| 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 | 41.7 | Very low | 45.6 | Very low | 248 Ų | 248 | 137.5 Ų | 137.5 | 100% | 1.222 | 86% | 0.859 | S | S | * | * | 0 | 133.9 | 0 | -74.5 | -178.1 | 173.9 | 0 | 0 | 108.1 | |||||
| 2 | R | 42.2 | Very low | 45.8 | Very low | 246 Ų | 246 | 135.9 Ų | 135.9 | 93% | 0.928 | 86% | 0.857 | S | S | * | * | trans | -66.6 | 132.4 | -167.4 | -76.7 | 171.3 | 165.6 | 171.9 | -6 | 111.7 | ||||
| 3 | A | 43.9 | Very low | 45.9 | Very low | 103 Ų | 103 | 138.4 Ų | 138.4 | 85% | 0.851 | 86% | 0.858 | S | S | * | * | trans | -88.4 | 123.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 4 | T | 48.5 | Very low | 46.1 | Very low | 132 Ų | 132 | 136.4 Ų | 136.4 | 81% | 0.81 | 85% | 0.852 | S | S | * | * | trans | -105.2 | 119.6 | 171.7 | -42.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 5 | P | 53.2 | Low | 46.7 | Very low | 120 Ų | 120 | 143.3 Ų | 143.3 | 78% | 0.779 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 132.6 | 174.1 | 20.7 | -10.7 | 0 | 0 | 0 | 110.6 | ||
| 6 | L | 43 | Very low | 47.3 | Very low | 177 Ų | 177 | 146.9 Ų | 146.9 | 93% | 0.927 | 86% | 0.857 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 122.5 | 175.6 | -176.3 | 65.9 | 0 | 0 | 0 | 109.5 | ||
| 7 | A | 43.8 | Very low | 47.9 | Very low | 93 Ų | 93 | 150.8 Ų | 150.8 | 77% | 0.769 | 86% | 0.861 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 131.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 8 | A | 48.8 | Very low | 48.5 | Very low | 92 Ų | 92 | 153.7 Ų | 153.7 | 76% | 0.76 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 139 | 168 | 0 | 0 | 0 | 0 | 0 | 110.2 | A10 | A8-A10 PolarHBondContact O-N 2.8Š|
| 9 | P | 47.6 | Very low | 48.7 | Very low | 131 Ų | 131 | 153.9 Ų | 153.9 | 85% | 0.851 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 128 | 179.2 | 26.5 | -31.1 | 0 | 0 | 0 | 111.2 | ||
| 10 | A | 47 | Very low | 48.9 | Very low | 99 Ų | 99 | 153.9 Ų | 153.9 | 82% | 0.818 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 136.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A8 S12 | A8-A10 PolarHBondContact O-N 2.8Å; A10-S12 PolarHBondContact O-N 3.44Å |
| 11 | G | 41.7 | Very low | 48.9 | Very low | 71 Ų | 71 | 153.7 Ų | 153.7 | 73% | 0.732 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 134.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | L13 | G11-L13 PolarHBondContact O-N 2.9Å; G11-L13 VanDerWaalsContact O-N 3.13Å |
| 12 | S | 48.2 | Very low | 49.3 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -67.6 | 106.4 | 172.9 | 45.4 | 0 | 0 | 0 | 0 | 109.7 | A10 S14 | A10-S12 PolarHBondContact O-N 3.44Å; S12-S14 PolarHBondContact O-N 3.49Å | ||
| 13 | L | 47.8 | Very low | 49.9 | Very low | 168 Ų | 168 | 143 Ų | 143 | 88% | 0.88 | 81% | 0.81 | S | S | * | * | trans | -66.4 | 103.8 | 166.6 | -70.2 | 167.7 | 0 | 0 | 0 | 108.2 | G11 R15 | G11-L13 PolarHBondContact O-N 2.9Å; G11-L13 VanDerWaalsContact O-N 3.13Å; L13-R15 PolarHBondContact O-N 3.3Å | ||
| 14 | S | 48.3 | Very low | 50.2 | Low | 110 Ų | 110 | 143.8 Ų | 143.8 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -55.2 | 110.2 | 171.8 | -178.2 | 0 | 0 | 0 | 0 | 109.3 | S12 K16 | S12-S14 PolarHBondContact O-N 3.49Å; S14-K16 PolarHBondContact O-N 2.96Å | ||
| 15 | R | 55.3 | Low | 50.7 | Low | 241 Ų | 241 | 145 Ų | 145 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | -64.7 | 103.2 | 177.9 | -71.1 | -177.9 | -179.1 | -171.5 | 0.3 | 108.3 | L13 K17 | L13-R15 PolarHBondContact O-N 3.3Å; R15-K17 PolarHBondContact O-N 2.95Å; R15-K17 VanDerWaalsContact O-N 3.1Å | ||
| 16 | K | 56.4 | Low | 50.7 | Low | 201 Ų | 201 | 145.4 Ų | 145.4 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -60.2 | 112 | 167.6 | -62 | 178.2 | 179.5 | 179.2 | 0 | 107.6 | S14 R18 | S14-K16 PolarHBondContact O-N 2.96Å; K16-R18 PolarHBondContact O-N 3.33Å; K16-R18 VanDerWaalsContact O-N 3.13Å | ||
| 17 | K | 57.6 | Low | 51.4 | Low | 212 Ų | 212 | 142.5 Ų | 142.5 | 92% | 0.922 | 79% | 0.787 | S | S | * | * | trans | -65.2 | 109.1 | 165.5 | -111.8 | -166.2 | 175.3 | -169.8 | 0 | 106.9 | R15 L19 | R15-K17 PolarHBondContact O-N 2.95Å; R15-K17 VanDerWaalsContact O-N 3.1Å; K17-L19 PolarHBondContact O-N 2.78Å | ||
| 18 | R | 58.5 | Low | 52.2 | Low | 204 Ų | 204 | 146.1 Ų | 146.1 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | trans | -69.3 | 120.2 | 168.8 | -173.1 | 179.9 | 179.9 | -147.1 | 2.6 | 107 | K16 E20 | K16-R18 PolarHBondContact O-N 3.33Å; K16-R18 VanDerWaalsContact O-N 3.13Å; R18-E20 IonicContact NH1-OE1 3.52Å; R18-E20 PolarHBondContact O-N 3.29Å | ||
| 19 | L | 51.2 | Low | 52.8 | Low | 158 Ų | 158 | 152.3 Ų | 152.3 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -74.8 | 110.1 | 169.3 | -175.3 | 73.4 | 0 | 0 | 0 | 106.8 | K17 | K17-L19 PolarHBondContact O-N 2.78Š| ||
| 20 | E | 53.4 | Low | 53.6 | Low | 152 Ų | 152 | 151.8 Ų | 151.8 | 71% | 0.71 | 79% | 0.788 | S | S | * | * | trans | -85.8 | 115.1 | 167.4 | -63.5 | -166.1 | 123 | 0 | 0 | 106.8 | R18 D22 | R18-E20 IonicContact NH1-OE1 3.52Å; R18-E20 PolarHBondContact O-N 3.29Å; E20-D22 PolarHBondContact O-N 2.87Å | ||
| 21 | L | 48.7 | Very low | 54.6 | Low | 150 Ų | 150 | 153.4 Ų | 153.4 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | -83.4 | 110.6 | 173.3 | -172.8 | 64.6 | 0 | 0 | 0 | 106.7 | D23 | L21-D23 PolarHBondContact O-N 3.33Š| ||
| 22 | D | 49.3 | Very low | 55.8 | Low | 139 Ų | 139 | 156.9 Ų | 156.9 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | trans | -67.8 | 110 | 172 | -174.5 | -111.9 | 0 | 0 | 0 | 108.5 | E20 N24 | E20-D22 PolarHBondContact O-N 2.87Å; D22-N24 VanDerWaalsContact C-N 3.31Å; D22-N24 PolarHBondContact O-N 2.81Å; D22-N24 WeakPolarHBondContact OD1-CB 3.49Å | ||
| 23 | D | 54.9 | Low | 56.8 | Low | 131 Ų | 131 | 161.2 Ų | 161.2 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -92.1 | 68.7 | 177.7 | -145.6 | -39.4 | 0 | 0 | 0 | 108.3 | L21 | L21-D23 PolarHBondContact O-N 3.33Š| ||
