| 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 | 46.5 | Very low | 45.8 | Very low | 226 Ų | 226 | 159.8 Ų | 159.8 | 100% | 1.113 | 84% | 0.844 | S | S | * | * | 0 | 133.4 | 0 | -75.8 | -172.7 | 177.3 | 0 | 0 | 107.7 | |||||
| 2 | F | 36.5 | Very low | 45.9 | Very low | 204 Ų | 204 | 156.4 Ų | 156.4 | 90% | 0.895 | 84% | 0.838 | S | S | * | * | trans | 146.9 | 102.3 | 156.6 | -74.8 | -61.8 | 0 | 0 | 0 | 110.8 | ||||
| 3 | T | 43.9 | Very low | 45.8 | Very low | 119 Ų | 119 | 151.4 Ų | 151.4 | 73% | 0.73 | 82% | 0.823 | S | S | * | * | trans | -8.3 | 145.2 | 166.7 | 54.3 | 0 | 0 | 0 | 0 | 122 | ||||
| 4 | P | 51.8 | Low | 45.6 | Very low | 128 Ų | 128 | 153.3 Ų | 153.3 | 83% | 0.831 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -93 | 123.9 | 153.6 | 33.6 | -24.9 | 0 | 0 | 0 | 110.5 | K6 | P4-K6 PolarHBondContact O-N 3.39Š|
| 5 | R | 40.8 | Very low | 45.1 | Very low | 230 Ų | 230 | 153.9 Ų | 153.9 | 87% | 0.868 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 117.3 | 169.2 | -80.1 | -175.2 | 169.8 | -176.2 | -2.9 | 109.5 | ||
| 6 | K | 53.6 | Low | 44.5 | Very low | 197 Ų | 197 | 153.6 Ų | 153.6 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 120.7 | 161.6 | -72.2 | 174.5 | 174.6 | 178.7 | 0 | 108.3 | P4 | P4-K6 PolarHBondContact O-N 3.39Š|
| 7 | N | 41.5 | Very low | 44.6 | Very low | 145 Ų | 145 | 150.3 Ų | 150.3 | 78% | 0.775 | 82% | 0.815 | S | S | * | * | trans | -123.9 | 93.6 | 161.1 | -77 | -9.4 | 0 | 0 | 0 | 107.5 | ||||
| 8 | S | 48.8 | Very low | 44.3 | Very low | 114 Ų | 114 | 151.6 Ų | 151.6 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -73.4 | 127.8 | 156 | 49.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 9 | L | 50.8 | Low | 44.4 | Very low | 164 Ų | 164 | 152.3 Ų | 152.3 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | trans | -124.4 | 148.2 | 158.5 | -81.5 | 175.4 | 0 | 0 | 0 | 109.8 | ||||
| 10 | P | 49.8 | Very low | 44.4 | Very low | 112 Ų | 112 | 150.2 Ų | 150.2 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 152.9 | -166.7 | 36.8 | -32.7 | 0 | 0 | 0 | 111.3 | ||
| 11 | S | 40.2 | Very low | 44.2 | Very low | 119 Ų | 119 | 151.2 Ų | 151.2 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 140 | 169.1 | -51.2 | 0 | 0 | 0 | 0 | 110.5 | ||
| 12 | P | 47.2 | Very low | 43.5 | Very low | 119 Ų | 119 | 145.2 Ų | 145.2 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 155.1 | -178.2 | 35 | -33.3 | 0 | 0 | 0 | 113 | ||
| 13 | S | 43.8 | Very low | 43.5 | Very low | 91 Ų | 91 | 141.7 Ų | 141.7 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | trans | -22.6 | 143.1 | 164.7 | 54.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 14 | L | 42.7 | Very low | 43 | Very low | 178 Ų | 178 | 141.1 Ų | 141.1 | 93% | 0.932 | 79% | 0.789 | S | S | * | * | -139.7 | 105.8 | 123.2 | -98.6 | 166.4 | 0 | 0 | 0 | 108.5 | |||||
| 15 | E | 39.3 | Very low | 42.1 | Very low | 162 Ų | 162 | 140.4 Ų | 140.4 | 76% | 0.757 | 79% | 0.788 | S | S | * | * | trans | -60.8 | 136.5 | 156.3 | -71.2 | 141.4 | 146.7 | 0 | 0 | 108.6 | ||||
| 16 | D | 34.8 | Very low | 41.9 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -146 | 115.7 | 137.9 | -136.7 | -11 | 0 | 0 | 0 | 110.3 | ||||
| 17 | S | 46.4 | Very low | 40.9 | Very low | 97 Ų | 97 | 131.6 Ų | 131.6 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | trans | -107 | 96.4 | -177.4 | -61.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 18 | F | 39.5 | Very low | 40.5 | Very low | 173 Ų | 173 | 129.6 Ų | 129.6 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -143.1 | 100.6 | 170.4 | -96.2 | -90.7 | 0 | 0 | 0 | 113.8 | ||||
| 19 | F | 45.4 | Very low | 39.7 | Very low | 166 Ų | 166 | 131.8 Ų | 131.8 | 73% | 0.728 | 78% | 0.779 | S | S | * | * | trans | 69.3 | 131.3 | 142.9 | -77.3 | -97.6 | 0 | 0 | 0 | 123.3 | ||||
| 20 | P | 44.2 | Very low | 38.9 | Very low | 110 Ų | 110 | 133.3 Ų | 133.3 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | trans | -83.8 | 123.9 | 164.5 | 34.2 | -26.8 | 0 | 0 | 0 | 109.2 | S22 | P20-S22 PolarHBondContact O-N 2.65Š| ||
| 21 | L | 40 | Very low | 38.1 | Very low | 172 Ų | 172 | 131.8 Ų | 131.8 | 90% | 0.901 | 78% | 0.776 | S | S | * | * | trans | -84.4 | 112.5 | 168.4 | -70.7 | 178.8 | 0 | 0 | 0 | 110 | ||||
| 22 | S | 32.4 | Very low | 37.7 | Very low | 100 Ų | 100 | 133.6 Ų | 133.6 | 70% | 0.699 | 78% | 0.776 | S | S | * | * | trans | -50.7 | 150.4 | 162.6 | -48.5 | 0 | 0 | 0 | 0 | 112.3 | P20 | P20-S22 PolarHBondContact O-N 2.65Š| ||
| 23 | S | 36.5 | Very low | 37 | Very low | 130 Ų | 130 | 136.2 Ų | 136.2 | 91% | 0.909 | 78% | 0.778 | S | S | * | * | trans | -133.4 | 94.2 | 143.7 | -73.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 24 | S | 32.7 | Very low | 36.4 | Very low | 106 Ų | 106 | 137.3 Ų | 137.3 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | trans | -60.1 | 132.3 | 158 | -70.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 25 | S | 33.9 | Very low | 35.8 | Very low | 114 Ų | 114 | 133.2 Ų | 133.2 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | trans | -129.4 | 93.1 | 148.3 | 173.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 26 | S | 35.8 | Very low | 35.5 | Very low | 102 Ų | 102 | 130.7 Ų | 130.7 | 71% | 0.713 | 78% | 0.778 | S | S | * | * | trans | -68.4 | 125.9 | 168.4 | -4.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 27 | V | 32.5 | Very low | 35.7 | Very low | 139 Ų | 139 | 128.6 Ų | 128.6 | 84% | 0.842 | 78% | 0.775 | S | S | * | * | trans | -132.2 | 109.3 | 151.9 | -171.9 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 28 | S | 33.3 | Very low | 35.6 | Very low | 103 Ų | 103 | 129.8 Ų | 129.8 | 72% | 0.72 | 78% | 0.78 | S | S | * | * | trans | -117.1 | 138.3 | 173.8 | -75.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 29 | L | 33.4 | Very low | 35.8 | Very low | 160 Ų | 160 | 127.4 Ų | 127.4 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | 80.4 | 111.7 | 155.6 | -56.3 | 167.8 | 0 | 0 | 0 | 118.8 | ||||
| 30 | F | 32.3 | Very low | 35.5 | Very low | 196 Ų | 196 | 127.3 Ų | 127.3 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | -144.9 | 116.1 | 115.5 | -130.5 | -92.3 | 0 | 0 | 0 | 110.3 | L32 | F30-L32 HydrophobicContact CD1-CD1 3.98Å; F30-L32 HydrophobicContact CE1-CD1 3.77Å | |||
| 31 | A | 33 | Very low | 35.3 | Very low | 81 Ų | 81 | 124.9 Ų | 124.9 | 67% | 0.669 | 78% | 0.782 | S | S | * | * | trans | -89.6 | 139.6 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 32 | L | 33 | Very low | 35.5 | Very low | 157 Ų | 157 | 125.4 Ų | 125.4 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | trans | -150.6 | 115.6 | 155.4 | -103.5 | 150.6 | 0 | 0 | 0 | 108.8 | F30 | F30-L32 HydrophobicContact CD1-CD1 3.98Å; F30-L32 HydrophobicContact CE1-CD1 3.77Å | ||
| 33 | Q | 32.7 | Very low | 35.7 | Very low | 174 Ų | 174 | 129 Ų | 129 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -91.7 | 143.3 | 168.1 | -92.2 | 177.8 | -2.9 | 0 | 0 | 109.2 | ||||
| 34 | S | 30.3 | Very low | 36.3 | Very low | 113 Ų | 113 | 126.5 Ų | 126.5 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | trans | 73.2 | 121.9 | 143.7 | -49 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 35 | A | 30 | Very low | 37 | Very low | 93 Ų | 93 | 124.5 Ų | 124.5 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | -176.4 | 124.9 | 109.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 36 | S | 33.9 | Very low | 38 | Very low | 109 Ų | 109 | 121.8 Ų | 121.8 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | trans | 27.6 | 132.6 | 141.7 | 57 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 37 | S | 37.3 | Very low | 39 | Very low | 106 Ų | 106 | 120 Ų | 120 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | trans | -46.9 | 162.7 | 156.9 | 45.7 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 38 | P | 46.3 | Very low | 40.3 | Very low | 122 Ų | 122 | 119.3 Ų | 119.3 | 79% | 0.792 | 76% | 0.756 | S | S | * | * | -135.6 | 146.4 | 104.2 | 36.5 | -24.1 | 0 | 0 | 0 | 114.5 | |||||
| 39 | T | 43.2 | Very low | 41.9 | Very low | 123 Ų | 123 | 119.2 Ų | 119.2 | 76% | 0.755 | 75% | 0.747 | S | S | * | * | trans | -46.2 | 152.9 | 149.3 | 49.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 40 | D | 39.4 | Very low | 43.7 | Very low | 163 Ų | 163 | 115.3 Ų | 115.3 | 87% | 0.872 | 73% | 0.73 | S | S | * | * | cis | -170.6 | 158.4 | 23.7 | -144.4 | -7.3 | 0 | 0 | 0 | 107.1 | ||||
| 41 | G | 40 | Very low | 45.9 | Very low | 59 Ų | 59 | 111 Ų | 111 | 61% | 0.608 | 72% | 0.716 | S | S | * | * | trans | 103.4 | 87.3 | 150.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 42 | M | 42.8 | Very low | 48.2 | Very low | 184 Ų | 184 | 112.8 Ų | 112.8 | 91% | 0.906 | 71% | 0.714 | S | S | * | * | trans | 68 | 128.8 | 136.4 | -82.6 | 55.8 | 166.5 | 0 | 0 | 123.3 | ||||
| 43 | D | 36.6 | Very low | 50.5 | Low | 174 Ų | 174 | 109.9 Ų | 109.9 | 93% | 0.93 | 70% | 0.698 | S | S | * | * | trans | 80 | 108.9 | 154.1 | -117.2 | 21.1 | 0 | 0 | 0 | 117.1 | ||||
| 44 | G | 49 | Very low | 52.9 | Low | 78 Ų | 78 | 106.5 Ų | 106.5 | 80% | 0.804 | 69% | 0.685 | S | S | * | * | cis | 142.2 | 101.5 | 9.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 45 | G | 47.5 | Very low | 55.4 | Low | 64 Ų | 64 | 104 Ų | 104 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | S | Bend | trans | 121.9 | -11.4 | 154.1 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||
| 46 | G | 55.8 | Low | 57.9 | Low | 58 Ų | 58 | 102.7 Ų | 102.7 | 60% | 0.598 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -107.1 | -14.5 | -170.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||
| 47 | A | 55.9 | Low | 60.3 | Low | 63 Ų | 63 | 103.3 Ų | 103.3 | 52% | 0.521 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -88.7 | -21.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114 | T50 D51 | A47-T50 PolarHBondContact O-OG1 2.9Å; A47-D51 PolarHBondContact O-N 2.84Å |
| 48 | I | 60.8 | Low | 62.7 | Low | 125 Ų | 125 | 103.5 Ų | 103.5 | 64% | 0.641 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -68.9 | -37.8 | -178.1 | -59.1 | 170.3 | 0 | 0 | 0 | 110.5 | L52 | I48-L52 VanDerWaalsContact O-CB 3.28Å; I48-L52 WeakPolarHBondContact O-CB 3.21Å; I48-L52 PolarHBondContact O-N 2.67Å |
| 49 | D | 65.8 | Low | 64.7 | Low | 101 Ų | 101 | 99 Ų | 99 | 54% | 0.54 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -71.8 | -37.3 | -176.9 | -67.3 | -17.6 | 0 | 0 | 0 | 112.4 | L52 I53 | D49-L52 PolarHBondContact O-N 3.4Å; D49-I53 WeakPolarHBondContact O-CD1 3.07Å; D49-I53 VanDerWaalsContact O-CG1 3.25Å; D49-I53 WeakPolarHBondContact O-CG1 3.37Å; D49-I53 PolarHBondContact O-N 3.13Å |
| 50 | T | 72.9 | Confident | 66.8 | Low | 78 Ų | 78 | 101 Ų | 101 | 48% | 0.479 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -69.8 | -39.9 | 176.3 | 50.9 | 0 | 0 | 0 | 0 | 112 | A47 L52 I53 L54 | A47-T50 PolarHBondContact O-OG1 2.9Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-I53 PolarHBondContact O-N 3.4Å; T50-L54 WeakPolarHBondContact O-CG 3.3Å; T50-L54 PolarHBondContact O-N 3.29Å |
| 51 | D | 77 | Confident | 69.2 | Low | 105 Ų | 105 | 95.5 Ų | 95.5 | 56% | 0.561 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -69.5 | -32.9 | 176.3 | -69.9 | -10.8 | 0 | 0 | 0 | 111.4 | A47 A55 | A47-D51 PolarHBondContact O-N 2.84Å; D51-A55 VanDerWaalsContact O-CB 3.24Å; D51-A55 WeakPolarHBondContact O-CB 2.92Å; D51-A55 PolarHBondContact O-N 2.67Å |
| 52 | L | 81.7 | Confident | 71.6 | Confident | 119 Ų | 119 | 97.2 Ų | 97.2 | 62% | 0.623 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.3 | -42.3 | 174.5 | -160.8 | 87 | 0 | 0 | 0 | 112.1 | I48 D49 T50 A55 A56 | I48-L52 VanDerWaalsContact O-CB 3.28Å; I48-L52 WeakPolarHBondContact O-CB 3.21Å; I48-L52 PolarHBondContact O-N 2.67Å; D49-L52 PolarHBondContact O-N 3.4Å; T50-L52 VanDerWaalsContact C-N 3.33Å; L52-A55 PolarHBondContact O-N 2.65Å; L52-A56 WeakPolarHBondContact O-CB 3.46Å; L52-A56 PolarHBondContact O-N 3.42Å |
| 53 | I | 81.4 | Confident | 74 | Confident | 96 Ų | 96 | 93.4 Ų | 93.4 | 49% | 0.492 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.1 | -46.5 | 177.2 | -68.2 | 164 | 0 | 0 | 0 | 110.4 | D49 T50 A55 A56 E57 | D49-I53 WeakPolarHBondContact O-CD1 3.07Å; D49-I53 VanDerWaalsContact O-CG1 3.25Å; D49-I53 WeakPolarHBondContact O-CG1 3.37Å; D49-I53 PolarHBondContact O-N 3.13Å; T50-I53 PolarHBondContact O-N 3.4Å; I53-A55 VanDerWaalsContact C-N 3.31Å; I53-A55 PolarHBondContact O-N 3.02Å; I53-A56 WeakPolarHBondContact O-CB 3.48Å; I53-A56 PolarHBondContact O-N 3.3Å; I53-A56 VanDerWaalsContact O-N 3.09Å; I53-E57 HydrophobicContact CG2-CG 4.45Å; I53-E57 WeakPolarHBondContact O-CG 3.31Å; I53-E57 PolarHBondContact O-N 2.91Å |
| 54 | L | 82.2 | Confident | 76.7 | Confident | 103 Ų | 103 | 89.2 Ų | 89.2 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.5 | -38.2 | 176.4 | -72.9 | 171.1 | 0 | 0 | 0 | 111.9 | T50 A56 E57 L58 | T50-L54 WeakPolarHBondContact O-CG 3.3Å; T50-L54 PolarHBondContact O-N 3.29Å; L54-A56 VanDerWaalsContact C-N 3.33Å; L54-E57 PolarHBondContact O-N 3.45Å; L54-L58 VanDerWaalsContact O-CB 3.23Å; L54-L58 WeakPolarHBondContact O-CB 3.42Å; L54-L58 PolarHBondContact O-N 3.4Å |
| 55 | A | 83.5 | Confident | 78.8 | Confident | 62 Ų | 62 | 91.1 Ų | 91.1 | 51% | 0.512 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.1 | -35.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | D51 L52 I53 G59 | D51-A55 VanDerWaalsContact O-CB 3.24Å; D51-A55 WeakPolarHBondContact O-CB 2.92Å; D51-A55 PolarHBondContact O-N 2.67Å; L52-A55 PolarHBondContact O-N 2.65Å; I53-A55 VanDerWaalsContact C-N 3.31Å; I53-A55 PolarHBondContact O-N 3.02Å; A55-G59 PolarHBondContact O-N 3.09Å |
| 56 | A | 83.1 | Confident | 80.9 | Confident | 65 Ų | 65 | 92.6 Ų | 92.6 | 54% | 0.537 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -71.1 | -40.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L52 I53 L54 G59 R60 | L52-A56 WeakPolarHBondContact O-CB 3.46Å; L52-A56 PolarHBondContact O-N 3.42Å; I53-A56 WeakPolarHBondContact O-CB 3.48Å; I53-A56 PolarHBondContact O-N 3.3Å; I53-A56 VanDerWaalsContact O-N 3.09Å; L54-A56 VanDerWaalsContact C-N 3.33Å; A56-G59 PolarHBondContact O-N 3.22Å; A56-R60 WeakPolarHBondContact O-CB 3.17Å; A56-R60 PolarHBondContact O-N 2.76Å |
| 57 | E | 85 | Confident | 82.7 | Confident | 121 Ų | 121 | 95.6 Ų | 95.6 | 57% | 0.565 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66 | -41.1 | 174.2 | -72.8 | -179.4 | 174.3 | 0 | 0 | 111.5 | I53 L54 R60 A61 | I53-E57 HydrophobicContact CG2-CG 4.45Å; I53-E57 WeakPolarHBondContact O-CG 3.31Å; I53-E57 PolarHBondContact O-N 2.91Å; L54-E57 PolarHBondContact O-N 3.45Å; E57-R60 PolarHBondContact O-N 3.46Å; E57-A61 WeakPolarHBondContact O-CB 3.45Å; E57-A61 PolarHBondContact O-N 3.08Å |
| 58 | L | 86.8 | Confident | 84.5 | Confident | 110 Ų | 110 | 97.2 Ų | 97.2 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.9 | -41 | 173.2 | -169.6 | 148.9 | 0 | 0 | 0 | 111 | L54 R60 A61 L62 | L54-L58 VanDerWaalsContact O-CB 3.23Å; L54-L58 WeakPolarHBondContact O-CB 3.42Å; L54-L58 PolarHBondContact O-N 3.4Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 2.67Å; L58-A61 PolarHBondContact O-N 2.82Å; L58-L62 HydrophobicContact CD2-CD1 3.52Å; L58-L62 HydrophobicContact CD2-CG 4.04Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 VanDerWaalsContact O-CG 3.25Å; L58-L62 WeakPolarHBondContact O-CG 3.1Å; L58-L62 PolarHBondContact O-N 3.49Å |
| 59 | G | 87.5 | Confident | 86.1 | Confident | 27 Ų | 27 | 96 Ų | 96 | 28% | 0.278 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.1 | -41 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | A55 A56 L62 L63 | A55-G59 PolarHBondContact O-N 3.09Å; A56-G59 PolarHBondContact O-N 3.22Å; G59-L62 PolarHBondContact O-N 3.27Å; G59-L63 VanDerWaalsContact O-CG 3.32Å; G59-L63 WeakPolarHBondContact O-CG 3.35Å; G59-L63 PolarHBondContact O-N 3.41Å |
| 60 | R | 88.9 | Confident | 87.4 | Confident | 165 Ų | 165 | 93.3 Ų | 93.3 | 62% | 0.623 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.9 | -46.4 | 174.7 | -177.8 | 179 | 171.7 | 173.3 | 2.1 | 112.2 | A56 E57 L58 L62 L63 E64 | A56-R60 WeakPolarHBondContact O-CB 3.17Å; A56-R60 PolarHBondContact O-N 2.76Å; E57-R60 PolarHBondContact O-N 3.46Å; L58-R60 VanDerWaalsContact C-N 3.32Å; L58-R60 PolarHBondContact O-N 2.67Å; R60-L62 VanDerWaalsContact C-N 3.25Å; R60-L62 PolarHBondContact O-N 3.14Å; R60-L63 WeakPolarHBondContact O-CB 3.48Å; R60-L63 PolarHBondContact O-N 3.39Å; R60-L63 VanDerWaalsContact O-N 3.09Å; R60-E64 HydrophobicContact CG-CG 4.48Å; R60-E64 IonicContact CZ-OE1 3.56Å; R60-E64 IonicContact NE-OE1 2.85Å; R60-E64 PolarHBondContact NE-OE1 3.3Å; R60-E64 IonicContact NH2-OE1 2.6Å; R60-E64 PolarHBondContact NH2-OE1 2.76Å; R60-E64 WeakPolarHBondContact O-CG 3.47Å; R60-E64 PolarHBondContact O-N 2.83Å |
| 61 | A | 88.9 | Confident | 88.5 | Confident | 49 Ų | 49 | 95.2 Ų | 95.2 | 41% | 0.405 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -36.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E57 L58 K65 | E57-A61 WeakPolarHBondContact O-CB 3.45Å; E57-A61 PolarHBondContact O-N 3.08Å; L58-A61 PolarHBondContact O-N 2.82Å; A61-K65 VanDerWaalsContact O-CB 3.31Å; A61-K65 WeakPolarHBondContact O-CB 3.49Å; A61-K65 WeakPolarHBondContact O-CG 3.47Å; A61-K65 PolarHBondContact O-N 2.84Å |
