y181 WeakPolarHBondContact CB-OH 3.5Å; L156-Y181 HydrophobicContact CD1-CE1 4.15Å; L156-Y181 HydrophobicContact CD1-CE2 3.94Å; L156-Y181 WeakPolarHBondContact CD1-OH 3.38Å; L156-Y181 HydrophobicContact CG-CE2 4.34Å |
| 157 | L | 95.3 | Very high | 95.2 | Very high | 5 Ų | 5 | 56.7 Ų | 56.7 | 3% | 0.026 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -79 | -12 | 179.4 | -63.4 | 178.2 | 0 | 0 | 0 | 113.6 | I153 E159 I165 Y181 T184 P204 Y208 | I153-L157 HydrophobicContact CG2-CD1 3.5Å; I153-L157 HydrophobicContact CG2-CG 4.1Å; I153-L157 WeakPolarHBondContact O-CB 3.43Å; I153-L157 VanDerWaalsContact O-CG 3.27Å; I153-L157 WeakPolarHBondContact O-CG 3.27Å; I153-L157 PolarHBondContact O-N 3.46Å; L157-E159 VanDerWaalsContact C-N 3.25Å; L157-E159 HydrophobicContact CB-CG 3.86Å; L157-E159 PolarHBondContact O-N 2.83Å; L157-I165 HydrophobicContact CD1-CD1 4.44Å; L157-Y181 HydrophobicContact CD2-CD2 3.93Å; L157-Y181 HydrophobicContact CD2-CE2 3.93Å; L157-Y181 HydrophobicContact CG-CD2 4.12Å; L157-Y181 HydrophobicContact CG-CE2 4.21Å; L157-T184 HydrophobicContact CD2-CG2 4.15Å; L157-P204 HydrophobicContact CD2-CB 4.29Å; L157-Y208 HydrophobicContact CD1-CD1 3.68Å; L157-Y208 HydrophobicContact CD1-CD2 4.03Å; L157-Y208 HydrophobicContact CD1-CE1 4.3Å; L157-Y208 HydrophobicContact CD1-CG 3.54Å |
| 158 | K | 94.3 | Very high | 95.1 | Very high | 184 Ų | 184 | 52 Ų | 52 | 80% | 0.8 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 41.4 | -173.7 | -56.8 | 179.4 | -177.7 | 175.8 | 0 | 112.2 | T154 N155 L156 | T154-K158 PolarHBondContact O-N 2.74Å; N155-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact C-N 3.3Å; L156-K158 PolarHBondContact O-N 3.39Å |
| 159 | E | 92.2 | Very high | 95.2 | Very high | 31 Ų | 31 | 48.4 Ų | 48.4 | 15% | 0.145 | 25% | 0.245 | C | C | . | . | trans | -84.3 | 131.5 | -177.6 | -80 | -66.5 | 139.9 | 0 | 0 | 111.3 | T154 L157 N161 I165 G205 G206 | T154-E159 PolarHBondContact O-N 2.92Å; L157-E159 VanDerWaalsContact C-N 3.25Å; L157-E159 HydrophobicContact CB-CG 3.86Å; L157-E159 PolarHBondContact O-N 2.83Å; E159-N161 VanDerWaalsContact C-N 3.29Å; E159-N161 PolarHBondContact O-N 3.1Å; E159-I165 HydrophobicContact CB-CG1 4.4Å; E159-G205 WeakPolarHBondContact OE1-CA 3.45Å; E159-G206 PolarHBondContact OE1-N 3.17Å | ||
| 160 | P | 91.6 | Very high | 95.2 | Very high | 124 Ų | 124 | 53.2 Ų | 53.2 | 81% | 0.805 | 27% | 0.271 | S | S | * | . | S | Bend | trans | -77 | -13.2 | -178.3 | 31.2 | -36.5 | 0 | 0 | 0 | 113.7 | ||
| 161 | N | 90 | Very high | 95.1 | Very high | 49 Ų | 49 | 55.8 Ų | 55.8 | 26% | 0.262 | 28% | 0.284 | S | S | . | . | trans | -112 | 85 | -177.6 | -171.2 | 1.9 | 0 | 0 | 0 | 110.3 | E159 D163 L164 D230 | E159-N161 VanDerWaalsContact C-N 3.29Å; E159-N161 PolarHBondContact O-N 3.1Å; N161-D163 VanDerWaalsContact C-N 3.28Å; N161-D163 PolarHBondContact O-N 3.33Å; N161-L164 HydrophobicContact CB-CB 4.21Å; N161-L164 WeakPolarHBondContact O-CB 3.44Å; N161-L164 PolarHBondContact O-N 2.93Å; N161-L164 PolarHBondContact OD1-N 3.16Å; N161-D230 PolarHBondContact ND2-OD1 3.29Å; N161-D230 PolarHBondContact ND2-OD2 3.47Å | ||
| 162 | E | 94.2 | Very high | 95.1 | Very high | 101 Ų | 101 | 52.1 Ų | 52.1 | 47% | 0.472 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.2 | -36.6 | -179.4 | -38.1 | -169.2 | 163.1 | 0 | 0 | 111.7 | T154 L164 I165 K166 | T154-E162 HydrophobicContact CG2-CB 4.07Å; T154-E162 HydrophobicContact CG2-CG 3.81Å; E162-L164 PolarHBondContact O-N 2.89Å; E162-I165 PolarHBondContact O-N 3.42Å; E162-K166 WeakPolarHBondContact O-CG 2.92Å; E162-K166 PolarHBondContact O-N 2.88Å |
| 163 | D | 94.5 | Very high | 95.1 | Very high | 105 Ų | 105 | 52.1 Ų | 52.1 | 56% | 0.561 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -62.2 | -28.6 | 179.4 | -64.4 | -26.7 | 0 | 0 | 0 | 112.8 | N161 R167 | N161-D163 VanDerWaalsContact C-N 3.28Å; N161-D163 PolarHBondContact O-N 3.33Å; D163-R167 WeakPolarHBondContact O-CB 3.23Å; D163-R167 WeakPolarHBondContact O-CG 3.13Å; D163-R167 PolarHBondContact O-N 3.38Å; D163-R167 PolarHBondContact O-NE 3.13Å |
| 164 | L | 95.2 | Very high | 95.1 | Very high | 10 Ų | 10 | 53.1 Ų | 53.1 | 5% | 0.052 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -71.2 | -41.6 | 174.6 | 177.6 | 60.3 | 0 | 0 | 0 | 111.3 | N161 E162 T168 L209 I226 F227 D230 | N161-L164 HydrophobicContact CB-CB 4.21Å; N161-L164 WeakPolarHBondContact O-CB 3.44Å; N161-L164 PolarHBondContact O-N 2.93Å; N161-L164 PolarHBondContact OD1-N 3.16Å; E162-L164 PolarHBondContact O-N 2.89Å; L164-T168 WeakPolarHBondContact O-CB 3.2Å; L164-T168 PolarHBondContact O-N 3.22Å; L164-T168 PolarHBondContact O-OG1 3.47Å; L164-L209 HydrophobicContact CD2-CD1 3.59Å; L164-L209 HydrophobicContact CD2-CD2 3.75Å; L164-L209 HydrophobicContact CD2-CG 4.33Å; L164-L209 HydrophobicContact CG-CD2 4.17Å; L164-I226 HydrophobicContact CD1-CG2 3.72Å; L164-F227 HydrophobicContact CD1-CD1 4.21Å; L164-F227 HydrophobicContact CD1-CE1 4.29Å; L164-D230 WeakPolarHBondContact CB-OD2 3.33Å; L164-D230 VanDerWaalsContact CD1-OD2 3.3Å; L164-D230 WeakPolarHBondContact CD1-OD2 3.35Å; L164-D230 VanDerWaalsContact CD2-OD2 3.3Å; L164-D230 WeakPolarHBondContact CD2-OD2 3.17Å; L164-D230 WeakPolarHBondContact CG-OD2 3.37Å |
| 165 | I | 96.5 | Very high | 95 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -69.1 | -46.3 | 178.6 | -58.3 | -57.5 | 0 | 0 | 0 | 110 | A150 I153 T154 L157 E159 E162 R167 T168 V169 Y208 L209 | A150-I165 HydrophobicContact CB-CG2 4.43Å; I153-I165 HydrophobicContact CB-CG2 4.09Å; I153-I165 HydrophobicContact CG2-CG2 3.78Å; T154-I165 WeakPolarHBondContact OG1-CB 3.5Å; T154-I165 WeakPolarHBondContact OG1-CG2 3.48Å; L157-I165 HydrophobicContact CD1-CD1 4.44Å; E159-I165 HydrophobicContact CB-CG1 4.4Å; E162-I165 PolarHBondContact O-N 3.42Å; I165-R167 PolarHBondContact O-N 3.02Å; I165-T168 WeakPolarHBondContact O-CA 3.49Å; I165-T168 VanDerWaalsContact O-CB 3.28Å; I165-T168 WeakPolarHBondContact O-CB 3.31Å; I165-T168 PolarHBondContact O-N 3.3Å; I165-V169 WeakPolarHBondContact O-CG2 3.04Å; I165-V169 PolarHBondContact O-N 2.89Å; I165-Y208 HydrophobicContact CD1-CD1 4.1Å; I165-Y208 HydrophobicContact CD1-CE1 3.91Å; I165-L209 HydrophobicContact CD1-CD2 4.43Å |
| 166 | K | 96.3 | Very high | 95 | Very high | 58 Ų | 58 | 55.4 Ų | 55.4 | 25% | 0.252 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -51.8 | -53.5 | 174.6 | -72.3 | 179.6 | 178.2 | -178 | 0 | 111.8 | A150 E162 T168 V169 D170 | A150-K166 HydrophobicContact CB-CB 4.33Å; A150-K166 HydrophobicContact CB-CG 3.66Å; E162-K166 WeakPolarHBondContact O-CG 2.92Å; E162-K166 PolarHBondContact O-N 2.88Å; K166-T168 VanDerWaalsContact C-N 3.26Å; K166-T168 PolarHBondContact O-N 3.2Å; K166-V169 PolarHBondContact O-N 2.67Å; K166-V169 VanDerWaalsContact O-N 3.08Å; K166-D170 VanDerWaalsContact O-CG 3.24Å; K166-D170 PolarHBondContact O-N 3.31Å |
| 167 | R | 95.7 | Very high | 95 | Very high | 41 Ų | 41 | 52.4 Ų | 52.4 | 16% | 0.155 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.7 | -33 | 176.1 | -74.9 | -179.3 | -67.6 | 139.2 | -1.6 | 113.9 | D163 I165 I171 I226 D230 | D163-R167 WeakPolarHBondContact O-CB 3.23Å; D163-R167 WeakPolarHBondContact O-CG 3.13Å; D163-R167 PolarHBondContact O-N 3.38Å; D163-R167 PolarHBondContact O-NE 3.13Å; I165-R167 PolarHBondContact O-N 3.02Å; R167-I171 HydrophobicContact CB-CD1 4.47Å; R167-I171 WeakPolarHBondContact O-CB 3.39Å; R167-I171 VanDerWaalsContact O-CD1 3.31Å; R167-I171 WeakPolarHBondContact O-CD1 3.46Å; R167-I171 WeakPolarHBondContact O-CG1 3.48Å; R167-I171 PolarHBondContact O-N 3.16Å; R167-I226 PolarHBondContact NH1-O 3.46Å; R167-D230 IonicContact CZ-OD1 3.29Å; R167-D230 IonicContact NH1-OD1 3.68Å; R167-D230 VanDerWaalsContact NH2-CG 3.3Å; R167-D230 IonicContact NH2-OD1 3.06Å; R167-D230 PolarHBondContact NH2-OD1 3.32Å; R167-D230 IonicContact NH2-OD2 3.79Å |
| 168 | T | 96.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65 | -45.5 | 176.2 | -60.7 | 0 | 0 | 0 | 0 | 110.5 | L164 I165 K166 I171 L172 Y208 I212 I226 | L164-T168 WeakPolarHBondContact O-CB 3.2Å; L164-T168 PolarHBondContact O-N 3.22Å; L164-T168 PolarHBondContact O-OG1 3.47Å; I165-T168 WeakPolarHBondContact O-CA 3.49Å; I165-T168 VanDerWaalsContact O-CB 3.28Å; I165-T168 WeakPolarHBondContact O-CB 3.31Å; I165-T168 PolarHBondContact O-N 3.3Å; K166-T168 VanDerWaalsContact C-N 3.26Å; K166-T168 PolarHBondContact O-N 3.2Å; T168-I171 PolarHBondContact O-N 3.32Å; T168-L172 HydrophobicContact CG2-CD1 3.68Å; T168-L172 HydrophobicContact CG2-CG 4.3Å; T168-L172 VanDerWaalsContact O-CB 3.29Å; T168-L172 WeakPolarHBondContact O-CB 3.31Å; T168-L172 WeakPolarHBondContact O-CG 3.3Å; T168-L172 PolarHBondContact O-N 3.21Å; T168-Y208 HydrophobicContact CG2-CE1 4.19Å; T168-I212 HydrophobicContact CG2-CD1 3.52Å; T168-I226 HydrophobicContact CG2-CD1 4.36Å; T168-I226 WeakPolarHBondContact OG1-CG2 3.37Å |
| 169 | V | 97 | Very high | 95.1 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.006 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.1 | -43.4 | 176.4 | 179.8 | 0 | 0 | 0 | 0 | 110.8 | P146 A150 I153 I165 K166 I171 G173 V174 A177 | P146-V169 HydrophobicContact CB-CG1 3.8Å; A150-V169 HydrophobicContact CB-CB 4.42Å; A150-V169 HydrophobicContact CB-CG2 3.98Å; I153-V169 HydrophobicContact CD1-CG2 4.45Å; I165-V169 WeakPolarHBondContact O-CG2 3.04Å; I165-V169 PolarHBondContact O-N 2.89Å; K166-V169 PolarHBondContact O-N 2.67Å; K166-V169 VanDerWaalsContact O-N 3.08Å; V169-I171 PolarHBondContact O-N 2.99Å; V169-G173 CarbonylContact O-C 3.45Å; V169-G173 WeakPolarHBondContact O-CA 3.48Å; V169-G173 PolarHBondContact O-N 2.93Å; V169-V174 HydrophobicContact CG1-CG2 4.15Å; V169-A177 HydrophobicContact CB-CB 4.41Å; V169-A177 HydrophobicContact CG2-CB 3.84Å |
| 170 | D | 96.1 | Very high | 95.2 | Very high | 102 Ų | 102 | 45.3 Ų | 45.3 | 55% | 0.545 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.1 | -40.3 | 179 | -62.9 | -27.5 | 0 | 0 | 0 | 112.9 | K166 | K166-D170 VanDerWaalsContact O-CG 3.24Å; K166-D170 PolarHBondContact O-N 3.31Å |
| 171 | I | 95.9 | Very high | 95.4 | Very high | 55 Ų | 55 | 40.2 Ų | 40.2 | 28% | 0.282 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -83.3 | -38.6 | -174.8 | -67.7 | 163.6 | 0 | 0 | 0 | 111.9 | R167 T168 V169 E222 S225 I226 | R167-I171 HydrophobicContact CB-CD1 4.47Å; R167-I171 WeakPolarHBondContact O-CB 3.39Å; R167-I171 VanDerWaalsContact O-CD1 3.31Å; R167-I171 WeakPolarHBondContact O-CD1 3.46Å; R167-I171 WeakPolarHBondContact O-CG1 3.48Å; R167-I171 PolarHBondContact O-N 3.16Å; T168-I171 PolarHBondContact O-N 3.32Å; V169-I171 PolarHBondContact O-N 2.99Å; I171-E222 HydrophobicContact CG2-CB 3.8Å; I171-E222 HydrophobicContact CG2-CG 4.01Å; I171-S225 WeakPolarHBondContact CD1-OG 3.49Å; I171-I226 HydrophobicContact CB-CD1 4.37Å; I171-I226 HydrophobicContact CB-CG1 4.02Å; I171-I226 HydrophobicContact CD1-CB 4.38Å; I171-I226 HydrophobicContact CD1-CG1 3.55Å; I171-I226 HydrophobicContact CG1-CG1 4.37Å; I171-I226 HydrophobicContact CG2-CD1 4.17Å; I171-I226 HydrophobicContact CG2-CG1 4.04Å |