| 24 | N | 52 | Low | 58 | Low | 119 Ų | 119 | 163.1 Ų | 163.1 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | trans | -109.5 | 75.2 | 169.1 | -160.5 | -46.1 | 0 | 0 | 0 | 109 | D22 D26 | D22-N24 VanDerWaalsContact C-N 3.31Å; D22-N24 PolarHBondContact O-N 2.81Å; D22-N24 WeakPolarHBondContact OD1-CB 3.49Å; N24-D26 PolarHBondContact O-N 3.4Å; N24-D26 VanDerWaalsContact O-N 3.09Å | ||
| 25 | L | 57.2 | Low | 59 | Low | 159 Ų | 159 | 162.6 Ų | 162.6 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | -81.6 | 68.1 | 172.1 | -71.5 | 171.9 | 0 | 0 | 0 | 110.1 | T27 | L25-T27 PolarHBondContact O-N 2.91Š| ||
| 26 | D | 53.5 | Low | 59.7 | Low | 128 Ų | 128 | 161.6 Ų | 161.6 | 68% | 0.684 | 78% | 0.782 | S | S | * | * | trans | -86.5 | 98.4 | 164.7 | -160.9 | 15.3 | 0 | 0 | 0 | 110.5 | N24 | N24-D26 PolarHBondContact O-N 3.4Å; N24-D26 VanDerWaalsContact O-N 3.09Å | ||
| 27 | T | 57.8 | Low | 60.1 | Low | 116 Ų | 116 | 158.3 Ų | 158.3 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | S | Bend | trans | 46.2 | 82.6 | 138.5 | -39 | 0 | 0 | 0 | 0 | 119.2 | L25 | L25-T27 PolarHBondContact O-N 2.91Š|
| 28 | E | 60.5 | Low | 60.8 | Low | 168 Ų | 168 | 150 Ų | 150 | 79% | 0.785 | 76% | 0.759 | S | S | * | * | trans | -155.9 | 113.4 | 130.2 | -114.5 | -71.1 | 90.7 | 0 | 0 | 108.5 | ||||
| 29 | R | 61.8 | Low | 61.3 | Low | 222 Ų | 222 | 146.8 Ų | 146.8 | 84% | 0.838 | 76% | 0.764 | S | S | * | * | trans | -75.3 | 129.3 | 178.5 | -70.5 | 179.7 | 173.7 | 176.7 | -1 | 107.8 | V31 | R29-V31 PolarHBondContact O-N 2.82Š| ||
| 30 | P | 65.4 | Low | 62.3 | Low | 121 Ų | 121 | 145.8 Ų | 145.8 | 79% | 0.786 | 76% | 0.756 | S | S | * | * | trans | -61.7 | 128.9 | 176.9 | 23.8 | -31.3 | 0 | 0 | 0 | 109.9 | Q32 | P30-Q32 PolarHBondContact O-N 2.92Š| ||
| 31 | V | 67.3 | Low | 63.3 | Low | 132 Ų | 132 | 143.5 Ų | 143.5 | 80% | 0.8 | 75% | 0.754 | S | S | * | * | trans | -56.4 | 113.4 | -179.5 | 176.9 | 0 | 0 | 0 | 0 | 109.8 | R29 K33 | R29-V31 PolarHBondContact O-N 2.82Å; V31-K33 PolarHBondContact O-N 2.78Å | ||
| 32 | Q | 66.9 | Low | 64.5 | Low | 145 Ų | 145 | 148 Ų | 148 | 68% | 0.678 | 76% | 0.761 | S | S | * | * | trans | -74.7 | 107.8 | -178.9 | -146 | -180 | 22.8 | 0 | 0 | 109.4 | P30 R34 | P30-Q32 PolarHBondContact O-N 2.92Å; Q32-R34 PolarHBondContact O-N 2.81Å | ||
| 33 | K | 68.2 | Low | 65.6 | Low | 209 Ų | 209 | 148.9 Ų | 148.9 | 91% | 0.909 | 76% | 0.764 | S | S | * | * | trans | -64.5 | 107.8 | 172.5 | -78.5 | -172.7 | 176.5 | 179.2 | 0 | 109.4 | V31 | V31-K33 PolarHBondContact O-N 2.78Š| ||
| 34 | R | 72.9 | Confident | 66.7 | Low | 209 Ų | 209 | 147.5 Ų | 147.5 | 79% | 0.789 | 76% | 0.762 | S | S | * | * | trans | -95.3 | 134.9 | 172.1 | -65.8 | -175.1 | 178.9 | -172.4 | -0.6 | 109.9 | Q32 R36 | Q32-R34 PolarHBondContact O-N 2.81Å; R34-R36 PolarHBondContact O-N 2.76Å | ||
| 35 | A | 70.7 | Confident | 67.8 | Low | 98 Ų | 98 | 147.1 Ų | 147.1 | 81% | 0.81 | 77% | 0.767 | S | S | * | * | trans | -63.5 | 129.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | S37 | A35-S37 PolarHBondContact O-N 2.9Å; A35-S37 VanDerWaalsContact O-N 3.15Å | ||
| 36 | R | 70.1 | Confident | 68.3 | Low | 221 Ų | 221 | 145.4 Ų | 145.4 | 83% | 0.834 | 77% | 0.766 | S | S | * | * | trans | -73.5 | 104.4 | 178.7 | -134.6 | -178.2 | -145.5 | -113.5 | 3.8 | 108.4 | R34 G38 | R34-R36 PolarHBondContact O-N 2.76Å; R36-G38 PolarHBondContact O-N 3.2Å | ||
| 37 | S | 63.8 | Low | 69.2 | Low | 131 Ų | 131 | 147.2 Ų | 147.2 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | trans | -83.8 | 54.1 | 178.2 | 63.7 | 0 | 0 | 0 | 0 | 112 | A35 | A35-S37 PolarHBondContact O-N 2.9Å; A35-S37 VanDerWaalsContact O-N 3.15Å | ||
| 38 | G | 72.4 | Confident | 70 | Confident | 39 Ų | 39 | 148.9 Ų | 148.9 | 40% | 0.402 | 78% | 0.779 | S | S | . | * | S | Bend | trans | -135.4 | 164.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | R36 Q40 | R36-G38 PolarHBondContact O-N 3.2Å; G38-Q40 PolarHBondContact O-N 3.05Å |
| 39 | P | 68.4 | Low | 70.5 | Confident | 135 Ų | 135 | 146.2 Ų | 146.2 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 117.7 | 175.8 | -20.5 | 31.1 | 0 | 0 | 0 | 109.5 | ||
| 40 | Q | 72.3 | Confident | 70.9 | Confident | 138 Ų | 138 | 143.9 Ų | 143.9 | 65% | 0.645 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 133.4 | 176.4 | -74.5 | -71.7 | -42.5 | 0 | 0 | 108.6 | G38 R42 | G38-Q40 PolarHBondContact O-N 3.05Å; Q40-R42 PolarHBondContact O-N 3.21Å |
| 41 | P | 74.3 | Confident | 71 | Confident | 104 Ų | 104 | 143.1 Ų | 143.1 | 68% | 0.675 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 129.3 | 168.2 | -21.6 | 31.6 | 0 | 0 | 0 | 108.7 | L43 | P41-L43 PolarHBondContact O-N 3.07Å; P41-L43 VanDerWaalsContact O-N 3.07Å |
| 42 | R | 74.4 | Confident | 71.2 | Confident | 244 Ų | 244 | 142 Ų | 142 | 92% | 0.921 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 117.2 | 178.3 | -70.7 | -172.2 | -178.3 | -173.1 | 1.1 | 108.2 | Q40 | Q40-R42 PolarHBondContact O-N 3.21Š|
| 43 | L | 72.6 | Confident | 71.3 | Confident | 157 Ų | 157 | 140.9 Ų | 140.9 | 82% | 0.822 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 136.1 | 173.9 | -64.9 | 172.8 | 0 | 0 | 0 | 108.4 | P41 | P41-L43 PolarHBondContact O-N 3.07Å; P41-L43 VanDerWaalsContact O-N 3.07Å |
| 44 | P | 78.7 | Confident | 71.1 | Confident | 102 Ų | 102 | 137.7 Ų | 137.7 | 66% | 0.662 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 144.7 | 173.3 | 25 | -31.8 | 0 | 0 | 0 | 109.6 | C46 | P44-C46 PolarHBondContact O-N 2.85Š|
| 45 | P | 73.6 | Confident | 70.5 | Confident | 112 Ų | 112 | 130.7 Ų | 130.7 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 125.1 | 177.4 | 22.7 | -30.9 | 0 | 0 | 0 | 109.6 | L47 | P45-L47 PolarHBondContact O-N 2.74Å; P45-L47 VanDerWaalsContact O-N 3.07Å |
| 46 | C | 68.1 | Low | 70 | Confident | 122 Ų | 122 | 131.3 Ų | 131.3 | 82% | 0.824 | 76% | 0.759 | S | S | * | * | trans | -65.2 | 108.3 | 175.4 | -58.2 | 0 | 0 | 0 | 0 | 108.7 | P44 L48 | P44-C46 PolarHBondContact O-N 2.85Å; C46-L48 PolarHBondContact O-N 2.72Å | ||