| 62 | L | 91.4 | Very high | 89.3 | Confident | 95 Ų | 95 | 93.2 Ų | 93.2 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 172.3 | -74.5 | 177.1 | 0 | 0 | 0 | 112.5 | L58 G59 R60 N66 | L58-L62 HydrophobicContact CD2-CD1 3.52Å; L58-L62 HydrophobicContact CD2-CG 4.04Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 VanDerWaalsContact O-CG 3.25Å; L58-L62 WeakPolarHBondContact O-CG 3.1Å; L58-L62 PolarHBondContact O-N 3.49Å; G59-L62 PolarHBondContact O-N 3.27Å; R60-L62 VanDerWaalsContact C-N 3.25Å; R60-L62 PolarHBondContact O-N 3.14Å; L62-N66 VanDerWaalsContact O-CB 3.32Å; L62-N66 WeakPolarHBondContact O-CB 3.27Å; L62-N66 PolarHBondContact O-N 3.46Å; L62-N66 PolarHBondContact O-ND2 3.32Å; L62-N66 VanDerWaalsContact O-ND2 3.13Å |
| 63 | L | 93.2 | Very high | 89.9 | Confident | 104 Ų | 104 | 92.7 Ų | 92.7 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.7 | -48.5 | 174.7 | -75.6 | 172.2 | 0 | 0 | 0 | 111.4 | G59 R60 K65 N66 E67 | G59-L63 VanDerWaalsContact O-CG 3.32Å; G59-L63 WeakPolarHBondContact O-CG 3.35Å; G59-L63 PolarHBondContact O-N 3.41Å; R60-L63 WeakPolarHBondContact O-CB 3.48Å; R60-L63 PolarHBondContact O-N 3.39Å; R60-L63 VanDerWaalsContact O-N 3.09Å; L63-K65 VanDerWaalsContact C-N 3.28Å; L63-K65 PolarHBondContact O-N 2.77Å; L63-N66 CarbonylContact O-C 3.54Å; L63-N66 WeakPolarHBondContact O-CA 3.34Å; L63-N66 WeakPolarHBondContact O-CB 3.42Å; L63-N66 PolarHBondContact O-N 2.75Å; L63-E67 WeakPolarHBondContact O-CB 3.35Å; L63-E67 WeakPolarHBondContact O-CG 3.36Å; L63-E67 PolarHBondContact O-N 2.78Å |
| 64 | E | 91.7 | Very high | 90.6 | Very high | 85 Ų | 85 | 93.2 Ų | 93.2 | 40% | 0.397 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.7 | -41.7 | 175.8 | -71.1 | 173.1 | -173.9 | 0 | 0 | 110.6 | R60 E67 E68 | R60-E64 HydrophobicContact CG-CG 4.48Å; R60-E64 IonicContact CZ-OE1 3.56Å; R60-E64 IonicContact NE-OE1 2.85Å; R60-E64 PolarHBondContact NE-OE1 3.3Å; R60-E64 IonicContact NH2-OE1 2.6Å; R60-E64 PolarHBondContact NH2-OE1 2.76Å; R60-E64 WeakPolarHBondContact O-CG 3.47Å; R60-E64 PolarHBondContact O-N 2.83Å; E64-E67 PolarHBondContact O-N 2.84Å; E64-E68 WeakPolarHBondContact O-CG 3.25Å; E64-E68 PolarHBondContact O-N 3.32Å |
| 65 | K | 93.4 | Very high | 91.2 | Very high | 118 Ų | 118 | 93.4 Ų | 93.4 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.5 | -39.1 | 172.9 | -73.1 | -73.7 | 159.2 | -150.5 | 0 | 113 | A61 L63 E68 L69 | A61-K65 VanDerWaalsContact O-CB 3.31Å; A61-K65 WeakPolarHBondContact O-CB 3.49Å; A61-K65 WeakPolarHBondContact O-CG 3.47Å; A61-K65 PolarHBondContact O-N 2.84Å; L63-K65 VanDerWaalsContact C-N 3.28Å; L63-K65 PolarHBondContact O-N 2.77Å; K65-E68 IonicContact NZ-OE1 3.39Å; K65-E68 IonicContact NZ-OE2 3.85Å; K65-E68 PolarHBondContact NZ-OE2 2.87Å; K65-L69 WeakPolarHBondContact O-CB 3.47Å; K65-L69 WeakPolarHBondContact O-CG 3.42Å; K65-L69 PolarHBondContact O-N 3.36Å |
| 66 | N | 92.3 | Very high | 91.7 | Very high | 96 Ų | 96 | 98.1 Ų | 98.1 | 51% | 0.513 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69 | -34.4 | 175.8 | -77.1 | -31.6 | 0 | 0 | 0 | 112.1 | L62 L63 L69 A70 | L62-N66 VanDerWaalsContact O-CB 3.32Å; L62-N66 WeakPolarHBondContact O-CB 3.27Å; L62-N66 PolarHBondContact O-N 3.46Å; L62-N66 PolarHBondContact O-ND2 3.32Å; L62-N66 VanDerWaalsContact O-ND2 3.13Å; L63-N66 CarbonylContact O-C 3.54Å; L63-N66 WeakPolarHBondContact O-CA 3.34Å; L63-N66 WeakPolarHBondContact O-CB 3.42Å; L63-N66 PolarHBondContact O-N 2.75Å; N66-L69 PolarHBondContact O-N 3.25Å; N66-A70 WeakPolarHBondContact O-CB 3.47Å; N66-A70 PolarHBondContact O-N 3.32Å |
| 67 | E | 93.3 | Very high | 92.3 | Very high | 120 Ų | 120 | 100.8 Ų | 100.8 | 56% | 0.561 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.5 | -47.2 | 174 | -73.5 | 173.3 | -178.3 | 0 | 0 | 110.9 | L63 E64 L69 A70 E71 | L63-E67 WeakPolarHBondContact O-CB 3.35Å; L63-E67 WeakPolarHBondContact O-CG 3.36Å; L63-E67 PolarHBondContact O-N 2.78Å; E64-E67 PolarHBondContact O-N 2.84Å; E67-L69 VanDerWaalsContact C-N 3.31Å; E67-L69 PolarHBondContact O-N 3.49Å; E67-A70 WeakPolarHBondContact O-CB 3.06Å; E67-A70 PolarHBondContact O-N 2.87Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E67-E71 WeakPolarHBondContact O-CG 3.22Å; E67-E71 PolarHBondContact O-N 2.82Å |
| 68 | E | 93.9 | Very high | 92.9 | Very high | 98 Ų | 98 | 101.6 Ų | 101.6 | 46% | 0.458 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58 | -42.5 | 172 | -72.3 | 174.6 | 177.9 | 0 | 0 | 111.7 | E64 K65 A70 E71 T72 | E64-E68 WeakPolarHBondContact O-CG 3.25Å; E64-E68 PolarHBondContact O-N 3.32Å; K65-E68 IonicContact NZ-OE1 3.39Å; K65-E68 IonicContact NZ-OE2 3.85Å; K65-E68 PolarHBondContact NZ-OE2 2.87Å; E68-A70 VanDerWaalsContact C-N 3.34Å; E68-E71 PolarHBondContact O-N 2.82Å; E68-T72 WeakPolarHBondContact O-CB 3.26Å; E68-T72 VanDerWaalsContact O-CG2 3.29Å; E68-T72 WeakPolarHBondContact O-CG2 3.35Å; E68-T72 PolarHBondContact O-N 2.91Å; E68-T72 PolarHBondContact O-OG1 2.66Å |
| 69 | L | 93.2 | Very high | 93.3 | Very high | 100 Ų | 100 | 101.4 Ų | 101.4 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.1 | -39 | 174.8 | -74 | 172.5 | 0 | 0 | 0 | 111.5 | K65 N66 E67 T72 L73 | K65-L69 WeakPolarHBondContact O-CB 3.47Å; K65-L69 WeakPolarHBondContact O-CG 3.42Å; K65-L69 PolarHBondContact O-N 3.36Å; N66-L69 PolarHBondContact O-N 3.25Å; E67-L69 VanDerWaalsContact C-N 3.31Å; E67-L69 PolarHBondContact O-N 3.49Å; L69-T72 WeakPolarHBondContact CA-OG1 3.44Å; L69-T72 PolarHBondContact O-OG1 2.82Å; L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 WeakPolarHBondContact O-CG 3.35Å; L69-L73 PolarHBondContact O-N 2.82Å |
| 70 | A | 94.1 | Very high | 93.7 | Very high | 44 Ų | 44 | 103.7 Ų | 103.7 | 36% | 0.364 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.7 | -43 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | N66 E67 E68 L73 Q74 | N66-A70 WeakPolarHBondContact O-CB 3.47Å; N66-A70 PolarHBondContact O-N 3.32Å; E67-A70 WeakPolarHBondContact O-CB 3.06Å; E67-A70 PolarHBondContact O-N 2.87Å; E67-A70 VanDerWaalsContact O-N 3.08Å; E68-A70 VanDerWaalsContact C-N 3.34Å; A70-L73 PolarHBondContact O-N 2.91Å; A70-Q74 WeakPolarHBondContact O-CB 3.39Å; A70-Q74 VanDerWaalsContact O-CG 3.31Å; A70-Q74 WeakPolarHBondContact O-CG 3.24Å; A70-Q74 PolarHBondContact O-N 3.46Å |
| 71 | E | 94.9 | Very high | 94.1 | Very high | 118 Ų | 118 | 101 Ų | 101 | 55% | 0.551 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.5 | -41.9 | 176.1 | -71.4 | -175 | 173.4 | 0 | 0 | 112 | E67 E68 Q74 Q75 | E67-E71 WeakPolarHBondContact O-CG 3.22Å; E67-E71 PolarHBondContact O-N 2.82Å; E68-E71 PolarHBondContact O-N 2.82Å; E71-Q74 PolarHBondContact O-N 3.1Å; E71-Q75 VanDerWaalsContact O-CG 3.27Å; E71-Q75 WeakPolarHBondContact O-CG 3.4Å; E71-Q75 PolarHBondContact O-N 2.96Å |
| 72 | T | 94.8 | Very high | 94.5 | Very high | 62 Ų | 62 | 100.8 Ų | 100.8 | 38% | 0.38 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.1 | -38.8 | 176 | 54.4 | 0 | 0 | 0 | 0 | 111.7 | E68 L69 Q75 R76 | E68-T72 WeakPolarHBondContact O-CB 3.26Å; E68-T72 VanDerWaalsContact O-CG2 3.29Å; E68-T72 WeakPolarHBondContact O-CG2 3.35Å; E68-T72 PolarHBondContact O-N 2.91Å; E68-T72 PolarHBondContact O-OG1 2.66Å; L69-T72 WeakPolarHBondContact CA-OG1 3.44Å; L69-T72 PolarHBondContact O-OG1 2.82Å; T72-Q75 PolarHBondContact O-N 3.43Å; T72-R76 VanDerWaalsContact O-CG 3.26Å; T72-R76 WeakPolarHBondContact O-CG 3.32Å; T72-R76 PolarHBondContact O-N 3.36Å |
| 73 | L | 94 | Very high | 94.7 | Very high | 109 Ų | 109 | 101.5 Ų | 101.5 | 57% | 0.571 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.5 | -45.8 | 172 | -75 | 172.9 | 0 | 0 | 0 | 111.6 | L69 A70 Q75 R76 E77 | L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 WeakPolarHBondContact O-CG 3.35Å; L69-L73 PolarHBondContact O-N 2.82Å; A70-L73 PolarHBondContact O-N 2.91Å; L73-Q75 VanDerWaalsContact C-N 3.31Å; L73-Q75 PolarHBondContact O-N 2.88Å; L73-R76 PolarHBondContact O-N 3.11Å; L73-R76 VanDerWaalsContact O-N 3.14Å; L73-E77 WeakPolarHBondContact O-CG 3.15Å; L73-E77 PolarHBondContact O-N 3.38Å |
| 74 | Q | 95.6 | Very high | 94.9 | Very high | 107 Ų | 107 | 101.5 Ų | 101.5 | 50% | 0.5 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.5 | -37 | 176.1 | -75 | 177.9 | 7 | 0 | 0 | 112.8 | A70 E71 E77 K78 | A70-Q74 WeakPolarHBondContact O-CB 3.39Å; A70-Q74 VanDerWaalsContact O-CG 3.31Å; A70-Q74 WeakPolarHBondContact O-CG 3.24Å; A70-Q74 PolarHBondContact O-N 3.46Å; E71-Q74 PolarHBondContact O-N 3.1Å; Q74-E77 PolarHBondContact O-N 3.44Å; Q74-K78 WeakPolarHBondContact O-CG 3.4Å; Q74-K78 PolarHBondContact O-N 3.42Å; Q74-K78 VanDerWaalsContact O-N 3.14Å |
| 75 | Q | 95.8 | Very high | 95.1 | Very high | 106 Ų | 106 | 103.9 Ų | 103.9 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65 | -44.1 | 173.8 | -72.2 | 168.8 | 11.7 | 0 | 0 | 111 | E71 T72 L73 E77 K78 E79 | E71-Q75 VanDerWaalsContact O-CG 3.27Å; E71-Q75 WeakPolarHBondContact O-CG 3.4Å; E71-Q75 PolarHBondContact O-N 2.96Å; T72-Q75 PolarHBondContact O-N 3.43Å; L73-Q75 VanDerWaalsContact C-N 3.31Å; L73-Q75 PolarHBondContact O-N 2.88Å; Q75-E77 VanDerWaalsContact C-N 3.33Å; Q75-E77 PolarHBondContact O-N 2.92Å; Q75-K78 PolarHBondContact O-N 2.86Å; Q75-E79 WeakPolarHBondContact O-CG 3.46Å; Q75-E79 PolarHBondContact O-N 3.3Å |
| 76 | R | 94.3 | Very high | 95.3 | Very high | 161 Ų | 161 | 103.8 Ų | 103.8 | 61% | 0.608 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.4 | -37.2 | 175.9 | -66.1 | -64.1 | 172.4 | 78.2 | 3.8 | 112.5 | T72 L73 E79 V80 | T72-R76 VanDerWaalsContact O-CG 3.26Å; T72-R76 WeakPolarHBondContact O-CG 3.32Å; T72-R76 PolarHBondContact O-N 3.36Å; L73-R76 PolarHBondContact O-N 3.11Å; L73-R76 VanDerWaalsContact O-N 3.14Å; R76-E79 WeakPolarHBondContact CD-OE2 3.49Å; R76-E79 IonicContact NE-OE2 2.73Å; R76-E79 PolarHBondContact O-N 2.94Å; R76-V80 VanDerWaalsContact O-CG2 3.26Å; R76-V80 WeakPolarHBondContact O-CG2 3.36Å; R76-V80 PolarHBondContact O-N 3.01Å |
| 77 | E | 95.9 | Very high | 95.5 | Very high | 121 Ų | 121 | 105 Ų | 105 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.5 | -46.9 | 174.2 | -74.3 | 173.1 | 172.3 | 0 | 0 | 111.5 | L73 Q74 Q75 E79 V80 E81 | L73-E77 WeakPolarHBondContact O-CG 3.15Å; L73-E77 PolarHBondContact O-N 3.38Å; Q74-E77 PolarHBondContact O-N 3.44Å; Q75-E77 VanDerWaalsContact C-N 3.33Å; Q75-E77 PolarHBondContact O-N 2.92Å; E77-E79 VanDerWaalsContact C-N 3.34Å; E77-E79 PolarHBondContact O-N 2.96Å; E77-V80 PolarHBondContact O-N 2.92Å; E77-E81 WeakPolarHBondContact O-CG 3.19Å; E77-E81 PolarHBondContact O-N 3.48Å |
| 78 | K | 96.6 | Very high | 95.8 | Very high | 138 Ų | 138 | 104 Ų | 104 | 60% | 0.6 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -39.7 | 175.8 | -70.2 | 172.5 | -176.5 | 171.3 | 0 | 112.7 | Q74 Q75 E81 A82 | Q74-K78 WeakPolarHBondContact O-CG 3.4Å; Q74-K78 PolarHBondContact O-N 3.42Å; Q74-K78 VanDerWaalsContact O-N 3.14Å; Q75-K78 PolarHBondContact O-N 2.86Å; K78-E81 PolarHBondContact O-N 3.32Å; K78-A82 WeakPolarHBondContact O-CB 3.48Å; K78-A82 PolarHBondContact O-N 2.92Å |
| 79 | E | 96.7 | Very high | 95.9 | Very high | 106 Ų | 106 | 102.5 Ų | 102.5 | 50% | 0.495 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 174.4 | -73.1 | 172.8 | -174.1 | 0 | 0 | 111.4 | Q75 R76 E77 A82 L83 | Q75-E79 WeakPolarHBondContact O-CG 3.46Å; Q75-E79 PolarHBondContact O-N 3.3Å; R76-E79 WeakPolarHBondContact CD-OE2 3.49Å; R76-E79 IonicContact NE-OE2 2.73Å; R76-E79 PolarHBondContact O-N 2.94Å; E77-E79 VanDerWaalsContact C-N 3.34Å; E77-E79 PolarHBondContact O-N 2.96Å; E79-A82 PolarHBondContact O-N 3.29Å; E79-L83 WeakPolarHBondContact O-CB 3.49Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.34Å; E79-L83 PolarHBondContact O-N 3.14Å |
| 80 | V | 95.7 | Very high | 96.1 | Very high | 76 Ų | 76 | 103 Ų | 103 | 46% | 0.461 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 175.8 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | R76 E77 L83 Q84 | R76-V80 VanDerWaalsContact O-CG2 3.26Å; R76-V80 WeakPolarHBondContact O-CG2 3.36Å; R76-V80 PolarHBondContact O-N 3.01Å; E77-V80 PolarHBondContact O-N 2.92Å; V80-L83 PolarHBondContact O-N 3.39Å; V80-Q84 HydrophobicContact CG1-CG 4.42Å; V80-Q84 WeakPolarHBondContact O-CB 3.4Å; V80-Q84 VanDerWaalsContact O-CG 3.23Å; V80-Q84 WeakPolarHBondContact O-CG 3.24Å; V80-Q84 PolarHBondContact O-N 2.88Å |
| 81 | E | 96.1 | Very high | 96.3 | Very high | 109 Ų | 109 | 104.7 Ų | 104.7 | 51% | 0.509 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 175.5 | -71.8 | 177.1 | 176.1 | 0 | 0 | 112.2 | E77 K78 Q84 Q85 | E77-E81 WeakPolarHBondContact O-CG 3.19Å; E77-E81 PolarHBondContact O-N 3.48Å; K78-E81 PolarHBondContact O-N 3.32Å; E81-Q84 PolarHBondContact O-N 3.45Å; E81-Q85 WeakPolarHBondContact O-CG 3.48Å; E81-Q85 PolarHBondContact O-N 3.29Å |
| 82 | A | 96.8 | Very high | 96.5 | Very high | 44 Ų | 44 | 107.1 Ų | 107.1 | 36% | 0.364 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | K78 E79 Q84 Q85 E86 | K78-A82 WeakPolarHBondContact O-CB 3.48Å; K78-A82 PolarHBondContact O-N 2.92Å; E79-A82 PolarHBondContact O-N 3.29Å; A82-Q84 VanDerWaalsContact C-N 3.32Å; A82-Q84 PolarHBondContact O-N 2.98Å; A82-Q85 PolarHBondContact O-N 3.46Å; A82-E86 WeakPolarHBondContact O-CG 3.23Å; A82-E86 PolarHBondContact O-N 2.89Å |
| 83 | L | 96.4 | Very high | 96.6 | Very high | 109 Ų | 109 | 110 Ų | 110 | 57% | 0.571 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.7 | -36.4 | 176.4 | -71.1 | 173.8 | 0 | 0 | 0 | 112.5 | E79 V80 K87 | E79-L83 WeakPolarHBondContact O-CB 3.49Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.34Å; E79-L83 PolarHBondContact O-N 3.14Å; V80-L83 PolarHBondContact O-N 3.39Å; L83-K87 VanDerWaalsContact O-CB 3.25Å; L83-K87 WeakPolarHBondContact O-CB 3.32Å; L83-K87 PolarHBondContact O-N 3.4Å |
| 84 | Q | 96.6 | Very high | 96.8 | Very high | 104 Ų | 104 | 109.3 Ų | 109.3 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -43.1 | 174.1 | -75.2 | 173.2 | 6.6 | 0 | 0 | 111.5 | V80 E81 A82 K87 H88 | V80-Q84 HydrophobicContact CG1-CG 4.42Å; V80-Q84 WeakPolarHBondContact O-CB 3.4Å; V80-Q84 VanDerWaalsContact O-CG 3.23Å; V80-Q84 WeakPolarHBondContact O-CG 3.24Å; V80-Q84 PolarHBondContact O-N 2.88Å; E81-Q84 PolarHBondContact O-N 3.45Å; A82-Q84 VanDerWaalsContact C-N 3.32Å; A82-Q84 PolarHBondContact O-N 2.98Å; Q84-K87 PolarHBondContact O-N 2.95Å; Q84-H88 PolarHBondContact O-CD2 3.41Å; Q84-H88 PolarHBondContact O-N 2.97Å |
| 85 | Q | 96.9 | Very high | 96.9 | Very high | 135 Ų | 135 | 109.3 Ų | 109.3 | 63% | 0.631 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.7 | -47.3 | 175.3 | -69.2 | 174.6 | 18.8 | 0 | 0 | 111.4 | E81 A82 K87 H88 V89 | E81-Q85 WeakPolarHBondContact O-CG 3.48Å; E81-Q85 PolarHBondContact O-N 3.29Å; A82-Q85 PolarHBondContact O-N 3.46Å; Q85-K87 VanDerWaalsContact C-N 3.34Å; Q85-K87 PolarHBondContact O-N 3.22Å; Q85-H88 PolarHBondContact O-N 3.48Å; Q85-V89 WeakPolarHBondContact O-CG2 3.44Å; Q85-V89 PolarHBondContact O-N 2.73Å |
| 86 | E | 97.1 | Very high | 97 | Very high | 116 Ų | 116 | 109.5 Ų | 109.5 | 54% | 0.542 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59 | -45 | 176.1 | -74 | -177.8 | 179.1 | 0 | 0 | 111.7 | A82 H88 V89 L90 | A82-E86 WeakPolarHBondContact O-CG 3.23Å; A82-E86 PolarHBondContact O-N 2.89Å; E86-H88 PolarHBondContact O-N 3.1Å; E86-V89 PolarHBondContact O-N 2.9Å; E86-L90 WeakPolarHBondContact O-CB 3.19Å; E86-L90 VanDerWaalsContact O-CG 3.28Å; E86-L90 WeakPolarHBondContact O-CG 3.47Å; E86-L90 PolarHBondContact O-N 3.31Å |
| 87 | K | 97.6 | Very high | 97.1 | Very high | 121 Ų | 121 | 106.5 Ų | 106.5 | 53% | 0.526 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -56 | -49.1 | 174.9 | 179.7 | -173.1 | 174.6 | -175.5 | 0 | 111.3 | L83 Q84 Q85 V89 L90 Q91 | L83-K87 VanDerWaalsContact O-CB 3.25Å; L83-K87 WeakPolarHBondContact O-CB 3.32Å; L83-K87 PolarHBondContact O-N 3.4Å; Q84-K87 PolarHBondContact O-N 2.95Å; Q85-K87 VanDerWaalsContact C-N 3.34Å; Q85-K87 PolarHBondContact O-N 3.22Å; K87-V89 VanDerWaalsContact C-N 3.35Å; K87-V89 PolarHBondContact O-N 3.43Å; K87-L90 PolarHBondContact O-N 3.47Å; K87-Q91 HydrophobicContact CG-CG 4.48Å; K87-Q91 WeakPolarHBondContact O-CB 3.48Å; K87-Q91 VanDerWaalsContact O-CG 3.25Å; K87-Q91 WeakPolarHBondContact O-CG 3.42Å; K87-Q91 PolarHBondContact O-N 2.83Å |
| 88 | H | 98.1 | Very high | 97.2 | Very high | 99 Ų | 99 | 106.7 Ų | 106.7 | 46% | 0.458 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.1 | -37.8 | 179.4 | -73.7 | -52.7 | 0 | 0 | 0 | 112.7 | Q84 Q85 E86 Q91 R92 | Q84-H88 PolarHBondContact O-CD2 3.41Å; Q84-H88 PolarHBondContact O-N 2.97Å; Q85-H88 PolarHBondContact O-N 3.48Å; E86-H88 PolarHBondContact O-N 3.1Å; H88-Q91 PolarHBondContact ND1-OE1 2.8Å; H88-Q91 PolarHBondContact O-N 3.13Å; H88-R92 WeakPolarHBondContact O-CG 3.39Å; H88-R92 PolarHBondContact O-N 3.41Å |
| 89 | V | 97.9 | Very high | 97.3 | Very high | 68 Ų | 68 | 105.4 Ų | 105.4 | 41% | 0.412 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.5 | -44.3 | 174.4 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | Q85 E86 K87 R92 K93 | Q85-V89 WeakPolarHBondContact O-CG2 3.44Å; Q85-V89 PolarHBondContact O-N 2.73Å; E86-V89 PolarHBondContact O-N 2.9Å; K87-V89 VanDerWaalsContact C-N 3.35Å; K87-V89 PolarHBondContact O-N 3.43Å; V89-R92 PolarHBondContact O-N 3.29Å; V89-K93 HydrophobicContact CG1-CD 4.12Å; V89-K93 WeakPolarHBondContact O-CG 3.42Å; V89-K93 PolarHBondContact O-N 2.93Å |