| 172 | L | 95.4 | Very high | 95.7 | Very high | 13 Ų | 13 | 38.8 Ų | 38.8 | 7% | 0.068 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -88.3 | -26.3 | -178.5 | -60.7 | -176.9 | 0 | 0 | 0 | 112.9 | T168 R176 F180 I212 V218 E222 I226 | T168-L172 HydrophobicContact CG2-CD1 3.68Å; T168-L172 HydrophobicContact CG2-CG 4.3Å; T168-L172 VanDerWaalsContact O-CB 3.29Å; T168-L172 WeakPolarHBondContact O-CB 3.31Å; T168-L172 WeakPolarHBondContact O-CG 3.3Å; T168-L172 PolarHBondContact O-N 3.21Å; L172-R176 HydrophobicContact CB-CB 4.14Å; L172-R176 WeakPolarHBondContact O-CD 3.25Å; L172-F180 HydrophobicContact CD1-CD2 4.04Å; L172-F180 HydrophobicContact CD1-CE2 4Å; L172-I212 HydrophobicContact CD1-CD1 4.37Å; L172-I212 HydrophobicContact CD1-CG1 4.24Å; L172-I212 HydrophobicContact CD1-CG2 4.26Å; L172-V218 HydrophobicContact CD1-CG2 4.45Å; L172-V218 HydrophobicContact CD2-CB 4.41Å; L172-V218 HydrophobicContact CD2-CG1 3.63Å; L172-V218 HydrophobicContact CD2-CG2 3.89Å; L172-E222 HydrophobicContact CD2-CB 4.36Å; L172-I226 HydrophobicContact CD1-CD1 4.35Å; L172-I226 HydrophobicContact CD2-CD1 4.12Å; L172-I226 HydrophobicContact CG-CD1 4.04Å |
| 173 | G | 96.2 | Very high | 95.7 | Very high | 31 Ų | 31 | 34.7 Ų | 34.7 | 32% | 0.32 | 17% | 0.174 | S | C | . | . | trans | 87.9 | 158.4 | -167.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V169 Q175 A177 | V169-G173 CarbonylContact O-C 3.45Å; V169-G173 WeakPolarHBondContact O-CA 3.48Å; V169-G173 PolarHBondContact O-N 2.93Å; G173-Q175 PolarHBondContact O-N 3.29Å; G173-A177 WeakPolarHBondContact O-CB 3.25Å; G173-A177 PolarHBondContact O-N 3.43Å | ||
| 174 | V | 96.7 | Very high | 95.8 | Very high | 23 Ų | 23 | 29.8 Ų | 29.8 | 14% | 0.139 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.4 | -48.5 | -178.2 | 174.2 | 0 | 0 | 0 | 0 | 111.8 | F142 P146 V149 V169 R176 A177 L178 | F142-V174 VanDerWaalsContact O-CG1 3.29Å; F142-V174 WeakPolarHBondContact O-CG1 3.38Å; P146-V174 HydrophobicContact CB-CG2 3.83Å; V149-V174 HydrophobicContact CB-CG1 4.41Å; V149-V174 HydrophobicContact CG1-CG1 4.22Å; V149-V174 HydrophobicContact CG2-CG1 3.6Å; V149-V174 HydrophobicContact CG2-CG2 4.26Å; V169-V174 HydrophobicContact CG1-CG2 4.15Å; V174-R176 PolarHBondContact O-N 2.91Å; V174-A177 PolarHBondContact O-N 3.42Å; V174-L178 HydrophobicContact CG1-CD1 3.92Å; V174-L178 PolarHBondContact O-N 2.81Å |
| 175 | Q | 95.3 | Very high | 95.7 | Very high | 118 Ų | 118 | 31 Ų | 31 | 55% | 0.551 | 15% | 0.154 | S | C | * | . | H | α-helix | trans | -56.5 | -55.3 | -177.2 | -175.4 | 179.5 | -6.5 | 0 | 0 | 112.1 | F142 G173 A177 L178 E179 | F142-Q175 HydrophobicContact CD1-CB 4.43Å; F142-Q175 HydrophobicContact CD1-CG 4.13Å; F142-Q175 HydrophobicContact CE1-CG 4.43Å; G173-Q175 PolarHBondContact O-N 3.29Å; Q175-A177 VanDerWaalsContact C-N 3.32Å; Q175-A177 PolarHBondContact O-N 3.25Å; Q175-L178 PolarHBondContact O-N 3.18Å; Q175-E179 PolarHBondContact NE2-OE1 3.27Å; Q175-E179 WeakPolarHBondContact O-CG 3.44Å; Q175-E179 PolarHBondContact O-N 3.36Å |
| 176 | R | 95.1 | Very high | 95.6 | Very high | 50 Ų | 50 | 31.6 Ų | 31.6 | 19% | 0.189 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.5 | -35.1 | -178 | -63.6 | -178.5 | 69 | -165.5 | 9.4 | 112.1 | L172 V174 E179 F180 S217 V218 E222 | L172-R176 HydrophobicContact CB-CB 4.14Å; L172-R176 WeakPolarHBondContact O-CD 3.25Å; V174-R176 PolarHBondContact O-N 2.91Å; R176-E179 PolarHBondContact O-N 3.13Å; R176-F180 WeakPolarHBondContact O-CD2 3.25Å; R176-F180 PolarHBondContact O-N 2.94Å; R176-F180 VanDerWaalsContact O-N 3.1Å; R176-S217 PolarHBondContact NH2-O 3.43Å; R176-S217 PolarHBondContact NH2-OG 3.39Å; R176-V218 VanDerWaalsContact NH2-CA 3.35Å; R176-E222 IonicContact NH1-OE1 3.64Å; R176-E222 IonicContact NH1-OE2 3.18Å; R176-E222 PolarHBondContact NH1-OE2 2.92Å |
| 177 | A | 96.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.1 | -41.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | I153 V169 G173 V174 Q175 F180 Y181 Y208 | I153-A177 HydrophobicContact CD1-CB 4.33Å; V169-A177 HydrophobicContact CB-CB 4.41Å; V169-A177 HydrophobicContact CG2-CB 3.84Å; G173-A177 WeakPolarHBondContact O-CB 3.25Å; G173-A177 PolarHBondContact O-N 3.43Å; V174-A177 PolarHBondContact O-N 3.42Å; Q175-A177 VanDerWaalsContact C-N 3.32Å; Q175-A177 PolarHBondContact O-N 3.25Å; A177-F180 PolarHBondContact O-N 3.19Å; A177-Y181 PolarHBondContact O-N 3.37Å; A177-Y181 VanDerWaalsContact O-N 3.15Å; A177-Y208 PolarHBondContact O-OH 3.04Å |
| 178 | L | 95.7 | Very high | 95.5 | Very high | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -67.5 | -41.4 | 174.4 | -75 | 171.6 | 0 | 0 | 0 | 112.1 | F142 V149 I153 V174 Q175 F180 Y181 Y182 | F142-L178 HydrophobicContact CD1-CB 4.26Å; F142-L178 HydrophobicContact CD1-CD1 3.82Å; F142-L178 HydrophobicContact CE1-CB 4.03Å; F142-L178 HydrophobicContact CE1-CD1 4.29Å; V149-L178 HydrophobicContact CG1-CD1 4.47Å; V149-L178 HydrophobicContact CG1-CD2 4.03Å; V149-L178 HydrophobicContact CG1-CG 4.01Å; I153-L178 HydrophobicContact CD1-CD2 4.29Å; V174-L178 HydrophobicContact CG1-CD1 3.92Å; V174-L178 PolarHBondContact O-N 2.81Å; Q175-L178 PolarHBondContact O-N 3.18Å; L178-F180 VanDerWaalsContact C-N 3.29Å; L178-F180 PolarHBondContact O-N 3.38Å; L178-Y181 WeakPolarHBondContact O-CA 3.27Å; L178-Y181 WeakPolarHBondContact O-CB 3.19Å; L178-Y181 PolarHBondContact O-N 3.39Å; L178-Y182 HydrophobicContact CB-CE2 4.36Å; L178-Y182 PolarHBondContact O-N 3.11Å |
| 179 | E | 94.7 | Very high | 95.3 | Very high | 54 Ų | 54 | 36 Ų | 36 | 25% | 0.252 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -56 | -43 | 174.3 | -70.4 | 172.3 | 179.4 | 0 | 0 | 112.1 | Q175 R176 Y181 Y182 L183 | Q175-E179 PolarHBondContact NE2-OE1 3.27Å; Q175-E179 WeakPolarHBondContact O-CG 3.44Å; Q175-E179 PolarHBondContact O-N 3.36Å; R176-E179 PolarHBondContact O-N 3.13Å; E179-Y181 VanDerWaalsContact C-N 3.32Å; E179-Y181 PolarHBondContact O-N 3.03Å; E179-Y182 PolarHBondContact O-N 3.5Å; E179-L183 WeakPolarHBondContact O-CB 3.42Å; E179-L183 PolarHBondContact O-N 2.98Å |
| 180 | F | 95.8 | Very high | 95.1 | Very high | 15 Ų | 15 | 42.5 Ų | 42.5 | 7% | 0.066 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67 | -33.3 | 175.2 | -79.3 | -59.8 | 0 | 0 | 0 | 112.8 | L172 R176 A177 L178 T184 Y208 L211 I212 S215 V218 | L172-F180 HydrophobicContact CD1-CD2 4.04Å; L172-F180 HydrophobicContact CD1-CE2 4Å; R176-F180 WeakPolarHBondContact O-CD2 3.25Å; R176-F180 PolarHBondContact O-N 2.94Å; R176-F180 VanDerWaalsContact O-N 3.1Å; A177-F180 PolarHBondContact O-N 3.19Å; L178-F180 VanDerWaalsContact C-N 3.29Å; L178-F180 PolarHBondContact O-N 3.38Å; F180-T184 WeakPolarHBondContact O-CB 3.24Å; F180-T184 PolarHBondContact O-N 3.48Å; F180-T184 PolarHBondContact O-OG1 2.84Å; F180-Y208 HydrophobicContact CB-CD2 3.95Å; F180-Y208 HydrophobicContact CB-CE2 3.48Å; F180-Y208 VanDerWaalsContact CB-CE2 3.48Å; F180-L211 HydrophobicContact CD1-CB 3.92Å; F180-L211 HydrophobicContact CE1-CB 4.3Å; F180-I212 HydrophobicContact CB-CG1 4.42Å; F180-I212 HydrophobicContact CD1-CG1 4.21Å; F180-I212 HydrophobicContact CD2-CG1 3.79Å; F180-I212 HydrophobicContact CE1-CG1 4.49Å; F180-I212 HydrophobicContact CE2-CG1 4.11Å; F180-I212 HydrophobicContact CG-CG1 3.88Å; F180-I212 HydrophobicContact CZ-CG1 4.47Å; F180-S215 WeakPolarHBondContact CZ-OG 3.21Å; F180-V218 HydrophobicContact CE2-CG2 3.65Å; F180-V218 HydrophobicContact CZ-CG2 3.62Å |
| 181 | Y | 95.8 | Very high | 94.9 | Very high | 17 Ų | 17 | 39.4 Ų | 39.4 | 7% | 0.067 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.3 | -47.8 | 175.7 | 174.6 | -91.3 | 0 | 0 | 0 | 110.6 | H137 I138 I153 L156 L157 A177 L178 E179 L183 T184 E185 | H137-Y181 PolarHBondContact NE2-OH 3.21Å; I138-Y181 HydrophobicContact CD1-CD1 3.97Å; I138-Y181 HydrophobicContact CD1-CE1 3.37Å; I138-Y181 HydrophobicContact CG1-CE1 4.16Å; I153-Y181 HydrophobicContact CG1-CD2 4.46Å; I153-Y181 HydrophobicContact CG1-CG 4.47Å; I153-Y181 HydrophobicContact CG2-CD2 4.35Å; L156-Y181 HydrophobicContact CB-CE2 3.56Å; L156-Y181 WeakPolarHBondContact CB-OH 3.5Å; L156-Y181 HydrophobicContact CD1-CE1 4.15Å; L156-Y181 HydrophobicContact CD1-CE2 3.94Å; L156-Y181 WeakPolarHBondContact CD1-OH 3.38Å; L156-Y181 HydrophobicContact CG-CE2 4.34Å; L157-Y181 HydrophobicContact CD2-CD2 3.93Å; L157-Y181 HydrophobicContact CD2-CE2 3.93Å; L157-Y181 HydrophobicContact CG-CD2 4.12Å; L157-Y181 HydrophobicContact CG-CE2 4.21Å; A177-Y181 PolarHBondContact O-N 3.37Å; A177-Y181 VanDerWaalsContact O-N 3.15Å; L178-Y181 WeakPolarHBondContact O-CA 3.27Å; L178-Y181 WeakPolarHBondContact O-CB 3.19Å; L178-Y181 PolarHBondContact O-N 3.39Å; E179-Y181 VanDerWaalsContact C-N 3.32Å; E179-Y181 PolarHBondContact O-N 3.03Å; Y181-L183 VanDerWaalsContact C-N 3.33Å; Y181-L183 PolarHBondContact O-N 3.26Å; Y181-T184 WeakPolarHBondContact O-CA 3.25Å; Y181-T184 VanDerWaalsContact O-CB 3.26Å; Y181-T184 WeakPolarHBondContact O-CB 3.23Å; Y181-T184 PolarHBondContact O-N 2.78Å; Y181-E185 PolarHBondContact O-N 3.34Å |
| 182 | Y | 95.3 | Very high | 94.8 | Very high | 20 Ų | 20 | 37.7 Ų | 37.7 | 8% | 0.078 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.2 | -43.6 | 175.7 | -61.3 | -20.2 | 0 | 0 | 0 | 112 | W129 I138 F142 L178 E179 T184 E185 D186 | W129-Y182 HydrophobicContact CD2-CD2 4.06Å; W129-Y182 HydrophobicContact CE3-CD2 4Å; W129-Y182 HydrophobicContact CH2-CD2 4.43Å; W129-Y182 HydrophobicContact CZ3-CD2 4.16Å; I138-Y182 HydrophobicContact CD1-CD1 4.03Å; I138-Y182 HydrophobicContact CD1-CE1 3.46Å; I138-Y182 VanDerWaalsContact CD1-CE1 3.46Å; F142-Y182 HydrophobicContact CE1-CE2 4.05Å; F142-Y182 AromaticContact CZ-CE2 3.77Å; F142-Y182 HydrophobicContact CZ-CE2 3.77Å; L178-Y182 HydrophobicContact CB-CE2 4.36Å; L178-Y182 PolarHBondContact O-N 3.11Å; E179-Y182 PolarHBondContact O-N 3.5Å; Y182-T184 PolarHBondContact O-N 3.4Å; Y182-E185 WeakPolarHBondContact O-CB 3.46Å; Y182-E185 PolarHBondContact O-N 2.96Å; Y182-D186 VanDerWaalsContact O-CG 3.23Å; Y182-D186 PolarHBondContact O-N 2.77Å |
| 183 | L | 94.1 | Very high | 94.7 | Very high | 14 Ų | 14 | 39.8 Ų | 39.8 | 7% | 0.073 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.1 | -32.8 | 174.3 | -177.3 | 60.6 | 0 | 0 | 0 | 112.5 | L127 W129 E179 Y181 I187 L211 | L127-L183 HydrophobicContact CB-CD1 4.22Å; L127-L183 HydrophobicContact CB-CD2 3.95Å; W129-L183 HydrophobicContact CB-CB 4.2Å; E179-L183 WeakPolarHBondContact O-CB 3.42Å; E179-L183 PolarHBondContact O-N 2.98Å; Y181-L183 VanDerWaalsContact C-N 3.33Å; Y181-L183 PolarHBondContact O-N 3.26Å; L183-I187 HydrophobicContact CD1-CD1 4.34Å; L183-I187 HydrophobicContact CG-CD1 4.15Å; L183-I187 WeakPolarHBondContact O-CD1 3.39Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.24Å; L183-I187 PolarHBondContact O-N 3.47Å; L183-I187 VanDerWaalsContact O-N 3.09Å; L183-L211 HydrophobicContact CB-CD1 4.26Å; L183-L211 HydrophobicContact CD2-CD1 4.03Å; L183-L211 HydrophobicContact CD2-CD2 4.03Å; L183-L211 HydrophobicContact CG-CD1 3.92Å; L183-L211 HydrophobicContact CG-CD2 4.44Å |