| 47 | L | 72.6 | Confident | 68.9 | Low | 166 Ų | 166 | 128.3 Ų | 128.3 | 87% | 0.869 | 76% | 0.759 | S | S | * | * | trans | -83.8 | 6.3 | 176 | -64.6 | 177.2 | 0 | 0 | 0 | 113.2 | P45 | P45-L47 PolarHBondContact O-N 2.74Å; P45-L47 VanDerWaalsContact O-N 3.07Å | ||
| 48 | L | 73.9 | Confident | 68.3 | Low | 151 Ų | 151 | 131.5 Ų | 131.5 | 79% | 0.791 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -82.4 | 128.3 | 179 | -72.5 | 168.9 | 0 | 0 | 0 | 109.6 | C46 L50 | C46-L48 PolarHBondContact O-N 2.72Å; L48-L50 PolarHBondContact O-N 2.95Å |
| 49 | P | 72.7 | Confident | 67.1 | Low | 112 Ų | 112 | 133.8 Ų | 133.8 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | -53.9 | 134.3 | 167.4 | -19.3 | 30.1 | 0 | 0 | 0 | 109 | S51 | P49-S51 PolarHBondContact O-N 3.36Š| ||
| 50 | L | 68.9 | Low | 66.3 | Low | 174 Ų | 174 | 131 Ų | 131 | 91% | 0.911 | 75% | 0.747 | S | S | * | * | trans | -58.2 | 108.4 | 169.2 | -76.5 | 157.5 | 0 | 0 | 0 | 107.3 | L48 | L48-L50 PolarHBondContact O-N 2.95Š| ||
| 51 | S | 67.2 | Low | 65.3 | Low | 104 Ų | 104 | 128.6 Ų | 128.6 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 129.6 | 165.7 | -45.6 | 0 | 0 | 0 | 0 | 106.9 | P49 | P49-S51 PolarHBondContact O-N 3.36Š|
| 52 | P | 73 | Confident | 64.3 | Low | 110 Ų | 110 | 128.9 Ų | 128.9 | 71% | 0.714 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 139.3 | 173.7 | 23.3 | -31.5 | 0 | 0 | 0 | 107.8 | T54 | P52-T54 PolarHBondContact O-N 3.46Å; P52-T54 VanDerWaalsContact O-N 3.13Å |
| 53 | P | 69.4 | Low | 63.6 | Low | 121 Ų | 121 | 119.7 Ų | 119.7 | 79% | 0.786 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 128.7 | 173.8 | 23.2 | -31.7 | 0 | 0 | 0 | 107.2 | A55 | P53-A55 VanDerWaalsContact C-N 3.3Å; P53-A55 PolarHBondContact O-N 2.84Å |
| 54 | T | 63.8 | Low | 63.2 | Low | 142 Ų | 142 | 118.1 Ų | 118.1 | 87% | 0.871 | 72% | 0.723 | S | S | * | * | trans | -56 | 102.5 | 171 | -52.6 | 0 | 0 | 0 | 0 | 106.2 | P52 | P52-T54 PolarHBondContact O-N 3.46Å; P52-T54 VanDerWaalsContact O-N 3.13Å | ||
| 55 | A | 59.9 | Low | 63.2 | Low | 62 Ų | 62 | 116.3 Ų | 116.3 | 51% | 0.512 | 72% | 0.717 | S | S | . | * | trans | -56.3 | 132 | 173.1 | 0 | 0 | 0 | 0 | 0 | 106 | P53 D57 | P53-A55 VanDerWaalsContact C-N 3.3Å; P53-A55 PolarHBondContact O-N 2.84Å; A55-D57 PolarHBondContact O-N 3.31Å | ||
| 56 | P | 59.9 | Low | 63.9 | Low | 111 Ų | 111 | 113.9 Ų | 113.9 | 72% | 0.721 | 70% | 0.703 | S | S | * | * | trans | -51.6 | 134.3 | 169.5 | 23.9 | -31.9 | 0 | 0 | 0 | 106.8 | R58 | P56-R58 VanDerWaalsContact C-N 3.34Å; P56-R58 PolarHBondContact O-N 2.75Å | ||
| 57 | D | 47.6 | Very low | 65 | Low | 157 Ų | 157 | 116.8 Ų | 116.8 | 84% | 0.84 | 70% | 0.696 | S | S | * | * | trans | -43.4 | 101.2 | -176.1 | -174.1 | 12.4 | 0 | 0 | 0 | 108.9 | A55 A59 | A55-D57 PolarHBondContact O-N 3.31Å; D57-A59 PolarHBondContact O-N 3.37Å | ||
| 58 | R | 51.7 | Low | 65.8 | Low | 198 Ų | 198 | 111.9 Ų | 111.9 | 75% | 0.747 | 67% | 0.671 | S | S | * | * | trans | -80.5 | 67.2 | -177 | -100.1 | -168.6 | -171.1 | -167.5 | 3.4 | 105.5 | P56 T60 | P56-R58 VanDerWaalsContact C-N 3.34Å; P56-R58 PolarHBondContact O-N 2.75Å; R58-T60 VanDerWaalsContact CB-OG1 3.28Å; R58-T60 WeakPolarHBondContact CB-OG1 3.47Å; R58-T60 PolarHBondContact O-N 3.24Å; R58-T60 PolarHBondContact O-OG1 3.44Å | ||
| 59 | A | 46.9 | Very low | 66.7 | Low | 87 Ų | 87 | 107.2 Ų | 107.2 | 72% | 0.719 | 66% | 0.659 | S | S | * | * | trans | -58.2 | 76.1 | 134.4 | 0 | 0 | 0 | 0 | 0 | 105.6 | D57 A61 | D57-A59 PolarHBondContact O-N 3.37Å; A59-A61 PolarHBondContact O-N 3.06Å | ||
| 60 | T | 50.8 | Low | 67.7 | Low | 78 Ų | 78 | 104.2 Ų | 104.2 | 48% | 0.479 | 64% | 0.64 | S | S | . | * | trans | -69.6 | 82.1 | 175.9 | -53.7 | 0 | 0 | 0 | 0 | 103.3 | R58 V62 | R58-T60 VanDerWaalsContact CB-OG1 3.28Å; R58-T60 WeakPolarHBondContact CB-OG1 3.47Å; R58-T60 PolarHBondContact O-N 3.24Å; R58-T60 PolarHBondContact O-OG1 3.44Å; T60-V62 HydrophobicContact CG2-CG2 3.89Å; T60-V62 PolarHBondContact O-N 3.31Å | ||
| 61 | A | 51 | Low | 68.9 | Low | 87 Ų | 87 | 97.2 Ų | 97.2 | 72% | 0.719 | 60% | 0.601 | S | S | * | * | trans | -50.7 | 100.5 | 139.5 | 0 | 0 | 0 | 0 | 0 | 102.7 | A59 A63 | A59-A61 PolarHBondContact O-N 3.06Å; A61-A63 PolarHBondContact O-N 3.26Å | ||
| 62 | V | 54 | Low | 70.3 | Confident | 110 Ų | 110 | 94 Ų | 94 | 67% | 0.667 | 58% | 0.577 | S | S | * | * | trans | -57.5 | 98.7 | 173.3 | 172 | 0 | 0 | 0 | 0 | 102.7 | T60 T64 | T60-V62 HydrophobicContact CG2-CG2 3.89Å; T60-V62 PolarHBondContact O-N 3.31Å; V62-T64 VanDerWaalsContact C-N 3.34Å; V62-T64 PolarHBondContact O-N 3.38Å | ||
| 63 | A | 58.4 | Low | 71.3 | Confident | 51 Ų | 51 | 89.4 Ų | 89.4 | 42% | 0.421 | 55% | 0.546 | S | S | . | . | trans | -47.4 | 108.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 104.8 | A61 A65 E75 | A61-A63 PolarHBondContact O-N 3.26Å; A63-A65 PolarHBondContact O-N 3.42Å; A63-E75 WeakPolarHBondContact CA-OE1 3.46Å; A63-E75 HydrophobicContact CB-CG 4.19Å; A63-E75 WeakPolarHBondContact CB-OE1 3.15Å | ||
| 64 | T | 65.9 | Low | 72.3 | Confident | 123 Ų | 123 | 87 Ų | 87 | 76% | 0.755 | 53% | 0.527 | S | S | * | . | trans | -77.4 | 77.6 | -170.7 | 35.3 | 0 | 0 | 0 | 0 | 106.2 | V62 S66 | V62-T64 VanDerWaalsContact C-N 3.34Å; V62-T64 PolarHBondContact O-N 3.38Å; T64-S66 PolarHBondContact O-N 2.92Å | ||
| 65 | A | 77.4 | Confident | 73.5 | Confident | 64 Ų | 64 | 85 Ų | 85 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | trans | -63.8 | 113.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | A63 V72 L73 | A63-A65 PolarHBondContact O-N 3.42Å; A65-V72 HydrophobicContact CB-CG1 4.01Å; A65-L73 VanDerWaalsContact CA-O 3.26Å; A65-L73 WeakPolarHBondContact CA-O 3.41Å | ||
| 66 | S | 89.1 | Confident | 74.8 | Confident | 62 Ų | 62 | 85 Ų | 85 | 43% | 0.434 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 138.1 | -179.8 | -177 | 0 | 0 | 0 | 0 | 109.3 | T64 L73 | T64-S66 PolarHBondContact O-N 2.92Å; S66-L73 PolarHBondContact N-O 2.8Å; S66-L73 WeakPolarHBondContact O-CB 3.45Å; S66-L73 PolarHBondContact O-N 3.04Å |