| 90 | L | 97.4 | Very high | 97.4 | Very high | 111 Ų | 111 | 104.3 Ų | 104.3 | 58% | 0.581 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.3 | -40.3 | 177.4 | -71 | 174.8 | 0 | 0 | 0 | 111.9 | E86 K87 K93 L94 | E86-L90 WeakPolarHBondContact O-CB 3.19Å; E86-L90 VanDerWaalsContact O-CG 3.28Å; E86-L90 WeakPolarHBondContact O-CG 3.47Å; E86-L90 PolarHBondContact O-N 3.31Å; K87-L90 PolarHBondContact O-N 3.47Å; L90-K93 PolarHBondContact O-N 3.24Å; L90-L94 WeakPolarHBondContact O-CB 3.47Å; L90-L94 PolarHBondContact O-N 3.13Å |
| 91 | Q | 97.9 | Very high | 97.4 | Very high | 78 Ų | 78 | 102.9 Ų | 102.9 | 36% | 0.364 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.3 | -49.5 | 174 | -76.5 | 174.5 | -27 | 0 | 0 | 111.4 | K87 H88 K93 L94 E95 | K87-Q91 HydrophobicContact CG-CG 4.48Å; K87-Q91 WeakPolarHBondContact O-CB 3.48Å; K87-Q91 VanDerWaalsContact O-CG 3.25Å; K87-Q91 WeakPolarHBondContact O-CG 3.42Å; K87-Q91 PolarHBondContact O-N 2.83Å; H88-Q91 PolarHBondContact ND1-OE1 2.8Å; H88-Q91 PolarHBondContact O-N 3.13Å; Q91-K93 VanDerWaalsContact C-N 3.34Å; Q91-K93 PolarHBondContact O-N 3.42Å; Q91-L94 WeakPolarHBondContact O-CB 3.45Å; Q91-L94 PolarHBondContact O-N 3.33Å; Q91-L94 VanDerWaalsContact O-N 3.17Å; Q91-E95 WeakPolarHBondContact O-CG 3.37Å; Q91-E95 PolarHBondContact O-N 2.91Å |
| 92 | R | 97.6 | Very high | 97.5 | Very high | 169 Ų | 169 | 99.3 Ų | 99.3 | 64% | 0.638 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.7 | -39.7 | 176.7 | -69.7 | 177.5 | -170.7 | 166.8 | 4.3 | 112.5 | H88 V89 L94 E95 M96 | H88-R92 WeakPolarHBondContact O-CG 3.39Å; H88-R92 PolarHBondContact O-N 3.41Å; V89-R92 PolarHBondContact O-N 3.29Å; R92-L94 VanDerWaalsContact C-N 3.31Å; R92-E95 PolarHBondContact O-N 3.01Å; R92-M96 WeakPolarHBondContact O-CB 3.37Å; R92-M96 WeakPolarHBondContact O-CG 3.37Å; R92-M96 PolarHBondContact O-N 3.02Å |
| 93 | K | 98 | Very high | 97.6 | Very high | 122 Ų | 122 | 102.7 Ų | 102.7 | 53% | 0.53 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 175.6 | -75.5 | 175.6 | -179.9 | 178 | 0 | 111.4 | V89 L90 Q91 N97 | V89-K93 HydrophobicContact CG1-CD 4.12Å; V89-K93 WeakPolarHBondContact O-CG 3.42Å; V89-K93 PolarHBondContact O-N 2.93Å; L90-K93 PolarHBondContact O-N 3.24Å; Q91-K93 VanDerWaalsContact C-N 3.34Å; Q91-K93 PolarHBondContact O-N 3.42Å; K93-N97 WeakPolarHBondContact O-CB 3.41Å; K93-N97 PolarHBondContact O-N 3.25Å; K93-N97 PolarHBondContact O-ND2 3.4Å |
| 94 | L | 97.6 | Very high | 97.7 | Very high | 96 Ų | 96 | 103 Ų | 103 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -49.2 | 176.1 | -173.2 | 157.3 | 0 | 0 | 0 | 110.5 | L90 Q91 R92 M96 N97 E98 | L90-L94 WeakPolarHBondContact O-CB 3.47Å; L90-L94 PolarHBondContact O-N 3.13Å; Q91-L94 WeakPolarHBondContact O-CB 3.45Å; Q91-L94 PolarHBondContact O-N 3.33Å; Q91-L94 VanDerWaalsContact O-N 3.17Å; R92-L94 VanDerWaalsContact C-N 3.31Å; L94-M96 VanDerWaalsContact C-N 3.34Å; L94-M96 PolarHBondContact O-N 3.26Å; L94-N97 PolarHBondContact O-N 3.49Å; L94-E98 HydrophobicContact CD2-CG 3.96Å; L94-E98 WeakPolarHBondContact CD2-OE1 3.43Å; L94-E98 WeakPolarHBondContact O-CG 3.35Å; L94-E98 PolarHBondContact O-N 3.31Å |
| 95 | E | 97.9 | Very high | 97.7 | Very high | 107 Ų | 107 | 104 Ų | 104 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.5 | -44.4 | 176 | -70.9 | 166.9 | -171.8 | 0 | 0 | 112.1 | Q91 R92 E98 L99 | Q91-E95 WeakPolarHBondContact O-CG 3.37Å; Q91-E95 PolarHBondContact O-N 2.91Å; R92-E95 PolarHBondContact O-N 3.01Å; E95-E98 PolarHBondContact O-N 2.81Å; E95-L99 WeakPolarHBondContact O-CG 3.37Å; E95-L99 PolarHBondContact O-N 3.2Å |
| 96 | M | 97.7 | Very high | 97.7 | Very high | 109 Ų | 109 | 100.8 Ų | 100.8 | 54% | 0.537 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.2 | -45.8 | 176 | -72.4 | -67.3 | -66.2 | 0 | 0 | 111.5 | R92 L94 E98 L99 E100 | R92-M96 WeakPolarHBondContact O-CB 3.37Å; R92-M96 WeakPolarHBondContact O-CG 3.37Å; R92-M96 PolarHBondContact O-N 3.02Å; L94-M96 VanDerWaalsContact C-N 3.34Å; L94-M96 PolarHBondContact O-N 3.26Å; M96-E98 VanDerWaalsContact C-N 3.33Å; M96-E98 PolarHBondContact O-N 2.9Å; M96-L99 PolarHBondContact O-N 2.9Å; M96-E100 WeakPolarHBondContact O-CG 3.47Å; M96-E100 PolarHBondContact O-N 2.94Å |
| 97 | N | 97.6 | Very high | 97.8 | Very high | 99 Ų | 99 | 100.9 Ų | 100.9 | 53% | 0.529 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.1 | -37 | 177.6 | -71.1 | -23.9 | 0 | 0 | 0 | 112.2 | K93 L94 E100 A101 | K93-N97 WeakPolarHBondContact O-CB 3.41Å; K93-N97 PolarHBondContact O-N 3.25Å; K93-N97 PolarHBondContact O-ND2 3.4Å; L94-N97 PolarHBondContact O-N 3.49Å; N97-E100 PolarHBondContact O-N 2.91Å; N97-A101 VanDerWaalsContact O-CB 3.31Å; N97-A101 WeakPolarHBondContact O-CB 3.37Å; N97-A101 PolarHBondContact O-N 3.19Å |
| 98 | E | 97.9 | Very high | 97.8 | Very high | 124 Ų | 124 | 100.2 Ų | 100.2 | 58% | 0.579 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.5 | -43.3 | 174.8 | -75.9 | -179.5 | 165.3 | 0 | 0 | 111.7 | L94 E95 M96 A101 G102 | L94-E98 HydrophobicContact CD2-CG 3.96Å; L94-E98 WeakPolarHBondContact CD2-OE1 3.43Å; L94-E98 WeakPolarHBondContact O-CG 3.35Å; L94-E98 PolarHBondContact O-N 3.31Å; E95-E98 PolarHBondContact O-N 2.81Å; M96-E98 VanDerWaalsContact C-N 3.33Å; M96-E98 PolarHBondContact O-N 2.9Å; E98-A101 PolarHBondContact O-N 2.89Å; E98-G102 PolarHBondContact O-N 2.93Å |
| 99 | L | 97.8 | Very high | 97.8 | Very high | 112 Ų | 112 | 100.2 Ų | 100.2 | 59% | 0.586 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.7 | -44.1 | 175.3 | -70.5 | 173.9 | 0 | 0 | 0 | 111.6 | E95 M96 A101 G102 Q103 | E95-L99 WeakPolarHBondContact O-CG 3.37Å; E95-L99 PolarHBondContact O-N 3.2Å; M96-L99 PolarHBondContact O-N 2.9Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 2.92Å; L99-G102 PolarHBondContact O-N 3.47Å; L99-Q103 WeakPolarHBondContact O-CB 3.26Å; L99-Q103 VanDerWaalsContact O-CG 3.32Å; L99-Q103 WeakPolarHBondContact O-CG 3.48Å; L99-Q103 PolarHBondContact O-N 3.3Å |
| 100 | E | 98.1 | Very high | 97.8 | Very high | 83 Ų | 83 | 99.7 Ų | 99.7 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 175.6 | -73.5 | -179.4 | -164.1 | 0 | 0 | 112 | M96 N97 K104 | M96-E100 WeakPolarHBondContact O-CG 3.47Å; M96-E100 PolarHBondContact O-N 2.94Å; N97-E100 PolarHBondContact O-N 2.91Å; E100-K104 WeakPolarHBondContact O-CD 3.46Å; E100-K104 VanDerWaalsContact O-CG 3.28Å; E100-K104 WeakPolarHBondContact O-CG 3.3Å; E100-K104 PolarHBondContact O-N 3.02Å; E100-K104 VanDerWaalsContact O-N 3.08Å |
| 101 | A | 97.6 | Very high | 97.9 | Very high | 45 Ų | 45 | 98.8 Ų | 98.8 | 37% | 0.372 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.9 | -46.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | N97 E98 L99 Q103 K104 E105 | N97-A101 VanDerWaalsContact O-CB 3.31Å; N97-A101 WeakPolarHBondContact O-CB 3.37Å; N97-A101 PolarHBondContact O-N 3.19Å; E98-A101 PolarHBondContact O-N 2.89Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 2.92Å; A101-Q103 VanDerWaalsContact C-N 3.34Å; A101-Q103 PolarHBondContact O-N 3.38Å; A101-K104 PolarHBondContact O-N 3.43Å; A101-E105 WeakPolarHBondContact O-CG 3.31Å; A101-E105 PolarHBondContact O-N 3.31Å |
| 102 | G | 98.3 | Very high | 97.9 | Very high | 35 Ų | 35 | 98.8 Ų | 98.8 | 36% | 0.361 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.9 | -38.5 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | E98 L99 E105 S106 | E98-G102 PolarHBondContact O-N 2.93Å; L99-G102 PolarHBondContact O-N 3.47Å; G102-E105 PolarHBondContact O-N 3.44Å; G102-S106 WeakPolarHBondContact O-CB 3.48Å; G102-S106 PolarHBondContact O-N 3.17Å |
| 103 | Q | 97.6 | Very high | 97.9 | Very high | 115 Ų | 115 | 93.3 Ų | 93.3 | 54% | 0.537 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.6 | -50.1 | 172.7 | -75.5 | 174.6 | 3.4 | 0 | 0 | 111.1 | L99 A101 E105 S106 E107 | L99-Q103 WeakPolarHBondContact O-CB 3.26Å; L99-Q103 VanDerWaalsContact O-CG 3.32Å; L99-Q103 WeakPolarHBondContact O-CG 3.48Å; L99-Q103 PolarHBondContact O-N 3.3Å; A101-Q103 VanDerWaalsContact C-N 3.34Å; A101-Q103 PolarHBondContact O-N 3.38Å; Q103-E105 VanDerWaalsContact C-N 3.31Å; Q103-E105 PolarHBondContact O-N 3.35Å; Q103-S106 WeakPolarHBondContact O-CB 3.4Å; Q103-S106 PolarHBondContact O-N 3.04Å; Q103-S106 PolarHBondContact O-OG 3.49Å; Q103-E107 WeakPolarHBondContact O-CG 3.41Å; Q103-E107 PolarHBondContact O-N 3.13Å |
| 104 | K | 98 | Very high | 97.9 | Very high | 116 Ų | 116 | 90 Ų | 90 | 50% | 0.504 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.7 | -41.1 | 176.8 | -71.2 | 166 | -173.2 | 158.3 | 0 | 112 | E100 A101 S106 E107 L108 | E100-K104 WeakPolarHBondContact O-CD 3.46Å; E100-K104 VanDerWaalsContact O-CG 3.28Å; E100-K104 WeakPolarHBondContact O-CG 3.3Å; E100-K104 PolarHBondContact O-N 3.02Å; E100-K104 VanDerWaalsContact O-N 3.08Å; A101-K104 PolarHBondContact O-N 3.43Å; K104-S106 VanDerWaalsContact C-N 3.34Å; K104-E107 PolarHBondContact O-N 2.89Å; K104-L108 WeakPolarHBondContact O-CB 3.47Å; K104-L108 VanDerWaalsContact O-CG 3.25Å; K104-L108 WeakPolarHBondContact O-CG 3.46Å; K104-L108 PolarHBondContact O-N 3.23Å |
| 105 | E | 97.9 | Very high | 97.9 | Very high | 124 Ų | 124 | 89.8 Ų | 89.8 | 58% | 0.579 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.9 | -40.7 | 174.4 | -74.6 | -176.8 | 177.2 | 0 | 0 | 112 | A101 G102 Q103 L108 N109 | A101-E105 WeakPolarHBondContact O-CG 3.31Å; A101-E105 PolarHBondContact O-N 3.31Å; G102-E105 PolarHBondContact O-N 3.44Å; Q103-E105 VanDerWaalsContact C-N 3.31Å; Q103-E105 PolarHBondContact O-N 3.35Å; E105-L108 PolarHBondContact O-N 3.09Å; E105-N109 VanDerWaalsContact O-CB 3.24Å; E105-N109 WeakPolarHBondContact O-CB 3.4Å; E105-N109 PolarHBondContact O-N 2.9Å; E105-N109 PolarHBondContact O-ND2 2.88Å |
| 106 | S | 97.1 | Very high | 97.9 | Very high | 68 Ų | 68 | 92.2 Ų | 92.2 | 48% | 0.476 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.1 | -40.2 | 178 | 77.8 | 0 | 0 | 0 | 0 | 112.8 | G102 Q103 K104 N109 A110 | G102-S106 WeakPolarHBondContact O-CB 3.48Å; G102-S106 PolarHBondContact O-N 3.17Å; Q103-S106 WeakPolarHBondContact O-CB 3.4Å; Q103-S106 PolarHBondContact O-N 3.04Å; Q103-S106 PolarHBondContact O-OG 3.49Å; K104-S106 VanDerWaalsContact C-N 3.34Å; S106-N109 PolarHBondContact O-N 3.26Å; S106-A110 WeakPolarHBondContact O-CB 3.43Å; S106-A110 PolarHBondContact O-N 3.41Å |
| 107 | E | 98.1 | Very high | 97.9 | Very high | 117 Ų | 117 | 89 Ų | 89 | 55% | 0.547 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.5 | -49.7 | 174.5 | -70.5 | 173.7 | 179.1 | 0 | 0 | 110.4 | Q103 K104 N109 A110 D111 | Q103-E107 WeakPolarHBondContact O-CG 3.41Å; Q103-E107 PolarHBondContact O-N 3.13Å; K104-E107 PolarHBondContact O-N 2.89Å; E107-N109 VanDerWaalsContact C-N 3.29Å; E107-N109 PolarHBondContact O-N 3.36Å; E107-A110 WeakPolarHBondContact O-CB 3.42Å; E107-A110 PolarHBondContact O-N 3.41Å; E107-A110 VanDerWaalsContact O-N 3.11Å; E107-D111 PolarHBondContact O-N 2.9Å |
| 108 | L | 98.1 | Very high | 98 | Very high | 108 Ų | 108 | 88.7 Ų | 88.7 | 57% | 0.565 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.6 | -37.5 | 176.6 | -70 | 175.5 | 0 | 0 | 0 | 112 | K104 E105 D111 L112 | K104-L108 WeakPolarHBondContact O-CB 3.47Å; K104-L108 VanDerWaalsContact O-CG 3.25Å; K104-L108 WeakPolarHBondContact O-CG 3.46Å; K104-L108 PolarHBondContact O-N 3.23Å; E105-L108 PolarHBondContact O-N 3.09Å; L108-D111 PolarHBondContact O-N 2.91Å; L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 WeakPolarHBondContact O-CG 3.45Å; L108-L112 PolarHBondContact O-N 2.9Å |
| 109 | N | 98.1 | Very high | 98 | Very high | 98 Ų | 98 | 87.6 Ų | 87.6 | 52% | 0.524 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 175 | -78.4 | -38.7 | 0 | 0 | 0 | 112 | E105 S106 E107 L112 A113 | E105-N109 VanDerWaalsContact O-CB 3.24Å; E105-N109 WeakPolarHBondContact O-CB 3.4Å; E105-N109 PolarHBondContact O-N 2.9Å; E105-N109 PolarHBondContact O-ND2 2.88Å; S106-N109 PolarHBondContact O-N 3.26Å; E107-N109 VanDerWaalsContact C-N 3.29Å; E107-N109 PolarHBondContact O-N 3.36Å; N109-L112 PolarHBondContact O-N 3.44Å; N109-A113 WeakPolarHBondContact O-CB 3.36Å; N109-A113 PolarHBondContact O-N 3.1Å |
| 110 | A | 98.2 | Very high | 98 | Very high | 58 Ų | 58 | 89 Ų | 89 | 48% | 0.479 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | S106 E107 A113 S114 | S106-A110 WeakPolarHBondContact O-CB 3.43Å; S106-A110 PolarHBondContact O-N 3.41Å; E107-A110 WeakPolarHBondContact O-CB 3.42Å; E107-A110 PolarHBondContact O-N 3.41Å; E107-A110 VanDerWaalsContact O-N 3.11Å; A110-A113 WeakPolarHBondContact O-CB 3.33Å; A110-A113 PolarHBondContact O-N 3.38Å; A110-S114 PolarHBondContact O-N 2.94Å; A110-S114 PolarHBondContact O-OG 3.07Å |
| 111 | D | 98.3 | Very high | 98 | Very high | 92 Ų | 92 | 91.2 Ų | 91.2 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.5 | -41.4 | 175.2 | -72.6 | -16.8 | 0 | 0 | 0 | 112 | E107 L108 A113 S114 L115 | E107-D111 PolarHBondContact O-N 2.9Å; L108-D111 PolarHBondContact O-N 2.91Å; D111-A113 VanDerWaalsContact C-N 3.3Å; D111-A113 PolarHBondContact O-N 3.37Å; D111-S114 WeakPolarHBondContact CA-OG 3.35Å; D111-S114 PolarHBondContact O-N 3.34Å; D111-S114 PolarHBondContact O-OG 3.17Å; D111-L115 WeakPolarHBondContact O-CB 3.42Å; D111-L115 VanDerWaalsContact O-CG 3.24Å; D111-L115 WeakPolarHBondContact O-CG 3.31Å; D111-L115 PolarHBondContact O-N 3.32Å |
| 112 | L | 98.1 | Very high | 98 | Very high | 78 Ų | 78 | 96.2 Ų | 96.2 | 41% | 0.408 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.8 | -37.3 | 173.8 | -74.4 | 174.4 | 0 | 0 | 0 | 111.6 | L108 N109 R116 | L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 WeakPolarHBondContact O-CG 3.45Å; L108-L112 PolarHBondContact O-N 2.9Å; N109-L112 PolarHBondContact O-N 3.44Å; L112-R116 WeakPolarHBondContact O-CB 3.42Å; L112-R116 WeakPolarHBondContact O-CD 3.49Å; L112-R116 WeakPolarHBondContact O-CG 3.37Å; L112-R116 PolarHBondContact O-N 3.16Å |
| 113 | A | 98.1 | Very high | 98 | Very high | 54 Ų | 54 | 100.5 Ų | 100.5 | 45% | 0.446 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.5 | -42.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | N109 A110 D111 R116 A117 | N109-A113 WeakPolarHBondContact O-CB 3.36Å; N109-A113 PolarHBondContact O-N 3.1Å; A110-A113 WeakPolarHBondContact O-CB 3.33Å; A110-A113 PolarHBondContact O-N 3.38Å; D111-A113 VanDerWaalsContact C-N 3.3Å; D111-A113 PolarHBondContact O-N 3.37Å; A113-R116 PolarHBondContact O-N 3.13Å; A113-A117 PolarHBondContact O-N 2.92Å |
| 114 | S | 98.3 | Very high | 98 | Very high | 51 Ų | 51 | 96.9 Ų | 96.9 | 36% | 0.357 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.8 | -46.5 | 177.1 | 68 | 0 | 0 | 0 | 0 | 111.4 | A110 D111 R116 A117 E118 | A110-S114 PolarHBondContact O-N 2.94Å; A110-S114 PolarHBondContact O-OG 3.07Å; D111-S114 WeakPolarHBondContact CA-OG 3.35Å; D111-S114 PolarHBondContact O-N 3.34Å; D111-S114 PolarHBondContact O-OG 3.17Å; S114-R116 VanDerWaalsContact C-N 3.33Å; S114-R116 PolarHBondContact O-N 3.2Å; S114-A117 WeakPolarHBondContact O-CB 3.37Å; S114-A117 PolarHBondContact O-N 3.47Å; S114-A117 VanDerWaalsContact O-N 3.1Å; S114-E118 WeakPolarHBondContact O-CG 3.47Å; S114-E118 PolarHBondContact O-N 2.98Å |
| 115 | L | 97.9 | Very high | 98 | Very high | 93 Ų | 93 | 94.9 Ų | 94.9 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -39.5 | 175.9 | -71.9 | 173 | 0 | 0 | 0 | 112.2 | D111 E118 L119 | D111-L115 WeakPolarHBondContact O-CB 3.42Å; D111-L115 VanDerWaalsContact O-CG 3.24Å; D111-L115 WeakPolarHBondContact O-CG 3.31Å; D111-L115 PolarHBondContact O-N 3.32Å; L115-E118 PolarHBondContact O-N 3.03Å; L115-L119 WeakPolarHBondContact O-CB 3.49Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.38Å; L115-L119 PolarHBondContact O-N 3.48Å |
| 116 | R | 97.9 | Very high | 98 | Very high | 157 Ų | 157 | 90.1 Ų | 90.1 | 59% | 0.592 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.5 | -41.4 | 173.8 | -77.1 | 169.4 | -178.1 | 155 | 1.4 | 111.7 | L112 A113 S114 L119 Q120 | L112-R116 WeakPolarHBondContact O-CB 3.42Å; L112-R116 WeakPolarHBondContact O-CD 3.49Å; L112-R116 WeakPolarHBondContact O-CG 3.37Å; L112-R116 PolarHBondContact O-N 3.16Å; A113-R116 PolarHBondContact O-N 3.13Å; S114-R116 VanDerWaalsContact C-N 3.33Å; S114-R116 PolarHBondContact O-N 3.2Å; R116-L119 PolarHBondContact O-N 3.45Å; R116-Q120 WeakPolarHBondContact O-CG 3.5Å; R116-Q120 PolarHBondContact O-N 3.48Å |
| 117 | A | 98.1 | Very high | 98.1 | Very high | 41 Ų | 41 | 93.9 Ų | 93.9 | 34% | 0.339 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.3 | -41.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A113 S114 Q120 K121 | A113-A117 PolarHBondContact O-N 2.92Å; S114-A117 WeakPolarHBondContact O-CB 3.37Å; S114-A117 PolarHBondContact O-N 3.47Å; S114-A117 VanDerWaalsContact O-N 3.1Å; A117-Q120 PolarHBondContact O-N 2.98Å; A117-K121 WeakPolarHBondContact O-CG 3.48Å; A117-K121 PolarHBondContact O-N 3.16Å |
| 118 | E | 98.4 | Very high | 98 | Very high | 94 Ų | 94 | 91.6 Ų | 91.6 | 44% | 0.439 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.7 | -46 | 174 | -72.9 | 177.9 | -177.5 | 0 | 0 | 111.6 | S114 L115 Q120 K121 Y122 | S114-E118 WeakPolarHBondContact O-CG 3.47Å; S114-E118 PolarHBondContact O-N 2.98Å; L115-E118 PolarHBondContact O-N 3.03Å; E118-Q120 VanDerWaalsContact C-N 3.33Å; E118-Q120 PolarHBondContact O-N 3.33Å; E118-K121 WeakPolarHBondContact O-CB 3.41Å; E118-K121 PolarHBondContact O-N 3.07Å; E118-K121 VanDerWaalsContact O-N 3.16Å; E118-Y122 HydrophobicContact CB-CE2 4.42Å; E118-Y122 WeakPolarHBondContact O-CD2 3.28Å; E118-Y122 PolarHBondContact O-N 2.92Å |