| 184 | T | 95.7 | Very high | 94.6 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 2% | 0.018 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67.7 | -42.8 | 175.5 | -58.9 | 0 | 0 | 0 | 0 | 110.8 | L157 F180 Y181 Y182 I187 E188 P204 V207 Y208 L211 | L157-T184 HydrophobicContact CD2-CG2 4.15Å; F180-T184 WeakPolarHBondContact O-CB 3.24Å; F180-T184 PolarHBondContact O-N 3.48Å; F180-T184 PolarHBondContact O-OG1 2.84Å; Y181-T184 WeakPolarHBondContact O-CA 3.25Å; Y181-T184 VanDerWaalsContact O-CB 3.26Å; Y181-T184 WeakPolarHBondContact O-CB 3.23Å; Y181-T184 PolarHBondContact O-N 2.78Å; Y182-T184 PolarHBondContact O-N 3.4Å; T184-I187 PolarHBondContact O-N 3.11Å; T184-E188 WeakPolarHBondContact O-CG 3.46Å; T184-E188 PolarHBondContact O-N 3.39Å; T184-P204 WeakPolarHBondContact CG2-O 3.48Å; T184-V207 HydrophobicContact CG2-CB 4.04Å; T184-V207 HydrophobicContact CG2-CG1 4.08Å; T184-Y208 WeakPolarHBondContact OG1-CA 3.47Å; T184-L211 WeakPolarHBondContact OG1-CD1 2.77Å |
| 185 | E | 94.7 | Very high | 94.4 | Very high | 36 Ų | 36 | 45 Ų | 45 | 17% | 0.168 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.8 | -47.5 | 176 | -175 | -179 | -163.5 | 0 | 0 | 111.3 | R135 H137 Y181 Y182 I187 E188 N189 | R135-E185 VanDerWaalsContact CD-OE2 3.28Å; R135-E185 WeakPolarHBondContact CD-OE2 3.26Å; R135-E185 WeakPolarHBondContact CG-OE2 3.37Å; R135-E185 IonicContact NE-OE2 2.65Å; R135-E185 PolarHBondContact NE-OE2 2.94Å; H137-E185 VanDerWaalsContact CE1-CD 3.49Å; H137-E185 IonicContact CE1-OE1 2.91Å; H137-E185 PolarHBondContact CE1-OE1 2.75Å; H137-E185 IonicContact CE1-OE2 3.52Å; H137-E185 IonicContact ND1-OE1 3.7Å; H137-E185 IonicContact NE2-OE1 3.69Å; Y181-E185 PolarHBondContact O-N 3.34Å; Y182-E185 WeakPolarHBondContact O-CB 3.46Å; Y182-E185 PolarHBondContact O-N 2.96Å; E185-I187 VanDerWaalsContact C-N 3.32Å; E185-I187 PolarHBondContact O-N 3.46Å; E185-E188 PolarHBondContact O-N 3.07Å; E185-N189 WeakPolarHBondContact O-CB 3.31Å; E185-N189 VanDerWaalsContact O-CG 3.25Å; E185-N189 PolarHBondContact O-N 2.78Å; E185-N189 PolarHBondContact O-ND2 3.07Å |
| 186 | D | 94.3 | Very high | 94.1 | Very high | 11 Ų | 11 | 47.4 Ų | 47.4 | 6% | 0.059 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.4 | -44.5 | 177.4 | -59.6 | -18.5 | 0 | 0 | 0 | 110.9 | W129 D130 R135 Y182 E188 N189 N190 | W129-D186 VanDerWaalsContact CA-OD2 3.31Å; W129-D186 WeakPolarHBondContact CA-OD2 3.08Å; D130-D186 PolarHBondContact N-OD2 3.3Å; R135-D186 IonicContact CZ-OD1 2.77Å; R135-D186 VanDerWaalsContact NH2-CG 3.3Å; R135-D186 IonicContact NH2-OD1 3.3Å; R135-D186 PolarHBondContact NH2-OD1 3.29Å; R135-D186 IonicContact NH2-OD2 3.76Å; R135-D186 PolarHBondContact NH2-OD2 3.3Å; Y182-D186 VanDerWaalsContact O-CG 3.23Å; Y182-D186 PolarHBondContact O-N 2.77Å; D186-E188 PolarHBondContact O-N 2.86Å; D186-N189 PolarHBondContact O-N 3.31Å; D186-N190 WeakPolarHBondContact O-CB 3.37Å; D186-N190 VanDerWaalsContact O-CG 3.29Å; D186-N190 PolarHBondContact O-N 3.16Å; D186-N190 PolarHBondContact O-OD1 2.88Å |
| 187 | I | 94.2 | Very high | 94 | Very high | 34 Ų | 34 | 50.1 Ų | 50.1 | 17% | 0.174 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 177.6 | -71.5 | 167.9 | 0 | 0 | 0 | 111.5 | L127 L183 T184 E185 N190 G191 G192 L193 V207 L211 | L127-I187 HydrophobicContact CD2-CD1 4.5Å; L183-I187 HydrophobicContact CD1-CD1 4.34Å; L183-I187 HydrophobicContact CG-CD1 4.15Å; L183-I187 WeakPolarHBondContact O-CD1 3.39Å; L183-I187 VanDerWaalsContact O-CG1 3.26Å; L183-I187 WeakPolarHBondContact O-CG1 3.24Å; L183-I187 PolarHBondContact O-N 3.47Å; L183-I187 VanDerWaalsContact O-N 3.09Å; T184-I187 PolarHBondContact O-N 3.11Å; E185-I187 VanDerWaalsContact C-N 3.32Å; E185-I187 PolarHBondContact O-N 3.46Å; I187-N190 CarbonylContact O-C 3.53Å; I187-N190 PolarHBondContact O-N 2.81Å; I187-G191 PolarHBondContact O-N 3.36Å; I187-G192 VanDerWaalsContact O-CA 3.23Å; I187-G192 WeakPolarHBondContact O-CA 3.43Å; I187-G192 PolarHBondContact O-N 3.23Å; I187-L193 HydrophobicContact CG2-CB 4.28Å; I187-V207 HydrophobicContact CB-CG1 4.39Å; I187-V207 HydrophobicContact CD1-CG1 4.42Å; I187-V207 HydrophobicContact CG2-CG1 3.91Å; I187-L211 HydrophobicContact CD1-CD1 4Å; I187-L211 HydrophobicContact CD1-CD2 3.62Å; I187-L211 HydrophobicContact CD1-CG 4.28Å |
| 188 | E | 94.3 | Very high | 93.8 | Very high | 48 Ų | 48 | 52.3 Ų | 52.3 | 22% | 0.224 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -66.7 | -39.8 | 178.7 | -74.8 | -61.6 | 122.6 | 0 | 0 | 112.1 | T184 E185 D186 N190 G191 G192 R201 P204 V207 | T184-E188 WeakPolarHBondContact O-CG 3.46Å; T184-E188 PolarHBondContact O-N 3.39Å; E185-E188 PolarHBondContact O-N 3.07Å; D186-E188 PolarHBondContact O-N 2.86Å; E188-N190 VanDerWaalsContact C-N 3.26Å; E188-N190 PolarHBondContact O-N 2.93Å; E188-G191 PolarHBondContact O-N 3.17Å; E188-G191 VanDerWaalsContact O-N 3.11Å; E188-G192 VanDerWaalsContact OE1-CA 3.26Å; E188-G192 WeakPolarHBondContact OE1-CA 3.46Å; E188-R201 IonicContact OE2-NH2 3.98Å; E188-R201 PolarHBondContact OE2-NH2 2.84Å; E188-P204 HydrophobicContact CG-CB 4.24Å; E188-V207 VanDerWaalsContact OE1-CG2 3.31Å; E188-V207 WeakPolarHBondContact OE1-CG2 3.26Å |
| 189 | N | 93.1 | Very high | 93.7 | Very high | 110 Ų | 110 | 56 Ų | 56 | 59% | 0.588 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -61.7 | -35.7 | 172.9 | -71.4 | -23.2 | 0 | 0 | 0 | 111.7 | E185 D186 G191 | E185-N189 WeakPolarHBondContact O-CB 3.31Å; E185-N189 VanDerWaalsContact O-CG 3.25Å; E185-N189 PolarHBondContact O-N 2.78Å; E185-N189 PolarHBondContact O-ND2 3.07Å; D186-N189 PolarHBondContact O-N 3.31Å; N189-G191 PolarHBondContact O-N 2.95Å |
| 190 | N | 92.9 | Very high | 93.6 | Very high | 137 Ų | 137 | 61 Ų | 61 | 73% | 0.733 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | 11 | 177 | -68.8 | 44.8 | 0 | 0 | 0 | 113.8 | D186 I187 E188 | D186-N190 WeakPolarHBondContact O-CB 3.37Å; D186-N190 VanDerWaalsContact O-CG 3.29Å; D186-N190 PolarHBondContact O-N 3.16Å; D186-N190 PolarHBondContact O-OD1 2.88Å; I187-N190 CarbonylContact O-C 3.53Å; I187-N190 PolarHBondContact O-N 2.81Å; E188-N190 VanDerWaalsContact C-N 3.26Å; E188-N190 PolarHBondContact O-N 2.93Å |
| 191 | G | 91.8 | Very high | 93.6 | Very high | 37 Ų | 37 | 65.5 Ų | 65.5 | 38% | 0.381 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 106 | 5.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | I187 E188 N189 R201 | I187-G191 PolarHBondContact O-N 3.36Å; E188-G191 PolarHBondContact O-N 3.17Å; E188-G191 VanDerWaalsContact O-N 3.11Å; N189-G191 PolarHBondContact O-N 2.95Å; G191-R201 PolarHBondContact O-NE 3.01Å; G191-R201 PolarHBondContact O-NH1 3.4Å; G191-R201 PolarHBondContact O-NH2 3Å |
| 192 | G | 93 | Very high | 93.6 | Very high | 19 Ų | 19 | 67.5 Ų | 67.5 | 20% | 0.196 | 35% | 0.349 | C | S | . | . | trans | 70.4 | -170.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | I187 E188 | I187-G192 VanDerWaalsContact O-CA 3.23Å; I187-G192 WeakPolarHBondContact O-CA 3.43Å; I187-G192 PolarHBondContact O-N 3.23Å; E188-G192 VanDerWaalsContact OE1-CA 3.26Å; E188-G192 WeakPolarHBondContact OE1-CA 3.46Å | ||
| 193 | L | 93.7 | Very high | 93.6 | Very high | 58 Ų | 58 | 69.6 Ų | 69.6 | 30% | 0.304 | 37% | 0.367 | S | S | . | . | trans | -120.7 | 131 | -175.3 | -171.5 | 65.3 | 0 | 0 | 0 | 112.3 | I187 R202 V207 N210 | I187-L193 HydrophobicContact CG2-CB 4.28Å; L193-R202 VanDerWaalsContact O-CB 3.25Å; L193-R202 WeakPolarHBondContact O-CB 3.3Å; L193-R202 WeakPolarHBondContact O-CG 3.3Å; L193-R202 PolarHBondContact O-N 3.37Å; L193-V207 HydrophobicContact CB-CG1 4.3Å; L193-V207 HydrophobicContact CB-CG2 3.79Å; L193-N210 HydrophobicContact CD2-CB 4.49Å; L193-N210 VanDerWaalsContact CD2-ND2 3.25Å; L193-N210 WeakPolarHBondContact CD2-ND2 3.23Å | ||
| 194 | Y | 94.7 | Very high | 93.6 | Very high | 129 Ų | 129 | 71.2 Ų | 71.2 | 51% | 0.506 | 38% | 0.379 | S | S | . | . | B | Isolated β-bridge | trans | -81.3 | 160 | 172.6 | -76.4 | -105.2 | 0 | 0 | 0 | 112.1 | R201 | Y194-R201 HydrophobicContact CD1-CG 3.95Å; Y194-R201 HydrophobicContact CD2-CG 3.9Å; Y194-R201 HydrophobicContact CE1-CG 3.53Å; Y194-R201 HydrophobicContact CE2-CG 3.46Å; Y194-R201 VanDerWaalsContact CE2-CG 3.46Å; Y194-R201 HydrophobicContact CG-CG 4.12Å |
| 195 | L | 93 | Very high | 93.6 | Very high | 35 Ų | 35 | 71.1 Ų | 71.1 | 18% | 0.183 | 38% | 0.378 | C | S | . | . | trans | -62.4 | 161.6 | 164.3 | -72.7 | 168.4 | 0 | 0 | 0 | 111.1 | D197 G198 R200 R202 | L195-D197 WeakPolarHBondContact CB-OD1 3.38Å; L195-D197 PolarHBondContact O-N 3.41Å; L195-D197 VanDerWaalsContact O-N 3.16Å; L195-G198 PolarHBondContact O-N 2.97Å; L195-R200 HydrophobicContact CD1-CB 4.14Å; L195-R200 HydrophobicContact CD1-CG 3.45Å; L195-R200 VanDerWaalsContact CD1-CG 3.45Å; L195-R200 HydrophobicContact CG-CG 4.21Å; L195-R200 PolarHBondContact N-O 3.27Å; L195-R202 HydrophobicContact CD2-CG 4.09Å; L195-R202 HydrophobicContact CG-CG 4.22Å | ||
| 196 | M | 88.6 | Confident | 93.6 | Very high | 167 Ų | 167 | 70.1 Ų | 70.1 | 82% | 0.823 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -22.3 | -179.4 | -57.2 | -60.6 | -71.9 | 0 | 0 | 113 | G198 | M196-G198 VanDerWaalsContact C-N 3.35Š|
| 197 | D | 92.1 | Very high | 93.7 | Very high | 107 Ų | 107 | 69.6 Ų | 69.6 | 57% | 0.572 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | -5.8 | 175.6 | 64.5 | -11.8 | 0 | 0 | 0 | 112.8 | L195 S199 | L195-D197 WeakPolarHBondContact CB-OD1 3.38Å; L195-D197 PolarHBondContact O-N 3.41Å; L195-D197 VanDerWaalsContact O-N 3.16Å; D197-S199 PolarHBondContact O-N 2.93Å; D197-S199 VanDerWaalsContact O-N 3.14Å; D197-S199 PolarHBondContact OD1-N 2.65Å; D197-S199 VanDerWaalsContact OD1-N 3.13Å; D197-S199 PolarHBondContact OD1-OG 3.31Å; D197-S199 WeakPolarHBondContact OD2-CB 3.31Å; D197-S199 PolarHBondContact OD2-OG 3.37Å |
| 198 | G | 92.2 | Very high | 93.8 | Very high | 46 Ų | 46 | 68 Ų | 68 | 47% | 0.474 | 37% | 0.367 | S | S | . | . | S | Bend | trans | 68.8 | 0.9 | -176 | 0 | 0 | 0 | 0 | 0 | 115 | L195 M196 R200 | L195-G198 PolarHBondContact O-N 2.97Å; M196-G198 VanDerWaalsContact C-N 3.35Å; G198-R200 VanDerWaalsContact C-N 3.34Å; G198-R200 PolarHBondContact O-N 2.93Å |
| 199 | S | 93.4 | Very high | 93.9 | Very high | 78 Ų | 78 | 67 Ų | 67 | 55% | 0.545 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -68.9 | -33.7 | -170.3 | 65.5 | 0 | 0 | 0 | 0 | 113.1 | D197 | D197-S199 PolarHBondContact O-N 2.93Å; D197-S199 VanDerWaalsContact O-N 3.14Å; D197-S199 PolarHBondContact OD1-N 2.65Å; D197-S199 VanDerWaalsContact OD1-N 3.13Å; D197-S199 PolarHBondContact OD1-OG 3.31Å; D197-S199 WeakPolarHBondContact OD2-CB 3.31Å; D197-S199 PolarHBondContact OD2-OG 3.37Å |