| 67 | R | 90.6 | Very high | 76.1 | Confident | 182 Ų | 182 | 83.5 Ų | 83.5 | 69% | 0.687 | 49% | 0.486 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 125.3 | -178.6 | -171.3 | 176.8 | 172.7 | -164.8 | -0.5 | 110.9 | G69 Y71 V72 | R67-G69 PolarHBondContact NE-O 3.11Å; R67-G69 PolarHBondContact NH2-O 3.27Å; R67-Y71 CarbonylContact C-O 3.59Å; R67-Y71 WeakPolarHBondContact CA-O 3.46Å; R67-Y71 WeakPolarHBondContact CG-O 3.36Å; R67-V72 HydrophobicContact CG-CG2 4.48Å |
| 68 | L | 90.3 | Very high | 77.6 | Confident | 64 Ų | 64 | 86 Ų | 86 | 34% | 0.335 | 49% | 0.492 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 92.4 | 175 | -63.7 | -178.3 | 0 | 0 | 0 | 109.1 | P70 Y71 L73 L127 | L68-P70 WeakPolarHBondContact O-CD 3.37Å; L68-P70 VanDerWaalsContact O-N 3.16Å; L68-Y71 PolarHBondContact N-O 3.3Å; L68-Y71 WeakPolarHBondContact O-CB 3.37Å; L68-Y71 PolarHBondContact O-N 3.06Å; L68-L73 HydrophobicContact CD1-CD1 3.51Å; L68-L73 HydrophobicContact CD1-CD2 4.21Å; L68-L73 HydrophobicContact CD1-CG 3.89Å; L68-L73 HydrophobicContact CG-CD1 4.05Å; L68-L73 HydrophobicContact CG-CG 4.22Å; L68-L127 HydrophobicContact CB-CD1 4.29Å |
| 69 | G | 91.2 | Very high | 78.7 | Confident | 53 Ų | 53 | 80 Ų | 80 | 55% | 0.546 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.6 | -118 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R67 Y71 | R67-G69 PolarHBondContact NE-O 3.11Å; R67-G69 PolarHBondContact NH2-O 3.27Å; G69-Y71 VanDerWaalsContact C-N 3.28Å |
| 70 | P | 94 | Very high | 80.5 | Confident | 48 Ų | 48 | 77.8 Ų | 77.8 | 31% | 0.312 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | 0.7 | 177.2 | 36.1 | -35.1 | 0 | 0 | 0 | 113.8 | L68 C88 P89 | L68-P70 WeakPolarHBondContact O-CD 3.37Å; L68-P70 VanDerWaalsContact O-N 3.16Å; P70-C88 PolarHBondContact O-N 3.4Å; P70-P89 HydrophobicContact CB-CG 4.21Å |
| 71 | Y | 95.5 | Very high | 82.3 | Confident | 28 Ų | 28 | 80.4 Ų | 80.4 | 11% | 0.11 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 142.3 | -179.3 | -59 | -86.4 | 0 | 0 | 0 | 112 | R67 L68 G69 L86 H87 Y94 E125 L127 | R67-Y71 CarbonylContact C-O 3.59Å; R67-Y71 WeakPolarHBondContact CA-O 3.46Å; R67-Y71 WeakPolarHBondContact CG-O 3.36Å; L68-Y71 PolarHBondContact N-O 3.3Å; L68-Y71 WeakPolarHBondContact O-CB 3.37Å; L68-Y71 PolarHBondContact O-N 3.06Å; G69-Y71 VanDerWaalsContact C-N 3.28Å; Y71-L86 CarbonylContact C-O 3.6Å; Y71-L86 VanDerWaalsContact CA-O 3.32Å; Y71-L86 WeakPolarHBondContact CA-O 3.49Å; Y71-H87 HydrophobicContact CD1-CB 3.84Å; Y71-H87 HydrophobicContact CE1-CB 3.58Å; Y71-H87 AromaticContact CE1-CD2 3.53Å; Y71-H87 AromaticContact CE1-CG 3.83Å; Y71-H87 AromaticContact CZ-CD2 3.5Å; Y71-H87 VanDerWaalsContact CZ-CD2 3.5Å; Y71-Y94 HydrophobicContact CD1-CD2 4.32Å; Y71-Y94 AromaticContact CE1-CD2 3.75Å; Y71-Y94 HydrophobicContact CE1-CD2 3.75Å; Y71-Y94 AromaticContact CE1-CE2 3.86Å; Y71-Y94 HydrophobicContact CE1-CE2 3.86Å; Y71-E125 WeakPolarHBondContact CE2-OE2 3.4Å; Y71-E125 PolarHBondContact OH-OE2 3.13Å; Y71-L127 HydrophobicContact CD2-CD1 4.27Å |
| 72 | V | 95.3 | Very high | 84.4 | Confident | 36 Ų | 36 | 77.1 Ų | 77.1 | 22% | 0.218 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 118.9 | 166.4 | 174.6 | 0 | 0 | 0 | 0 | 108.1 | A65 R67 L74 A85 L86 | A65-V72 HydrophobicContact CB-CG1 4.01Å; R67-V72 HydrophobicContact CG-CG2 4.48Å; V72-L74 HydrophobicContact CG1-CD2 4.18Å; V72-A85 CarbonylContact O-C 3.51Å; V72-A85 WeakPolarHBondContact O-CA 3.41Å; V72-L86 PolarHBondContact N-O 3.47Å; V72-L86 PolarHBondContact O-N 3.21Å |
| 73 | L | 94 | Very high | 86.3 | Confident | 13 Ų | 13 | 74.9 Ų | 74.9 | 7% | 0.068 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 127.3 | 170.1 | -61.4 | -174.5 | 0 | 0 | 0 | 109.3 | A65 S66 L68 Y83 Q84 A85 C96 | A65-L73 VanDerWaalsContact CA-O 3.26Å; A65-L73 WeakPolarHBondContact CA-O 3.41Å; S66-L73 PolarHBondContact N-O 2.8Å; S66-L73 WeakPolarHBondContact O-CB 3.45Å; S66-L73 PolarHBondContact O-N 3.04Å; L68-L73 HydrophobicContact CD1-CD1 3.51Å; L68-L73 HydrophobicContact CD1-CD2 4.21Å; L68-L73 HydrophobicContact CD1-CG 3.89Å; L68-L73 HydrophobicContact CG-CD1 4.05Å; L68-L73 HydrophobicContact CG-CG 4.22Å; L73-Y83 HydrophobicContact CD1-CG 4.46Å; L73-Q84 WeakPolarHBondContact CA-O 3.32Å; L73-A85 HydrophobicContact CD2-CB 3.75Å; L73-C96 HydrophobicContact CD2-CB 3.55Å |
| 74 | L | 91.2 | Very high | 88 | Confident | 71 Ų | 71 | 77.1 Ų | 77.1 | 37% | 0.372 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | -160.5 | 174.3 | -54.2 | 178.6 | 0 | 0 | 0 | 109.5 | V72 Y83 Q84 | V72-L74 HydrophobicContact CG1-CD2 4.18Å; L74-Y83 WeakPolarHBondContact O-CD1 3.46Å; L74-Q84 HydrophobicContact CB-CB 4.18Å; L74-Q84 HydrophobicContact CD1-CB 4.14Å; L74-Q84 PolarHBondContact N-O 2.92Å |
| 75 | E | 87.8 | Confident | 89.4 | Confident | 100 Ų | 100 | 71.4 Ų | 71.4 | 47% | 0.467 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -58 | 142.6 | -179.8 | -67 | -58.2 | 110.2 | 0 | 0 | 112.3 | A63 | A63-E75 WeakPolarHBondContact CA-OE1 3.46Å; A63-E75 HydrophobicContact CB-CG 4.19Å; A63-E75 WeakPolarHBondContact CB-OE1 3.15Å |
| 76 | P | 88.9 | Confident | 90.3 | Very high | 63 Ų | 63 | 71.2 Ų | 71.2 | 41% | 0.409 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.4 | 141.3 | 172.7 | 25.4 | -31 | 0 | 0 | 0 | 111 | A82 Y83 | P76-A82 CarbonylContact C-O 3.59Å; P76-A82 WeakPolarHBondContact CA-O 3.43Å; P76-Y83 HydrophobicContact CB-CD1 3.92Å; P76-Y83 HydrophobicContact CB-CE1 3.63Å; P76-Y83 HydrophobicContact CG-CE1 4.19Å |
| 77 | E | 87.4 | Confident | 90.6 | Very high | 78 Ų | 78 | 69.6 Ų | 69.6 | 36% | 0.364 | 37% | 0.374 | S | S | . | . | P | Polyproline II helix | trans | -72.4 | 166 | 168.2 | -60.9 | -173.2 | 159.5 | 0 | 0 | 111 | G79 G80 A82 | E77-G79 PolarHBondContact O-N 2.78Å; E77-G79 VanDerWaalsContact O-N 3.1Å; E77-G80 PolarHBondContact O-N 3.25Å; E77-A82 HydrophobicContact CB-CB 4.14Å; E77-A82 HydrophobicContact CG-CB 4.41Å; E77-A82 PolarHBondContact N-O 2.92Å |