| 119 | L | 97.9 | Very high | 98 | Very high | 100 Ų | 100 | 92.8 Ų | 92.8 | 52% | 0.524 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -57.8 | -45.9 | 174.1 | -75.6 | 172.6 | 0 | 0 | 0 | 111.4 | L115 R116 K121 Y122 H123 | L115-L119 WeakPolarHBondContact O-CB 3.49Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.38Å; L115-L119 PolarHBondContact O-N 3.48Å; R116-L119 PolarHBondContact O-N 3.45Å; L119-K121 VanDerWaalsContact C-N 3.32Å; L119-K121 PolarHBondContact O-N 2.97Å; L119-Y122 PolarHBondContact O-N 3.46Å; L119-H123 PolarHBondContact O-N 3.2Å; L119-H123 PolarHBondContact O-ND1 3.35Å |
| 120 | Q | 98.2 | Very high | 98 | Very high | 141 Ų | 141 | 97.3 Ų | 97.3 | 66% | 0.659 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60.2 | -40.5 | 176.9 | -75.7 | 178.9 | -0.4 | 0 | 0 | 112.4 | R116 A117 E118 H123 S124 | R116-Q120 WeakPolarHBondContact O-CG 3.5Å; R116-Q120 PolarHBondContact O-N 3.48Å; A117-Q120 PolarHBondContact O-N 2.98Å; E118-Q120 VanDerWaalsContact C-N 3.33Å; E118-Q120 PolarHBondContact O-N 3.33Å; Q120-H123 PolarHBondContact O-N 2.84Å; Q120-S124 PolarHBondContact O-N 3.41Å; Q120-S124 PolarHBondContact O-OG 2.97Å |
| 121 | K | 98.1 | Very high | 98 | Very high | 131 Ų | 131 | 99.6 Ų | 99.6 | 57% | 0.57 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.3 | -48.9 | 174.5 | -71.7 | 175.4 | -177.4 | -179.9 | 0 | 111.8 | A117 E118 L119 H123 S124 E125 | A117-K121 WeakPolarHBondContact O-CG 3.48Å; A117-K121 PolarHBondContact O-N 3.16Å; E118-K121 WeakPolarHBondContact O-CB 3.41Å; E118-K121 PolarHBondContact O-N 3.07Å; E118-K121 VanDerWaalsContact O-N 3.16Å; L119-K121 VanDerWaalsContact C-N 3.32Å; L119-K121 PolarHBondContact O-N 2.97Å; K121-H123 VanDerWaalsContact C-N 3.26Å; K121-H123 PolarHBondContact O-N 2.96Å; K121-S124 WeakPolarHBondContact CA-OG 3.37Å; K121-S124 PolarHBondContact O-N 3.37Å; K121-S124 PolarHBondContact O-OG 3.3Å; K121-E125 WeakPolarHBondContact O-CB 3.37Å; K121-E125 VanDerWaalsContact O-CG 3.29Å; K121-E125 WeakPolarHBondContact O-CG 3.34Å; K121-E125 PolarHBondContact O-N 2.88Å |
| 122 | Y | 98.1 | Very high | 98 | Very high | 149 Ų | 149 | 99.1 Ų | 99.1 | 58% | 0.584 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.7 | -37.3 | 176.3 | -72.4 | -61.7 | 0 | 0 | 0 | 112.2 | E118 L119 G126 | E118-Y122 HydrophobicContact CB-CE2 4.42Å; E118-Y122 WeakPolarHBondContact O-CD2 3.28Å; E118-Y122 PolarHBondContact O-N 2.92Å; L119-Y122 PolarHBondContact O-N 3.46Å; Y122-G126 PolarHBondContact O-N 3.15Å |
| 123 | H | 98.3 | Very high | 98 | Very high | 126 Ų | 126 | 99.9 Ų | 99.9 | 58% | 0.583 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -70.1 | -35.8 | 175.7 | -75.8 | 77.9 | 0 | 0 | 0 | 113 | L119 Q120 K121 R127 | L119-H123 PolarHBondContact O-N 3.2Å; L119-H123 PolarHBondContact O-ND1 3.35Å; Q120-H123 PolarHBondContact O-N 2.84Å; K121-H123 VanDerWaalsContact C-N 3.26Å; K121-H123 PolarHBondContact O-N 2.96Å; H123-R127 VanDerWaalsContact O-CG 3.31Å; H123-R127 WeakPolarHBondContact O-CG 3.25Å; H123-R127 PolarHBondContact O-N 2.96Å; H123-R127 PolarHBondContact O-NE 3.45Å |
| 124 | S | 97.4 | Very high | 98 | Very high | 38 Ų | 38 | 100.7 Ų | 100.7 | 27% | 0.266 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -70.1 | -48.9 | 173.4 | 54.3 | 0 | 0 | 0 | 0 | 111.2 | Q120 K121 G126 R127 D128 | Q120-S124 PolarHBondContact O-N 3.41Å; Q120-S124 PolarHBondContact O-OG 2.97Å; K121-S124 WeakPolarHBondContact CA-OG 3.37Å; K121-S124 PolarHBondContact O-N 3.37Å; K121-S124 PolarHBondContact O-OG 3.3Å; S124-G126 VanDerWaalsContact C-N 3.3Å; S124-G126 PolarHBondContact O-N 2.96Å; S124-R127 WeakPolarHBondContact O-CA 3.45Å; S124-R127 WeakPolarHBondContact O-CB 3.45Å; S124-R127 PolarHBondContact O-N 3.27Å; S124-D128 PolarHBondContact O-N 3.05Å |
| 125 | E | 97.9 | Very high | 98 | Very high | 75 Ų | 75 | 103.3 Ų | 103.3 | 35% | 0.35 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.9 | -38.5 | 178.6 | -66.4 | 174 | -167.6 | 0 | 0 | 112 | K121 R127 D128 R129 | K121-E125 WeakPolarHBondContact O-CB 3.37Å; K121-E125 VanDerWaalsContact O-CG 3.29Å; K121-E125 WeakPolarHBondContact O-CG 3.34Å; K121-E125 PolarHBondContact O-N 2.88Å; E125-R127 VanDerWaalsContact C-N 3.33Å; E125-D128 PolarHBondContact O-N 3Å; E125-R129 VanDerWaalsContact CB-NH1 3.27Å; E125-R129 WeakPolarHBondContact O-CB 3.46Å; E125-R129 VanDerWaalsContact O-CG 3.25Å; E125-R129 WeakPolarHBondContact O-CG 3.5Å; E125-R129 PolarHBondContact O-N 3.16Å; E125-R129 IonicContact OE2-CZ 3.95Å; E125-R129 IonicContact OE2-NH1 3.85Å; E125-R129 PolarHBondContact OE2-NH1 3.48Å; E125-R129 IonicContact OE2-NH2 3.77Å; E125-R129 PolarHBondContact OE2-NH2 3.03Å |
| 126 | G | 98 | Very high | 98 | Very high | 23 Ų | 23 | 104.1 Ų | 104.1 | 24% | 0.237 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -64.3 | -36.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y122 S124 R130 | Y122-G126 PolarHBondContact O-N 3.15Å; S124-G126 VanDerWaalsContact C-N 3.3Å; S124-G126 PolarHBondContact O-N 2.96Å; G126-R130 VanDerWaalsContact O-CG 3.25Å; G126-R130 WeakPolarHBondContact O-CG 3.44Å; G126-R130 PolarHBondContact O-N 3.37Å |
| 127 | R | 97.8 | Very high | 98 | Very high | 148 Ų | 148 | 102.7 Ų | 102.7 | 56% | 0.558 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -69.1 | -41.2 | 173 | -77.9 | -179.1 | -67 | 141.1 | -2.7 | 111.8 | H123 S124 E125 R130 K131 | H123-R127 VanDerWaalsContact O-CG 3.31Å; H123-R127 WeakPolarHBondContact O-CG 3.25Å; H123-R127 PolarHBondContact O-N 2.96Å; H123-R127 PolarHBondContact O-NE 3.45Å; S124-R127 WeakPolarHBondContact O-CA 3.45Å; S124-R127 WeakPolarHBondContact O-CB 3.45Å; S124-R127 PolarHBondContact O-N 3.27Å; E125-R127 VanDerWaalsContact C-N 3.33Å; R127-R130 PolarHBondContact O-N 3.11Å; R127-K131 WeakPolarHBondContact O-CG 3.22Å; R127-K131 PolarHBondContact O-N 2.97Å |
| 128 | D | 97.6 | Very high | 98 | Very high | 69 Ų | 69 | 104 Ų | 104 | 37% | 0.369 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -70.4 | -43.1 | -178.5 | -62.9 | -29.1 | 0 | 0 | 0 | 111.2 | S124 E125 R130 K131 D132 | S124-D128 PolarHBondContact O-N 3.05Å; E125-D128 PolarHBondContact O-N 3Å; D128-R130 VanDerWaalsContact C-N 3.29Å; D128-R130 PolarHBondContact O-N 3.47Å; D128-K131 WeakPolarHBondContact O-CA 3.49Å; D128-K131 WeakPolarHBondContact O-CB 3.47Å; D128-K131 PolarHBondContact O-N 3.25Å; D128-K131 IonicContact OD1-NZ 3.55Å; D128-K131 PolarHBondContact OD1-NZ 3.14Å; D128-D132 PolarHBondContact O-N 3.04Å |
| 129 | R | 97.6 | Very high | 98 | Very high | 132 Ų | 132 | 105.4 Ų | 105.4 | 50% | 0.498 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -55.2 | -42.6 | 170.9 | -70.5 | 176.4 | -166.4 | 108.7 | 4.2 | 112.4 | E125 K131 D132 D133 | E125-R129 VanDerWaalsContact CB-NH1 3.27Å; E125-R129 WeakPolarHBondContact O-CB 3.46Å; E125-R129 VanDerWaalsContact O-CG 3.25Å; E125-R129 WeakPolarHBondContact O-CG 3.5Å; E125-R129 PolarHBondContact O-N 3.16Å; E125-R129 IonicContact OE2-CZ 3.95Å; E125-R129 IonicContact OE2-NH1 3.85Å; E125-R129 PolarHBondContact OE2-NH1 3.48Å; E125-R129 IonicContact OE2-NH2 3.77Å; E125-R129 PolarHBondContact OE2-NH2 3.03Å; R129-K131 VanDerWaalsContact C-N 3.33Å; R129-K131 PolarHBondContact O-N 3.42Å; R129-D132 PolarHBondContact O-N 3.39Å; R129-D133 WeakPolarHBondContact O-CB 3.37Å; R129-D133 PolarHBondContact O-N 3.41Å |
| 130 | R | 97.7 | Very high | 98 | Very high | 194 Ų | 194 | 105.3 Ų | 105.3 | 73% | 0.732 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.4 | -34.1 | 176.2 | -73.8 | 175.1 | -170.8 | -167.7 | 4.3 | 113 | G126 R127 D128 S134 | G126-R130 VanDerWaalsContact O-CG 3.25Å; G126-R130 WeakPolarHBondContact O-CG 3.44Å; G126-R130 PolarHBondContact O-N 3.37Å; R127-R130 PolarHBondContact O-N 3.11Å; D128-R130 VanDerWaalsContact C-N 3.29Å; D128-R130 PolarHBondContact O-N 3.47Å; R130-S134 VanDerWaalsContact O-CB 3.29Å; R130-S134 WeakPolarHBondContact O-CB 3.29Å; R130-S134 PolarHBondContact O-N 2.86Å |
| 131 | K | 98.1 | Very high | 98 | Very high | 106 Ų | 106 | 101.2 Ų | 101.2 | 46% | 0.461 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68 | -48.1 | 174.1 | -68.6 | 170.2 | -167.5 | 158.2 | 0 | 110 | R127 D128 R129 D133 S134 E135 | R127-K131 WeakPolarHBondContact O-CG 3.22Å; R127-K131 PolarHBondContact O-N 2.97Å; D128-K131 WeakPolarHBondContact O-CA 3.49Å; D128-K131 WeakPolarHBondContact O-CB 3.47Å; D128-K131 PolarHBondContact O-N 3.25Å; D128-K131 IonicContact OD1-NZ 3.55Å; D128-K131 PolarHBondContact OD1-NZ 3.14Å; R129-K131 VanDerWaalsContact C-N 3.33Å; R129-K131 PolarHBondContact O-N 3.42Å; K131-D133 VanDerWaalsContact C-N 3.33Å; K131-D133 PolarHBondContact O-N 2.72Å; K131-S134 CarbonylContact O-C 3.57Å; K131-S134 WeakPolarHBondContact O-CA 3.38Å; K131-S134 WeakPolarHBondContact O-CB 3.45Å; K131-S134 PolarHBondContact O-N 3.4Å; K131-S134 VanDerWaalsContact O-N 3.09Å; K131-E135 WeakPolarHBondContact O-CB 3.42Å; K131-E135 WeakPolarHBondContact O-CG 3.3Å; K131-E135 PolarHBondContact O-N 2.97Å |
| 132 | D | 98.1 | Very high | 98 | Very high | 82 Ų | 82 | 98.6 Ų | 98.6 | 44% | 0.439 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.2 | -46 | 177.9 | -61.9 | -17.5 | 0 | 0 | 0 | 110.9 | D128 R129 S134 E135 Q136 | D128-D132 PolarHBondContact O-N 3.04Å; R129-D132 PolarHBondContact O-N 3.39Å; D132-S134 PolarHBondContact O-N 3.13Å; D132-E135 PolarHBondContact O-N 3.42Å; D132-Q136 VanDerWaalsContact O-CG 3.3Å; D132-Q136 WeakPolarHBondContact O-CG 3.48Å; D132-Q136 PolarHBondContact O-N 2.97Å |
| 133 | D | 98.3 | Very high | 98 | Very high | 93 Ų | 93 | 96.2 Ų | 96.2 | 50% | 0.497 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 175.2 | -69.9 | -18.7 | 0 | 0 | 0 | 111 | R129 K131 Q136 M137 | R129-D133 WeakPolarHBondContact O-CB 3.37Å; R129-D133 PolarHBondContact O-N 3.41Å; K131-D133 VanDerWaalsContact C-N 3.33Å; K131-D133 PolarHBondContact O-N 2.72Å; D133-Q136 PolarHBondContact O-N 3.26Å; D133-M137 WeakPolarHBondContact O-CB 3.48Å; D133-M137 VanDerWaalsContact O-CG 3.23Å; D133-M137 WeakPolarHBondContact O-CG 3.32Å; D133-M137 PolarHBondContact O-N 3.5Å |
| 134 | S | 98 | Very high | 98 | Very high | 71 Ų | 71 | 94.7 Ų | 94.7 | 50% | 0.497 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.8 | -43.3 | 176.5 | -174.5 | 0 | 0 | 0 | 0 | 111.7 | R130 K131 D132 M137 T138 | R130-S134 VanDerWaalsContact O-CB 3.29Å; R130-S134 WeakPolarHBondContact O-CB 3.29Å; R130-S134 PolarHBondContact O-N 2.86Å; K131-S134 CarbonylContact O-C 3.57Å; K131-S134 WeakPolarHBondContact O-CA 3.38Å; K131-S134 WeakPolarHBondContact O-CB 3.45Å; K131-S134 PolarHBondContact O-N 3.4Å; K131-S134 VanDerWaalsContact O-N 3.09Å; D132-S134 PolarHBondContact O-N 3.13Å; S134-M137 PolarHBondContact O-N 3.36Å; S134-T138 VanDerWaalsContact O-CG2 3.29Å; S134-T138 WeakPolarHBondContact O-CG2 3.37Å; S134-T138 PolarHBondContact O-N 2.85Å; S134-T138 PolarHBondContact O-OG1 2.93Å |
| 135 | E | 98.4 | Very high | 98.1 | Very high | 106 Ų | 106 | 98 Ų | 98 | 50% | 0.495 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.2 | -46.8 | 177.6 | -74.1 | 176 | -164.9 | 0 | 0 | 110.7 | K131 D132 M137 T138 Q139 | K131-E135 WeakPolarHBondContact O-CB 3.42Å; K131-E135 WeakPolarHBondContact O-CG 3.3Å; K131-E135 PolarHBondContact O-N 2.97Å; D132-E135 PolarHBondContact O-N 3.42Å; E135-M137 VanDerWaalsContact C-N 3.35Å; E135-M137 PolarHBondContact O-N 3.02Å; E135-T138 PolarHBondContact O-N 3.2Å; E135-T138 PolarHBondContact O-OG1 3.49Å; E135-Q139 VanDerWaalsContact O-CG 3.32Å; E135-Q139 WeakPolarHBondContact O-CG 3.34Å; E135-Q139 PolarHBondContact O-N 2.83Å |
| 136 | Q | 98.1 | Very high | 98.1 | Very high | 110 Ų | 110 | 101.9 Ų | 101.9 | 51% | 0.514 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.9 | -45 | 174.1 | -70.9 | 175.1 | 19.6 | 0 | 0 | 111.7 | D132 D133 T138 Q139 L140 | D132-Q136 VanDerWaalsContact O-CG 3.3Å; D132-Q136 WeakPolarHBondContact O-CG 3.48Å; D132-Q136 PolarHBondContact O-N 2.97Å; D133-Q136 PolarHBondContact O-N 3.26Å; Q136-T138 VanDerWaalsContact C-N 3.34Å; Q136-T138 PolarHBondContact O-N 2.99Å; Q136-Q139 PolarHBondContact O-N 3.42Å; Q136-L140 WeakPolarHBondContact O-CG 3.39Å; Q136-L140 PolarHBondContact O-N 2.65Å |
| 137 | M | 97.9 | Very high | 98.1 | Very high | 127 Ų | 127 | 104 Ų | 104 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.2 | -40.2 | 176.3 | -72.1 | -56.7 | -61.1 | 0 | 0 | 112 | D133 S134 E135 L140 A141 | D133-M137 WeakPolarHBondContact O-CB 3.48Å; D133-M137 VanDerWaalsContact O-CG 3.23Å; D133-M137 WeakPolarHBondContact O-CG 3.32Å; D133-M137 PolarHBondContact O-N 3.5Å; S134-M137 PolarHBondContact O-N 3.36Å; E135-M137 VanDerWaalsContact C-N 3.35Å; E135-M137 PolarHBondContact O-N 3.02Å; M137-L140 PolarHBondContact O-N 3.2Å; M137-A141 VanDerWaalsContact O-CB 3.3Å; M137-A141 WeakPolarHBondContact O-CB 3.34Å; M137-A141 PolarHBondContact O-N 2.96Å |
| 138 | T | 98 | Very high | 98.2 | Very high | 69 Ų | 69 | 101.3 Ų | 101.3 | 42% | 0.423 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67 | -37.2 | 174.5 | 64.1 | 0 | 0 | 0 | 0 | 112.7 | S134 E135 Q136 A141 N142 | S134-T138 VanDerWaalsContact O-CG2 3.29Å; S134-T138 WeakPolarHBondContact O-CG2 3.37Å; S134-T138 PolarHBondContact O-N 2.85Å; S134-T138 PolarHBondContact O-OG1 2.93Å; E135-T138 PolarHBondContact O-N 3.2Å; E135-T138 PolarHBondContact O-OG1 3.49Å; Q136-T138 VanDerWaalsContact C-N 3.34Å; Q136-T138 PolarHBondContact O-N 2.99Å; T138-A141 PolarHBondContact O-N 3.35Å; T138-N142 WeakPolarHBondContact O-CB 3.38Å; T138-N142 PolarHBondContact O-N 3.14Å; T138-N142 PolarHBondContact O-ND2 2.98Å; T138-N142 VanDerWaalsContact O-ND2 3.15Å |
| 139 | Q | 98.5 | Very high | 98.2 | Very high | 123 Ų | 123 | 102 Ų | 102 | 58% | 0.575 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.1 | -44.1 | 176 | -71.5 | 172.7 | 16.1 | 0 | 0 | 111.4 | E135 Q136 N142 H143 | E135-Q139 VanDerWaalsContact O-CG 3.32Å; E135-Q139 WeakPolarHBondContact O-CG 3.34Å; E135-Q139 PolarHBondContact O-N 2.83Å; Q136-Q139 PolarHBondContact O-N 3.42Å; Q139-N142 PolarHBondContact O-N 3.41Å; Q139-H143 WeakPolarHBondContact O-CB 3.35Å; Q139-H143 PolarHBondContact O-N 2.99Å |
| 140 | L | 98.3 | Very high | 98.2 | Very high | 98 Ų | 98 | 101.5 Ų | 101.5 | 51% | 0.513 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 175.1 | -70 | 176 | 0 | 0 | 0 | 111.6 | Q136 M137 H143 N144 | Q136-L140 WeakPolarHBondContact O-CG 3.39Å; Q136-L140 PolarHBondContact O-N 2.65Å; M137-L140 PolarHBondContact O-N 3.2Å; L140-H143 PolarHBondContact O-N 2.94Å; L140-N144 WeakPolarHBondContact O-CB 3.1Å; L140-N144 VanDerWaalsContact O-CG 3.26Å; L140-N144 PolarHBondContact O-N 3.35Å; L140-N144 PolarHBondContact O-ND2 2.84Å |
| 141 | A | 97.9 | Very high | 98.3 | Very high | 55 Ų | 55 | 97.8 Ų | 97.8 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -45 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | M137 T138 H143 N144 Q145 | M137-A141 VanDerWaalsContact O-CB 3.3Å; M137-A141 WeakPolarHBondContact O-CB 3.34Å; M137-A141 PolarHBondContact O-N 2.96Å; T138-A141 PolarHBondContact O-N 3.35Å; A141-H143 PolarHBondContact O-N 3.18Å; A141-N144 PolarHBondContact O-N 3.49Å; A141-Q145 WeakPolarHBondContact O-CB 3.44Å; A141-Q145 PolarHBondContact O-N 3.43Å |
| 142 | N | 98.4 | Very high | 98.2 | Very high | 77 Ų | 77 | 95.7 Ų | 95.7 | 41% | 0.412 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -39.9 | 176.2 | -71 | -25.6 | 0 | 0 | 0 | 112 | T138 Q139 Q145 R146 | T138-N142 WeakPolarHBondContact O-CB 3.38Å; T138-N142 PolarHBondContact O-N 3.14Å; T138-N142 PolarHBondContact O-ND2 2.98Å; T138-N142 VanDerWaalsContact O-ND2 3.15Å; Q139-N142 PolarHBondContact O-N 3.41Å; N142-Q145 PolarHBondContact O-N 3.03Å; N142-R146 WeakPolarHBondContact O-CG 3.29Å; N142-R146 PolarHBondContact O-N 3.42Å |
| 143 | H | 98.3 | Very high | 98.3 | Very high | 98 Ų | 98 | 97.4 Ų | 97.4 | 45% | 0.454 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -46.5 | 175.8 | -177.8 | 55.6 | 0 | 0 | 0 | 111.5 | Q139 L140 A141 Q145 R146 L147 | Q139-H143 WeakPolarHBondContact O-CB 3.35Å; Q139-H143 PolarHBondContact O-N 2.99Å; L140-H143 PolarHBondContact O-N 2.94Å; A141-H143 PolarHBondContact O-N 3.18Å; H143-Q145 VanDerWaalsContact C-N 3.31Å; H143-Q145 PolarHBondContact O-N 2.68Å; H143-R146 PolarHBondContact O-N 3.29Å; H143-L147 WeakPolarHBondContact O-CG 3.48Å; H143-L147 PolarHBondContact O-N 3.41Å |
| 144 | N | 98.3 | Very high | 98.3 | Very high | 94 Ų | 94 | 95.6 Ų | 95.6 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.9 | -41 | 175.8 | -72.8 | -16.9 | 0 | 0 | 0 | 111.6 | L140 A141 L147 V148 | L140-N144 WeakPolarHBondContact O-CB 3.1Å; L140-N144 VanDerWaalsContact O-CG 3.26Å; L140-N144 PolarHBondContact O-N 3.35Å; L140-N144 PolarHBondContact O-ND2 2.84Å; A141-N144 PolarHBondContact O-N 3.49Å; N144-L147 PolarHBondContact O-N 3.46Å; N144-V148 VanDerWaalsContact O-CG2 3.3Å; N144-V148 WeakPolarHBondContact O-CG2 3.23Å; N144-V148 PolarHBondContact O-N 3.02Å |