| 200 | R | 93.9 | Very high | 93.9 | Very high | 159 Ų | 159 | 62.7 Ų | 62.7 | 60% | 0.6 | 34% | 0.339 | S | S | * | . | S | Bend | trans | -150.6 | 145.8 | -172 | 113 | -170.7 | 77.5 | 119.5 | -2.7 | 110.8 | L195 G198 | L195-R200 HydrophobicContact CD1-CB 4.14Å; L195-R200 HydrophobicContact CD1-CG 3.45Å; L195-R200 VanDerWaalsContact CD1-CG 3.45Å; L195-R200 HydrophobicContact CG-CG 4.21Å; L195-R200 PolarHBondContact N-O 3.27Å; G198-R200 VanDerWaalsContact C-N 3.34Å; G198-R200 PolarHBondContact O-N 2.93Å |
| 201 | R | 95 | Very high | 94 | Very high | 111 Ų | 111 | 57 Ų | 57 | 42% | 0.419 | 31% | 0.309 | S | S | . | . | B | Isolated β-bridge | trans | -65.9 | 140.5 | 167.2 | -77.4 | -168.1 | 59.4 | -177.3 | -6.9 | 110.3 | E188 G191 Y194 | E188-R201 IonicContact OE2-NH2 3.98Å; E188-R201 PolarHBondContact OE2-NH2 2.84Å; G191-R201 PolarHBondContact O-NE 3.01Å; G191-R201 PolarHBondContact O-NH1 3.4Å; G191-R201 PolarHBondContact O-NH2 3Å; Y194-R201 HydrophobicContact CD1-CG 3.95Å; Y194-R201 HydrophobicContact CD2-CG 3.9Å; Y194-R201 HydrophobicContact CE1-CG 3.53Å; Y194-R201 HydrophobicContact CE2-CG 3.46Å; Y194-R201 VanDerWaalsContact CE2-CG 3.46Å; Y194-R201 HydrophobicContact CG-CG 4.12Å |
| 202 | R | 95 | Very high | 94.1 | Very high | 58 Ų | 58 | 55.3 Ų | 55.3 | 22% | 0.219 | 29% | 0.291 | C | S | . | . | P | Polyproline II helix | trans | -72 | 154 | 170.8 | -67.1 | -175 | 174.4 | -125 | 9.1 | 109.9 | L193 L195 G206 V207 N210 | L193-R202 VanDerWaalsContact O-CB 3.25Å; L193-R202 WeakPolarHBondContact O-CB 3.3Å; L193-R202 WeakPolarHBondContact O-CG 3.3Å; L193-R202 PolarHBondContact O-N 3.37Å; L195-R202 HydrophobicContact CD2-CG 4.09Å; L195-R202 HydrophobicContact CG-CG 4.22Å; R202-G206 PolarHBondContact NH1-O 2.91Å; R202-V207 HydrophobicContact CB-CG2 3.83Å; R202-N210 PolarHBondContact NH1-OD1 2.96Å; R202-N210 PolarHBondContact NH2-OD1 3.22Å |
| 203 | S | 94.9 | Very high | 94.1 | Very high | 64 Ų | 64 | 60.5 Ų | 60.5 | 45% | 0.448 | 31% | 0.308 | S | S | . | . | P | Polyproline II helix | trans | -71 | 157.4 | 166.1 | 55.2 | 0 | 0 | 0 | 0 | 110.1 | G205 G206 V207 | S203-G205 PolarHBondContact O-N 3.37Å; S203-G206 CarbonylContact O-C 3.36Å; S203-G206 VanDerWaalsContact O-CA 3.23Å; S203-G206 WeakPolarHBondContact O-CA 3.48Å; S203-G206 PolarHBondContact O-N 3.37Å; S203-G206 PolarHBondContact OG-N 3.36Å; S203-G206 VanDerWaalsContact OG-N 3.17Å; S203-V207 WeakPolarHBondContact O-CG2 3.31Å; S203-V207 PolarHBondContact O-N 3.2Å |
| 204 | P | 95.6 | Very high | 93.9 | Very high | 49 Ų | 49 | 61.9 Ų | 61.9 | 32% | 0.318 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -53.7 | -47.9 | 177.9 | 19.1 | -32.8 | 0 | 0 | 0 | 112.5 | L157 T184 E188 G206 V207 Y208 | L157-P204 HydrophobicContact CD2-CB 4.29Å; T184-P204 WeakPolarHBondContact CG2-O 3.48Å; E188-P204 HydrophobicContact CG-CB 4.24Å; P204-G206 VanDerWaalsContact C-N 3.29Å; P204-G206 PolarHBondContact O-N 3.41Å; P204-V207 WeakPolarHBondContact O-CA 3.43Å; P204-V207 VanDerWaalsContact O-CB 3.31Å; P204-V207 WeakPolarHBondContact O-CB 3.49Å; P204-V207 PolarHBondContact O-N 3.18Å; P204-Y208 PolarHBondContact O-N 2.88Å |
| 205 | G | 96.2 | Very high | 93.6 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -70.3 | -25.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | E159 S203 V207 Y208 L209 | E159-G205 WeakPolarHBondContact OE1-CA 3.45Å; S203-G205 PolarHBondContact O-N 3.37Å; G205-V207 VanDerWaalsContact C-N 3.27Å; G205-V207 PolarHBondContact O-N 3.3Å; G205-Y208 PolarHBondContact O-N 2.95Å; G205-L209 VanDerWaalsContact O-CG 3.31Å; G205-L209 WeakPolarHBondContact O-CG 3.4Å; G205-L209 PolarHBondContact O-N 3.41Å |
| 206 | G | 94.6 | Very high | 93.3 | Very high | 16 Ų | 16 | 62.7 Ų | 62.7 | 17% | 0.165 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.3 | -25.5 | 166.8 | 0 | 0 | 0 | 0 | 0 | 114 | E159 R202 S203 P204 N210 | E159-G206 PolarHBondContact OE1-N 3.17Å; R202-G206 PolarHBondContact NH1-O 2.91Å; S203-G206 CarbonylContact O-C 3.36Å; S203-G206 VanDerWaalsContact O-CA 3.23Å; S203-G206 WeakPolarHBondContact O-CA 3.48Å; S203-G206 PolarHBondContact O-N 3.37Å; S203-G206 PolarHBondContact OG-N 3.36Å; S203-G206 VanDerWaalsContact OG-N 3.17Å; P204-G206 VanDerWaalsContact C-N 3.29Å; P204-G206 PolarHBondContact O-N 3.41Å; G206-N210 VanDerWaalsContact O-CB 3.25Å; G206-N210 WeakPolarHBondContact O-CB 3.31Å; G206-N210 PolarHBondContact O-N 3.05Å |
| 207 | V | 95.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -76.9 | -49.9 | 170.4 | 179.2 | 0 | 0 | 0 | 0 | 109.8 | T184 I187 E188 L193 R202 S203 P204 G205 L209 N210 L211 | T184-V207 HydrophobicContact CG2-CB 4.04Å; T184-V207 HydrophobicContact CG2-CG1 4.08Å; I187-V207 HydrophobicContact CB-CG1 4.39Å; I187-V207 HydrophobicContact CD1-CG1 4.42Å; I187-V207 HydrophobicContact CG2-CG1 3.91Å; E188-V207 VanDerWaalsContact OE1-CG2 3.31Å; E188-V207 WeakPolarHBondContact OE1-CG2 3.26Å; L193-V207 HydrophobicContact CB-CG1 4.3Å; L193-V207 HydrophobicContact CB-CG2 3.79Å; R202-V207 HydrophobicContact CB-CG2 3.83Å; S203-V207 WeakPolarHBondContact O-CG2 3.31Å; S203-V207 PolarHBondContact O-N 3.2Å; P204-V207 WeakPolarHBondContact O-CA 3.43Å; P204-V207 VanDerWaalsContact O-CB 3.31Å; P204-V207 WeakPolarHBondContact O-CB 3.49Å; P204-V207 PolarHBondContact O-N 3.18Å; G205-V207 VanDerWaalsContact C-N 3.27Å; G205-V207 PolarHBondContact O-N 3.3Å; V207-L209 PolarHBondContact O-N 3.31Å; V207-N210 CarbonylContact O-C 3.55Å; V207-N210 WeakPolarHBondContact O-CA 3.23Å; V207-N210 VanDerWaalsContact O-CB 3.27Å; V207-N210 WeakPolarHBondContact O-CB 3.43Å; V207-N210 PolarHBondContact O-N 3.15Å; V207-L211 HydrophobicContact CG1-CD1 4.3Å; V207-L211 HydrophobicContact CG1-CG 4.4Å; V207-L211 WeakPolarHBondContact O-CG 3.3Å; V207-L211 PolarHBondContact O-N 2.98Å |
| 208 | Y | 96.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -50.5 | -54.2 | 176.2 | 179 | -101.8 | 0 | 0 | 0 | 112.6 | L157 I165 T168 A177 F180 T184 P204 G205 N210 L211 I212 | L157-Y208 HydrophobicContact CD1-CD1 3.68Å; L157-Y208 HydrophobicContact CD1-CD2 4.03Å; L157-Y208 HydrophobicContact CD1-CE1 4.3Å; L157-Y208 HydrophobicContact CD1-CG 3.54Å; I165-Y208 HydrophobicContact CD1-CD1 4.1Å; I165-Y208 HydrophobicContact CD1-CE1 3.91Å; T168-Y208 HydrophobicContact CG2-CE1 4.19Å; A177-Y208 PolarHBondContact O-OH 3.04Å; F180-Y208 HydrophobicContact CB-CD2 3.95Å; F180-Y208 HydrophobicContact CB-CE2 3.48Å; F180-Y208 VanDerWaalsContact CB-CE2 3.48Å; T184-Y208 WeakPolarHBondContact OG1-CA 3.47Å; P204-Y208 PolarHBondContact O-N 2.88Å; G205-Y208 PolarHBondContact O-N 2.95Å; Y208-N210 PolarHBondContact O-N 3.48Å; Y208-L211 WeakPolarHBondContact O-CB 3Å; Y208-L211 PolarHBondContact O-N 3.04Å; Y208-L211 VanDerWaalsContact O-N 3.17Å; Y208-I212 HydrophobicContact CD1-CD1 3.8Å; Y208-I212 HydrophobicContact CE1-CD1 3.36Å; Y208-I212 HydrophobicContact CE2-CD1 4.24Å; Y208-I212 HydrophobicContact CG-CD1 4.39Å; Y208-I212 PolarHBondContact O-N 3.21Å; Y208-I212 VanDerWaalsContact O-N 3.16Å |
| 209 | L | 95.2 | Very high | 93.2 | Very high | 28 Ų | 28 | 57.2 Ų | 57.2 | 15% | 0.147 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65 | -29.5 | 178 | -62.9 | 176.1 | 0 | 0 | 0 | 112.4 | L164 I165 G205 V207 K213 F227 | L164-L209 HydrophobicContact CD2-CD1 3.59Å; L164-L209 HydrophobicContact CD2-CD2 3.75Å; L164-L209 HydrophobicContact CD2-CG 4.33Å; L164-L209 HydrophobicContact CG-CD2 4.17Å; I165-L209 HydrophobicContact CD1-CD2 4.43Å; G205-L209 VanDerWaalsContact O-CG 3.31Å; G205-L209 WeakPolarHBondContact O-CG 3.4Å; G205-L209 PolarHBondContact O-N 3.41Å; V207-L209 PolarHBondContact O-N 3.31Å; L209-K213 VanDerWaalsContact O-CB 3.31Å; L209-K213 WeakPolarHBondContact O-CB 3.34Å; L209-K213 PolarHBondContact O-N 2.92Å; L209-F227 HydrophobicContact CB-CE1 4.46Å; L209-F227 HydrophobicContact CB-CZ 4.46Å; L209-F227 HydrophobicContact CD2-CE1 4.1Å; L209-F227 HydrophobicContact CD2-CZ 4.3Å |
| 210 | N | 94.5 | Very high | 93.2 | Very high | 18 Ų | 18 | 61.1 Ų | 61.1 | 10% | 0.096 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -70.6 | -38.3 | 175.8 | -169.3 | 72.5 | 0 | 0 | 0 | 112.2 | L193 R202 G206 V207 Y208 K213 H214 | L193-N210 HydrophobicContact CD2-CB 4.49Å; L193-N210 VanDerWaalsContact CD2-ND2 3.25Å; L193-N210 WeakPolarHBondContact CD2-ND2 3.23Å; R202-N210 PolarHBondContact NH1-OD1 2.96Å; R202-N210 PolarHBondContact NH2-OD1 3.22Å; G206-N210 VanDerWaalsContact O-CB 3.25Å; G206-N210 WeakPolarHBondContact O-CB 3.31Å; G206-N210 PolarHBondContact O-N 3.05Å; V207-N210 CarbonylContact O-C 3.55Å; V207-N210 WeakPolarHBondContact O-CA 3.23Å; V207-N210 VanDerWaalsContact O-CB 3.27Å; V207-N210 WeakPolarHBondContact O-CB 3.43Å; V207-N210 PolarHBondContact O-N 3.15Å; Y208-N210 PolarHBondContact O-N 3.48Å; N210-K213 PolarHBondContact O-N 2.72Å; N210-H214 PolarHBondContact O-N 3.08Å; N210-H214 VanDerWaalsContact O-N 3.11Å; N210-H214 PolarHBondContact O-ND1 2.99Å; N210-H214 PolarHBondContact OD1-CE1 2.98Å; N210-H214 PolarHBondContact OD1-ND1 3.32Å |
| 211 | L | 94.3 | Very high | 93.2 | Very high | 19 Ų | 19 | 60.8 Ų | 60.8 | 10% | 0.099 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.9 | -50.3 | 175.6 | -67.9 | 170.7 | 0 | 0 | 0 | 110.3 | F180 L183 T184 I187 V207 Y208 K213 H214 S215 | F180-L211 HydrophobicContact CD1-CB 3.92Å; F180-L211 HydrophobicContact CE1-CB 4.3Å; L183-L211 HydrophobicContact CB-CD1 4.26Å; L183-L211 HydrophobicContact CD2-CD1 4.03Å; L183-L211 HydrophobicContact CD2-CD2 4.03Å; L183-L211 HydrophobicContact CG-CD1 3.92Å; L183-L211 HydrophobicContact CG-CD2 4.44Å; T184-L211 WeakPolarHBondContact OG1-CD1 2.77Å; I187-L211 HydrophobicContact CD1-CD1 4Å; I187-L211 HydrophobicContact CD1-CD2 3.62Å; I187-L211 HydrophobicContact CD1-CG 4.28Å; V207-L211 HydrophobicContact CG1-CD1 4.3Å; V207-L211 HydrophobicContact CG1-CG 4.4Å; V207-L211 WeakPolarHBondContact O-CG 3.3Å; V207-L211 PolarHBondContact O-N 2.98Å; Y208-L211 WeakPolarHBondContact O-CB 3Å; Y208-L211 PolarHBondContact O-N 3.04Å; Y208-L211 VanDerWaalsContact O-N 3.17Å; L211-K213 VanDerWaalsContact C-N 3.28Å; L211-K213 PolarHBondContact O-N 3.38Å; L211-H214 PolarHBondContact O-N 3.09Å; L211-H214 VanDerWaalsContact O-N 3.13Å; L211-S215 VanDerWaalsContact O-CB 3.24Å; L211-S215 WeakPolarHBondContact O-CB 3.29Å; L211-S215 PolarHBondContact O-N 2.9Å; L211-S215 PolarHBondContact O-OG 3.05Å |
| 212 | I | 94.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 177.5 | -65.3 | 159.5 | 0 | 0 | 0 | 111.1 | T168 L172 F180 Y208 H214 S215 K223 I226 F227 | T168-I212 HydrophobicContact CG2-CD1 3.52Å; L172-I212 HydrophobicContact CD1-CD1 4.37Å; L172-I212 HydrophobicContact CD1-CG1 4.24Å; L172-I212 HydrophobicContact CD1-CG2 4.26Å; F180-I212 HydrophobicContact CB-CG1 4.42Å; F180-I212 HydrophobicContact CD1-CG1 4.21Å; F180-I212 HydrophobicContact CD2-CG1 3.79Å; F180-I212 HydrophobicContact CE1-CG1 4.49Å; F180-I212 HydrophobicContact CE2-CG1 4.11Å; F180-I212 HydrophobicContact CG-CG1 3.88Å; F180-I212 HydrophobicContact CZ-CG1 4.47Å; Y208-I212 HydrophobicContact CD1-CD1 3.8Å; Y208-I212 HydrophobicContact CE1-CD1 3.36Å; Y208-I212 HydrophobicContact CE2-CD1 4.24Å; Y208-I212 HydrophobicContact CG-CD1 4.39Å; Y208-I212 PolarHBondContact O-N 3.21Å; Y208-I212 VanDerWaalsContact O-N 3.16Å; I212-H214 VanDerWaalsContact C-N 3.31Å; I212-H214 PolarHBondContact O-N 2.7Å; I212-S215 PolarHBondContact O-OG 3.22Å; I212-K223 WeakPolarHBondContact O-CE 3.34Å; I212-I226 HydrophobicContact CG2-CD1 4.24Å; I212-F227 HydrophobicContact CG2-CE2 4.24Å; I212-F227 HydrophobicContact CG2-CZ 4.46Å |