| 78 | E | 77.4 | Confident | 90.8 | Very high | 209 Ų | 209 | 64.3 Ų | 64.3 | 98% | 0.977 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.2 | 117.6 | 177.7 | -168.1 | 166.2 | -140.3 | 0 | 0 | 110.6 | ||
| 79 | G | 76 | Confident | 91.1 | Very high | 73 Ų | 73 | 65.9 Ų | 65.9 | 75% | 0.753 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 107.6 | -4.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | E77 R81 | E77-G79 PolarHBondContact O-N 2.78Å; E77-G79 VanDerWaalsContact O-N 3.1Å; G79-R81 VanDerWaalsContact C-N 3.27Å; G79-R81 PolarHBondContact O-N 3.28Å; G79-R81 VanDerWaalsContact O-N 3.09Å |
| 80 | G | 84.6 | Confident | 91.4 | Very high | 40 Ų | 40 | 67.5 Ų | 67.5 | 41% | 0.412 | 38% | 0.378 | S | S | . | . | S | Bend | trans | 73.4 | 2.2 | 158.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | E77 Y83 | E77-G80 PolarHBondContact O-N 3.25Å; G80-Y83 PolarHBondContact O-OH 3.11Å |
| 81 | R | 88.9 | Confident | 91.4 | Very high | 134 Ų | 134 | 67.5 Ų | 67.5 | 51% | 0.506 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -115.6 | -13.8 | 178 | -62 | -175.7 | -176.8 | -156.3 | 0 | 113.9 | G79 K97 V98 E103 | G79-R81 VanDerWaalsContact C-N 3.27Å; G79-R81 PolarHBondContact O-N 3.28Å; G79-R81 VanDerWaalsContact O-N 3.09Å; R81-K97 WeakPolarHBondContact O-CA 3.3Å; R81-V98 PolarHBondContact O-N 3.03Å; R81-E103 IonicContact NH1-OE2 3.63Å |
| 82 | A | 93.8 | Very high | 91.5 | Very high | 17 Ų | 17 | 68.9 Ų | 68.9 | 14% | 0.14 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 139.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | P76 E77 T95 C96 K97 | P76-A82 CarbonylContact C-O 3.59Å; P76-A82 WeakPolarHBondContact CA-O 3.43Å; E77-A82 HydrophobicContact CB-CB 4.14Å; E77-A82 HydrophobicContact CG-CB 4.41Å; E77-A82 PolarHBondContact N-O 2.92Å; A82-T95 HydrophobicContact CB-CG2 4.27Å; A82-C96 CarbonylContact C-O 3.54Å; A82-C96 WeakPolarHBondContact CA-O 3.31Å; A82-K97 HydrophobicContact CB-CG 4.32Å |
| 83 | Y | 94 | Very high | 91.5 | Very high | 63 Ų | 63 | 74.4 Ų | 74.4 | 25% | 0.247 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 143.7 | -178.2 | -63.2 | -97.3 | 0 | 0 | 0 | 108.2 | L73 L74 P76 G80 T95 C96 V98 | L73-Y83 HydrophobicContact CD1-CG 4.46Å; L74-Y83 WeakPolarHBondContact O-CD1 3.46Å; P76-Y83 HydrophobicContact CB-CD1 3.92Å; P76-Y83 HydrophobicContact CB-CE1 3.63Å; P76-Y83 HydrophobicContact CG-CE1 4.19Å; G80-Y83 PolarHBondContact O-OH 3.11Å; Y83-T95 CarbonylContact O-C 3.52Å; Y83-C96 PolarHBondContact N-O 3.27Å; Y83-C96 PolarHBondContact O-N 3.31Å; Y83-V98 HydrophobicContact CD2-CG2 3.87Å; Y83-V98 HydrophobicContact CE2-CB 4.28Å; Y83-V98 HydrophobicContact CE2-CG2 3.83Å |
| 84 | Q | 94.8 | Very high | 91.6 | Very high | 98 Ų | 98 | 77.3 Ų | 77.3 | 46% | 0.458 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 134.6 | 163.2 | -67.8 | -174.3 | -19.9 | 0 | 0 | 109 | L73 L74 | L73-Q84 WeakPolarHBondContact CA-O 3.32Å; L74-Q84 HydrophobicContact CB-CB 4.18Å; L74-Q84 HydrophobicContact CD1-CB 4.14Å; L74-Q84 PolarHBondContact N-O 2.92Å |
| 85 | A | 95.4 | Very high | 91.8 | Very high | 4 Ų | 4 | 78 Ų | 78 | 3% | 0.033 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 123.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | V72 L73 E93 Y94 C96 | V72-A85 CarbonylContact O-C 3.51Å; V72-A85 WeakPolarHBondContact O-CA 3.41Å; L73-A85 HydrophobicContact CD2-CB 3.75Å; A85-E93 CarbonylContact O-C 3.58Å; A85-E93 WeakPolarHBondContact O-CA 3.33Å; A85-Y94 PolarHBondContact N-O 3.13Å; A85-Y94 PolarHBondContact O-N 2.8Å; A85-C96 HydrophobicContact CB-CB 3.87Å |
| 86 | L | 95.9 | Very high | 92.1 | Very high | 59 Ų | 59 | 74.9 Ų | 74.9 | 31% | 0.309 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 122 | 176 | -177.5 | 67.7 | 0 | 0 | 0 | 110 | Y71 V72 C88 G91 E93 | Y71-L86 CarbonylContact C-O 3.6Å; Y71-L86 VanDerWaalsContact CA-O 3.32Å; Y71-L86 WeakPolarHBondContact CA-O 3.49Å; V72-L86 PolarHBondContact N-O 3.47Å; V72-L86 PolarHBondContact O-N 3.21Å; L86-C88 PolarHBondContact O-N 3.49Å; L86-G91 WeakPolarHBondContact CD1-O 3.5Å; L86-E93 HydrophobicContact CD1-CG 4Å |
| 87 | H | 96.3 | Very high | 92.4 | Very high | 29 Ų | 29 | 77.6 Ų | 77.6 | 13% | 0.134 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 106 | 170.1 | -174.8 | -116.1 | 0 | 0 | 0 | 109.9 | Y71 T90 G91 T92 Y94 | Y71-H87 HydrophobicContact CD1-CB 3.84Å; Y71-H87 HydrophobicContact CE1-CB 3.58Å; Y71-H87 AromaticContact CE1-CD2 3.53Å; Y71-H87 AromaticContact CE1-CG 3.83Å; Y71-H87 AromaticContact CZ-CD2 3.5Å; Y71-H87 VanDerWaalsContact CZ-CD2 3.5Å; H87-T90 WeakPolarHBondContact ND1-CG2 2.88Å; H87-T90 PolarHBondContact ND1-OG1 3.07Å; H87-T90 PolarHBondContact O-N 2.78Å; H87-G91 WeakPolarHBondContact O-CA 3.26Å; H87-G91 PolarHBondContact O-N 2.75Å; H87-T92 WeakPolarHBondContact CB-O 3.49Å; H87-T92 PolarHBondContact N-O 2.75Å; H87-Y94 HydrophobicContact CB-CD2 4.29Å; H87-Y94 HydrophobicContact CB-CE2 3.83Å |
| 88 | C | 94.8 | Very high | 92.7 | Very high | 70 Ų | 70 | 77 Ų | 77 | 47% | 0.473 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -41.4 | -171.5 | -57.2 | 0 | 0 | 0 | 0 | 114.4 | P70 L86 T90 | P70-C88 PolarHBondContact O-N 3.4Å; L86-C88 PolarHBondContact O-N 3.49Å; C88-T90 PolarHBondContact O-N 3.13Å |
| 89 | P | 96.1 | Very high | 93.4 | Very high | 98 Ų | 98 | 71.1 Ų | 71.1 | 64% | 0.636 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -33.8 | -178.1 | -23.6 | 34.2 | 0 | 0 | 0 | 114.5 | P70 | P70-P89 HydrophobicContact CB-CG 4.21Š|
| 90 | T | 96.6 | Very high | 94.2 | Very high | 87 Ų | 87 | 70.3 Ų | 70.3 | 53% | 0.534 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.3 | -11.8 | -174.7 | 64.6 | 0 | 0 | 0 | 0 | 113.6 | H87 C88 T92 | H87-T90 WeakPolarHBondContact ND1-CG2 2.88Å; H87-T90 PolarHBondContact ND1-OG1 3.07Å; H87-T90 PolarHBondContact O-N 2.78Å; C88-T90 PolarHBondContact O-N 3.13Å; T90-T92 WeakPolarHBondContact CB-OG1 2.95Å; T90-T92 PolarHBondContact O-N 2.72Å; T90-T92 WeakPolarHBondContact OG1-CB 3.28Å; T90-T92 PolarHBondContact OG1-N 2.84Å; T90-T92 PolarHBondContact OG1-OG1 3.22Å |