| 145 | Q | 98.3 | Very high | 98.3 | Very high | 108 Ų | 108 | 96.5 Ų | 96.5 | 51% | 0.505 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.9 | -46.5 | 175.3 | -179 | 175.5 | -11.5 | 0 | 0 | 111.6 | A141 N142 H143 L147 V148 E149 | A141-Q145 WeakPolarHBondContact O-CB 3.44Å; A141-Q145 PolarHBondContact O-N 3.43Å; N142-Q145 PolarHBondContact O-N 3.03Å; H143-Q145 VanDerWaalsContact C-N 3.31Å; H143-Q145 PolarHBondContact O-N 2.68Å; Q145-L147 VanDerWaalsContact C-N 3.32Å; Q145-L147 PolarHBondContact O-N 3Å; Q145-V148 WeakPolarHBondContact O-CB 3.44Å; Q145-V148 PolarHBondContact O-N 3.3Å; Q145-V148 VanDerWaalsContact O-N 3.15Å; Q145-E149 WeakPolarHBondContact CG-OE1 3.41Å; Q145-E149 PolarHBondContact NE2-OE1 2.97Å; Q145-E149 WeakPolarHBondContact O-CG 3.42Å; Q145-E149 PolarHBondContact O-N 3.38Å |
| 146 | R | 98.5 | Very high | 98.3 | Very high | 156 Ų | 156 | 95.8 Ų | 95.8 | 59% | 0.589 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.3 | -39.8 | 176.2 | -71.2 | 173.6 | -169 | 158.2 | 3.8 | 112.5 | N142 H143 V148 E149 Q150 | N142-R146 WeakPolarHBondContact O-CG 3.29Å; N142-R146 PolarHBondContact O-N 3.42Å; H143-R146 PolarHBondContact O-N 3.29Å; R146-V148 VanDerWaalsContact C-N 3.34Å; R146-E149 PolarHBondContact O-N 3.44Å; R146-Q150 WeakPolarHBondContact O-CB 3.32Å; R146-Q150 VanDerWaalsContact O-CG 3.31Å; R146-Q150 WeakPolarHBondContact O-CG 3.49Å; R146-Q150 PolarHBondContact O-N 3.4Å |
| 147 | L | 98.4 | Very high | 98.3 | Very high | 67 Ų | 67 | 95.7 Ų | 95.7 | 35% | 0.351 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -41.1 | 175 | -71.8 | 175.9 | 0 | 0 | 0 | 111.3 | H143 N144 Q145 Q150 L151 | H143-L147 WeakPolarHBondContact O-CG 3.48Å; H143-L147 PolarHBondContact O-N 3.41Å; N144-L147 PolarHBondContact O-N 3.46Å; Q145-L147 VanDerWaalsContact C-N 3.32Å; Q145-L147 PolarHBondContact O-N 3Å; L147-Q150 PolarHBondContact O-N 3.2Å; L147-L151 WeakPolarHBondContact O-CB 3.4Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.43Å; L147-L151 PolarHBondContact O-N 2.91Å |
| 148 | V | 98.6 | Very high | 98.3 | Very high | 93 Ų | 93 | 93.9 Ų | 93.9 | 56% | 0.564 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.6 | -42.7 | 175.1 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | N144 Q145 R146 L151 S152 | N144-V148 VanDerWaalsContact O-CG2 3.3Å; N144-V148 WeakPolarHBondContact O-CG2 3.23Å; N144-V148 PolarHBondContact O-N 3.02Å; Q145-V148 WeakPolarHBondContact O-CB 3.44Å; Q145-V148 PolarHBondContact O-N 3.3Å; Q145-V148 VanDerWaalsContact O-N 3.15Å; R146-V148 VanDerWaalsContact C-N 3.34Å; V148-L151 PolarHBondContact O-N 2.86Å; V148-S152 WeakPolarHBondContact O-CB 3.21Å; V148-S152 PolarHBondContact O-N 2.92Å |
| 149 | E | 98.3 | Very high | 98.3 | Very high | 84 Ų | 84 | 96 Ų | 96 | 39% | 0.393 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.6 | -50 | 175.1 | -72.8 | 165.6 | -175.3 | 0 | 0 | 110.6 | Q145 R146 L151 S152 E153 | Q145-E149 WeakPolarHBondContact CG-OE1 3.41Å; Q145-E149 PolarHBondContact NE2-OE1 2.97Å; Q145-E149 WeakPolarHBondContact O-CG 3.42Å; Q145-E149 PolarHBondContact O-N 3.38Å; R146-E149 PolarHBondContact O-N 3.44Å; E149-L151 VanDerWaalsContact C-N 3.35Å; E149-L151 PolarHBondContact O-N 2.72Å; E149-S152 PolarHBondContact O-N 3.38Å; E149-S152 VanDerWaalsContact O-N 3.09Å; E149-S152 PolarHBondContact O-OG 3.47Å; E149-E153 WeakPolarHBondContact O-CG 3.34Å; E149-E153 PolarHBondContact O-N 3.26Å |
| 150 | Q | 98.4 | Very high | 98.3 | Very high | 120 Ų | 120 | 92 Ų | 92 | 56% | 0.561 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.8 | -40.8 | 176.2 | -73.7 | 177.6 | -16 | 0 | 0 | 113.2 | R146 L147 S152 E153 A154 | R146-Q150 WeakPolarHBondContact O-CB 3.32Å; R146-Q150 VanDerWaalsContact O-CG 3.31Å; R146-Q150 WeakPolarHBondContact O-CG 3.49Å; R146-Q150 PolarHBondContact O-N 3.4Å; L147-Q150 PolarHBondContact O-N 3.2Å; Q150-S152 VanDerWaalsContact C-N 3.34Å; Q150-E153 PolarHBondContact O-N 2.98Å; Q150-A154 WeakPolarHBondContact O-CB 3.5Å; Q150-A154 PolarHBondContact O-N 3.36Å |
| 151 | L | 98.3 | Very high | 98.3 | Very high | 116 Ų | 116 | 92.1 Ų | 92.1 | 61% | 0.607 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -65.3 | -40 | 175 | -73.8 | 172.8 | 0 | 0 | 0 | 111.1 | L147 V148 E149 A154 V155 | L147-L151 WeakPolarHBondContact O-CB 3.4Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.43Å; L147-L151 PolarHBondContact O-N 2.91Å; V148-L151 PolarHBondContact O-N 2.86Å; E149-L151 VanDerWaalsContact C-N 3.35Å; E149-L151 PolarHBondContact O-N 2.72Å; L151-A154 PolarHBondContact O-N 2.91Å; L151-V155 WeakPolarHBondContact O-CB 3.42Å; L151-V155 VanDerWaalsContact O-CG2 3.23Å; L151-V155 WeakPolarHBondContact O-CG2 3.25Å; L151-V155 PolarHBondContact O-N 3.28Å |
| 152 | S | 97.7 | Very high | 98.4 | Very high | 63 Ų | 63 | 95.4 Ų | 95.4 | 44% | 0.441 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.8 | -40.6 | 176.9 | 77 | 0 | 0 | 0 | 0 | 112.1 | V148 E149 Q150 V155 T156 | V148-S152 WeakPolarHBondContact O-CB 3.21Å; V148-S152 PolarHBondContact O-N 2.92Å; E149-S152 PolarHBondContact O-N 3.38Å; E149-S152 VanDerWaalsContact O-N 3.09Å; E149-S152 PolarHBondContact O-OG 3.47Å; Q150-S152 VanDerWaalsContact C-N 3.34Å; S152-V155 PolarHBondContact O-N 2.94Å; S152-T156 WeakPolarHBondContact O-CG2 3.34Å; S152-T156 PolarHBondContact O-N 3.15Å; S152-T156 PolarHBondContact O-OG1 3.31Å |
| 153 | E | 98.4 | Very high | 98.3 | Very high | 118 Ų | 118 | 94.2 Ų | 94.2 | 55% | 0.551 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.7 | -43.5 | 173.7 | -71.2 | 175.7 | -179.7 | 0 | 0 | 111.5 | E149 Q150 V155 T156 L157 | E149-E153 WeakPolarHBondContact O-CG 3.34Å; E149-E153 PolarHBondContact O-N 3.26Å; Q150-E153 PolarHBondContact O-N 2.98Å; E153-V155 VanDerWaalsContact C-N 3.33Å; E153-V155 PolarHBondContact O-N 2.91Å; E153-T156 WeakPolarHBondContact CA-OG1 3.32Å; E153-T156 PolarHBondContact O-N 3.39Å; E153-T156 PolarHBondContact O-OG1 3.39Å; E153-L157 WeakPolarHBondContact O-CB 3.38Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.5Å; E153-L157 PolarHBondContact O-N 2.93Å |
| 154 | A | 98.3 | Very high | 98.4 | Very high | 55 Ų | 55 | 94.4 Ų | 94.4 | 46% | 0.455 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | Q150 L151 E158 | Q150-A154 WeakPolarHBondContact O-CB 3.5Å; Q150-A154 PolarHBondContact O-N 3.36Å; L151-A154 PolarHBondContact O-N 2.91Å; A154-E158 WeakPolarHBondContact O-CB 3.44Å; A154-E158 PolarHBondContact O-N 3.39Å |
| 155 | V | 98.4 | Very high | 98.4 | Very high | 90 Ų | 90 | 94.3 Ų | 94.3 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.9 | -39.1 | 177.5 | 169.4 | 0 | 0 | 0 | 0 | 111.8 | L151 S152 E153 E158 H159 | L151-V155 WeakPolarHBondContact O-CB 3.42Å; L151-V155 VanDerWaalsContact O-CG2 3.23Å; L151-V155 WeakPolarHBondContact O-CG2 3.25Å; L151-V155 PolarHBondContact O-N 3.28Å; S152-V155 PolarHBondContact O-N 2.94Å; E153-V155 VanDerWaalsContact C-N 3.33Å; E153-V155 PolarHBondContact O-N 2.91Å; V155-E158 PolarHBondContact O-N 3.36Å; V155-H159 WeakPolarHBondContact O-CB 3.16Å; V155-H159 PolarHBondContact O-N 3.18Å |
| 156 | T | 98.3 | Very high | 98.4 | Very high | 90 Ų | 90 | 94.4 Ų | 94.4 | 55% | 0.552 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -68.5 | -40.1 | 176.3 | 56.1 | 0 | 0 | 0 | 0 | 111.8 | S152 E153 H159 S160 | S152-T156 WeakPolarHBondContact O-CG2 3.34Å; S152-T156 PolarHBondContact O-N 3.15Å; S152-T156 PolarHBondContact O-OG1 3.31Å; E153-T156 WeakPolarHBondContact CA-OG1 3.32Å; E153-T156 PolarHBondContact O-N 3.39Å; E153-T156 PolarHBondContact O-OG1 3.39Å; T156-H159 WeakPolarHBondContact O-CB 3.35Å; T156-H159 PolarHBondContact O-N 2.86Å; T156-S160 PolarHBondContact O-N 2.97Å |
| 157 | L | 98.4 | Very high | 98.4 | Very high | 109 Ų | 109 | 90 Ų | 90 | 57% | 0.571 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63.6 | -40.4 | 172.3 | -70.3 | 174.3 | 0 | 0 | 0 | 112 | E153 H159 S160 L161 | E153-L157 WeakPolarHBondContact O-CB 3.38Å; E153-L157 VanDerWaalsContact O-CG 3.27Å; E153-L157 WeakPolarHBondContact O-CG 3.5Å; E153-L157 PolarHBondContact O-N 2.93Å; L157-H159 VanDerWaalsContact C-N 3.32Å; L157-H159 PolarHBondContact O-N 2.91Å; L157-S160 PolarHBondContact O-N 3.41Å; L157-S160 PolarHBondContact O-OG 2.85Å; L157-L161 WeakPolarHBondContact O-CB 3.39Å; L157-L161 VanDerWaalsContact O-CG 3.28Å; L157-L161 WeakPolarHBondContact O-CG 3.29Å; L157-L161 PolarHBondContact O-N 2.87Å |
| 158 | E | 98.1 | Very high | 98.3 | Very high | 88 Ų | 88 | 91.2 Ų | 91.2 | 41% | 0.411 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.5 | -41.1 | 173.9 | -169.4 | -170.9 | -169.4 | 0 | 0 | 111 | A154 V155 L161 R162 | A154-E158 WeakPolarHBondContact O-CB 3.44Å; A154-E158 PolarHBondContact O-N 3.39Å; V155-E158 PolarHBondContact O-N 3.36Å; E158-L161 PolarHBondContact O-N 2.88Å; E158-R162 VanDerWaalsContact CD-CZ 3.46Å; E158-R162 VanDerWaalsContact CD-NH2 3.29Å; E158-R162 HydrophobicContact CG-CG 4.4Å; E158-R162 VanDerWaalsContact O-CB 3.29Å; E158-R162 WeakPolarHBondContact O-CB 3.33Å; E158-R162 WeakPolarHBondContact O-CG 3.45Å; E158-R162 PolarHBondContact O-N 2.99Å; E158-R162 IonicContact OE1-CZ 2.72Å; E158-R162 IonicContact OE1-NE 2.72Å; E158-R162 PolarHBondContact OE1-NE 3.2Å; E158-R162 VanDerWaalsContact OE1-NE 3.08Å; E158-R162 IonicContact OE1-NH2 2.86Å; E158-R162 PolarHBondContact OE1-NH2 2.97Å; E158-R162 IonicContact OE2-CZ 3.38Å; E158-R162 IonicContact OE2-NH2 2.83Å |
| 159 | H | 98.4 | Very high | 98.3 | Very high | 115 Ų | 115 | 94.3 Ų | 94.3 | 53% | 0.532 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 176 | -172.9 | 83.1 | 0 | 0 | 0 | 111.8 | V155 T156 L157 R162 T163 | V155-H159 WeakPolarHBondContact O-CB 3.16Å; V155-H159 PolarHBondContact O-N 3.18Å; T156-H159 WeakPolarHBondContact O-CB 3.35Å; T156-H159 PolarHBondContact O-N 2.86Å; L157-H159 VanDerWaalsContact C-N 3.32Å; L157-H159 PolarHBondContact O-N 2.91Å; H159-R162 PolarHBondContact O-N 3.39Å; H159-T163 WeakPolarHBondContact O-CG2 3.25Å; H159-T163 PolarHBondContact O-N 3.4Å; H159-T163 PolarHBondContact O-OG1 3.14Å |
| 160 | S | 98.5 | Very high | 98.3 | Very high | 39 Ų | 39 | 95.3 Ų | 95.3 | 27% | 0.273 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 178.3 | 69.1 | 0 | 0 | 0 | 0 | 111.8 | T156 L157 R162 T163 E164 | T156-S160 PolarHBondContact O-N 2.97Å; L157-S160 PolarHBondContact O-N 3.41Å; L157-S160 PolarHBondContact O-OG 2.85Å; S160-R162 VanDerWaalsContact C-N 3.32Å; S160-R162 PolarHBondContact O-N 3.17Å; S160-T163 WeakPolarHBondContact CA-OG1 3.46Å; S160-T163 PolarHBondContact O-N 2.94Å; S160-T163 VanDerWaalsContact O-N 3.11Å; S160-T163 PolarHBondContact O-OG1 3.46Å; S160-E164 WeakPolarHBondContact O-CG 3.45Å; S160-E164 PolarHBondContact O-N 3.1Å |
| 161 | L | 98.4 | Very high | 98.3 | Very high | 99 Ų | 99 | 94.9 Ų | 94.9 | 52% | 0.518 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.2 | -38.9 | 175.1 | -69.1 | 174.7 | 0 | 0 | 0 | 111.7 | L157 E158 T163 E164 L165 | L157-L161 WeakPolarHBondContact O-CB 3.39Å; L157-L161 VanDerWaalsContact O-CG 3.28Å; L157-L161 WeakPolarHBondContact O-CG 3.29Å; L157-L161 PolarHBondContact O-N 2.87Å; E158-L161 PolarHBondContact O-N 2.88Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.27Å; L161-E164 PolarHBondContact O-N 3.49Å; L161-L165 WeakPolarHBondContact O-CB 3.49Å; L161-L165 VanDerWaalsContact O-CG 3.29Å; L161-L165 WeakPolarHBondContact O-CG 3.38Å; L161-L165 PolarHBondContact O-N 3.42Å |
| 162 | R | 98.5 | Very high | 98.3 | Very high | 125 Ų | 125 | 95.9 Ų | 95.9 | 47% | 0.472 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.6 | -35.5 | 173.8 | -75.7 | 171 | 178 | -171 | -0.4 | 111.9 | E158 H159 S160 R166 | E158-R162 VanDerWaalsContact CD-CZ 3.46Å; E158-R162 VanDerWaalsContact CD-NH2 3.29Å; E158-R162 HydrophobicContact CG-CG 4.4Å; E158-R162 VanDerWaalsContact O-CB 3.29Å; E158-R162 WeakPolarHBondContact O-CB 3.33Å; E158-R162 WeakPolarHBondContact O-CG 3.45Å; E158-R162 PolarHBondContact O-N 2.99Å; E158-R162 IonicContact OE1-CZ 2.72Å; E158-R162 IonicContact OE1-NE 2.72Å; E158-R162 PolarHBondContact OE1-NE 3.2Å; E158-R162 VanDerWaalsContact OE1-NE 3.08Å; E158-R162 IonicContact OE1-NH2 2.86Å; E158-R162 PolarHBondContact OE1-NH2 2.97Å; E158-R162 IonicContact OE2-CZ 3.38Å; E158-R162 IonicContact OE2-NH2 2.83Å; H159-R162 PolarHBondContact O-N 3.39Å; S160-R162 VanDerWaalsContact C-N 3.32Å; S160-R162 PolarHBondContact O-N 3.17Å; R162-R166 WeakPolarHBondContact O-CG 3.46Å; R162-R166 PolarHBondContact O-N 3.42Å |
| 163 | T | 98.4 | Very high | 98.3 | Very high | 52 Ų | 52 | 98.9 Ų | 98.9 | 32% | 0.319 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.2 | -44.8 | 173.9 | 49 | 0 | 0 | 0 | 0 | 111.7 | H159 S160 L161 L165 R166 T167 | H159-T163 WeakPolarHBondContact O-CG2 3.25Å; H159-T163 PolarHBondContact O-N 3.4Å; H159-T163 PolarHBondContact O-OG1 3.14Å; S160-T163 WeakPolarHBondContact CA-OG1 3.46Å; S160-T163 PolarHBondContact O-N 2.94Å; S160-T163 VanDerWaalsContact O-N 3.11Å; S160-T163 PolarHBondContact O-OG1 3.46Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.27Å; T163-L165 VanDerWaalsContact C-N 3.32Å; T163-L165 PolarHBondContact O-N 3.18Å; T163-R166 VanDerWaalsContact CG2-NH1 3.35Å; T163-R166 WeakPolarHBondContact O-CB 3.24Å; T163-R166 PolarHBondContact O-N 3.37Å; T163-T167 PolarHBondContact O-N 3.04Å |
| 164 | E | 98.5 | Very high | 98.2 | Very high | 102 Ų | 102 | 99.8 Ų | 99.8 | 48% | 0.477 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.2 | -39.5 | 176.3 | -70.9 | 171.5 | -167.5 | 0 | 0 | 111.9 | S160 L161 R166 T167 L168 | S160-E164 WeakPolarHBondContact O-CG 3.45Å; S160-E164 PolarHBondContact O-N 3.1Å; L161-E164 PolarHBondContact O-N 3.49Å; E164-R166 VanDerWaalsContact C-N 3.3Å; E164-R166 PolarHBondContact O-N 2.93Å; E164-T167 WeakPolarHBondContact CA-OG1 3.34Å; E164-T167 PolarHBondContact O-N 3.38Å; E164-T167 PolarHBondContact O-OG1 3.42Å; E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 VanDerWaalsContact O-CG 3.29Å; E164-L168 WeakPolarHBondContact O-CG 3.42Å; E164-L168 PolarHBondContact O-N 2.97Å |
| 165 | L | 98.4 | Very high | 98.2 | Very high | 91 Ų | 91 | 100.1 Ų | 100.1 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.8 | -31.5 | 173.9 | -74.1 | 175.1 | 0 | 0 | 0 | 112.9 | L161 T163 R169 | L161-L165 WeakPolarHBondContact O-CB 3.49Å; L161-L165 VanDerWaalsContact O-CG 3.29Å; L161-L165 WeakPolarHBondContact O-CG 3.38Å; L161-L165 PolarHBondContact O-N 3.42Å; T163-L165 VanDerWaalsContact C-N 3.32Å; T163-L165 PolarHBondContact O-N 3.18Å; L165-R169 WeakPolarHBondContact O-CB 3.48Å; L165-R169 WeakPolarHBondContact O-CD 3.48Å; L165-R169 WeakPolarHBondContact O-CG 3.4Å; L165-R169 PolarHBondContact O-N 2.89Å |
| 166 | R | 98.4 | Very high | 98.2 | Very high | 111 Ų | 111 | 98.5 Ų | 98.5 | 42% | 0.419 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -70.7 | -46.8 | 173.8 | -72.7 | -177.1 | -147.5 | 102.3 | 0.2 | 110.6 | R162 T163 E164 L168 R169 E170 | R162-R166 WeakPolarHBondContact O-CG 3.46Å; R162-R166 PolarHBondContact O-N 3.42Å; T163-R166 VanDerWaalsContact CG2-NH1 3.35Å; T163-R166 WeakPolarHBondContact O-CB 3.24Å; T163-R166 PolarHBondContact O-N 3.37Å; E164-R166 VanDerWaalsContact C-N 3.3Å; E164-R166 PolarHBondContact O-N 2.93Å; R166-L168 PolarHBondContact O-N 2.9Å; R166-R169 WeakPolarHBondContact O-CB 3.35Å; R166-R169 PolarHBondContact O-N 3.3Å; R166-R169 VanDerWaalsContact O-N 3.14Å; R166-E170 WeakPolarHBondContact O-CG 3.17Å; R166-E170 PolarHBondContact O-N 3.48Å |
| 167 | T | 98.1 | Very high | 98.1 | Very high | 64 Ų | 64 | 100.6 Ų | 100.6 | 39% | 0.393 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.4 | -43 | 178.9 | 59.2 | 0 | 0 | 0 | 0 | 111.5 | T163 E164 R169 E170 E171 | T163-T167 PolarHBondContact O-N 3.04Å; E164-T167 WeakPolarHBondContact CA-OG1 3.34Å; E164-T167 PolarHBondContact O-N 3.38Å; E164-T167 PolarHBondContact O-OG1 3.42Å; T167-R169 VanDerWaalsContact C-N 3.3Å; T167-R169 PolarHBondContact O-N 3.42Å; T167-E170 PolarHBondContact O-N 2.88Å; T167-E171 WeakPolarHBondContact O-CG 3.36Å; T167-E171 PolarHBondContact O-N 3.32Å |
| 168 | L | 98 | Very high | 98.1 | Very high | 92 Ų | 92 | 98.6 Ų | 98.6 | 48% | 0.482 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.3 | -34.8 | 175.6 | -72.8 | 173.5 | 0 | 0 | 0 | 112.7 | E164 R166 M172 | E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 VanDerWaalsContact O-CG 3.29Å; E164-L168 WeakPolarHBondContact O-CG 3.42Å; E164-L168 PolarHBondContact O-N 2.97Å; R166-L168 PolarHBondContact O-N 2.9Å; L168-M172 WeakPolarHBondContact O-CB 3.42Å; L168-M172 WeakPolarHBondContact O-CG 3.47Å; L168-M172 PolarHBondContact O-N 3.44Å |
| 169 | R | 98.4 | Very high | 98.1 | Very high | 157 Ų | 157 | 103.5 Ų | 103.5 | 59% | 0.592 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.9 | -43.8 | 174 | -77.7 | 171.5 | -176.2 | 162.8 | 2.4 | 111.3 | L165 R166 T167 M172 E173 | L165-R169 WeakPolarHBondContact O-CB 3.48Å; L165-R169 WeakPolarHBondContact O-CD 3.48Å; L165-R169 WeakPolarHBondContact O-CG 3.4Å; L165-R169 PolarHBondContact O-N 2.89Å; R166-R169 WeakPolarHBondContact O-CB 3.35Å; R166-R169 PolarHBondContact O-N 3.3Å; R166-R169 VanDerWaalsContact O-N 3.14Å; T167-R169 VanDerWaalsContact C-N 3.3Å; T167-R169 PolarHBondContact O-N 3.42Å; R169-M172 PolarHBondContact O-N 3.09Å; R169-E173 WeakPolarHBondContact O-CB 3.49Å; R169-E173 WeakPolarHBondContact O-CG 3.29Å; R169-E173 PolarHBondContact O-N 3.45Å |