| 213 | K | 92.7 | Very high | 93.2 | Very high | 128 Ų | 128 | 56.5 Ų | 56.5 | 56% | 0.557 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.6 | -36.8 | 179.3 | -172.9 | 175.6 | -179.9 | -177.8 | 0 | 112.7 | L209 N210 L211 K223 F227 | L209-K213 VanDerWaalsContact O-CB 3.31Å; L209-K213 WeakPolarHBondContact O-CB 3.34Å; L209-K213 PolarHBondContact O-N 2.92Å; N210-K213 PolarHBondContact O-N 2.72Å; L211-K213 VanDerWaalsContact C-N 3.28Å; L211-K213 PolarHBondContact O-N 3.38Å; K213-K223 PolarHBondContact O-NZ 3.33Å; K213-F227 HydrophobicContact CB-CE2 4.44Å |
| 214 | H | 89.9 | Confident | 93.1 | Very high | 88 Ų | 88 | 59.4 Ų | 59.4 | 41% | 0.407 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -106.6 | -8.3 | -171.9 | -61.2 | 96.9 | 0 | 0 | 0 | 115.2 | N210 L211 I212 | N210-H214 PolarHBondContact O-N 3.08Å; N210-H214 VanDerWaalsContact O-N 3.11Å; N210-H214 PolarHBondContact O-ND1 2.99Å; N210-H214 PolarHBondContact OD1-CE1 2.98Å; N210-H214 PolarHBondContact OD1-ND1 3.32Å; L211-H214 PolarHBondContact O-N 3.09Å; L211-H214 VanDerWaalsContact O-N 3.13Å; I212-H214 VanDerWaalsContact C-N 3.31Å; I212-H214 PolarHBondContact O-N 2.7Å |
| 215 | S | 88.4 | Confident | 93 | Very high | 18 Ų | 18 | 59.6 Ų | 59.6 | 13% | 0.126 | 28% | 0.284 | C | S | . | . | trans | -63.9 | 140.3 | 178.3 | 62.7 | 0 | 0 | 0 | 0 | 111.4 | F180 L211 I212 S217 V218 K223 | F180-S215 WeakPolarHBondContact CZ-OG 3.21Å; L211-S215 VanDerWaalsContact O-CB 3.24Å; L211-S215 WeakPolarHBondContact O-CB 3.29Å; L211-S215 PolarHBondContact O-N 2.9Å; L211-S215 PolarHBondContact O-OG 3.05Å; I212-S215 PolarHBondContact O-OG 3.22Å; S215-S217 VanDerWaalsContact C-N 3.33Å; S215-V218 VanDerWaalsContact OG-CG2 3.23Å; S215-V218 WeakPolarHBondContact OG-CG2 3.11Å; S215-K223 WeakPolarHBondContact O-CE 3.35Å; S215-K223 PolarHBondContact O-NZ 3.39Å | ||
| 216 | Y | 85.4 | Confident | 92.9 | Very high | 162 Ų | 162 | 59.6 Ų | 59.6 | 64% | 0.635 | 28% | 0.284 | S | S | * | . | S | Bend | trans | -80.5 | -20.9 | 172.8 | 58.1 | -86.1 | 0 | 0 | 0 | 111.5 | P126 V218 | P126-Y216 VanDerWaalsContact CA-OH 3.25Å; P126-Y216 WeakPolarHBondContact CA-OH 3.46Å; P126-Y216 HydrophobicContact CB-CE1 4.06Å; P126-Y216 HydrophobicContact CB-CE2 4.41Å; P126-Y216 WeakPolarHBondContact CB-OH 3.33Å; Y216-V218 VanDerWaalsContact C-N 3.28Å; Y216-V218 PolarHBondContact O-N 3.24Å |
| 217 | S | 86.5 | Confident | 92.9 | Very high | 60 Ų | 60 | 61.4 Ų | 61.4 | 42% | 0.42 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -61.3 | -36.1 | 177.2 | 175.7 | 0 | 0 | 0 | 0 | 111.8 | R176 S215 | R176-S217 PolarHBondContact NH2-O 3.43Å; R176-S217 PolarHBondContact NH2-OG 3.39Å; S215-S217 VanDerWaalsContact C-N 3.33Å |
| 218 | V | 91.2 | Very high | 92.6 | Very high | 6 Ų | 6 | 65.8 Ų | 65.8 | 4% | 0.036 | 31% | 0.311 | C | S | . | . | S | Bend | trans | -88 | 128 | -176.5 | -177.2 | 0 | 0 | 0 | 0 | 110.7 | L172 R176 F180 S215 Y216 E222 K223 | L172-V218 HydrophobicContact CD1-CG2 4.45Å; L172-V218 HydrophobicContact CD2-CB 4.41Å; L172-V218 HydrophobicContact CD2-CG1 3.63Å; L172-V218 HydrophobicContact CD2-CG2 3.89Å; R176-V218 VanDerWaalsContact NH2-CA 3.35Å; F180-V218 HydrophobicContact CE2-CG2 3.65Å; F180-V218 HydrophobicContact CZ-CG2 3.62Å; S215-V218 VanDerWaalsContact OG-CG2 3.23Å; S215-V218 WeakPolarHBondContact OG-CG2 3.11Å; Y216-V218 VanDerWaalsContact C-N 3.28Å; Y216-V218 PolarHBondContact O-N 3.24Å; V218-E222 HydrophobicContact CG1-CB 3.73Å; V218-E222 WeakPolarHBondContact CG1-OE2 3.46Å; V218-K223 HydrophobicContact CB-CG 4.31Å; V218-K223 HydrophobicContact CG1-CD 4.48Å; V218-K223 HydrophobicContact CG1-CG 3.64Å; V218-K223 VanDerWaalsContact O-CE 3.23Å; V218-K223 WeakPolarHBondContact O-CE 3.44Å |
| 219 | K | 93.5 | Very high | 92.2 | Very high | 139 Ų | 139 | 69.6 Ų | 69.6 | 60% | 0.604 | 33% | 0.33 | S | S | * | . | trans | -64.5 | 151.2 | 178.8 | -66.7 | 175.5 | -177.7 | 168.7 | 0 | 110.5 | E221 E222 K223 | K219-E221 PolarHBondContact O-N 3.27Å; K219-E222 HydrophobicContact CB-CB 4.47Å; K219-E222 HydrophobicContact CB-CG 4.06Å; K219-E222 PolarHBondContact N-OE2 2.85Å; K219-E222 PolarHBondContact O-N 2.87Å; K219-K223 WeakPolarHBondContact O-CG 3.28Å; K219-K223 PolarHBondContact O-N 3.41Å; K219-K223 VanDerWaalsContact O-N 3.11Å | ||
| 220 | K | 93.3 | Very high | 91.8 | Very high | 160 Ų | 160 | 69.8 Ų | 69.8 | 70% | 0.696 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -61.2 | -30.5 | 178.8 | -171.1 | 177.6 | -178.2 | 179.2 | 0 | 112.5 | K224 | K220-K224 VanDerWaalsContact O-CG 3.31Å; K220-K224 WeakPolarHBondContact O-CG 3.44Å; K220-K224 PolarHBondContact O-N 3.33Å; K220-K224 VanDerWaalsContact O-N 3.16Å |
| 221 | E | 94.2 | Very high | 91.5 | Very high | 152 Ų | 152 | 77.2 Ų | 77.2 | 71% | 0.71 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -70.1 | -47.6 | 178.3 | -66.8 | 174.3 | -177 | 0 | 0 | 111.4 | K219 K223 K224 S225 | K219-E221 PolarHBondContact O-N 3.27Å; E221-K223 VanDerWaalsContact C-N 3.32Å; E221-K223 PolarHBondContact O-N 2.94Å; E221-K224 WeakPolarHBondContact O-CA 3.26Å; E221-K224 WeakPolarHBondContact O-CB 3.42Å; E221-K224 PolarHBondContact O-N 3.3Å; E221-S225 PolarHBondContact O-N 3.49Å; E221-S225 PolarHBondContact O-OG 3.38Å |
| 222 | E | 94.8 | Very high | 91.3 | Very high | 37 Ų | 37 | 80.7 Ų | 80.7 | 17% | 0.173 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -55.2 | -45.7 | 173.2 | -64.8 | 167 | 173.3 | 0 | 0 | 111.2 | I171 L172 R176 V218 K219 K224 S225 I226 | I171-E222 HydrophobicContact CG2-CB 3.8Å; I171-E222 HydrophobicContact CG2-CG 4.01Å; L172-E222 HydrophobicContact CD2-CB 4.36Å; R176-E222 IonicContact NH1-OE1 3.64Å; R176-E222 IonicContact NH1-OE2 3.18Å; R176-E222 PolarHBondContact NH1-OE2 2.92Å; V218-E222 HydrophobicContact CG1-CB 3.73Å; V218-E222 WeakPolarHBondContact CG1-OE2 3.46Å; K219-E222 HydrophobicContact CB-CB 4.47Å; K219-E222 HydrophobicContact CB-CG 4.06Å; K219-E222 PolarHBondContact N-OE2 2.85Å; K219-E222 PolarHBondContact O-N 2.87Å; E222-K224 VanDerWaalsContact C-N 3.28Å; E222-K224 PolarHBondContact O-N 3.11Å; E222-S225 WeakPolarHBondContact CA-OG 3.43Å; E222-S225 PolarHBondContact O-N 3.49Å; E222-S225 PolarHBondContact O-OG 3.45Å; E222-I226 WeakPolarHBondContact O-CD1 3.32Å; E222-I226 VanDerWaalsContact O-CG1 3.24Å; E222-I226 WeakPolarHBondContact O-CG1 3.44Å; E222-I226 PolarHBondContact O-N 3.19Å |
| 223 | K | 94.6 | Very high | 91 | Very high | 43 Ų | 43 | 85 Ų | 85 | 19% | 0.187 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -60.7 | -38.9 | 175.6 | -64.7 | 178.9 | -172.9 | -172.5 | 0 | 112.3 | I212 K213 S215 V218 K219 E221 F227 | I212-K223 WeakPolarHBondContact O-CE 3.34Å; K213-K223 PolarHBondContact O-NZ 3.33Å; S215-K223 WeakPolarHBondContact O-CE 3.35Å; S215-K223 PolarHBondContact O-NZ 3.39Å; V218-K223 HydrophobicContact CB-CG 4.31Å; V218-K223 HydrophobicContact CG1-CD 4.48Å; V218-K223 HydrophobicContact CG1-CG 3.64Å; V218-K223 VanDerWaalsContact O-CE 3.23Å; V218-K223 WeakPolarHBondContact O-CE 3.44Å; K219-K223 WeakPolarHBondContact O-CG 3.28Å; K219-K223 PolarHBondContact O-N 3.41Å; K219-K223 VanDerWaalsContact O-N 3.11Å; E221-K223 VanDerWaalsContact C-N 3.32Å; E221-K223 PolarHBondContact O-N 2.94Å; K223-F227 WeakPolarHBondContact O-CD2 3.26Å; K223-F227 PolarHBondContact O-N 2.75Å |
| 224 | K | 93.8 | Very high | 90.8 | Very high | 125 Ų | 125 | 86.4 Ų | 86.4 | 54% | 0.543 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -68.2 | -45.3 | 179 | -75.1 | 171.7 | 178.6 | -179 | 0 | 110.5 | K220 E221 E222 I226 F227 L228 | K220-K224 VanDerWaalsContact O-CG 3.31Å; K220-K224 WeakPolarHBondContact O-CG 3.44Å; K220-K224 PolarHBondContact O-N 3.33Å; K220-K224 VanDerWaalsContact O-N 3.16Å; E221-K224 WeakPolarHBondContact O-CA 3.26Å; E221-K224 WeakPolarHBondContact O-CB 3.42Å; E221-K224 PolarHBondContact O-N 3.3Å; E222-K224 VanDerWaalsContact C-N 3.28Å; E222-K224 PolarHBondContact O-N 3.11Å; K224-I226 VanDerWaalsContact C-N 3.32Å; K224-I226 PolarHBondContact O-N 3.4Å; K224-F227 PolarHBondContact O-N 3.4Å; K224-L228 WeakPolarHBondContact O-CB 3.38Å; K224-L228 PolarHBondContact O-N 3.47Å |
| 225 | S | 93.4 | Very high | 90.9 | Very high | 53 Ų | 53 | 86.2 Ų | 86.2 | 37% | 0.371 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.3 | -39.5 | -179.8 | 46.7 | 0 | 0 | 0 | 0 | 112.1 | I171 E221 E222 | I171-S225 WeakPolarHBondContact CD1-OG 3.49Å; E221-S225 PolarHBondContact O-N 3.49Å; E221-S225 PolarHBondContact O-OG 3.38Å; E222-S225 WeakPolarHBondContact CA-OG 3.43Å; E222-S225 PolarHBondContact O-N 3.49Å; E222-S225 PolarHBondContact O-OG 3.45Å |
| 226 | I | 94.1 | Very high | 91.1 | Very high | 0 Ų | 0 | 91.4 Ų | 91.4 | 0% | 0 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.8 | -53.2 | 176.3 | -64 | 164.9 | 0 | 0 | 0 | 111.3 | L164 R167 T168 I171 L172 I212 E222 K224 | L164-I226 HydrophobicContact CD1-CG2 3.72Å; R167-I226 PolarHBondContact NH1-O 3.46Å; T168-I226 HydrophobicContact CG2-CD1 4.36Å; T168-I226 WeakPolarHBondContact OG1-CG2 3.37Å; I171-I226 HydrophobicContact CB-CD1 4.37Å; I171-I226 HydrophobicContact CB-CG1 4.02Å; I171-I226 HydrophobicContact CD1-CB 4.38Å; I171-I226 HydrophobicContact CD1-CG1 3.55Å; I171-I226 HydrophobicContact CG1-CG1 4.37Å; I171-I226 HydrophobicContact CG2-CD1 4.17Å; I171-I226 HydrophobicContact CG2-CG1 4.04Å; L172-I226 HydrophobicContact CD1-CD1 4.35Å; L172-I226 HydrophobicContact CD2-CD1 4.12Å; L172-I226 HydrophobicContact CG-CD1 4.04Å; I212-I226 HydrophobicContact CG2-CD1 4.24Å; E222-I226 WeakPolarHBondContact O-CD1 3.32Å; E222-I226 VanDerWaalsContact O-CG1 3.24Å; E222-I226 WeakPolarHBondContact O-CG1 3.44Å; E222-I226 PolarHBondContact O-N 3.19Å; K224-I226 VanDerWaalsContact C-N 3.32Å; K224-I226 PolarHBondContact O-N 3.4Å |
| 227 | F | 93.3 | Very high | 91.4 | Very high | 54 Ų | 54 | 89.8 Ų | 89.8 | 24% | 0.237 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -93 | -10.1 | -168.2 | -65.3 | -66.3 | 0 | 0 | 0 | 115.6 | L164 L209 I212 K213 K223 K224 R231 | L164-F227 HydrophobicContact CD1-CD1 4.21Å; L164-F227 HydrophobicContact CD1-CE1 4.29Å; L209-F227 HydrophobicContact CB-CE1 4.46Å; L209-F227 HydrophobicContact CB-CZ 4.46Å; L209-F227 HydrophobicContact CD2-CE1 4.1Å; L209-F227 HydrophobicContact CD2-CZ 4.3Å; I212-F227 HydrophobicContact CG2-CE2 4.24Å; I212-F227 HydrophobicContact CG2-CZ 4.46Å; K213-F227 HydrophobicContact CB-CE2 4.44Å; K223-F227 WeakPolarHBondContact O-CD2 3.26Å; K223-F227 PolarHBondContact O-N 2.75Å; K224-F227 PolarHBondContact O-N 3.4Å; F227-R231 VanDerWaalsContact O-CB 3.3Å; F227-R231 WeakPolarHBondContact O-CB 3.44Å; F227-R231 PolarHBondContact O-N 3.43Å |