| 91 | G | 95.5 | Very high | 94.5 | Very high | 47 Ų | 47 | 73.4 Ų | 73.4 | 49% | 0.485 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.3 | 14.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | L86 H87 | L86-G91 WeakPolarHBondContact CD1-O 3.5Å; H87-G91 WeakPolarHBondContact O-CA 3.26Å; H87-G91 PolarHBondContact O-N 2.75Å |
| 92 | T | 96.7 | Very high | 94.8 | Very high | 58 Ų | 58 | 75.1 Ų | 75.1 | 36% | 0.356 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 132.1 | -178.3 | -49.8 | 0 | 0 | 0 | 0 | 110.4 | H87 T90 Y94 | H87-T92 WeakPolarHBondContact CB-O 3.49Å; H87-T92 PolarHBondContact N-O 2.75Å; T90-T92 WeakPolarHBondContact CB-OG1 2.95Å; T90-T92 PolarHBondContact O-N 2.72Å; T90-T92 WeakPolarHBondContact OG1-CB 3.28Å; T90-T92 PolarHBondContact OG1-N 2.84Å; T90-T92 PolarHBondContact OG1-OG1 3.22Å; T92-Y94 HydrophobicContact CG2-CD2 4.36Å; T92-Y94 HydrophobicContact CG2-CE1 4.34Å; T92-Y94 HydrophobicContact CG2-CE2 3.64Å; T92-Y94 WeakPolarHBondContact O-CD2 3.45Å |
| 93 | E | 95.6 | Very high | 94.8 | Very high | 151 Ų | 151 | 77.9 Ų | 77.9 | 71% | 0.706 | 42% | 0.42 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 141 | 176 | -66.5 | 177.5 | -176.6 | 0 | 0 | 111.2 | A85 L86 | A85-E93 CarbonylContact O-C 3.58Å; A85-E93 WeakPolarHBondContact O-CA 3.33Å; L86-E93 HydrophobicContact CD1-CG 4Å |
| 94 | Y | 95.7 | Very high | 94.7 | Very high | 75 Ų | 75 | 76.5 Ų | 76.5 | 29% | 0.294 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.4 | 158.8 | 178.1 | -63.5 | -86.8 | 0 | 0 | 0 | 110 | Y71 A85 H87 T92 T124 | Y71-Y94 HydrophobicContact CD1-CD2 4.32Å; Y71-Y94 AromaticContact CE1-CD2 3.75Å; Y71-Y94 HydrophobicContact CE1-CD2 3.75Å; Y71-Y94 AromaticContact CE1-CE2 3.86Å; Y71-Y94 HydrophobicContact CE1-CE2 3.86Å; A85-Y94 PolarHBondContact N-O 3.13Å; A85-Y94 PolarHBondContact O-N 2.8Å; H87-Y94 HydrophobicContact CB-CD2 4.29Å; H87-Y94 HydrophobicContact CB-CE2 3.83Å; T92-Y94 HydrophobicContact CG2-CD2 4.36Å; T92-Y94 HydrophobicContact CG2-CE1 4.34Å; T92-Y94 HydrophobicContact CG2-CE2 3.64Å; T92-Y94 WeakPolarHBondContact O-CD2 3.45Å; Y94-T124 HydrophobicContact CE1-CG2 4.23Å |
| 95 | T | 95.2 | Very high | 94.7 | Very high | 86 Ų | 86 | 78.9 Ų | 78.9 | 53% | 0.528 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 114.6 | 163.8 | -53.3 | 0 | 0 | 0 | 0 | 108.5 | A82 Y83 | A82-T95 HydrophobicContact CB-CG2 4.27Å; Y83-T95 CarbonylContact O-C 3.52Å |
| 96 | C | 94.8 | Very high | 94.8 | Very high | 33 Ų | 33 | 82.3 Ų | 82.3 | 22% | 0.223 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.4 | 125.7 | 173.7 | -177.5 | 0 | 0 | 0 | 0 | 109.7 | L73 A82 Y83 A85 | L73-C96 HydrophobicContact CD2-CB 3.55Å; A82-C96 CarbonylContact C-O 3.54Å; A82-C96 WeakPolarHBondContact CA-O 3.31Å; Y83-C96 PolarHBondContact N-O 3.27Å; Y83-C96 PolarHBondContact O-N 3.31Å; A85-C96 HydrophobicContact CB-CB 3.87Å |
| 97 | K | 94.9 | Very high | 94.7 | Very high | 120 Ų | 120 | 81.5 Ų | 81.5 | 52% | 0.522 | 46% | 0.463 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 122.3 | 172.3 | -64.2 | -174.5 | 178.2 | -177.5 | 0 | 109.6 | R81 A82 Y99 | R81-K97 WeakPolarHBondContact O-CA 3.3Å; A82-K97 HydrophobicContact CB-CG 4.32Å; K97-Y99 HydrophobicContact CB-CD2 4.3Å; K97-Y99 HydrophobicContact CB-CE2 3.51Å; K97-Y99 HydrophobicContact CD-CE2 4.44Å |
| 98 | V | 93.2 | Very high | 94.7 | Very high | 66 Ų | 66 | 82.9 Ų | 82.9 | 40% | 0.4 | 47% | 0.471 | S | S | . | . | trans | -100.7 | 128.1 | -176.9 | -176 | 0 | 0 | 0 | 0 | 109.5 | R81 Y83 | R81-V98 PolarHBondContact O-N 3.03Å; Y83-V98 HydrophobicContact CD2-CG2 3.87Å; Y83-V98 HydrophobicContact CE2-CB 4.28Å; Y83-V98 HydrophobicContact CE2-CG2 3.83Å | ||
| 99 | Y | 93.4 | Very high | 94.8 | Very high | 85 Ų | 85 | 83.6 Ų | 83.6 | 33% | 0.333 | 47% | 0.467 | S | S | . | . | trans | -129.9 | 149.8 | 178.5 | -64.9 | -87.2 | 0 | 0 | 0 | 110.4 | K97 V107 | K97-Y99 HydrophobicContact CB-CD2 4.3Å; K97-Y99 HydrophobicContact CB-CE2 3.51Å; K97-Y99 HydrophobicContact CD-CE2 4.44Å; Y99-V107 HydrophobicContact CD1-CG2 3.74Å; Y99-V107 HydrophobicContact CD2-CG1 4.14Å; Y99-V107 HydrophobicContact CD2-CG2 4.35Å; Y99-V107 HydrophobicContact CE1-CG1 4.47Å; Y99-V107 HydrophobicContact CE1-CG2 3.8Å; Y99-V107 HydrophobicContact CE2-CG1 3.76Å; Y99-V107 HydrophobicContact CE2-CG2 4.38Å; Y99-V107 HydrophobicContact CG-CG2 4.04Å | ||
| 100 | P | 92.9 | Very high | 94.8 | Very high | 56 Ų | 56 | 81.7 Ų | 81.7 | 36% | 0.364 | 46% | 0.455 | S | S | . | . | trans | -55.7 | 144 | 164.6 | -21.7 | 33.3 | 0 | 0 | 0 | 110.8 | Q102 E103 A104 | P100-Q102 PolarHBondContact O-N 3.08Å; P100-Q102 VanDerWaalsContact O-N 3.11Å; P100-E103 HydrophobicContact CB-CG 4.48Å; P100-E103 PolarHBondContact O-N 2.8Å; P100-A104 PolarHBondContact O-N 3.07Å | ||
| 101 | V | 90.9 | Very high | 94.7 | Very high | 106 Ų | 106 | 81 Ų | 81 | 64% | 0.642 | 44% | 0.443 | S | S | * | . | G | 310 helix | trans | -57 | -32.9 | -177.6 | 175.9 | 0 | 0 | 0 | 0 | 111.8 | E103 A104 | V101-E103 PolarHBondContact O-N 3.28Å; V101-A104 WeakPolarHBondContact O-CB 3.47Å; V101-A104 PolarHBondContact O-N 3.07Å |
| 102 | Q | 93.9 | Very high | 94.6 | Very high | 169 Ų | 169 | 82.7 Ų | 82.7 | 79% | 0.79 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -63.6 | -26.8 | 178.2 | -59 | 80.9 | 0.1 | 0 | 0 | 112.8 | P100 | P100-Q102 PolarHBondContact O-N 3.08Å; P100-Q102 VanDerWaalsContact O-N 3.11Å |
| 103 | E | 94.9 | Very high | 94.6 | Very high | 75 Ų | 75 | 88.8 Ų | 88.8 | 35% | 0.35 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -91.6 | -12.6 | -179.8 | -64 | 177.3 | -154.9 | 0 | 0 | 112.6 | R81 P100 V101 L105 A106 V107 | R81-E103 IonicContact NH1-OE2 3.63Å; P100-E103 HydrophobicContact CB-CG 4.48Å; P100-E103 PolarHBondContact O-N 2.8Å; V101-E103 PolarHBondContact O-N 3.28Å; E103-L105 PolarHBondContact O-N 3.09Å; E103-A106 PolarHBondContact O-N 3.43Å; E103-A106 VanDerWaalsContact O-N 3.11Å; E103-V107 WeakPolarHBondContact O-CG2 3.43Å; E103-V107 PolarHBondContact O-N 3.08Å |