| 170 | E | 98.1 | Very high | 98.1 | Very high | 106 Ų | 106 | 103 Ų | 103 | 50% | 0.495 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 175.4 | -70.7 | 165.4 | -171.7 | 0 | 0 | 110.6 | R166 T167 M172 E173 E174 | R166-E170 WeakPolarHBondContact O-CG 3.17Å; R166-E170 PolarHBondContact O-N 3.48Å; T167-E170 PolarHBondContact O-N 2.88Å; E170-M172 VanDerWaalsContact C-N 3.34Å; E170-M172 PolarHBondContact O-N 3.17Å; E170-E173 PolarHBondContact O-N 2.87Å; E170-E174 WeakPolarHBondContact O-CB 3.33Å; E170-E174 WeakPolarHBondContact O-CG 3.19Å; E170-E174 PolarHBondContact O-N 3.38Å |
| 171 | E | 98.3 | Very high | 98.1 | Very high | 111 Ų | 111 | 104.4 Ų | 104.4 | 52% | 0.519 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.1 | -39.4 | 174.7 | -71.7 | 172.5 | -168.5 | 0 | 0 | 112.7 | T167 S175 | T167-E171 WeakPolarHBondContact O-CG 3.36Å; T167-E171 PolarHBondContact O-N 3.32Å; E171-S175 VanDerWaalsContact O-CB 3.3Å; E171-S175 WeakPolarHBondContact O-CB 3.47Å; E171-S175 PolarHBondContact O-N 3.1Å; E171-S175 PolarHBondContact O-OG 3.3Å |
| 172 | M | 97.3 | Very high | 98 | Very high | 136 Ų | 136 | 102.6 Ų | 102.6 | 67% | 0.67 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.8 | -40.3 | 174.5 | -72.6 | -113 | -65.3 | 0 | 0 | 111.9 | L168 R169 E170 S175 S176 | L168-M172 WeakPolarHBondContact O-CB 3.42Å; L168-M172 WeakPolarHBondContact O-CG 3.47Å; L168-M172 PolarHBondContact O-N 3.44Å; R169-M172 PolarHBondContact O-N 3.09Å; E170-M172 VanDerWaalsContact C-N 3.34Å; E170-M172 PolarHBondContact O-N 3.17Å; M172-S175 WeakPolarHBondContact CA-OG 3.45Å; M172-S175 PolarHBondContact O-OG 3.4Å; M172-S176 VanDerWaalsContact O-CB 3.26Å; M172-S176 WeakPolarHBondContact O-CB 3.28Å; M172-S176 PolarHBondContact O-N 2.82Å; M172-S176 PolarHBondContact O-OG 2.82Å |
| 173 | E | 97.7 | Very high | 98 | Very high | 127 Ų | 127 | 99.1 Ų | 99.1 | 59% | 0.593 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.8 | -46 | 176 | -74.9 | 175 | -168.5 | 0 | 0 | 110.8 | R169 E170 S176 F177 | R169-E173 WeakPolarHBondContact O-CB 3.49Å; R169-E173 WeakPolarHBondContact O-CG 3.29Å; R169-E173 PolarHBondContact O-N 3.45Å; E170-E173 PolarHBondContact O-N 2.87Å; E173-S176 PolarHBondContact O-N 3.01Å; E173-S176 PolarHBondContact O-OG 3.02Å; E173-F177 VanDerWaalsContact O-CB 3.3Å; E173-F177 WeakPolarHBondContact O-CB 3.34Å; E173-F177 PolarHBondContact O-N 3.3Å |
| 174 | E | 97.8 | Very high | 98 | Very high | 136 Ų | 136 | 99.2 Ų | 99.2 | 64% | 0.636 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.2 | -42.7 | 175.3 | -72.9 | -179.3 | 178.5 | 0 | 0 | 112.6 | E170 F177 S178 | E170-E174 WeakPolarHBondContact O-CB 3.33Å; E170-E174 WeakPolarHBondContact O-CG 3.19Å; E170-E174 PolarHBondContact O-N 3.38Å; E174-F177 PolarHBondContact O-N 3.4Å; E174-S178 WeakPolarHBondContact O-CB 3.39Å; E174-S178 PolarHBondContact O-N 3.39Å; E174-S178 PolarHBondContact O-OG 2.83Å |
| 175 | S | 97.9 | Very high | 98 | Very high | 62 Ų | 62 | 100.2 Ų | 100.2 | 43% | 0.434 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 175.3 | 62.2 | 0 | 0 | 0 | 0 | 112.1 | E171 M172 S178 R179 | E171-S175 VanDerWaalsContact O-CB 3.3Å; E171-S175 WeakPolarHBondContact O-CB 3.47Å; E171-S175 PolarHBondContact O-N 3.1Å; E171-S175 PolarHBondContact O-OG 3.3Å; M172-S175 WeakPolarHBondContact CA-OG 3.45Å; M172-S175 PolarHBondContact O-OG 3.4Å; S175-S178 WeakPolarHBondContact CA-OG 3.33Å; S175-S178 PolarHBondContact O-OG 3.39Å; S175-R179 VanDerWaalsContact O-CB 3.26Å; S175-R179 WeakPolarHBondContact O-CB 3.26Å; S175-R179 PolarHBondContact O-N 3.27Å |
| 176 | S | 97.6 | Very high | 98 | Very high | 56 Ų | 56 | 100.5 Ų | 100.5 | 39% | 0.392 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.3 | -40.6 | 173.1 | 80.3 | 0 | 0 | 0 | 0 | 111.6 | M172 E173 R179 N180 | M172-S176 VanDerWaalsContact O-CB 3.26Å; M172-S176 WeakPolarHBondContact O-CB 3.28Å; M172-S176 PolarHBondContact O-N 2.82Å; M172-S176 PolarHBondContact O-OG 2.82Å; E173-S176 PolarHBondContact O-N 3.01Å; E173-S176 PolarHBondContact O-OG 3.02Å; S176-R179 PolarHBondContact O-N 3.19Å; S176-N180 WeakPolarHBondContact O-CB 3.44Å; S176-N180 PolarHBondContact O-N 2.92Å; S176-N180 PolarHBondContact O-ND2 2.93Å; S176-N180 PolarHBondContact O-OD1 2.84Å |
| 177 | F | 97.8 | Very high | 97.9 | Very high | 135 Ų | 135 | 100.6 Ų | 100.6 | 59% | 0.592 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.2 | -46.6 | 179.1 | -178.5 | -108.1 | 0 | 0 | 0 | 111.5 | E173 E174 R179 N180 I181 | E173-F177 VanDerWaalsContact O-CB 3.3Å; E173-F177 WeakPolarHBondContact O-CB 3.34Å; E173-F177 PolarHBondContact O-N 3.3Å; E174-F177 PolarHBondContact O-N 3.4Å; F177-R179 VanDerWaalsContact C-N 3.33Å; F177-R179 PolarHBondContact O-N 2.97Å; F177-N180 PolarHBondContact O-N 3.29Å; F177-I181 HydrophobicContact CD1-CD1 3.63Å; F177-I181 HydrophobicContact CE1-CD1 3.25Å; F177-I181 HydrophobicContact CE1-CG1 4.29Å; F177-I181 HydrophobicContact CE2-CD1 4.35Å; F177-I181 HydrophobicContact CG-CD1 4.33Å; F177-I181 HydrophobicContact CZ-CD1 3.66Å; F177-I181 HydrophobicContact CZ-CG1 4.31Å; F177-I181 WeakPolarHBondContact O-CG1 3.26Å; F177-I181 PolarHBondContact O-N 3.07Å |
| 178 | S | 97.6 | Very high | 97.9 | Very high | 66 Ų | 66 | 101.7 Ų | 101.7 | 46% | 0.462 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.5 | -36.8 | 174.9 | 56.8 | 0 | 0 | 0 | 0 | 112.6 | E174 S175 I181 S182 | E174-S178 WeakPolarHBondContact O-CB 3.39Å; E174-S178 PolarHBondContact O-N 3.39Å; E174-S178 PolarHBondContact O-OG 2.83Å; S175-S178 WeakPolarHBondContact CA-OG 3.33Å; S175-S178 PolarHBondContact O-OG 3.39Å; S178-I181 PolarHBondContact O-N 3.19Å; S178-S182 PolarHBondContact O-N 3.45Å; S178-S182 PolarHBondContact O-OG 3.17Å |
| 179 | R | 97.9 | Very high | 97.9 | Very high | 191 Ų | 191 | 102.1 Ų | 102.1 | 72% | 0.721 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.2 | -39.8 | 171.6 | -175 | 175.3 | 179.1 | 166.7 | 0.2 | 112.5 | S175 S176 F177 S182 S183 | S175-R179 VanDerWaalsContact O-CB 3.26Å; S175-R179 WeakPolarHBondContact O-CB 3.26Å; S175-R179 PolarHBondContact O-N 3.27Å; S176-R179 PolarHBondContact O-N 3.19Å; F177-R179 VanDerWaalsContact C-N 3.33Å; F177-R179 PolarHBondContact O-N 2.97Å; R179-S182 PolarHBondContact O-N 3.47Å; R179-S182 PolarHBondContact O-OG 3.41Å; R179-S183 WeakPolarHBondContact O-CB 3.34Å; R179-S183 PolarHBondContact O-N 2.92Å |
| 180 | N | 98.1 | Very high | 97.9 | Very high | 104 Ų | 104 | 98.8 Ų | 98.8 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.3 | -40.2 | 176.3 | -68.9 | -21.8 | 0 | 0 | 0 | 111.1 | S176 F177 S183 A184 | S176-N180 WeakPolarHBondContact O-CB 3.44Å; S176-N180 PolarHBondContact O-N 2.92Å; S176-N180 PolarHBondContact O-ND2 2.93Å; S176-N180 PolarHBondContact O-OD1 2.84Å; F177-N180 PolarHBondContact O-N 3.29Å; N180-S183 PolarHBondContact O-N 3.46Å; N180-A184 WeakPolarHBondContact O-CB 3.45Å; N180-A184 PolarHBondContact O-N 3.29Å |
| 181 | I | 98.1 | Very high | 97.9 | Very high | 70 Ų | 70 | 95.7 Ų | 95.7 | 36% | 0.359 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.2 | -48.6 | 173.8 | -68.6 | 164.6 | 0 | 0 | 0 | 110.8 | F177 S178 S183 A184 Q185 | F177-I181 HydrophobicContact CD1-CD1 3.63Å; F177-I181 HydrophobicContact CE1-CD1 3.25Å; F177-I181 HydrophobicContact CE1-CG1 4.29Å; F177-I181 HydrophobicContact CE2-CD1 4.35Å; F177-I181 HydrophobicContact CG-CD1 4.33Å; F177-I181 HydrophobicContact CZ-CD1 3.66Å; F177-I181 HydrophobicContact CZ-CG1 4.31Å; F177-I181 WeakPolarHBondContact O-CG1 3.26Å; F177-I181 PolarHBondContact O-N 3.07Å; S178-I181 PolarHBondContact O-N 3.19Å; I181-S183 VanDerWaalsContact C-N 3.34Å; I181-S183 PolarHBondContact O-N 3.34Å; I181-A184 PolarHBondContact O-N 2.69Å; I181-Q185 HydrophobicContact CG2-CG 4.41Å; I181-Q185 WeakPolarHBondContact O-CG 3.33Å; I181-Q185 PolarHBondContact O-N 3.01Å |
| 182 | S | 97.6 | Very high | 97.9 | Very high | 61 Ų | 61 | 94.7 Ų | 94.7 | 43% | 0.427 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.1 | -34.8 | -179.7 | 67 | 0 | 0 | 0 | 0 | 112.5 | S178 R179 Q185 L186 | S178-S182 PolarHBondContact O-N 3.45Å; S178-S182 PolarHBondContact O-OG 3.17Å; R179-S182 PolarHBondContact O-N 3.47Å; R179-S182 PolarHBondContact O-OG 3.41Å; S182-Q185 PolarHBondContact O-N 3.43Å; S182-L186 VanDerWaalsContact O-CB 3.29Å; S182-L186 WeakPolarHBondContact O-CB 3.43Å; S182-L186 PolarHBondContact O-N 2.87Å |
| 183 | S | 98 | Very high | 97.9 | Very high | 51 Ų | 51 | 92.1 Ų | 92.1 | 36% | 0.357 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.1 | -48.8 | 171.3 | -165.5 | 0 | 0 | 0 | 0 | 111.4 | R179 N180 I181 Q185 L186 E187 | R179-S183 WeakPolarHBondContact O-CB 3.34Å; R179-S183 PolarHBondContact O-N 2.92Å; N180-S183 PolarHBondContact O-N 3.46Å; I181-S183 VanDerWaalsContact C-N 3.34Å; I181-S183 PolarHBondContact O-N 3.34Å; S183-Q185 PolarHBondContact O-N 2.96Å; S183-L186 PolarHBondContact O-N 2.91Å; S183-E187 WeakPolarHBondContact O-CG 3.38Å; S183-E187 PolarHBondContact O-N 3.01Å; S183-E187 PolarHBondContact OG-OE1 3.21Å |
| 184 | A | 98 | Very high | 97.9 | Very high | 55 Ų | 55 | 93.1 Ų | 93.1 | 46% | 0.455 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.2 | -40 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N180 I181 E187 N188 | N180-A184 WeakPolarHBondContact O-CB 3.45Å; N180-A184 PolarHBondContact O-N 3.29Å; I181-A184 PolarHBondContact O-N 2.69Å; A184-E187 PolarHBondContact O-N 3.17Å; A184-N188 PolarHBondContact O-N 3.44Å |
| 185 | Q | 98.1 | Very high | 97.9 | Very high | 123 Ų | 123 | 91 Ų | 91 | 58% | 0.575 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -61.5 | -43.8 | 173.3 | -74.3 | 175.8 | -9 | 0 | 0 | 111.5 | I181 S182 S183 N188 M189 | I181-Q185 HydrophobicContact CG2-CG 4.41Å; I181-Q185 WeakPolarHBondContact O-CG 3.33Å; I181-Q185 PolarHBondContact O-N 3.01Å; S182-Q185 PolarHBondContact O-N 3.43Å; S183-Q185 PolarHBondContact O-N 2.96Å; Q185-N188 PolarHBondContact O-N 2.71Å; Q185-M189 WeakPolarHBondContact O-CG 3.46Å; Q185-M189 PolarHBondContact O-N 3.3Å |
| 186 | L | 98.3 | Very high | 97.9 | Very high | 96 Ų | 96 | 92.4 Ų | 92.4 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.5 | -39.7 | 178 | -177.6 | 139.6 | 0 | 0 | 0 | 111.9 | S182 S183 M189 Q190 | S182-L186 VanDerWaalsContact O-CB 3.29Å; S182-L186 WeakPolarHBondContact O-CB 3.43Å; S182-L186 PolarHBondContact O-N 2.87Å; S183-L186 PolarHBondContact O-N 2.91Å; L186-M189 PolarHBondContact O-N 3.48Å; L186-Q190 HydrophobicContact CD2-CG 4.26Å; L186-Q190 WeakPolarHBondContact O-CB 3.36Å; L186-Q190 VanDerWaalsContact O-CG 3.24Å; L186-Q190 WeakPolarHBondContact O-CG 3.32Å; L186-Q190 PolarHBondContact O-N 2.84Å |
| 187 | E | 98.2 | Very high | 97.9 | Very high | 114 Ų | 114 | 95.4 Ų | 95.4 | 53% | 0.533 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 173 | -75.4 | 170.2 | -155.3 | 0 | 0 | 111.9 | S183 A184 Q190 A191 | S183-E187 WeakPolarHBondContact O-CG 3.38Å; S183-E187 PolarHBondContact O-N 3.01Å; S183-E187 PolarHBondContact OG-OE1 3.21Å; A184-E187 PolarHBondContact O-N 3.17Å; E187-Q190 PolarHBondContact O-N 3.37Å; E187-A191 WeakPolarHBondContact O-CB 3.47Å; E187-A191 PolarHBondContact O-N 2.89Å |
| 188 | N | 98.1 | Very high | 98 | Very high | 87 Ų | 87 | 95.1 Ų | 95.1 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63 | -48.2 | 174.8 | -174 | 49.2 | 0 | 0 | 0 | 111.6 | A184 Q185 Q190 A191 E192 | A184-N188 PolarHBondContact O-N 3.44Å; Q185-N188 PolarHBondContact O-N 2.71Å; N188-Q190 VanDerWaalsContact C-N 3.25Å; N188-Q190 PolarHBondContact O-N 2.87Å; N188-A191 WeakPolarHBondContact O-CB 3.37Å; N188-A191 PolarHBondContact O-N 3.39Å; N188-A191 VanDerWaalsContact O-N 3.1Å; N188-E192 PolarHBondContact ND2-OE1 3.41Å; N188-E192 WeakPolarHBondContact O-CG 3.33Å; N188-E192 PolarHBondContact O-N 3.42Å |
| 189 | M | 97.6 | Very high | 98 | Very high | 100 Ų | 100 | 100.4 Ų | 100.4 | 49% | 0.493 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -35.6 | 176 | -68.5 | -56.9 | -56.6 | 0 | 0 | 112.1 | Q185 L186 N193 | Q185-M189 WeakPolarHBondContact O-CG 3.46Å; Q185-M189 PolarHBondContact O-N 3.3Å; L186-M189 PolarHBondContact O-N 3.48Å; M189-N193 WeakPolarHBondContact O-CB 3.45Å; M189-N193 PolarHBondContact O-N 3.46Å; M189-N193 PolarHBondContact O-ND2 3.17Å |
| 190 | Q | 98 | Very high | 98 | Very high | 87 Ų | 87 | 96.4 Ų | 96.4 | 41% | 0.407 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 173.9 | -78 | -178.9 | -0.8 | 0 | 0 | 111.9 | L186 E187 N188 N193 R194 | L186-Q190 HydrophobicContact CD2-CG 4.26Å; L186-Q190 WeakPolarHBondContact O-CB 3.36Å; L186-Q190 VanDerWaalsContact O-CG 3.24Å; L186-Q190 WeakPolarHBondContact O-CG 3.32Å; L186-Q190 PolarHBondContact O-N 2.84Å; E187-Q190 PolarHBondContact O-N 3.37Å; N188-Q190 VanDerWaalsContact C-N 3.25Å; N188-Q190 PolarHBondContact O-N 2.87Å; Q190-N193 PolarHBondContact O-N 3.44Å; Q190-R194 WeakPolarHBondContact O-CG 3.43Å; Q190-R194 PolarHBondContact O-N 2.95Å |
| 191 | A | 97.8 | Very high | 98 | Very high | 42 Ų | 42 | 96.4 Ų | 96.4 | 35% | 0.347 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | E187 N188 N193 R194 V195 | E187-A191 WeakPolarHBondContact O-CB 3.47Å; E187-A191 PolarHBondContact O-N 2.89Å; N188-A191 WeakPolarHBondContact O-CB 3.37Å; N188-A191 PolarHBondContact O-N 3.39Å; N188-A191 VanDerWaalsContact O-N 3.1Å; A191-N193 VanDerWaalsContact C-N 3.35Å; A191-N193 PolarHBondContact O-N 2.96Å; A191-R194 WeakPolarHBondContact O-CB 3.44Å; A191-R194 PolarHBondContact O-N 2.91Å; A191-V195 WeakPolarHBondContact O-CG2 3.38Å; A191-V195 PolarHBondContact O-N 3.03Å |
| 192 | E | 97.8 | Very high | 98 | Very high | 90 Ų | 90 | 98 Ų | 98 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.7 | -45.2 | 174.7 | -71.9 | 176.8 | -163.1 | 0 | 0 | 111.7 | N188 R194 V195 L196 | N188-E192 PolarHBondContact ND2-OE1 3.41Å; N188-E192 WeakPolarHBondContact O-CG 3.33Å; N188-E192 PolarHBondContact O-N 3.42Å; E192-R194 VanDerWaalsContact C-N 3.34Å; E192-R194 PolarHBondContact O-N 3.43Å; E192-V195 PolarHBondContact O-N 3.35Å; E192-L196 WeakPolarHBondContact O-CG 3.2Å; E192-L196 PolarHBondContact O-N 3.35Å |
| 193 | N | 97.3 | Very high | 98.1 | Very high | 82 Ų | 82 | 99.9 Ų | 99.9 | 44% | 0.439 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -38.8 | 175.8 | -84.7 | -63.8 | 0 | 0 | 0 | 112.7 | M189 Q190 A191 L196 Q197 | M189-N193 WeakPolarHBondContact O-CB 3.45Å; M189-N193 PolarHBondContact O-N 3.46Å; M189-N193 PolarHBondContact O-ND2 3.17Å; Q190-N193 PolarHBondContact O-N 3.44Å; A191-N193 VanDerWaalsContact C-N 3.35Å; A191-N193 PolarHBondContact O-N 2.96Å; N193-L196 PolarHBondContact O-N 2.84Å; N193-Q197 WeakPolarHBondContact O-CB 3.35Å; N193-Q197 VanDerWaalsContact O-CG 3.25Å; N193-Q197 WeakPolarHBondContact O-CG 3.3Å; N193-Q197 PolarHBondContact O-N 3.06Å |
| 194 | R | 98.4 | Very high | 98.1 | Very high | 147 Ų | 147 | 102.1 Ų | 102.1 | 56% | 0.555 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.4 | -46.6 | 175.1 | -72.2 | 172.8 | -167 | 161.8 | 7.2 | 111.1 | Q190 A191 E192 L196 Q197 E198 | Q190-R194 WeakPolarHBondContact O-CG 3.43Å; Q190-R194 PolarHBondContact O-N 2.95Å; A191-R194 WeakPolarHBondContact O-CB 3.44Å; A191-R194 PolarHBondContact O-N 2.91Å; E192-R194 VanDerWaalsContact C-N 3.34Å; E192-R194 PolarHBondContact O-N 3.43Å; R194-L196 VanDerWaalsContact C-N 3.33Å; R194-L196 PolarHBondContact O-N 3.14Å; R194-Q197 WeakPolarHBondContact O-CB 3.3Å; R194-Q197 PolarHBondContact O-N 2.93Å; R194-E198 WeakPolarHBondContact O-CG 3.44Å; R194-E198 PolarHBondContact O-N 3.46Å |
| 195 | V | 98.2 | Very high | 98.1 | Very high | 91 Ų | 91 | 103.4 Ų | 103.4 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.9 | -41.4 | 177.5 | 174.5 | 0 | 0 | 0 | 0 | 111.4 | A191 E192 E198 R199 | A191-V195 WeakPolarHBondContact O-CG2 3.38Å; A191-V195 PolarHBondContact O-N 3.03Å; E192-V195 PolarHBondContact O-N 3.35Å; V195-E198 PolarHBondContact O-N 2.98Å; V195-R199 WeakPolarHBondContact O-CB 3.1Å; V195-R199 PolarHBondContact O-N 3.1Å |
| 196 | L | 98.1 | Very high | 98.1 | Very high | 93 Ų | 93 | 102 Ų | 102 | 49% | 0.487 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.7 | -39.7 | 175.6 | -69.7 | 175.7 | 0 | 0 | 0 | 112.1 | E192 N193 R194 R199 L200 | E192-L196 WeakPolarHBondContact O-CG 3.2Å; E192-L196 PolarHBondContact O-N 3.35Å; N193-L196 PolarHBondContact O-N 2.84Å; R194-L196 VanDerWaalsContact C-N 3.33Å; R194-L196 PolarHBondContact O-N 3.14Å; L196-R199 PolarHBondContact O-N 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.47Å; L196-L200 PolarHBondContact O-N 2.87Å |
| 197 | Q | 98.1 | Very high | 98.1 | Very high | 118 Ų | 118 | 102.4 Ų | 102.4 | 55% | 0.551 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.9 | -45 | 174.3 | -74.6 | 171.5 | -0.3 | 0 | 0 | 111.7 | N193 R194 R199 L200 L201 | N193-Q197 WeakPolarHBondContact O-CB 3.35Å; N193-Q197 VanDerWaalsContact O-CG 3.25Å; N193-Q197 WeakPolarHBondContact O-CG 3.3Å; N193-Q197 PolarHBondContact O-N 3.06Å; R194-Q197 WeakPolarHBondContact O-CB 3.3Å; R194-Q197 PolarHBondContact O-N 2.93Å; Q197-R199 VanDerWaalsContact C-N 3.3Å; Q197-R199 PolarHBondContact O-N 2.83Å; Q197-L200 WeakPolarHBondContact O-CB 3.35Å; Q197-L200 PolarHBondContact O-N 3.41Å; Q197-L201 WeakPolarHBondContact O-CG 3.35Å; Q197-L201 PolarHBondContact O-N 2.81Å |
| 198 | E | 98.3 | Very high | 98.1 | Very high | 129 Ų | 129 | 102.2 Ų | 102.2 | 60% | 0.603 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59 | -42.6 | 174.9 | -73 | 172.5 | -175 | 0 | 0 | 111.4 | R194 V195 L201 H202 | R194-E198 WeakPolarHBondContact O-CG 3.44Å; R194-E198 PolarHBondContact O-N 3.46Å; V195-E198 PolarHBondContact O-N 2.98Å; E198-L201 PolarHBondContact O-N 2.87Å; E198-H202 WeakPolarHBondContact O-CB 3.45Å; E198-H202 PolarHBondContact O-N 2.98Å |