| 228 | L | 89.9 | Confident | 91.7 | Very high | 91 Ų | 91 | 94.3 Ų | 94.3 | 48% | 0.476 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.1 | -48.9 | -173.8 | 178.9 | 63.5 | 0 | 0 | 0 | 112.7 | K224 D230 R231 Q232 | K224-L228 WeakPolarHBondContact O-CB 3.38Å; K224-L228 PolarHBondContact O-N 3.47Å; L228-D230 PolarHBondContact O-N 3.07Å; L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.8Å; L228-Q232 HydrophobicContact CD1-CG 4.48Å; L228-Q232 WeakPolarHBondContact O-CG 3.45Å; L228-Q232 PolarHBondContact O-N 2.81Å |
| 229 | I | 87.9 | Confident | 91.8 | Very high | 80 Ų | 80 | 102.8 Ų | 102.8 | 41% | 0.41 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.4 | -45.5 | -177 | -56.4 | 173.6 | 0 | 0 | 0 | 109.8 | R231 Q232 M233 | I229-R231 VanDerWaalsContact C-N 3.32Å; I229-R231 PolarHBondContact O-N 3.1Å; I229-Q232 WeakPolarHBondContact O-CB 3.31Å; I229-Q232 PolarHBondContact O-N 2.97Å; I229-Q232 VanDerWaalsContact O-N 3.1Å; I229-M233 HydrophobicContact CG2-CG 4.36Å; I229-M233 WeakPolarHBondContact O-CG 3.27Å; I229-M233 PolarHBondContact O-N 3.48Å |
| 230 | D | 87.8 | Confident | 91.8 | Very high | 33 Ų | 33 | 98.6 Ų | 98.6 | 18% | 0.176 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -61.2 | -40.1 | 176.8 | -86.5 | 15.6 | 0 | 0 | 0 | 113.2 | N161 L164 R167 L228 Q232 M233 K234 | N161-D230 PolarHBondContact ND2-OD1 3.29Å; N161-D230 PolarHBondContact ND2-OD2 3.47Å; L164-D230 WeakPolarHBondContact CB-OD2 3.33Å; L164-D230 VanDerWaalsContact CD1-OD2 3.3Å; L164-D230 WeakPolarHBondContact CD1-OD2 3.35Å; L164-D230 VanDerWaalsContact CD2-OD2 3.3Å; L164-D230 WeakPolarHBondContact CD2-OD2 3.17Å; L164-D230 WeakPolarHBondContact CG-OD2 3.37Å; R167-D230 IonicContact CZ-OD1 3.29Å; R167-D230 IonicContact NH1-OD1 3.68Å; R167-D230 VanDerWaalsContact NH2-CG 3.3Å; R167-D230 IonicContact NH2-OD1 3.06Å; R167-D230 PolarHBondContact NH2-OD1 3.32Å; R167-D230 IonicContact NH2-OD2 3.79Å; L228-D230 PolarHBondContact O-N 3.07Å; D230-Q232 VanDerWaalsContact C-N 3.33Å; D230-M233 PolarHBondContact O-N 3.49Å; D230-K234 WeakPolarHBondContact O-CB 3.33Å; D230-K234 PolarHBondContact O-N 2.99Å |
| 231 | R | 87.7 | Confident | 91.9 | Very high | 173 Ų | 173 | 98.7 Ų | 98.7 | 65% | 0.653 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -61.3 | -45.5 | 174.2 | -176.5 | 178 | 178.2 | -179.7 | 0.8 | 110.7 | F227 L228 I229 K234 D235 | F227-R231 VanDerWaalsContact O-CB 3.3Å; F227-R231 WeakPolarHBondContact O-CB 3.44Å; F227-R231 PolarHBondContact O-N 3.43Å; L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.8Å; I229-R231 VanDerWaalsContact C-N 3.32Å; I229-R231 PolarHBondContact O-N 3.1Å; R231-K234 PolarHBondContact O-N 2.99Å; R231-D235 VanDerWaalsContact O-CB 3.31Å; R231-D235 WeakPolarHBondContact O-CB 3.49Å; R231-D235 PolarHBondContact O-N 2.87Å |
| 232 | Q | 90.4 | Very high | 91.9 | Very high | 92 Ų | 92 | 99.5 Ų | 99.5 | 43% | 0.43 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.2 | -43.6 | 177.2 | -69.8 | 178.3 | -0 | 0 | 0 | 112 | L228 I229 D230 D235 K236 | L228-Q232 HydrophobicContact CD1-CG 4.48Å; L228-Q232 WeakPolarHBondContact O-CG 3.45Å; L228-Q232 PolarHBondContact O-N 2.81Å; I229-Q232 WeakPolarHBondContact O-CB 3.31Å; I229-Q232 PolarHBondContact O-N 2.97Å; I229-Q232 VanDerWaalsContact O-N 3.1Å; D230-Q232 VanDerWaalsContact C-N 3.33Å; Q232-D235 PolarHBondContact O-N 3.29Å; Q232-K236 WeakPolarHBondContact O-CB 3.37Å; Q232-K236 VanDerWaalsContact O-CG 3.27Å; Q232-K236 WeakPolarHBondContact O-CG 3.39Å; Q232-K236 PolarHBondContact O-N 3.45Å |
| 233 | M | 88.4 | Confident | 91.8 | Very high | 92 Ų | 92 | 101.5 Ų | 101.5 | 45% | 0.453 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 177.5 | -70.5 | -55.5 | 138.5 | 0 | 0 | 111.7 | I229 D230 D235 K236 L237 | I229-M233 HydrophobicContact CG2-CG 4.36Å; I229-M233 WeakPolarHBondContact O-CG 3.27Å; I229-M233 PolarHBondContact O-N 3.48Å; D230-M233 PolarHBondContact O-N 3.49Å; M233-D235 VanDerWaalsContact C-N 3.34Å; M233-D235 PolarHBondContact O-N 3.01Å; M233-K236 HydrophobicContact CE-CD 4.23Å; M233-K236 PolarHBondContact O-N 3.4Å; M233-K236 HydrophobicContact SD-CD 4.21Å; M233-L237 WeakPolarHBondContact O-CB 3.21Å; M233-L237 PolarHBondContact O-N 3.43Å |
| 234 | K | 89.2 | Confident | 91.6 | Very high | 157 Ų | 157 | 102.7 Ų | 102.7 | 68% | 0.683 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.2 | -40 | 175.1 | -173.2 | 173.1 | -176.7 | 170 | 0 | 112.3 | D230 R231 K238 | D230-K234 WeakPolarHBondContact O-CB 3.33Å; D230-K234 PolarHBondContact O-N 2.99Å; R231-K234 PolarHBondContact O-N 2.99Å; K234-K238 VanDerWaalsContact O-CB 3.25Å; K234-K238 WeakPolarHBondContact O-CB 3.37Å; K234-K238 PolarHBondContact O-N 3.29Å |
| 235 | D | 91.2 | Very high | 91.5 | Very high | 84 Ų | 84 | 103.6 Ų | 103.6 | 45% | 0.449 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.6 | -40.7 | 177 | -75 | -22.3 | 0 | 0 | 0 | 111.6 | R231 Q232 M233 K238 R239 | R231-D235 VanDerWaalsContact O-CB 3.31Å; R231-D235 WeakPolarHBondContact O-CB 3.49Å; R231-D235 PolarHBondContact O-N 2.87Å; Q232-D235 PolarHBondContact O-N 3.29Å; M233-D235 VanDerWaalsContact C-N 3.34Å; M233-D235 PolarHBondContact O-N 3.01Å; D235-K238 PolarHBondContact O-N 3.15Å; D235-R239 WeakPolarHBondContact O-CB 3.42Å; D235-R239 PolarHBondContact O-N 2.77Å |
| 236 | K | 92.7 | Very high | 91.3 | Very high | 127 Ų | 127 | 107.6 Ų | 107.6 | 55% | 0.552 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.9 | -49.7 | 172.6 | -74.3 | 173.7 | -178.8 | -177.4 | 0 | 111.3 | Q232 M233 K238 R239 A240 | Q232-K236 WeakPolarHBondContact O-CB 3.37Å; Q232-K236 VanDerWaalsContact O-CG 3.27Å; Q232-K236 WeakPolarHBondContact O-CG 3.39Å; Q232-K236 PolarHBondContact O-N 3.45Å; M233-K236 HydrophobicContact CE-CD 4.23Å; M233-K236 PolarHBondContact O-N 3.4Å; M233-K236 HydrophobicContact SD-CD 4.21Å; K236-K238 VanDerWaalsContact C-N 3.34Å; K236-K238 PolarHBondContact O-N 3.13Å; K236-R239 PolarHBondContact O-N 3.4Å; K236-A240 WeakPolarHBondContact O-CB 3.45Å; K236-A240 PolarHBondContact O-N 3.4Å |
| 237 | L | 91.5 | Very high | 91.1 | Very high | 127 Ų | 127 | 111.2 Ų | 111.2 | 67% | 0.665 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.2 | -41.9 | 177.8 | -177.5 | 61.8 | 0 | 0 | 0 | 111.8 | M233 R239 A240 R241 | M233-L237 WeakPolarHBondContact O-CB 3.21Å; M233-L237 PolarHBondContact O-N 3.43Å; L237-R239 PolarHBondContact O-N 3.18Å; L237-A240 PolarHBondContact O-N 2.99Å; L237-R241 WeakPolarHBondContact O-CB 3.41Å; L237-R241 PolarHBondContact O-N 2.95Å |
| 238 | K | 93.5 | Very high | 90.9 | Very high | 155 Ų | 155 | 117.3 Ų | 117.3 | 67% | 0.674 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 175.4 | -174.9 | 178.7 | 179.7 | -179 | 0 | 111.9 | K234 D235 K236 R242 | K234-K238 VanDerWaalsContact O-CB 3.25Å; K234-K238 WeakPolarHBondContact O-CB 3.37Å; K234-K238 PolarHBondContact O-N 3.29Å; D235-K238 PolarHBondContact O-N 3.15Å; K236-K238 VanDerWaalsContact C-N 3.34Å; K236-K238 PolarHBondContact O-N 3.13Å; K238-R242 WeakPolarHBondContact O-CB 3.47Å; K238-R242 PolarHBondContact O-N 3.06Å |
| 239 | R | 93.6 | Very high | 90.8 | Very high | 185 Ų | 185 | 120.1 Ų | 120.1 | 70% | 0.698 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.1 | -44.7 | 175.9 | -175.3 | 178.3 | -78.9 | -179.4 | -4.4 | 111.1 | D235 K236 L237 R242 N243 | D235-R239 WeakPolarHBondContact O-CB 3.42Å; D235-R239 PolarHBondContact O-N 2.77Å; K236-R239 PolarHBondContact O-N 3.4Å; L237-R239 PolarHBondContact O-N 3.18Å; R239-R242 WeakPolarHBondContact O-CB 3.29Å; R239-R242 PolarHBondContact O-N 2.99Å; R239-N243 PolarHBondContact O-N 2.94Å; R239-N243 PolarHBondContact O-OD1 2.97Å |
| 240 | A | 93.6 | Very high | 90.6 | Very high | 51 Ų | 51 | 124 Ų | 124 | 42% | 0.421 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -57.8 | -50.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | K236 L237 R242 N243 S244 | K236-A240 WeakPolarHBondContact O-CB 3.45Å; K236-A240 PolarHBondContact O-N 3.4Å; L237-A240 PolarHBondContact O-N 2.99Å; A240-R242 VanDerWaalsContact C-N 3.27Å; A240-R242 PolarHBondContact O-N 3.46Å; A240-N243 PolarHBondContact O-N 3.38Å; A240-S244 PolarHBondContact O-N 3.26Å; A240-S244 PolarHBondContact O-OG 2.66Å; A240-S244 VanDerWaalsContact O-OG 3.11Å |
| 241 | R | 93.8 | Very high | 90.2 | Very high | 162 Ų | 162 | 127.6 Ų | 127.6 | 61% | 0.611 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -57.6 | -37.9 | 176 | -170.5 | 178.2 | -172.8 | -170.3 | 1.9 | 112.7 | L237 R245 | L237-R241 WeakPolarHBondContact O-CB 3.41Å; L237-R241 PolarHBondContact O-N 2.95Å; R241-R245 VanDerWaalsContact O-CG 3.27Å; R241-R245 WeakPolarHBondContact O-CG 3.49Å; R241-R245 PolarHBondContact O-N 3.34Å; R241-R245 VanDerWaalsContact O-N 3.15Å |
| 242 | R | 93.8 | Very high | 89.6 | Confident | 168 Ų | 168 | 125.9 Ų | 125.9 | 63% | 0.634 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68 | -40.2 | 176.3 | -166.1 | -179.8 | -146.1 | 169.6 | 5.5 | 111.8 | K238 R239 A240 R246 | K238-R242 WeakPolarHBondContact O-CB 3.47Å; K238-R242 PolarHBondContact O-N 3.06Å; R239-R242 WeakPolarHBondContact O-CB 3.29Å; R239-R242 PolarHBondContact O-N 2.99Å; A240-R242 VanDerWaalsContact C-N 3.27Å; A240-R242 PolarHBondContact O-N 3.46Å; R242-R246 WeakPolarHBondContact O-CG 3.41Å; R242-R246 PolarHBondContact O-N 2.91Å |
| 243 | N | 93 | Very high | 88.8 | Confident | 79 Ų | 79 | 124 Ų | 124 | 42% | 0.422 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.4 | -45.6 | 177.5 | -74.3 | 6.1 | 0 | 0 | 0 | 111.1 | R239 A240 R245 R246 V247 | R239-N243 PolarHBondContact O-N 2.94Å; R239-N243 PolarHBondContact O-OD1 2.97Å; A240-N243 PolarHBondContact O-N 3.38Å; N243-R245 VanDerWaalsContact C-N 3.27Å; N243-R245 PolarHBondContact O-N 2.93Å; N243-R246 WeakPolarHBondContact O-CA 3.43Å; N243-R246 WeakPolarHBondContact O-CB 3.26Å; N243-R246 PolarHBondContact O-N 3.5Å; N243-V247 PolarHBondContact O-N 3.26Å |
| 244 | S | 90.4 | Very high | 87.9 | Confident | 69 Ų | 69 | 124.9 Ų | 124.9 | 48% | 0.483 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -59.9 | -36.9 | 176.2 | -51.5 | 0 | 0 | 0 | 0 | 112.5 | A240 R246 V247 R248 | A240-S244 PolarHBondContact O-N 3.26Å; A240-S244 PolarHBondContact O-OG 2.66Å; A240-S244 VanDerWaalsContact O-OG 3.11Å; S244-R246 VanDerWaalsContact C-N 3.29Å; S244-R246 PolarHBondContact O-N 3.21Å; S244-V247 PolarHBondContact O-N 3Å; S244-R248 WeakPolarHBondContact O-CG 3.5Å; S244-R248 PolarHBondContact O-N 3.36Å |
| 245 | R | 91.8 | Very high | 86.6 | Confident | 144 Ų | 144 | 123.4 Ų | 123.4 | 54% | 0.543 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.7 | -28 | 172.8 | -75.5 | 174.7 | 178.2 | -168.1 | -3.2 | 113.6 | R241 N243 K249 | R241-R245 VanDerWaalsContact O-CG 3.27Å; R241-R245 WeakPolarHBondContact O-CG 3.49Å; R241-R245 PolarHBondContact O-N 3.34Å; R241-R245 VanDerWaalsContact O-N 3.15Å; N243-R245 VanDerWaalsContact C-N 3.27Å; N243-R245 PolarHBondContact O-N 2.93Å; R245-K249 VanDerWaalsContact O-CG 3.31Å; R245-K249 WeakPolarHBondContact O-CG 3.41Å; R245-K249 PolarHBondContact O-N 3.3Å |