| 104 | A | 92 | Very high | 94.5 | Very high | 34 Ų | 34 | 85.7 Ų | 85.7 | 28% | 0.281 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -57.1 | -45.3 | -168.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | P100 V101 V107 L108 | P100-A104 PolarHBondContact O-N 3.07Å; V101-A104 WeakPolarHBondContact O-CB 3.47Å; V101-A104 PolarHBondContact O-N 3.07Å; A104-V107 PolarHBondContact O-N 2.77Å; A104-L108 WeakPolarHBondContact O-CB 3.36Å; A104-L108 VanDerWaalsContact O-CG 3.3Å; A104-L108 WeakPolarHBondContact O-CG 3.34Å; A104-L108 PolarHBondContact O-N 3.06Å |
| 105 | L | 94.3 | Very high | 94.5 | Very high | 149 Ų | 149 | 86.8 Ų | 86.8 | 78% | 0.78 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -64.4 | -43.2 | 179 | -69.4 | -179.5 | 0 | 0 | 0 | 111.8 | E103 V107 L108 E109 | E103-L105 PolarHBondContact O-N 3.09Å; L105-V107 VanDerWaalsContact C-N 3.3Å; L105-V107 PolarHBondContact O-N 2.94Å; L105-L108 PolarHBondContact O-N 3.1Å; L105-E109 VanDerWaalsContact O-CB 3.31Å; L105-E109 WeakPolarHBondContact O-CB 3.33Å; L105-E109 PolarHBondContact O-N 3.15Å |
| 106 | A | 96.6 | Very high | 94.4 | Very high | 76 Ų | 76 | 87.7 Ų | 87.7 | 63% | 0.628 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.8 | -36.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112 | E103 P110 | E103-A106 PolarHBondContact O-N 3.43Å; E103-A106 VanDerWaalsContact O-N 3.11Å; A106-P110 WeakPolarHBondContact O-CD 3.46Å |
| 107 | V | 95.2 | Very high | 94.5 | Very high | 42 Ų | 42 | 91 Ų | 91 | 26% | 0.255 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -71.6 | -36.4 | 177.2 | 174.1 | 0 | 0 | 0 | 0 | 112 | Y99 E103 A104 L105 Y111 | Y99-V107 HydrophobicContact CD1-CG2 3.74Å; Y99-V107 HydrophobicContact CD2-CG1 4.14Å; Y99-V107 HydrophobicContact CD2-CG2 4.35Å; Y99-V107 HydrophobicContact CE1-CG1 4.47Å; Y99-V107 HydrophobicContact CE1-CG2 3.8Å; Y99-V107 HydrophobicContact CE2-CG1 3.76Å; Y99-V107 HydrophobicContact CE2-CG2 4.38Å; Y99-V107 HydrophobicContact CG-CG2 4.04Å; E103-V107 WeakPolarHBondContact O-CG2 3.43Å; E103-V107 PolarHBondContact O-N 3.08Å; A104-V107 PolarHBondContact O-N 2.77Å; L105-V107 VanDerWaalsContact C-N 3.3Å; L105-V107 PolarHBondContact O-N 2.94Å; V107-Y111 WeakPolarHBondContact O-CD2 3.27Å; V107-Y111 WeakPolarHBondContact O-CE2 3.42Å |
| 108 | L | 95.3 | Very high | 94.6 | Very high | 58 Ų | 58 | 93.7 Ų | 93.7 | 30% | 0.304 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -86.4 | -26 | -175.7 | -67.6 | 173.3 | 0 | 0 | 0 | 113.9 | A104 L105 P110 Y111 A112 P123 V126 | A104-L108 WeakPolarHBondContact O-CB 3.36Å; A104-L108 VanDerWaalsContact O-CG 3.3Å; A104-L108 WeakPolarHBondContact O-CG 3.34Å; A104-L108 PolarHBondContact O-N 3.06Å; L105-L108 PolarHBondContact O-N 3.1Å; L108-P110 VanDerWaalsContact C-CD 3.49Å; L108-Y111 PolarHBondContact O-N 3.03Å; L108-Y111 VanDerWaalsContact O-N 3.08Å; L108-A112 PolarHBondContact O-N 3.25Å; L108-P123 HydrophobicContact CD2-CG 4.01Å; L108-V126 HydrophobicContact CD1-CG1 3.99Å; L108-V126 HydrophobicContact CD1-CG2 4.06Å; L108-V126 HydrophobicContact CD2-CG2 3.91Å |
| 109 | E | 96.6 | Very high | 94.7 | Very high | 85 Ų | 85 | 97.6 Ų | 97.6 | 40% | 0.397 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -52.2 | -43.5 | -176.6 | -173.5 | -89.6 | -173.1 | 0 | 0 | 114.3 | L105 Y111 A112 R113 | L105-E109 VanDerWaalsContact O-CB 3.31Å; L105-E109 WeakPolarHBondContact O-CB 3.33Å; L105-E109 PolarHBondContact O-N 3.15Å; E109-Y111 VanDerWaalsContact C-N 3.28Å; E109-Y111 PolarHBondContact O-N 3.24Å; E109-A112 WeakPolarHBondContact O-CB 2.82Å; E109-A112 PolarHBondContact O-N 3.29Å; E109-R113 PolarHBondContact O-N 3.09Å; E109-R113 WeakPolarHBondContact OE1-CD 3.26Å; E109-R113 IonicContact OE1-CZ 2.8Å; E109-R113 IonicContact OE1-NE 3.62Å; E109-R113 IonicContact OE1-NH1 3.58Å; E109-R113 PolarHBondContact OE1-NH1 3.2Å; E109-R113 IonicContact OE2-NH1 3.59Å |
| 110 | P | 95.9 | Very high | 94.8 | Very high | 58 Ų | 58 | 96.1 Ų | 96.1 | 38% | 0.377 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.2 | -36.7 | 179.8 | -25.8 | 35.9 | 0 | 0 | 0 | 112.5 | A106 L108 A112 R113 L114 | A106-P110 WeakPolarHBondContact O-CD 3.46Å; L108-P110 VanDerWaalsContact C-CD 3.49Å; P110-A112 VanDerWaalsContact C-N 3.3Å; P110-A112 PolarHBondContact O-N 3.39Å; P110-R113 PolarHBondContact O-N 3.13Å; P110-L114 VanDerWaalsContact O-CG 3.27Å; P110-L114 WeakPolarHBondContact O-CG 3.43Å; P110-L114 PolarHBondContact O-N 3.41Å; P110-L114 VanDerWaalsContact O-N 3.13Å |
| 111 | Y | 95.1 | Very high | 94.8 | Very high | 73 Ų | 73 | 97.7 Ų | 97.7 | 29% | 0.286 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -70.4 | -27.5 | 178.4 | -59.5 | -79.8 | 0 | 0 | 0 | 112.4 | V107 L108 E109 A121 R122 P123 | V107-Y111 WeakPolarHBondContact O-CD2 3.27Å; V107-Y111 WeakPolarHBondContact O-CE2 3.42Å; L108-Y111 PolarHBondContact O-N 3.03Å; L108-Y111 VanDerWaalsContact O-N 3.08Å; E109-Y111 VanDerWaalsContact C-N 3.28Å; E109-Y111 PolarHBondContact O-N 3.24Å; Y111-A121 VanDerWaalsContact CE1-O 3.26Å; Y111-A121 WeakPolarHBondContact CE1-O 3.41Å; Y111-R122 PolarHBondContact O-NH2 3.48Å; Y111-P123 HydrophobicContact CD2-CG 4.33Å; Y111-P123 HydrophobicContact CE2-CG 4.42Å; Y111-P123 HydrophobicContact CG-CG 4.48Å |
| 112 | A | 93.3 | Very high | 95 | Very high | 82 Ų | 82 | 98.5 Ų | 98.5 | 68% | 0.678 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -73.5 | -31.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L108 E109 P110 | L108-A112 PolarHBondContact O-N 3.25Å; E109-A112 WeakPolarHBondContact O-CB 2.82Å; E109-A112 PolarHBondContact O-N 3.29Å; P110-A112 VanDerWaalsContact C-N 3.3Å; P110-A112 PolarHBondContact O-N 3.39Å |
| 113 | R | 96.1 | Very high | 95.1 | Very high | 185 Ų | 185 | 93.3 Ų | 93.3 | 70% | 0.698 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -83.8 | -27.8 | 179.7 | -71.9 | 170.7 | 60.4 | -169.2 | 1.1 | 113.8 | E109 P110 | E109-R113 PolarHBondContact O-N 3.09Å; E109-R113 WeakPolarHBondContact OE1-CD 3.26Å; E109-R113 IonicContact OE1-CZ 2.8Å; E109-R113 IonicContact OE1-NE 3.62Å; E109-R113 IonicContact OE1-NH1 3.58Å; E109-R113 PolarHBondContact OE1-NH1 3.2Å; E109-R113 IonicContact OE2-NH1 3.59Å; P110-R113 PolarHBondContact O-N 3.13Å |