| 199 | R | 98.2 | Very high | 98.1 | Very high | 177 Ų | 177 | 100.2 Ų | 100.2 | 67% | 0.668 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.5 | -42 | 174.8 | -174.8 | 176.6 | -179.7 | 176 | 0.9 | 112.2 | V195 L196 Q197 H202 M203 | V195-R199 WeakPolarHBondContact O-CB 3.1Å; V195-R199 PolarHBondContact O-N 3.1Å; L196-R199 PolarHBondContact O-N 3.24Å; Q197-R199 VanDerWaalsContact C-N 3.3Å; Q197-R199 PolarHBondContact O-N 2.83Å; R199-H202 PolarHBondContact O-N 2.95Å; R199-M203 WeakPolarHBondContact O-CG 3.39Å; R199-M203 PolarHBondContact O-N 3.27Å |
| 200 | L | 98.3 | Very high | 98 | Very high | 108 Ų | 108 | 98.8 Ų | 98.8 | 57% | 0.565 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.6 | -48.8 | 175.7 | -76.4 | 171.2 | 0 | 0 | 0 | 111.1 | L196 Q197 H202 M203 E204 | L196-L200 WeakPolarHBondContact O-CG 3.47Å; L196-L200 PolarHBondContact O-N 2.87Å; Q197-L200 WeakPolarHBondContact O-CB 3.35Å; Q197-L200 PolarHBondContact O-N 3.41Å; L200-H202 VanDerWaalsContact C-N 3.29Å; L200-H202 PolarHBondContact O-N 2.86Å; L200-M203 PolarHBondContact O-N 2.88Å; L200-M203 VanDerWaalsContact O-N 3.14Å; L200-E204 WeakPolarHBondContact O-CG 3.38Å; L200-E204 PolarHBondContact O-N 2.97Å |
| 201 | L | 98.4 | Very high | 98 | Very high | 103 Ų | 103 | 99.3 Ų | 99.3 | 54% | 0.539 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.8 | -41.7 | 176.9 | -69.3 | 174.2 | 0 | 0 | 0 | 111.4 | Q197 E198 E204 T205 | Q197-L201 WeakPolarHBondContact O-CG 3.35Å; Q197-L201 PolarHBondContact O-N 2.81Å; E198-L201 PolarHBondContact O-N 2.87Å; L201-E204 PolarHBondContact O-N 2.81Å; L201-T205 WeakPolarHBondContact O-CG2 3.47Å; L201-T205 PolarHBondContact O-N 3.17Å; L201-T205 PolarHBondContact O-OG1 3.17Å |
| 202 | H | 98.4 | Very high | 98 | Very high | 104 Ų | 104 | 101.9 Ų | 101.9 | 48% | 0.481 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.7 | -48.5 | 174.9 | -175.3 | 65.1 | 0 | 0 | 0 | 111.8 | E198 R199 L200 E204 T205 Q206 | E198-H202 WeakPolarHBondContact O-CB 3.45Å; E198-H202 PolarHBondContact O-N 2.98Å; R199-H202 PolarHBondContact O-N 2.95Å; L200-H202 VanDerWaalsContact C-N 3.29Å; L200-H202 PolarHBondContact O-N 2.86Å; H202-E204 VanDerWaalsContact C-N 3.33Å; H202-E204 PolarHBondContact O-N 3.34Å; H202-T205 PolarHBondContact O-N 2.96Å; H202-T205 PolarHBondContact O-OG1 3.47Å; H202-Q206 PolarHBondContact NE2-NE2 3.36Å; H202-Q206 WeakPolarHBondContact O-CG 3.35Å; H202-Q206 PolarHBondContact O-N 2.95Å |
| 203 | M | 98.1 | Very high | 98 | Very high | 101 Ų | 101 | 101.4 Ų | 101.4 | 50% | 0.498 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 176.7 | -67.3 | -57.4 | -58.9 | 0 | 0 | 112.4 | R199 L200 Q206 L207 | R199-M203 WeakPolarHBondContact O-CG 3.39Å; R199-M203 PolarHBondContact O-N 3.27Å; L200-M203 PolarHBondContact O-N 2.88Å; L200-M203 VanDerWaalsContact O-N 3.14Å; M203-Q206 PolarHBondContact O-N 3Å; M203-L207 WeakPolarHBondContact O-CB 3.45Å; M203-L207 PolarHBondContact O-N 3.47Å |
| 204 | E | 98.3 | Very high | 98 | Very high | 98 Ų | 98 | 100 Ų | 100 | 46% | 0.458 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -41 | 174.4 | -73.5 | 178.3 | -177.2 | 0 | 0 | 112.2 | L200 L201 H202 L207 K208 | L200-E204 WeakPolarHBondContact O-CG 3.38Å; L200-E204 PolarHBondContact O-N 2.97Å; L201-E204 PolarHBondContact O-N 2.81Å; H202-E204 VanDerWaalsContact C-N 3.33Å; H202-E204 PolarHBondContact O-N 3.34Å; E204-L207 PolarHBondContact O-N 2.74Å; E204-K208 WeakPolarHBondContact O-CG 3.38Å; E204-K208 PolarHBondContact O-N 3.45Å |
| 205 | T | 98.2 | Very high | 98 | Very high | 81 Ų | 81 | 98.4 Ų | 98.4 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.6 | -41 | 176.1 | 59.4 | 0 | 0 | 0 | 0 | 112 | L201 H202 K208 A209 | L201-T205 WeakPolarHBondContact O-CG2 3.47Å; L201-T205 PolarHBondContact O-N 3.17Å; L201-T205 PolarHBondContact O-OG1 3.17Å; H202-T205 PolarHBondContact O-N 2.96Å; H202-T205 PolarHBondContact O-OG1 3.47Å; T205-K208 PolarHBondContact O-N 2.92Å; T205-A209 PolarHBondContact O-N 3.34Å |
| 206 | Q | 98.4 | Very high | 98 | Very high | 95 Ų | 95 | 100.9 Ų | 100.9 | 44% | 0.444 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 174.7 | -70.7 | -172 | -4.8 | 0 | 0 | 111.8 | H202 M203 A209 S210 | H202-Q206 PolarHBondContact NE2-NE2 3.36Å; H202-Q206 WeakPolarHBondContact O-CG 3.35Å; H202-Q206 PolarHBondContact O-N 2.95Å; M203-Q206 PolarHBondContact O-N 3Å; Q206-A209 PolarHBondContact O-N 3.01Å; Q206-S210 PolarHBondContact O-N 3.22Å |
| 207 | L | 98.1 | Very high | 98 | Very high | 103 Ų | 103 | 101.8 Ų | 101.8 | 54% | 0.539 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -48 | 177.4 | -172.6 | 115.2 | 0 | 0 | 0 | 110.9 | M203 E204 A209 S210 E211 | M203-L207 WeakPolarHBondContact O-CB 3.45Å; M203-L207 PolarHBondContact O-N 3.47Å; E204-L207 PolarHBondContact O-N 2.74Å; L207-A209 PolarHBondContact O-N 3.41Å; L207-S210 WeakPolarHBondContact O-CB 3.29Å; L207-S210 PolarHBondContact O-N 3.03Å; L207-S210 VanDerWaalsContact O-N 3.13Å; L207-E211 WeakPolarHBondContact CD2-OE1 3.34Å; L207-E211 WeakPolarHBondContact O-CG 3.29Å; L207-E211 PolarHBondContact O-N 3.19Å |
| 208 | K | 98.1 | Very high | 98 | Very high | 111 Ų | 111 | 103.4 Ų | 103.4 | 48% | 0.483 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58 | -45.3 | 176.2 | -73.6 | 171.3 | -176.2 | 169.7 | 0 | 112.2 | E204 T205 S210 E211 E212 | E204-K208 WeakPolarHBondContact O-CG 3.38Å; E204-K208 PolarHBondContact O-N 3.45Å; T205-K208 PolarHBondContact O-N 2.92Å; K208-S210 VanDerWaalsContact C-N 3.32Å; K208-S210 PolarHBondContact O-N 3.42Å; K208-E211 WeakPolarHBondContact O-CB 3.42Å; K208-E211 PolarHBondContact O-N 2.88Å; K208-E212 WeakPolarHBondContact O-CG 3.45Å; K208-E212 PolarHBondContact O-N 3.19Å |
| 209 | A | 98.1 | Very high | 98 | Very high | 45 Ų | 45 | 102.3 Ų | 102.3 | 37% | 0.372 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | T205 Q206 L207 E212 N213 | T205-A209 PolarHBondContact O-N 3.34Å; Q206-A209 PolarHBondContact O-N 3.01Å; L207-A209 PolarHBondContact O-N 3.41Å; A209-E212 PolarHBondContact O-N 2.91Å; A209-N213 WeakPolarHBondContact O-CB 3.39Å; A209-N213 PolarHBondContact O-N 2.94Å; A209-N213 PolarHBondContact O-ND2 3.39Å |
| 210 | S | 96.4 | Very high | 97.9 | Very high | 69 Ų | 69 | 99.6 Ų | 99.6 | 48% | 0.483 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.8 | -38.2 | 174.6 | -176 | 0 | 0 | 0 | 0 | 112.7 | Q206 L207 K208 S214 | Q206-S210 PolarHBondContact O-N 3.22Å; L207-S210 WeakPolarHBondContact O-CB 3.29Å; L207-S210 PolarHBondContact O-N 3.03Å; L207-S210 VanDerWaalsContact O-N 3.13Å; K208-S210 VanDerWaalsContact C-N 3.32Å; K208-S210 PolarHBondContact O-N 3.42Å; S210-S214 WeakPolarHBondContact O-CB 3.33Å; S210-S214 PolarHBondContact O-N 3.39Å; S210-S214 PolarHBondContact O-OG 2.9Å |
| 211 | E | 98 | Very high | 97.9 | Very high | 98 Ų | 98 | 100.8 Ų | 100.8 | 46% | 0.458 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.7 | -45.4 | 174.5 | -74 | 178.5 | 167.1 | 0 | 0 | 111.3 | L207 K208 N213 S214 Q215 | L207-E211 WeakPolarHBondContact CD2-OE1 3.34Å; L207-E211 WeakPolarHBondContact O-CG 3.29Å; L207-E211 PolarHBondContact O-N 3.19Å; K208-E211 WeakPolarHBondContact O-CB 3.42Å; K208-E211 PolarHBondContact O-N 2.88Å; E211-N213 PolarHBondContact O-N 3.14Å; E211-S214 WeakPolarHBondContact O-CB 3.18Å; E211-S214 PolarHBondContact O-N 2.89Å; E211-Q215 VanDerWaalsContact O-CG 3.3Å; E211-Q215 WeakPolarHBondContact O-CG 3.39Å; E211-Q215 PolarHBondContact O-N 3.38Å |
| 212 | E | 98.1 | Very high | 97.9 | Very high | 97 Ų | 97 | 98.8 Ų | 98.8 | 45% | 0.453 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 174.7 | -73.6 | 176.1 | -166.3 | 0 | 0 | 111.6 | K208 A209 S214 Q215 R216 | K208-E212 WeakPolarHBondContact O-CG 3.45Å; K208-E212 PolarHBondContact O-N 3.19Å; A209-E212 PolarHBondContact O-N 2.91Å; E212-S214 VanDerWaalsContact C-N 3.32Å; E212-S214 PolarHBondContact O-N 3.21Å; E212-Q215 WeakPolarHBondContact O-CB 3.34Å; E212-Q215 PolarHBondContact O-N 2.9Å; E212-R216 WeakPolarHBondContact O-CG 3.29Å; E212-R216 PolarHBondContact O-N 2.85Å; E212-R216 IonicContact OE2-NH2 3.75Å |
| 213 | N | 97.6 | Very high | 97.8 | Very high | 80 Ų | 80 | 95.8 Ų | 95.8 | 43% | 0.428 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 175.1 | -71.3 | -23.4 | 0 | 0 | 0 | 111.6 | A209 E211 Q215 R216 L217 | A209-N213 WeakPolarHBondContact O-CB 3.39Å; A209-N213 PolarHBondContact O-N 2.94Å; A209-N213 PolarHBondContact O-ND2 3.39Å; E211-N213 PolarHBondContact O-N 3.14Å; N213-Q215 VanDerWaalsContact C-N 3.32Å; N213-Q215 PolarHBondContact O-N 3.36Å; N213-R216 PolarHBondContact O-N 2.75Å; N213-R216 PolarHBondContact OD1-NH1 3.34Å; N213-L217 WeakPolarHBondContact O-CG 3.44Å; N213-L217 PolarHBondContact O-N 3.44Å |
| 214 | S | 97.5 | Very high | 97.8 | Very high | 51 Ų | 51 | 96.2 Ų | 96.2 | 36% | 0.357 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64 | -37.5 | 175.5 | -61.3 | 0 | 0 | 0 | 0 | 112 | S210 E211 E212 R218 | S210-S214 WeakPolarHBondContact O-CB 3.33Å; S210-S214 PolarHBondContact O-N 3.39Å; S210-S214 PolarHBondContact O-OG 2.9Å; E211-S214 WeakPolarHBondContact O-CB 3.18Å; E211-S214 PolarHBondContact O-N 2.89Å; E212-S214 VanDerWaalsContact C-N 3.32Å; E212-S214 PolarHBondContact O-N 3.21Å; S214-R218 VanDerWaalsContact O-CG 3.28Å; S214-R218 WeakPolarHBondContact O-CG 3.37Å; S214-R218 PolarHBondContact O-N 3.45Å |
| 215 | Q | 97.9 | Very high | 97.8 | Very high | 115 Ų | 115 | 99.9 Ų | 99.9 | 54% | 0.537 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.4 | -43.6 | 174.3 | -71.2 | 171.2 | 16.4 | 0 | 0 | 111.4 | E211 E212 N213 L217 R218 V219 | E211-Q215 VanDerWaalsContact O-CG 3.3Å; E211-Q215 WeakPolarHBondContact O-CG 3.39Å; E211-Q215 PolarHBondContact O-N 3.38Å; E212-Q215 WeakPolarHBondContact O-CB 3.34Å; E212-Q215 PolarHBondContact O-N 2.9Å; N213-Q215 VanDerWaalsContact C-N 3.32Å; N213-Q215 PolarHBondContact O-N 3.36Å; Q215-L217 PolarHBondContact O-N 2.85Å; Q215-R218 WeakPolarHBondContact O-CB 3.38Å; Q215-R218 PolarHBondContact O-N 3.32Å; Q215-R218 VanDerWaalsContact O-N 3.16Å; Q215-V219 WeakPolarHBondContact O-CG2 3.28Å; Q215-V219 PolarHBondContact O-N 3.28Å |
| 216 | R | 98.1 | Very high | 97.7 | Very high | 142 Ų | 142 | 100.4 Ų | 100.4 | 54% | 0.536 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.1 | -49.1 | 174.2 | -69.5 | 172.7 | -167.9 | 167.3 | 6 | 111.2 | E212 N213 R218 V219 E220 | E212-R216 WeakPolarHBondContact O-CG 3.29Å; E212-R216 PolarHBondContact O-N 2.85Å; E212-R216 IonicContact OE2-NH2 3.75Å; N213-R216 PolarHBondContact O-N 2.75Å; N213-R216 PolarHBondContact OD1-NH1 3.34Å; R216-R218 VanDerWaalsContact C-N 3.3Å; R216-R218 PolarHBondContact O-N 2.88Å; R216-V219 PolarHBondContact O-N 2.87Å; R216-V219 VanDerWaalsContact O-N 3.15Å; R216-E220 WeakPolarHBondContact O-CG 3.4Å; R216-E220 PolarHBondContact O-N 3.3Å |
| 217 | L | 97.6 | Very high | 97.7 | Very high | 112 Ų | 112 | 103.8 Ų | 103.8 | 59% | 0.586 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61 | -36.3 | 176.3 | -70.5 | 172.9 | 0 | 0 | 0 | 112.7 | N213 Q215 R221 | N213-L217 WeakPolarHBondContact O-CG 3.44Å; N213-L217 PolarHBondContact O-N 3.44Å; Q215-L217 PolarHBondContact O-N 2.85Å; L217-R221 VanDerWaalsContact O-CB 3.25Å; L217-R221 WeakPolarHBondContact O-CB 3.43Å; L217-R221 PolarHBondContact O-N 2.6Å |
| 218 | R | 98.1 | Very high | 97.7 | Very high | 153 Ų | 153 | 104.4 Ų | 104.4 | 58% | 0.577 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.5 | -44.8 | 174 | -75.4 | 173.6 | -171.5 | -176.2 | 4.9 | 111.7 | S214 Q215 R216 R221 D222 | S214-R218 VanDerWaalsContact O-CG 3.28Å; S214-R218 WeakPolarHBondContact O-CG 3.37Å; S214-R218 PolarHBondContact O-N 3.45Å; Q215-R218 WeakPolarHBondContact O-CB 3.38Å; Q215-R218 PolarHBondContact O-N 3.32Å; Q215-R218 VanDerWaalsContact O-N 3.16Å; R216-R218 VanDerWaalsContact C-N 3.3Å; R216-R218 PolarHBondContact O-N 2.88Å; R218-R221 PolarHBondContact O-N 3.08Å; R218-D222 WeakPolarHBondContact O-CB 3.48Å; R218-D222 PolarHBondContact O-N 3.5Å |
| 219 | V | 97.9 | Very high | 97.6 | Very high | 105 Ų | 105 | 102 Ų | 102 | 64% | 0.636 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.4 | -44.7 | 177.5 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | Q215 R216 D222 G223 | Q215-V219 WeakPolarHBondContact O-CG2 3.28Å; Q215-V219 PolarHBondContact O-N 3.28Å; R216-V219 PolarHBondContact O-N 2.87Å; R216-V219 VanDerWaalsContact O-N 3.15Å; V219-D222 PolarHBondContact O-N 2.93Å; V219-G223 PolarHBondContact O-N 3.47Å |
| 220 | E | 97.5 | Very high | 97.6 | Very high | 121 Ų | 121 | 105 Ų | 105 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.1 | -45.1 | 175.3 | -73 | 175.6 | -177.7 | 0 | 0 | 111.9 | R216 D222 G223 L224 | R216-E220 WeakPolarHBondContact O-CG 3.4Å; R216-E220 PolarHBondContact O-N 3.3Å; E220-D222 VanDerWaalsContact C-N 3.33Å; E220-D222 PolarHBondContact O-N 2.89Å; E220-G223 PolarHBondContact O-N 2.65Å; E220-L224 WeakPolarHBondContact O-CG 3.44Å; E220-L224 PolarHBondContact O-N 3.48Å |
| 221 | R | 97.8 | Very high | 97.6 | Very high | 133 Ų | 133 | 106.1 Ų | 106.1 | 50% | 0.502 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.1 | -44.6 | 174.4 | 177.4 | -149.1 | 62.9 | -159.2 | -7.5 | 111.5 | L217 R218 L224 R225 | L217-R221 VanDerWaalsContact O-CB 3.25Å; L217-R221 WeakPolarHBondContact O-CB 3.43Å; L217-R221 PolarHBondContact O-N 2.6Å; R218-R221 PolarHBondContact O-N 3.08Å; R221-L224 PolarHBondContact O-N 3.37Å; R221-R225 WeakPolarHBondContact O-CB 3.38Å; R221-R225 PolarHBondContact O-N 2.86Å |
| 222 | D | 97.4 | Very high | 97.6 | Very high | 60 Ų | 60 | 107.2 Ų | 107.2 | 32% | 0.321 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.8 | -42.5 | -179.9 | -67.3 | -20.5 | 0 | 0 | 0 | 111 | R218 V219 E220 L224 R225 D226 | R218-D222 WeakPolarHBondContact O-CB 3.48Å; R218-D222 PolarHBondContact O-N 3.5Å; V219-D222 PolarHBondContact O-N 2.93Å; E220-D222 VanDerWaalsContact C-N 3.33Å; E220-D222 PolarHBondContact O-N 2.89Å; D222-L224 VanDerWaalsContact C-N 3.35Å; D222-L224 PolarHBondContact O-N 2.91Å; D222-R225 WeakPolarHBondContact O-CB 3.45Å; D222-R225 PolarHBondContact O-N 3.47Å; D222-R225 VanDerWaalsContact O-N 3.1Å; D222-D226 PolarHBondContact O-N 2.91Å |
| 223 | G | 97.6 | Very high | 97.6 | Very high | 41 Ų | 41 | 106 Ų | 106 | 42% | 0.423 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.7 | -38.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | V219 E220 D226 R227 | V219-G223 PolarHBondContact O-N 3.47Å; E220-G223 PolarHBondContact O-N 2.65Å; G223-D226 PolarHBondContact O-N 3.41Å; G223-R227 PolarHBondContact O-N 2.87Å |
| 224 | L | 96.9 | Very high | 97.6 | Very high | 110 Ų | 110 | 107.3 Ų | 107.3 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.2 | -37.9 | 172.5 | -72.1 | 175.3 | 0 | 0 | 0 | 111.9 | E220 R221 D222 R227 L228 | E220-L224 WeakPolarHBondContact O-CG 3.44Å; E220-L224 PolarHBondContact O-N 3.48Å; R221-L224 PolarHBondContact O-N 3.37Å; D222-L224 VanDerWaalsContact C-N 3.35Å; D222-L224 PolarHBondContact O-N 2.91Å; L224-R227 PolarHBondContact O-N 2.95Å; L224-L228 WeakPolarHBondContact O-CG 3.34Å; L224-L228 PolarHBondContact O-N 3.39Å |
| 225 | R | 98 | Very high | 97.5 | Very high | 175 Ų | 175 | 109.2 Ų | 109.2 | 66% | 0.66 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.1 | -41.5 | 176.4 | -173.6 | -180 | -175.9 | 179.1 | 0.6 | 111.7 | R221 D222 L228 S229 | R221-R225 WeakPolarHBondContact O-CB 3.38Å; R221-R225 PolarHBondContact O-N 2.86Å; D222-R225 WeakPolarHBondContact O-CB 3.45Å; D222-R225 PolarHBondContact O-N 3.47Å; D222-R225 VanDerWaalsContact O-N 3.1Å; R225-L228 PolarHBondContact O-N 2.66Å; R225-S229 PolarHBondContact O-N 3.11Å |
| 226 | D | 97.4 | Very high | 97.5 | Very high | 93 Ų | 93 | 106.5 Ų | 106.5 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 175.1 | -67.3 | -20.8 | 0 | 0 | 0 | 110.9 | D222 G223 L228 S229 E230 | D222-D226 PolarHBondContact O-N 2.91Å; G223-D226 PolarHBondContact O-N 3.41Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 2.89Å; D226-S229 PolarHBondContact O-N 3.42Å; D226-S229 PolarHBondContact O-OG 2.74Å; D226-E230 WeakPolarHBondContact O-CG 3.5Å; D226-E230 PolarHBondContact O-N 3.31Å |
| 227 | R | 98 | Very high | 97.5 | Very high | 166 Ų | 166 | 104.8 Ų | 104.8 | 63% | 0.626 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63 | -38.8 | 173.9 | -171.5 | 171.5 | -176.8 | 172.9 | 0.9 | 112.8 | G223 L224 L231 | G223-R227 PolarHBondContact O-N 2.87Å; L224-R227 PolarHBondContact O-N 2.95Å; R227-L231 HydrophobicContact CG-CD1 4.48Å; R227-L231 WeakPolarHBondContact O-CB 3.23Å; R227-L231 VanDerWaalsContact O-CG 3.3Å; R227-L231 WeakPolarHBondContact O-CG 3.48Å; R227-L231 PolarHBondContact O-N 3.49Å |
| 228 | L | 97.3 | Very high | 97.4 | Very high | 116 Ų | 116 | 104.6 Ų | 104.6 | 61% | 0.607 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.7 | -40.3 | 174.6 | -77.2 | 171.2 | 0 | 0 | 0 | 111.6 | L224 R225 D226 L231 H232 | L224-L228 WeakPolarHBondContact O-CG 3.34Å; L224-L228 PolarHBondContact O-N 3.39Å; R225-L228 PolarHBondContact O-N 2.66Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 2.89Å; L228-L231 PolarHBondContact O-N 2.95Å; L228-H232 WeakPolarHBondContact O-CB 3.41Å; L228-H232 PolarHBondContact O-N 2.94Å |