| 246 | R | 90.7 | Very high | 85 | Confident | 137 Ų | 137 | 124.4 Ų | 124.4 | 52% | 0.517 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -75.3 | -46.1 | 175.4 | -73.4 | 171.8 | 172.3 | -178.7 | -7 | 110.3 | R242 N243 S244 R248 K249 Y250 | R242-R246 WeakPolarHBondContact O-CG 3.41Å; R242-R246 PolarHBondContact O-N 2.91Å; N243-R246 WeakPolarHBondContact O-CA 3.43Å; N243-R246 WeakPolarHBondContact O-CB 3.26Å; N243-R246 PolarHBondContact O-N 3.5Å; S244-R246 VanDerWaalsContact C-N 3.29Å; S244-R246 PolarHBondContact O-N 3.21Å; R246-R248 PolarHBondContact O-N 3.3Å; R246-K249 WeakPolarHBondContact O-CB 3.45Å; R246-K249 PolarHBondContact O-N 3.41Å; R246-K249 VanDerWaalsContact O-N 3.15Å; R246-Y250 HydrophobicContact CB-CE2 4.49Å; R246-Y250 WeakPolarHBondContact O-CD2 3.3Å; R246-Y250 PolarHBondContact O-N 3.39Å |
| 247 | V | 89.6 | Confident | 83.3 | Confident | 76 Ų | 76 | 123.6 Ų | 123.6 | 46% | 0.461 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -57.9 | -49.6 | 178 | 176.8 | 0 | 0 | 0 | 0 | 110.9 | N243 S244 K249 Y250 E251 | N243-V247 PolarHBondContact O-N 3.26Å; S244-V247 PolarHBondContact O-N 3Å; V247-K249 PolarHBondContact O-N 3.23Å; V247-Y250 PolarHBondContact O-N 3.17Å; V247-E251 HydrophobicContact CG1-CG 4.31Å; V247-E251 WeakPolarHBondContact CG1-OE1 3.28Å; V247-E251 PolarHBondContact O-N 2.9Å |
| 248 | R | 88.9 | Confident | 81.4 | Confident | 182 Ų | 182 | 125.7 Ų | 125.7 | 69% | 0.687 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -56.5 | -35.4 | 176.3 | -73 | -177.7 | -179.6 | -170.5 | -2.1 | 113.9 | S244 R246 E252 | S244-R248 WeakPolarHBondContact O-CG 3.5Å; S244-R248 PolarHBondContact O-N 3.36Å; R246-R248 PolarHBondContact O-N 3.3Å; R248-E252 VanDerWaalsContact O-CB 3.26Å; R248-E252 WeakPolarHBondContact O-CB 3.43Å; R248-E252 PolarHBondContact O-N 3.49Å |
| 249 | K | 87.6 | Confident | 79.6 | Confident | 150 Ų | 150 | 125 Ų | 125 | 65% | 0.652 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.9 | -31.9 | 176.7 | -77.2 | -177.8 | 178.2 | -153.9 | 0 | 112.9 | R245 R246 V247 S253 | R245-K249 VanDerWaalsContact O-CG 3.31Å; R245-K249 WeakPolarHBondContact O-CG 3.41Å; R245-K249 PolarHBondContact O-N 3.3Å; R246-K249 WeakPolarHBondContact O-CB 3.45Å; R246-K249 PolarHBondContact O-N 3.41Å; R246-K249 VanDerWaalsContact O-N 3.15Å; V247-K249 PolarHBondContact O-N 3.23Å; K249-S253 PolarHBondContact O-N 3.02Å; K249-S253 PolarHBondContact O-OG 3.3Å |
| 250 | Y | 83.2 | Confident | 77.5 | Confident | 160 Ų | 160 | 121.4 Ų | 121.4 | 63% | 0.627 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -76.4 | -43.7 | 175.6 | -72.6 | -69 | 0 | 0 | 0 | 111 | R246 V247 E252 S253 D254 | R246-Y250 HydrophobicContact CB-CE2 4.49Å; R246-Y250 WeakPolarHBondContact O-CD2 3.3Å; R246-Y250 PolarHBondContact O-N 3.39Å; V247-Y250 PolarHBondContact O-N 3.17Å; Y250-E252 VanDerWaalsContact C-N 3.32Å; Y250-E252 PolarHBondContact O-N 2.83Å; Y250-S253 WeakPolarHBondContact CA-OG 3.47Å; Y250-S253 PolarHBondContact O-N 2.88Å; Y250-S253 VanDerWaalsContact O-N 3.15Å; Y250-S253 PolarHBondContact O-OG 2.92Å; Y250-D254 VanDerWaalsContact O-CG 3.27Å; Y250-D254 PolarHBondContact O-N 2.86Å |
| 251 | E | 80.1 | Confident | 75.5 | Confident | 109 Ų | 109 | 124.3 Ų | 124.3 | 51% | 0.509 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -58.7 | -43.3 | 174.7 | -69.8 | 169.6 | 171.3 | 0 | 0 | 111.6 | V247 S253 D254 I255 | V247-E251 HydrophobicContact CG1-CG 4.31Å; V247-E251 WeakPolarHBondContact CG1-OE1 3.28Å; V247-E251 PolarHBondContact O-N 2.9Å; E251-S253 PolarHBondContact O-N 3.3Å; E251-D254 PolarHBondContact O-N 2.97Å; E251-I255 WeakPolarHBondContact O-CD1 3.43Å; E251-I255 VanDerWaalsContact O-CG1 3.24Å; E251-I255 WeakPolarHBondContact O-CG1 3.46Å; E251-I255 PolarHBondContact O-N 3.22Å; E251-I255 VanDerWaalsContact O-N 3.1Å |
| 252 | E | 75.8 | Confident | 73.5 | Confident | 137 Ų | 137 | 123.7 Ų | 123.7 | 64% | 0.64 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.8 | -33.3 | 177 | -169.1 | 170 | -160.2 | 0 | 0 | 112.6 | R248 Y250 V256 | R248-E252 VanDerWaalsContact O-CB 3.26Å; R248-E252 WeakPolarHBondContact O-CB 3.43Å; R248-E252 PolarHBondContact O-N 3.49Å; Y250-E252 VanDerWaalsContact C-N 3.32Å; Y250-E252 PolarHBondContact O-N 2.83Å; E252-V256 WeakPolarHBondContact O-CG2 3.2Å; E252-V256 PolarHBondContact O-N 3.47Å |
| 253 | S | 73.6 | Confident | 71.6 | Confident | 54 Ų | 54 | 121.4 Ų | 121.4 | 38% | 0.378 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -73.8 | -30.8 | 174.1 | 59.4 | 0 | 0 | 0 | 0 | 113.5 | K249 Y250 E251 | K249-S253 PolarHBondContact O-N 3.02Å; K249-S253 PolarHBondContact O-OG 3.3Å; Y250-S253 WeakPolarHBondContact CA-OG 3.47Å; Y250-S253 PolarHBondContact O-N 2.88Å; Y250-S253 VanDerWaalsContact O-N 3.15Å; Y250-S253 PolarHBondContact O-OG 2.92Å; E251-S253 PolarHBondContact O-N 3.3Å |
| 254 | D | 69.2 | Low | 69.4 | Low | 110 Ų | 110 | 123.7 Ų | 123.7 | 59% | 0.588 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -74 | -35.7 | 178.3 | -68.2 | -18.9 | 0 | 0 | 0 | 110.9 | Y250 E251 V256 C257 | Y250-D254 VanDerWaalsContact O-CG 3.27Å; Y250-D254 PolarHBondContact O-N 2.86Å; E251-D254 PolarHBondContact O-N 2.97Å; D254-V256 VanDerWaalsContact C-N 3.3Å; D254-V256 PolarHBondContact O-N 3.23Å; D254-C257 PolarHBondContact O-N 3.47Å |
| 255 | I | 61.8 | Low | 67.5 | Low | 125 Ų | 125 | 129.6 Ų | 129.6 | 64% | 0.641 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -65.1 | -31.2 | 175.1 | -66.8 | 162 | 0 | 0 | 0 | 112.3 | E251 C257 | E251-I255 WeakPolarHBondContact O-CD1 3.43Å; E251-I255 VanDerWaalsContact O-CG1 3.24Å; E251-I255 WeakPolarHBondContact O-CG1 3.46Å; E251-I255 PolarHBondContact O-N 3.22Å; E251-I255 VanDerWaalsContact O-N 3.1Å; I255-C257 VanDerWaalsContact C-N 3.26Å; I255-C257 PolarHBondContact O-N 2.96Å |
| 256 | V | 57.4 | Low | 65.5 | Low | 105 Ų | 105 | 128.4 Ų | 128.4 | 64% | 0.636 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -18.9 | 179.4 | 172.6 | 0 | 0 | 0 | 0 | 112.5 | E252 D254 | E252-V256 WeakPolarHBondContact O-CG2 3.2Å; E252-V256 PolarHBondContact O-N 3.47Å; D254-V256 VanDerWaalsContact C-N 3.3Å; D254-V256 PolarHBondContact O-N 3.23Å |
| 257 | C | 57.1 | Low | 63.7 | Low | 110 Ų | 110 | 129 Ų | 129 | 74% | 0.743 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -15.4 | 178.9 | -72.2 | 0 | 0 | 0 | 0 | 114.3 | D254 I255 | D254-C257 PolarHBondContact O-N 3.47Å; I255-C257 VanDerWaalsContact C-N 3.26Å; I255-C257 PolarHBondContact O-N 2.96Å |
| 258 | E | 51.7 | Low | 61.9 | Low | 171 Ų | 171 | 132.4 Ų | 132.4 | 80% | 0.799 | 71% | 0.707 | S | S | * | * | trans | -95.2 | 12.7 | -177.4 | -67.6 | -147 | 161.3 | 0 | 0 | 114.8 | P260 | E258-P260 WeakPolarHBondContact O-CD 3.29Š| ||
| 259 | L | 54.9 | Low | 60.3 | Low | 140 Ų | 140 | 128.1 Ų | 128.1 | 73% | 0.733 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -75.3 | 118.3 | 171 | -73.2 | 172.4 | 0 | 0 | 0 | 110.5 | S261 | L259-S261 PolarHBondContact O-N 2.91Š|
| 260 | P | 48.9 | Very low | 58.5 | Low | 110 Ų | 110 | 128.7 Ų | 128.7 | 71% | 0.714 | 72% | 0.716 | S | S | * | * | trans | -70 | 109.6 | -178.4 | 27.3 | -31.7 | 0 | 0 | 0 | 109.8 | E258 N262 | E258-P260 WeakPolarHBondContact O-CD 3.29Å; P260-N262 PolarHBondContact O-N 3.19Å | ||
| 261 | S | 51.7 | Low | 56.6 | Low | 113 Ų | 113 | 126.1 Ų | 126.1 | 79% | 0.79 | 72% | 0.72 | S | S | * | * | trans | -65.2 | 96 | 168.6 | 56.1 | 0 | 0 | 0 | 0 | 109.5 | L259 P263 | L259-S261 PolarHBondContact O-N 2.91Å; S261-P263 VanDerWaalsContact O-CD 3.27Å; S261-P263 WeakPolarHBondContact O-CD 3.28Å | ||
| 262 | N | 52.9 | Low | 55.1 | Low | 148 Ų | 148 | 126.6 Ų | 126.6 | 79% | 0.791 | 73% | 0.732 | S | S | * | * | trans | -75.6 | 115.3 | 165.5 | -84.1 | -37.5 | 0 | 0 | 0 | 109.4 | P260 T264 | P260-N262 PolarHBondContact O-N 3.19Å; N262-T264 PolarHBondContact O-N 3.2Å | ||
| 263 | P | 53.1 | Low | 54 | Low | 120 Ų | 120 | 124.9 Ų | 124.9 | 78% | 0.779 | 74% | 0.735 | S | S | * | * | trans | -80.5 | 121.3 | 168.3 | 31.9 | -29.8 | 0 | 0 | 0 | 109.5 | S261 K265 | S261-P263 VanDerWaalsContact O-CD 3.27Å; S261-P263 WeakPolarHBondContact O-CD 3.28Å; P263-K265 PolarHBondContact O-N 3.07Å | ||
| 264 | T | 47.7 | Very low | 53 | Low | 127 Ų | 127 | 127.5 Ų | 127.5 | 78% | 0.779 | 75% | 0.751 | S | S | * | * | trans | -63.1 | 120.8 | 172.7 | 47.3 | 0 | 0 | 0 | 0 | 112.1 | N262 | N262-T264 PolarHBondContact O-N 3.2Š| ||
| 265 | K | 48.9 | Very low | 51.8 | Low | 194 Ų | 194 | 129.4 Ų | 129.4 | 84% | 0.843 | 76% | 0.76 | S | S | * | * | 36.9 | 111.9 | 129.8 | -58.4 | 177.6 | -178.8 | 178 | 0 | 118.2 | P263 | P263-K265 PolarHBondContact O-N 3.07Š| |||
| 266 | S | 50 | Low | 51.2 | Low | 118 Ų | 118 | 129.9 Ų | 129.9 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | 166.8 | 106.3 | 102.2 | 60.1 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 267 | V | 54.6 | Low | 50.9 | Low | 150 Ų | 150 | 131.2 Ų | 131.2 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -115.8 | 131.5 | 163.6 | 173.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 268 | D | 51.4 | Low | 50.4 | Low | 147 Ų | 147 | 134.6 Ų | 134.6 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | trans | -59.5 | 143.6 | -177.8 | -82.2 | -53.6 | 0 | 0 | 0 | 114.6 | ||||
| 269 | S | 55.6 | Low | 50.2 | Low | 93 Ų | 93 | 131 Ų | 131 | 65% | 0.65 | 77% | 0.765 | S | S | * | * | trans | 65.2 | 106.5 | 136.3 | -59 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 270 | N | 48.5 | Very low | 50 | Low | 162 Ų | 162 | 128.9 Ų | 128.9 | 87% | 0.866 | 76% | 0.762 | S | S | * | * | trans | 124 | 96.9 | 131.7 | -68.1 | -34.3 | 0 | 0 | 0 | 114.9 | ||||
| 271 | C | 42.8 | Very low | 50.1 | Low | 106 Ų | 106 | 132.8 Ų | 132.8 | 72% | 0.716 | 77% | 0.77 | S | S | * | * | trans | -74.9 | 151.8 | 157.6 | -151.9 | 0 | 0 | 0 | 0 | 108.5 | S273 | C271-S273 PolarHBondContact SG-N 3.12Š| ||
| 272 | P | 49.7 | Very low | 49.8 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | -142.9 | 126.9 | 87.2 | 31.9 | -13.5 | 0 | 0 | 0 | 114.7 | |||||
| 273 | S | 53.3 | Low | 49.9 | Very low | 100 Ų | 100 | 134.6 Ų | 134.6 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | 53.4 | 147.8 | 124.3 | -57.1 | 0 | 0 | 0 | 0 | 122.6 | C271 | C271-S273 PolarHBondContact SG-N 3.12Š| |||
| 274 | P | 50.9 | Low | 49.6 | Very low | 110 Ų | 110 | 134.5 Ų | 134.5 | 71% | 0.714 | 77% | 0.769 | S | S | * | * | trans | -105.5 | 175.1 | -147.2 | 33.3 | -17.3 | 0 | 0 | 0 | 112.6 | ||||
| 275 | L | 45.6 | Very low | 49.9 | Very low | 149 Ų | 149 | 136 Ų | 136 | 78% | 0.78 | 77% | 0.77 | S | S | * | * | trans | 171.8 | 116.2 | 132.4 | -87.5 | 168.3 | 0 | 0 | 0 | 110.4 | ||||
| 276 | D | 48.4 | Very low | 50.1 | Low | 135 Ų | 135 | 134.2 Ų | 134.2 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | trans | 41.9 | 148.6 | 136.5 | -54 | -32.1 | 0 | 0 | 0 | 123.6 | ||||