| 114 | L | 94.8 | Very high | 95.1 | Very high | 87 Ų | 87 | 95 Ų | 95 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | S | Bend | trans | -81.2 | 131.5 | -179.5 | -70.2 | 171.8 | 0 | 0 | 0 | 111 | P110 | P110-L114 VanDerWaalsContact O-CG 3.27Å; P110-L114 WeakPolarHBondContact O-CG 3.43Å; P110-L114 PolarHBondContact O-N 3.41Å; P110-L114 VanDerWaalsContact O-N 3.13Å |
| 115 | P | 95.5 | Very high | 95.2 | Very high | 98 Ų | 98 | 98.4 Ų | 98.4 | 64% | 0.636 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -63.7 | 151.2 | 169.9 | 27.6 | -33 | 0 | 0 | 0 | 110.2 | H117 | P115-H117 PolarHBondContact O-N 3.1Š|
| 116 | P | 93.9 | Very high | 95.2 | Very high | 105 Ų | 105 | 95.7 Ų | 95.7 | 68% | 0.682 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -55.3 | 131.3 | 175.3 | -24.8 | 34.3 | 0 | 0 | 0 | 111.3 | ||
| 117 | H | 96.3 | Very high | 94.9 | Very high | 101 Ų | 101 | 96.4 Ų | 96.4 | 47% | 0.468 | 52% | 0.515 | S | S | . | . | trans | -145.7 | 139.9 | -177.2 | -170.9 | -103 | 0 | 0 | 0 | 111.2 | P115 H119 V120 | P115-H117 PolarHBondContact O-N 3.1Å; H117-H119 AromaticContact CE1-CD2 3.52Å; H117-H119 AromaticContact CE1-CG 3.95Å; H117-H119 PolarHBondContact ND1-N 3.05Å; H117-H119 PolarHBondContact O-N 3.36Å; H117-H119 VanDerWaalsContact O-N 3.08Å; H117-V120 HydrophobicContact CB-CB 4.39Å; H117-V120 HydrophobicContact CB-CG2 4.1Å; H117-V120 PolarHBondContact O-N 3.49Å | ||
| 118 | K | 96.5 | Very high | 94.6 | Very high | 178 Ų | 178 | 98.5 Ų | 98.5 | 77% | 0.774 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -19.3 | -175.4 | 66.6 | -176.7 | -179.5 | -177.7 | 0 | 115 | ||
| 119 | H | 95.9 | Very high | 93.7 | Very high | 147 Ų | 147 | 99.1 Ų | 99.1 | 68% | 0.681 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | 8.8 | 179.3 | -58.3 | -49.5 | 0 | 0 | 0 | 113.3 | H117 | H117-H119 AromaticContact CE1-CD2 3.52Å; H117-H119 AromaticContact CE1-CG 3.95Å; H117-H119 PolarHBondContact ND1-N 3.05Å; H117-H119 PolarHBondContact O-N 3.36Å; H117-H119 VanDerWaalsContact O-N 3.08Å |
| 120 | V | 94.9 | Very high | 92 | Very high | 55 Ų | 55 | 105.2 Ų | 105.2 | 33% | 0.333 | 60% | 0.601 | S | S | . | * | S | Bend | trans | -118.3 | 110 | 176.2 | -179.3 | 0 | 0 | 0 | 0 | 108.1 | H117 R122 | H117-V120 HydrophobicContact CB-CB 4.39Å; H117-V120 HydrophobicContact CB-CG2 4.1Å; H117-V120 PolarHBondContact O-N 3.49Å; V120-R122 PolarHBondContact O-N 3.03Å |
| 121 | A | 93.4 | Very high | 91.8 | Very high | 89 Ų | 89 | 107.6 Ų | 107.6 | 74% | 0.736 | 61% | 0.612 | S | S | * | * | trans | -67.1 | 124.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | Y111 | Y111-A121 VanDerWaalsContact CE1-O 3.26Å; Y111-A121 WeakPolarHBondContact CE1-O 3.41Å | ||
| 122 | R | 94.7 | Very high | 91.6 | Very high | 122 Ų | 122 | 109.4 Ų | 109.4 | 46% | 0.46 | 63% | 0.629 | S | S | . | * | trans | -105.1 | 149 | 176 | -61.4 | -174.3 | 94 | -147.7 | 9.5 | 109.7 | Y111 V120 T124 | Y111-R122 PolarHBondContact O-NH2 3.48Å; V120-R122 PolarHBondContact O-N 3.03Å; R122-T124 PolarHBondContact O-N 3.01Å | ||
| 123 | P | 95.3 | Very high | 91.5 | Very high | 60 Ų | 60 | 110.9 Ų | 110.9 | 39% | 0.39 | 63% | 0.627 | S | S | . | * | trans | -57 | 125.6 | 170.6 | -22.4 | 33.1 | 0 | 0 | 0 | 110.4 | L108 Y111 V126 | L108-P123 HydrophobicContact CD2-CG 4.01Å; Y111-P123 HydrophobicContact CD2-CG 4.33Å; Y111-P123 HydrophobicContact CE2-CG 4.42Å; Y111-P123 HydrophobicContact CG-CG 4.48Å; P123-V126 HydrophobicContact CB-CG2 4.26Å | ||
| 124 | T | 94.6 | Very high | 91.3 | Very high | 112 Ų | 112 | 106.6 Ų | 106.6 | 69% | 0.687 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -73.6 | -38.5 | 174.9 | -53 | 0 | 0 | 0 | 0 | 111 | Y94 R122 | Y94-T124 HydrophobicContact CE1-CG2 4.23Å; R122-T124 PolarHBondContact O-N 3.01Å |
| 125 | E | 94.3 | Very high | 91 | Very high | 104 Ų | 104 | 107.8 Ų | 107.8 | 49% | 0.486 | 63% | 0.633 | S | S | . | * | trans | -146.5 | 149.5 | -179.4 | -170.4 | 172.2 | -166.4 | 0 | 0 | 109.6 | Y71 L127 | Y71-E125 WeakPolarHBondContact CE2-OE2 3.4Å; Y71-E125 PolarHBondContact OH-OE2 3.13Å; E125-L127 HydrophobicContact CG-CD2 3.93Å; E125-L127 HydrophobicContact CG-CG 4.36Å; E125-L127 WeakPolarHBondContact OE1-CD2 3.33Å | ||
| 126 | V | 94.2 | Very high | 90.7 | Very high | 92 Ų | 92 | 108.5 Ų | 108.5 | 56% | 0.558 | 63% | 0.633 | S | S | * | * | trans | -125 | 118 | 173.9 | 179 | 0 | 0 | 0 | 0 | 107.7 | L108 P123 | L108-V126 HydrophobicContact CD1-CG1 3.99Å; L108-V126 HydrophobicContact CD1-CG2 4.06Å; L108-V126 HydrophobicContact CD2-CG2 3.91Å; P123-V126 HydrophobicContact CB-CG2 4.26Å | ||
| 127 | L | 91.8 | Very high | 90.5 | Very high | 91 Ų | 91 | 108.7 Ų | 108.7 | 48% | 0.476 | 63% | 0.629 | S | S | . | * | trans | -104.2 | 124.7 | 179.6 | -58.4 | 176.9 | 0 | 0 | 0 | 109.1 | L68 Y71 E125 | L68-L127 HydrophobicContact CB-CD1 4.29Å; Y71-L127 HydrophobicContact CD2-CD1 4.27Å; E125-L127 HydrophobicContact CG-CD2 3.93Å; E125-L127 HydrophobicContact CG-CG 4.36Å; E125-L127 WeakPolarHBondContact OE1-CD2 3.33Å | ||
| 128 | A | 87.7 | Confident | 90.1 | Very high | 87 Ų | 87 | 109.3 Ų | 109.3 | 72% | 0.719 | 64% | 0.641 | S | S | * | * | trans | -91.3 | 132.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | T130 | A128-T130 PolarHBondContact O-N 3.41Š| ||
| 129 | G | 77.3 | Confident | 89.5 | Confident | 71 Ų | 71 | 103.6 Ų | 103.6 | 73% | 0.732 | 63% | 0.63 | S | S | * | * | trans | -65.3 | 126.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 130 | T | 60.4 | Low | 89 | Confident | 213 Ų | 213 | 99.6 Ų | 99.6 | 100% | 1.307 | 63% | 0.626 | S | S | * | * | trans | -80.9 | 0 | 173.8 | 54.3 | 0 | 0 | 0 | 0 | 111.6 | A128 | A128-T130 PolarHBondContact O-N 3.41Š|
Retrieved 130 of 130 residues in 35.2 ms
(Link to these results)