| 277 | I | 50.7 | Low | 49.8 | Very low | 133 Ų | 133 | 137.3 Ų | 137.3 | 68% | 0.682 | 77% | 0.771 | S | S | * | * | trans | 118.2 | 103.5 | 138.2 | -54.6 | -169.4 | 0 | 0 | 0 | 116 | ||||
| 278 | H | 47.5 | Very low | 49.6 | Very low | 181 Ų | 181 | 133.6 Ų | 133.6 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | trans | 70.1 | 150.7 | 147.2 | -61.5 | -15.5 | 0 | 0 | 0 | 117.9 | ||||
| 279 | S | 46.1 | Very low | 49.5 | Very low | 96 Ų | 96 | 135.5 Ų | 135.5 | 67% | 0.671 | 77% | 0.768 | S | S | * | * | cis | 174.9 | 151.3 | -10.9 | 173.7 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 280 | S | 52.2 | Low | 49.4 | Very low | 95 Ų | 95 | 139.2 Ų | 139.2 | 66% | 0.664 | 78% | 0.778 | S | S | * | * | trans | 79.9 | 104.6 | 158.8 | -43.5 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 281 | Q | 50.1 | Low | 49.6 | Very low | 192 Ų | 192 | 136.8 Ų | 136.8 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | 157.7 | 126.6 | 100.2 | -101.4 | 166.8 | -10.9 | 0 | 0 | 111 | |||||
| 282 | E | 46.5 | Very low | 50.4 | Low | 179 Ų | 179 | 140 Ų | 140 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | trans | -64.7 | 162.2 | 173.1 | -65.8 | -177.7 | 149 | 0 | 0 | 112.8 | ||||
| 283 | P | 54.1 | Low | 51.2 | Low | 120 Ų | 120 | 140 Ų | 140 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | -139.3 | 133.5 | 112.3 | 34 | -19.8 | 0 | 0 | 0 | 114.9 | |||||
| 284 | V | 48 | Very low | 51.6 | Low | 118 Ų | 118 | 141.2 Ų | 141.2 | 72% | 0.715 | 78% | 0.784 | S | S | * | * | 19.2 | 139.8 | 126.3 | -166 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 285 | I | 53.9 | Low | 51.9 | Low | 158 Ų | 158 | 140.9 Ų | 140.9 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | 124.7 | 126.1 | 155.4 | -64.3 | 157.9 | 0 | 0 | 0 | 109.3 | ||||
| 286 | L | 52.6 | Low | 53 | Low | 157 Ų | 157 | 139.8 Ų | 139.8 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | cis | -172.6 | 121.7 | -8.4 | -172.6 | 113.3 | 0 | 0 | 0 | 104.4 | ||||
| 287 | E | 42.3 | Very low | 53.5 | Low | 183 Ų | 183 | 139.1 Ų | 139.1 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -69.4 | 129.8 | 179.6 | -58.3 | -72.3 | 152.9 | 0 | 0 | 110.5 | ||||
| 288 | G | 51.2 | Low | 53.8 | Low | 73 Ų | 73 | 139.7 Ų | 139.7 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -123 | 86.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | I290 | G288-I290 PolarHBondContact O-N 3.39Š| ||
| 289 | E | 49.6 | Very low | 54 | Low | 187 Ų | 187 | 136.2 Ų | 136.2 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -68.5 | 121 | 174.7 | -69.4 | -174.5 | 122.2 | 0 | 0 | 111.2 | ||||
| 290 | I | 54 | Low | 54.8 | Low | 170 Ų | 170 | 139.8 Ų | 139.8 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | -95.8 | 95.8 | 163.8 | -105.3 | 155.5 | 0 | 0 | 0 | 107.8 | G288 | G288-I290 PolarHBondContact O-N 3.39Š| ||
| 291 | S | 52.5 | Low | 54.4 | Low | 112 Ų | 112 | 142.4 Ų | 142.4 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -87 | 117.1 | 173.7 | -177.5 | 0 | 0 | 0 | 0 | 109.6 | ||
| 292 | Q | 59.8 | Low | 54.9 | Low | 172 Ų | 172 | 139.6 Ų | 139.6 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 135 | 170.5 | -72.3 | -179.5 | -21.9 | 0 | 0 | 110.1 | ||
| 293 | P | 66.5 | Low | 55.2 | Low | 121 Ų | 121 | 137 Ų | 137 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 139.1 | 175.3 | 31.2 | -32.1 | 0 | 0 | 0 | 111.7 | ||
| 294 | P | 60.3 | Low | 54.9 | Low | 124 Ų | 124 | 137 Ų | 137 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 145.7 | 174.1 | 32.2 | -31.8 | 0 | 0 | 0 | 111.6 | ||
| 295 | S | 59 | Low | 55.1 | Low | 103 Ų | 103 | 136.1 Ų | 136.1 | 72% | 0.72 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 148.7 | 176.7 | 35.5 | 0 | 0 | 0 | 0 | 114.2 | V297 | S295-V297 PolarHBondContact O-N 3.06Š|
| 296 | P | 67.5 | Low | 55 | Low | 126 Ų | 126 | 134 Ų | 134 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 127.1 | -172.2 | 29.8 | -33.7 | 0 | 0 | 0 | 112.5 | ||
| 297 | V | 58.3 | Low | 55 | Low | 122 Ų | 122 | 132.6 Ų | 132.6 | 74% | 0.739 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 122.7 | 165.4 | 178.4 | 0 | 0 | 0 | 0 | 107.8 | S295 T299 | S295-V297 PolarHBondContact O-N 3.06Å; V297-T299 HydrophobicContact CG1-CG2 4.03Å; V297-T299 PolarHBondContact O-N 3.24Å |
| 298 | I | 57.9 | Low | 55 | Low | 145 Ų | 145 | 129.6 Ų | 129.6 | 74% | 0.744 | 79% | 0.792 | S | S | * | * | trans | -90.2 | 99.1 | 172 | -57.8 | 171.8 | 0 | 0 | 0 | 107.3 | M300 | I298-M300 HydrophobicContact CG2-CE 4.41Å; I298-M300 HydrophobicContact CG2-CG 4.18Å | ||
| 299 | T | 50.7 | Low | 55.4 | Low | 108 Ų | 108 | 135.4 Ų | 135.4 | 66% | 0.663 | 80% | 0.797 | S | S | * | * | trans | -98.1 | 120.6 | 163.2 | 45.7 | 0 | 0 | 0 | 0 | 108.3 | V297 | V297-T299 HydrophobicContact CG1-CG2 4.03Å; V297-T299 PolarHBondContact O-N 3.24Å | ||
| 300 | M | 64.7 | Low | 55.4 | Low | 170 Ų | 170 | 136 Ų | 136 | 84% | 0.837 | 80% | 0.797 | S | S | * | * | trans | -114.3 | 94.1 | 168.7 | -71.1 | -72.8 | 180 | 0 | 0 | 107.7 | I298 | I298-M300 HydrophobicContact CG2-CE 4.41Å; I298-M300 HydrophobicContact CG2-CG 4.18Å | ||
| 301 | D | 42.7 | Very low | 55.1 | Low | 150 Ų | 150 | 133.2 Ų | 133.2 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | trans | -105.7 | 119 | 162.9 | -74.9 | -32 | 0 | 0 | 0 | 107.6 | ||||
| 302 | T | 59.9 | Low | 55.5 | Low | 133 Ų | 133 | 132.2 Ų | 132.2 | 82% | 0.816 | 78% | 0.783 | S | S | * | * | trans | -153.5 | 95.3 | 156.2 | -59.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 303 | T | 54.6 | Low | 55.3 | Low | 125 Ų | 125 | 131.7 Ų | 131.7 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | 42.8 | 100.2 | 123.9 | -41.9 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 304 | C | 46 | Very low | 54.7 | Low | 121 Ų | 121 | 131.4 Ų | 131.4 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | 29.4 | 116.7 | 116.4 | -162.6 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 305 | A | 53.4 | Low | 54.6 | Low | 98 Ų | 98 | 135 Ų | 135 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | -172 | 109.7 | 129 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 306 | S | 50.7 | Low | 54.4 | Low | 114 Ų | 114 | 138.9 Ų | 138.9 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | -82.2 | 159.1 | 155.1 | -67.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 307 | P | 53.4 | Low | 53.9 | Low | 128 Ų | 128 | 137.6 Ų | 137.6 | 83% | 0.831 | 77% | 0.772 | S | S | * | * | -149.2 | 156 | 87.8 | 33.6 | -13.2 | 0 | 0 | 0 | 116.9 | |||||
| 308 | C | 42.7 | Very low | 53.8 | Low | 119 Ų | 119 | 140.7 Ų | 140.7 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -40.8 | 151.2 | 166.7 | -54 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 309 | K | 59.4 | Low | 54.1 | Low | 196 Ų | 196 | 143.1 Ų | 143.1 | 85% | 0.852 | 79% | 0.789 | S | S | * | * | -166.5 | 121.1 | 124.1 | -70.2 | -150.8 | -179.2 | 167.1 | 0 | 113.5 | |||||
| 310 | K | 49 | Very low | 54.3 | Low | 200 Ų | 200 | 147.1 Ų | 147.1 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | trans | 53.4 | 126.2 | 131.8 | -66.9 | -179.1 | 174.4 | -175.1 | 0 | 122.8 | ||||
| 311 | S | 49.3 | Very low | 54.2 | Low | 110 Ų | 110 | 142.7 Ų | 142.7 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -54 | -176.8 | 152.7 | 55.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 312 | P | 59.3 | Low | 55.3 | Low | 92 Ų | 92 | 144.9 Ų | 144.9 | 60% | 0.597 | 80% | 0.804 | S | S | * | * | cis | -150.5 | -168.6 | 24.2 | 42.8 | -19.1 | 0 | 0 | 0 | 118.1 | ||||
| 313 | E | 56.5 | Low | 55.8 | Low | 161 Ų | 161 | 146.4 Ų | 146.4 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | trans | 75.5 | 134.1 | 147.7 | -79.9 | 160.7 | -141.1 | 0 | 0 | 117.3 | ||||
| 314 | D | 54.3 | Low | 56.8 | Low | 115 Ų | 115 | 145.7 Ų | 145.7 | 62% | 0.615 | 80% | 0.803 | S | S | * | * | cis | -171.6 | 170.4 | 31.4 | -83.6 | -44.8 | 0 | 0 | 0 | 113.5 | ||||
| 315 | Y | 57.3 | Low | 58.1 | Low | 199 Ų | 199 | 145.8 Ų | 145.8 | 78% | 0.78 | 80% | 0.802 | S | S | * | * | trans | 84.2 | 116 | 140.7 | 59.5 | -110.4 | 0 | 0 | 0 | 124.9 | ||||
| 316 | E | 54.8 | Low | 58.9 | Low | 185 Ų | 185 | 146.7 Ų | 146.7 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | 49.6 | 137.7 | 125.5 | -75.3 | 178.5 | 151.8 | 0 | 0 | 120 | |||||
| 317 | S | 56.5 | Low | 59.8 | Low | 99 Ų | 99 | 148.4 Ų | 148.4 | 69% | 0.692 | 80% | 0.803 | S | S | * | * | cis | 179.1 | 156.7 | 36.1 | 33.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 318 | M | 56.6 | Low | 60.8 | Low | 187 Ų | 187 | 150.3 Ų | 150.3 | 92% | 0.921 | 81% | 0.807 | S | S | * | * | trans | 50.7 | 126.8 | 144.6 | -68.7 | -179.9 | 157.2 | 0 | 0 | 121.6 | ||||
| 319 | E | 64.3 | Low | 62.3 | Low | 195 Ų | 195 | 152.6 Ų | 152.6 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | 176.6 | 128.4 | 100.9 | -167.6 | 165.7 | -171.3 | 0 | 0 | 110.9 | |||||
| 320 | E | 54.2 | Low | 62.6 | Low | 192 Ų | 192 | 155 Ų | 155 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | trans | -78.4 | 146.1 | 176.5 | -65.4 | -166.4 | 148.8 | 0 | 0 | 111.4 | ||||
| 321 | G | 62.5 | Low | 63.3 | Low | 77 Ų | 77 | 152.7 Ų | 152.7 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | trans | -134.2 | 92.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 322 | E | 65.8 | Low | 64.1 | Low | 196 Ų | 196 | 154.9 Ų | 154.9 | 92% | 0.916 | 83% | 0.831 | S | S | * | * | trans | -51.6 | 139 | 169.1 | -112.6 | 170.8 | 153 | 0 | 0 | 113.1 | ||||
| 323 | L | 71.3 | Confident | 64.3 | Low | 166 Ų | 166 | 158.4 Ų | 158.4 | 87% | 0.869 | 84% | 0.844 | S | S | * | * | trans | -125.8 | 131.8 | 157.7 | -85 | 171.3 | 0 | 0 | 0 | 108.9 | ||||
| 324 | P | 76.2 | Confident | 64.8 | Low | 109 Ų | 109 | 158.3 Ų | 158.3 | 71% | 0.708 | 85% | 0.85 | S | S | * | * | trans | -83.7 | 158.6 | -175 | 34.2 | -34.9 | 0 | 0 | 0 | 112.5 | ||||
| 325 | P | 71.7 | Confident | 65.4 | Low | 123 Ų | 123 | 161 Ų | 161 | 80% | 0.799 | 86% | 0.864 | S | S | * | * | trans | -77.3 | 142.8 | 169.9 | 33.2 | -31.3 | 0 | 0 | 0 | 110.3 | ||||
| 326 | S | 71.3 | Confident | 66 | Low | 118 Ų | 118 | 158.5 Ų | 158.5 | 83% | 0.825 | 87% | 0.87 | S | S | * | * | trans | -110.7 | 126.3 | 167.9 | 24.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 327 | D | 70 | Confident | 66.8 | Low | 149 Ų | 149 | 156.6 Ų | 156.6 | 80% | 0.797 | 87% | 0.87 | S | S | * | * | trans | -66.8 | 140.7 | 176.2 | -56.3 | -61.6 | 0 | 0 | 0 | 111.5 | ||||
| 328 | D | 74.8 | Confident | 67.6 | Low | 169 Ų | 169 | 161 Ų | 161 | 90% | 0.904 | 88% | 0.884 | S | S | * | * | trans | -145.7 | 92.4 | 156 | -87.6 | -40.9 | 0 | 0 | 0 | 108 | ||||
| 329 | D | 72.5 | Confident | 68.5 | Low | 167 Ų | 167 | 158.8 Ų | 158.8 | 89% | 0.893 | 88% | 0.881 | S | S | * | * | trans | -107.9 | 112.2 | 161.5 | -100.4 | -30.5 | 0 | 0 | 0 | 107.6 | ||||
| 330 | I | 67 | Low | 68.8 | Low | 245 Ų | 245 | 155.5 Ų | 155.5 | 100% | 1.256 | 88% | 0.878 | S | S | * | * | trans | -142.1 | 0 | 151.2 | -67.2 | -173 | 0 | 0 | 0 | 108.4 |
Retrieved 330 of 330 residues in 78.1 ms
(Link to these results)