| 229 | S | 96.9 | Very high | 97.3 | Very high | 61 Ų | 61 | 101.9 Ų | 101.9 | 43% | 0.427 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.6 | -41.2 | 176.9 | 72.2 | 0 | 0 | 0 | 0 | 111.5 | R225 D226 L231 H232 V233 | R225-S229 PolarHBondContact O-N 3.11Å; D226-S229 PolarHBondContact O-N 3.42Å; D226-S229 PolarHBondContact O-OG 2.74Å; S229-L231 PolarHBondContact O-N 3.4Å; S229-H232 WeakPolarHBondContact O-CB 3.43Å; S229-H232 PolarHBondContact O-N 3.38Å; S229-V233 WeakPolarHBondContact O-CG2 3.32Å; S229-V233 PolarHBondContact O-N 2.95Å |
| 230 | E | 97.4 | Very high | 97.2 | Very high | 107 Ų | 107 | 99.4 Ų | 99.4 | 50% | 0.5 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 171.8 | -74 | 179.3 | -168.1 | 0 | 0 | 112.4 | D226 H232 V233 K234 | D226-E230 WeakPolarHBondContact O-CG 3.5Å; D226-E230 PolarHBondContact O-N 3.31Å; E230-H232 VanDerWaalsContact C-N 3.32Å; E230-V233 PolarHBondContact O-N 3.14Å; E230-K234 VanDerWaalsContact O-CG 3.32Å; E230-K234 WeakPolarHBondContact O-CG 3.24Å; E230-K234 PolarHBondContact O-N 3.25Å |
| 231 | L | 97 | Very high | 97.1 | Very high | 93 Ų | 93 | 97.4 Ų | 97.4 | 49% | 0.487 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.5 | -36.8 | 176.4 | -74.1 | 174.6 | 0 | 0 | 0 | 111.8 | R227 L228 S229 K234 L235 | R227-L231 HydrophobicContact CG-CD1 4.48Å; R227-L231 WeakPolarHBondContact O-CB 3.23Å; R227-L231 VanDerWaalsContact O-CG 3.3Å; R227-L231 WeakPolarHBondContact O-CG 3.48Å; R227-L231 PolarHBondContact O-N 3.49Å; L228-L231 PolarHBondContact O-N 2.95Å; S229-L231 PolarHBondContact O-N 3.4Å; L231-K234 PolarHBondContact O-N 2.92Å; L231-L235 WeakPolarHBondContact O-CB 3.41Å; L231-L235 PolarHBondContact O-N 2.95Å |
| 232 | H | 97.7 | Very high | 96.9 | Very high | 120 Ų | 120 | 95.2 Ų | 95.2 | 56% | 0.556 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.1 | -43.5 | 175.2 | -172.8 | 61 | 0 | 0 | 0 | 111.6 | L228 S229 E230 L235 T236 | L228-H232 WeakPolarHBondContact O-CB 3.41Å; L228-H232 PolarHBondContact O-N 2.94Å; S229-H232 WeakPolarHBondContact O-CB 3.43Å; S229-H232 PolarHBondContact O-N 3.38Å; E230-H232 VanDerWaalsContact C-N 3.32Å; H232-L235 WeakPolarHBondContact O-CB 3.45Å; H232-L235 PolarHBondContact O-N 3.45Å; H232-T236 WeakPolarHBondContact O-CG2 3.45Å; H232-T236 PolarHBondContact O-N 3.39Å; H232-T236 PolarHBondContact O-OG1 3.36Å |
| 233 | V | 97.4 | Very high | 96.8 | Very high | 73 Ų | 73 | 98.7 Ų | 98.7 | 44% | 0.442 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.1 | -49 | 174.1 | 173.1 | 0 | 0 | 0 | 0 | 110.5 | S229 E230 L235 T236 E237 | S229-V233 WeakPolarHBondContact O-CG2 3.32Å; S229-V233 PolarHBondContact O-N 2.95Å; E230-V233 PolarHBondContact O-N 3.14Å; V233-L235 VanDerWaalsContact C-N 3.26Å; V233-L235 PolarHBondContact O-N 3.39Å; V233-T236 WeakPolarHBondContact CA-OG1 3.49Å; V233-T236 PolarHBondContact O-N 2.89Å; V233-T236 VanDerWaalsContact O-N 3.1Å; V233-T236 PolarHBondContact O-OG1 2.84Å; V233-E237 HydrophobicContact CG1-CG 4.4Å; V233-E237 WeakPolarHBondContact O-CG 3.32Å; V233-E237 PolarHBondContact O-N 2.93Å |
| 234 | K | 97.4 | Very high | 96.6 | Very high | 106 Ų | 106 | 103.5 Ų | 103.5 | 46% | 0.461 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.3 | -39.9 | 175.9 | -72.4 | 170.1 | -173.6 | 167.2 | 0 | 112.2 | E230 L231 E237 K238 | E230-K234 VanDerWaalsContact O-CG 3.32Å; E230-K234 WeakPolarHBondContact O-CG 3.24Å; E230-K234 PolarHBondContact O-N 3.25Å; L231-K234 PolarHBondContact O-N 2.92Å; K234-E237 PolarHBondContact O-N 3.35Å; K234-K238 WeakPolarHBondContact O-CG 3.27Å; K234-K238 PolarHBondContact O-N 2.9Å |
| 235 | L | 97.1 | Very high | 96.5 | Very high | 91 Ų | 91 | 104.2 Ų | 104.2 | 48% | 0.476 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.8 | -49.2 | 175.6 | -178.9 | 68.4 | 0 | 0 | 0 | 110.8 | L231 H232 V233 E237 K238 E239 | L231-L235 WeakPolarHBondContact O-CB 3.41Å; L231-L235 PolarHBondContact O-N 2.95Å; H232-L235 WeakPolarHBondContact O-CB 3.45Å; H232-L235 PolarHBondContact O-N 3.45Å; V233-L235 VanDerWaalsContact C-N 3.26Å; V233-L235 PolarHBondContact O-N 3.39Å; L235-E237 VanDerWaalsContact C-N 3.33Å; L235-E237 PolarHBondContact O-N 3.24Å; L235-K238 PolarHBondContact O-N 2.97Å; L235-K238 VanDerWaalsContact O-N 3.14Å; L235-E239 WeakPolarHBondContact O-CG 3.44Å; L235-E239 PolarHBondContact O-N 3.3Å |
| 236 | T | 97.4 | Very high | 96.3 | Very high | 59 Ų | 59 | 101.6 Ų | 101.6 | 36% | 0.362 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.1 | -35.1 | 179 | 57.6 | 0 | 0 | 0 | 0 | 113.1 | H232 V233 E239 A240 | H232-T236 WeakPolarHBondContact O-CG2 3.45Å; H232-T236 PolarHBondContact O-N 3.39Å; H232-T236 PolarHBondContact O-OG1 3.36Å; V233-T236 WeakPolarHBondContact CA-OG1 3.49Å; V233-T236 PolarHBondContact O-N 2.89Å; V233-T236 VanDerWaalsContact O-N 3.1Å; V233-T236 PolarHBondContact O-OG1 2.84Å; T236-E239 PolarHBondContact O-N 2.91Å; T236-A240 WeakPolarHBondContact O-CB 3.37Å; T236-A240 PolarHBondContact O-N 3.33Å |
| 237 | E | 96.6 | Very high | 96.1 | Very high | 105 Ų | 105 | 98.8 Ų | 98.8 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 172.4 | -72.2 | 172.3 | 172.7 | 0 | 0 | 111 | V233 K234 L235 A240 E241 | V233-E237 HydrophobicContact CG1-CG 4.4Å; V233-E237 WeakPolarHBondContact O-CG 3.32Å; V233-E237 PolarHBondContact O-N 2.93Å; K234-E237 PolarHBondContact O-N 3.35Å; L235-E237 VanDerWaalsContact C-N 3.33Å; L235-E237 PolarHBondContact O-N 3.24Å; E237-A240 PolarHBondContact O-N 3.43Å; E237-E241 WeakPolarHBondContact O-CG 3.39Å; E237-E241 PolarHBondContact O-N 2.99Å |
| 238 | K | 95.9 | Very high | 95.9 | Very high | 109 Ų | 109 | 94.1 Ų | 94.1 | 47% | 0.474 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.2 | -38.1 | 175.3 | -68.3 | -44.2 | -176.2 | -171 | 0 | 113 | K234 L235 A240 E241 I242 | K234-K238 WeakPolarHBondContact O-CG 3.27Å; K234-K238 PolarHBondContact O-N 2.9Å; L235-K238 PolarHBondContact O-N 2.97Å; L235-K238 VanDerWaalsContact O-N 3.14Å; K238-A240 VanDerWaalsContact C-N 3.35Å; K238-E241 WeakPolarHBondContact CD-OE2 3.35Å; K238-E241 IonicContact NZ-OE1 2.82Å; K238-E241 PolarHBondContact NZ-OE1 3.36Å; K238-E241 IonicContact NZ-OE2 2.66Å; K238-E241 PolarHBondContact NZ-OE2 2.95Å; K238-E241 PolarHBondContact O-N 3.25Å; K238-I242 WeakPolarHBondContact O-CB 3.44Å; K238-I242 WeakPolarHBondContact O-CD1 3.3Å; K238-I242 VanDerWaalsContact O-CG1 3.23Å; K238-I242 WeakPolarHBondContact O-CG1 3.32Å; K238-I242 PolarHBondContact O-N 2.91Å |
| 239 | E | 96.2 | Very high | 95.7 | Very high | 96 Ų | 96 | 91.4 Ų | 91.4 | 45% | 0.449 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.1 | -45.4 | 172 | -72.2 | 170.2 | 169.9 | 0 | 0 | 110.8 | L235 T236 I242 E243 | L235-E239 WeakPolarHBondContact O-CG 3.44Å; L235-E239 PolarHBondContact O-N 3.3Å; T236-E239 PolarHBondContact O-N 2.91Å; E239-I242 PolarHBondContact O-N 3.22Å; E239-E243 WeakPolarHBondContact O-CG 3.43Å; E239-E243 PolarHBondContact O-N 2.96Å |
| 240 | A | 95.3 | Very high | 95.6 | Very high | 52 Ų | 52 | 95 Ų | 95 | 43% | 0.43 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.2 | -39.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | T236 E237 K238 I242 E243 Q244 | T236-A240 WeakPolarHBondContact O-CB 3.37Å; T236-A240 PolarHBondContact O-N 3.33Å; E237-A240 PolarHBondContact O-N 3.43Å; K238-A240 VanDerWaalsContact C-N 3.35Å; A240-I242 VanDerWaalsContact C-N 3.34Å; A240-E243 PolarHBondContact O-N 2.98Å; A240-Q244 PolarHBondContact O-N 3.47Å |
| 241 | E | 96.2 | Very high | 95.4 | Very high | 80 Ų | 80 | 95.8 Ų | 95.8 | 37% | 0.374 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.7 | -46.1 | 171.9 | -76.3 | 175.2 | -162.8 | 0 | 0 | 110.7 | E237 K238 E243 Q244 E245 | E237-E241 WeakPolarHBondContact O-CG 3.39Å; E237-E241 PolarHBondContact O-N 2.99Å; K238-E241 WeakPolarHBondContact CD-OE2 3.35Å; K238-E241 IonicContact NZ-OE1 2.82Å; K238-E241 PolarHBondContact NZ-OE1 3.36Å; K238-E241 IonicContact NZ-OE2 2.66Å; K238-E241 PolarHBondContact NZ-OE2 2.95Å; K238-E241 PolarHBondContact O-N 3.25Å; E241-E243 PolarHBondContact O-N 3.47Å; E241-Q244 WeakPolarHBondContact O-CB 3.4Å; E241-Q244 PolarHBondContact O-N 3.33Å; E241-E245 WeakPolarHBondContact O-CG 3.36Å; E241-E245 PolarHBondContact O-N 3.28Å |
| 242 | I | 93.8 | Very high | 95.1 | Very high | 86 Ų | 86 | 96.3 Ų | 96.3 | 44% | 0.441 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 176.8 | -70.5 | 165.2 | 0 | 0 | 0 | 110.8 | K238 E239 A240 Q244 E245 Q246 | K238-I242 WeakPolarHBondContact O-CB 3.44Å; K238-I242 WeakPolarHBondContact O-CD1 3.3Å; K238-I242 VanDerWaalsContact O-CG1 3.23Å; K238-I242 WeakPolarHBondContact O-CG1 3.32Å; K238-I242 PolarHBondContact O-N 2.91Å; E239-I242 PolarHBondContact O-N 3.22Å; A240-I242 VanDerWaalsContact C-N 3.34Å; I242-Q244 VanDerWaalsContact C-N 3.34Å; I242-Q244 PolarHBondContact O-N 2.93Å; I242-E245 PolarHBondContact O-N 3.44Å; I242-Q246 HydrophobicContact CG2-CG 4.32Å; I242-Q246 VanDerWaalsContact CG2-NE2 3.28Å; I242-Q246 WeakPolarHBondContact O-CB 3.49Å; I242-Q246 WeakPolarHBondContact O-CG 3.44Å; I242-Q246 PolarHBondContact O-N 3.18Å |
| 243 | E | 95.1 | Very high | 94.8 | Very high | 134 Ų | 134 | 99 Ų | 99 | 63% | 0.626 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61 | -41.7 | 175.6 | -74.4 | -179.4 | 176.2 | 0 | 0 | 112.1 | E239 A240 E241 Q246 G247 | E239-E243 WeakPolarHBondContact O-CG 3.43Å; E239-E243 PolarHBondContact O-N 2.96Å; A240-E243 PolarHBondContact O-N 2.98Å; E241-E243 PolarHBondContact O-N 3.47Å; E243-Q246 WeakPolarHBondContact O-CB 3.45Å; E243-Q246 PolarHBondContact O-N 3.31Å; E243-G247 PolarHBondContact O-N 3.34Å |
| 244 | Q | 94.3 | Very high | 94.5 | Very high | 142 Ų | 142 | 98.5 Ų | 98.5 | 66% | 0.664 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63 | -48 | 174.9 | -176.9 | -176.9 | 1.5 | 0 | 0 | 111.3 | A240 E241 I242 Q246 G247 V248 | A240-Q244 PolarHBondContact O-N 3.47Å; E241-Q244 WeakPolarHBondContact O-CB 3.4Å; E241-Q244 PolarHBondContact O-N 3.33Å; I242-Q244 VanDerWaalsContact C-N 3.34Å; I242-Q244 PolarHBondContact O-N 2.93Å; Q244-Q246 VanDerWaalsContact C-N 3.3Å; Q244-Q246 PolarHBondContact O-N 2.92Å; Q244-G247 WeakPolarHBondContact O-CA 3.48Å; Q244-G247 PolarHBondContact O-N 2.88Å; Q244-G247 VanDerWaalsContact O-N 3.1Å; Q244-V248 WeakPolarHBondContact O-CG2 3.31Å; Q244-V248 PolarHBondContact O-N 2.86Å |
| 245 | E | 93.1 | Very high | 94.1 | Very high | 124 Ų | 124 | 98.2 Ų | 98.2 | 58% | 0.579 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -59.1 | -41.8 | 175.6 | -74.1 | -177.5 | 174 | 0 | 0 | 111.3 | E241 I242 G247 V248 V249 | E241-E245 WeakPolarHBondContact O-CG 3.36Å; E241-E245 PolarHBondContact O-N 3.28Å; I242-E245 PolarHBondContact O-N 3.44Å; E245-G247 VanDerWaalsContact C-N 3.32Å; E245-G247 PolarHBondContact O-N 3.38Å; E245-V248 PolarHBondContact O-N 3.37Å; E245-V249 WeakPolarHBondContact O-CB 3.48Å; E245-V249 VanDerWaalsContact O-CG2 3.24Å; E245-V249 WeakPolarHBondContact O-CG2 3.47Å; E245-V249 PolarHBondContact O-N 2.86Å |
| 246 | Q | 93.8 | Very high | 93.6 | Very high | 121 Ų | 121 | 97.8 Ų | 97.8 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.5 | -40.9 | 173.4 | -74.3 | 174.7 | 18.8 | 0 | 0 | 111.9 | I242 E243 Q244 V249 F250 | I242-Q246 HydrophobicContact CG2-CG 4.32Å; I242-Q246 VanDerWaalsContact CG2-NE2 3.28Å; I242-Q246 WeakPolarHBondContact O-CB 3.49Å; I242-Q246 WeakPolarHBondContact O-CG 3.44Å; I242-Q246 PolarHBondContact O-N 3.18Å; E243-Q246 WeakPolarHBondContact O-CB 3.45Å; E243-Q246 PolarHBondContact O-N 3.31Å; Q244-Q246 VanDerWaalsContact C-N 3.3Å; Q244-Q246 PolarHBondContact O-N 2.92Å; Q246-V249 PolarHBondContact O-N 3.42Å; Q246-F250 WeakPolarHBondContact O-CB 3.47Å; Q246-F250 PolarHBondContact O-N 3.45Å |
| 247 | G | 93.9 | Very high | 93.1 | Very high | 34 Ų | 34 | 103 Ų | 103 | 35% | 0.351 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -48.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | E243 Q244 E245 V249 F250 E251 | E243-G247 PolarHBondContact O-N 3.34Å; Q244-G247 WeakPolarHBondContact O-CA 3.48Å; Q244-G247 PolarHBondContact O-N 2.88Å; Q244-G247 VanDerWaalsContact O-N 3.1Å; E245-G247 VanDerWaalsContact C-N 3.32Å; E245-G247 PolarHBondContact O-N 3.38Å; G247-V249 VanDerWaalsContact C-N 3.34Å; G247-V249 PolarHBondContact O-N 2.89Å; G247-F250 WeakPolarHBondContact O-CB 3.43Å; G247-F250 PolarHBondContact O-N 2.68Å; G247-F250 VanDerWaalsContact O-N 3.11Å; G247-E251 PolarHBondContact O-N 3.09Å |
| 248 | V | 94.3 | Very high | 92.4 | Very high | 67 Ų | 67 | 99.9 Ų | 99.9 | 41% | 0.406 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 175.1 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | Q244 E245 F250 E251 L252 | Q244-V248 WeakPolarHBondContact O-CG2 3.31Å; Q244-V248 PolarHBondContact O-N 2.86Å; E245-V248 PolarHBondContact O-N 3.37Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 2.86Å; V248-E251 PolarHBondContact O-N 3.15Å; V248-L252 HydrophobicContact CG1-CD1 4.04Å; V248-L252 HydrophobicContact CG1-CG 4.32Å; V248-L252 WeakPolarHBondContact O-CB 3.39Å; V248-L252 WeakPolarHBondContact O-CG 3.4Å; V248-L252 PolarHBondContact O-N 2.96Å |
| 249 | V | 93.1 | Very high | 91.7 | Very high | 59 Ų | 59 | 99 Ų | 99 | 36% | 0.358 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -37.9 | 175.3 | 167.9 | 0 | 0 | 0 | 0 | 111 | E245 Q246 G247 L252 R253 | E245-V249 WeakPolarHBondContact O-CB 3.48Å; E245-V249 VanDerWaalsContact O-CG2 3.24Å; E245-V249 WeakPolarHBondContact O-CG2 3.47Å; E245-V249 PolarHBondContact O-N 2.86Å; Q246-V249 PolarHBondContact O-N 3.42Å; G247-V249 VanDerWaalsContact C-N 3.34Å; G247-V249 PolarHBondContact O-N 2.89Å; V249-L252 PolarHBondContact O-N 3.41Å; V249-R253 HydrophobicContact CG1-CG 4.22Å; V249-R253 VanDerWaalsContact O-CB 3.24Å; V249-R253 WeakPolarHBondContact O-CB 3.43Å; V249-R253 WeakPolarHBondContact O-CG 3.39Å; V249-R253 PolarHBondContact O-N 3.24Å |
| 250 | F | 93.8 | Very high | 90.8 | Very high | 138 Ų | 138 | 99.4 Ų | 99.4 | 61% | 0.605 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.5 | -43.8 | 174.8 | 179.9 | -93.2 | 0 | 0 | 0 | 112.1 | Q246 G247 V248 R253 T254 | Q246-F250 WeakPolarHBondContact O-CB 3.47Å; Q246-F250 PolarHBondContact O-N 3.45Å; G247-F250 WeakPolarHBondContact O-CB 3.43Å; G247-F250 PolarHBondContact O-N 2.68Å; G247-F250 VanDerWaalsContact O-N 3.11Å; V248-F250 VanDerWaalsContact C-N 3.29Å; V248-F250 PolarHBondContact O-N 2.86Å; F250-R253 PolarHBondContact O-N 2.91Å; F250-T254 HydrophobicContact CD1-CG2 4.2Å; F250-T254 HydrophobicContact CE1-CG2 3.77Å; F250-T254 HydrophobicContact CE2-CG2 4.23Å; F250-T254 HydrophobicContact CZ-CG2 3.79Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 WeakPolarHBondContact O-CG2 3.37Å; F250-T254 PolarHBondContact O-N 3.49Å; F250-T254 PolarHBondContact O-OG1 3.3Å |
| 251 | E | 93.6 | Very high | 89.9 | Confident | 122 Ų | 122 | 102.1 Ų | 102.1 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.6 | -46.7 | 172.9 | -69.9 | 179.8 | -177.8 | 0 | 0 | 111.6 | G247 V248 R253 T254 L255 | G247-E251 PolarHBondContact O-N 3.09Å; V248-E251 PolarHBondContact O-N 3.15Å; E251-R253 PolarHBondContact O-N 2.94Å; E251-T254 WeakPolarHBondContact CA-OG1 3.42Å; E251-T254 PolarHBondContact O-N 3.28Å; E251-T254 PolarHBondContact O-OG1 2.92Å; E251-L255 WeakPolarHBondContact O-CB 3.34Å; E251-L255 VanDerWaalsContact O-CG 3.32Å; E251-L255 WeakPolarHBondContact O-CG 3.33Å; E251-L255 PolarHBondContact O-N 2.91Å |
| 252 | L | 90.7 | Very high | 88.9 | Confident | 105 Ų | 105 | 104 Ų | 104 | 55% | 0.55 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.9 | -41 | 175.5 | -72.2 | 175.6 | 0 | 0 | 0 | 111.7 | V248 V249 N256 | V248-L252 HydrophobicContact CG1-CD1 4.04Å; V248-L252 HydrophobicContact CG1-CG 4.32Å; V248-L252 WeakPolarHBondContact O-CB 3.39Å; V248-L252 WeakPolarHBondContact O-CG 3.4Å; V248-L252 PolarHBondContact O-N 2.96Å; V249-L252 PolarHBondContact O-N 3.41Å; L252-N256 WeakPolarHBondContact O-CA 3.38Å; L252-N256 WeakPolarHBondContact O-CB 3.48Å; L252-N256 PolarHBondContact O-N 2.97Å |
| 253 | R | 92.9 | Very high | 87.5 | Confident | 175 Ų | 175 | 104.5 Ų | 104.5 | 66% | 0.66 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.2 | -38.2 | 175.9 | -79.2 | 176 | -175.2 | 172.1 | 5 | 112.1 | V249 F250 E251 R257 | V249-R253 HydrophobicContact CG1-CG 4.22Å; V249-R253 VanDerWaalsContact O-CB 3.24Å; V249-R253 WeakPolarHBondContact O-CB 3.43Å; V249-R253 WeakPolarHBondContact O-CG 3.39Å; V249-R253 PolarHBondContact O-N 3.24Å; F250-R253 PolarHBondContact O-N 2.91Å; E251-R253 PolarHBondContact O-N 2.94Å; R253-R257 VanDerWaalsContact O-CB 3.22Å; R253-R257 WeakPolarHBondContact O-CB 3.3Å; R253-R257 PolarHBondContact O-N 3.49Å |
| 254 | T | 89.7 | Confident | 85.9 | Confident | 63 Ų | 63 | 103.2 Ų | 103.2 | 39% | 0.387 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -72.8 | -41.6 | 177.7 | 48.5 | 0 | 0 | 0 | 0 | 111.4 | F250 E251 R257 S258 | F250-T254 HydrophobicContact CD1-CG2 4.2Å; F250-T254 HydrophobicContact CE1-CG2 3.77Å; F250-T254 HydrophobicContact CE2-CG2 4.23Å; F250-T254 HydrophobicContact CZ-CG2 3.79Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 WeakPolarHBondContact O-CG2 3.37Å; F250-T254 PolarHBondContact O-N 3.49Å; F250-T254 PolarHBondContact O-OG1 3.3Å; E251-T254 WeakPolarHBondContact CA-OG1 3.42Å; E251-T254 PolarHBondContact O-N 3.28Å; E251-T254 PolarHBondContact O-OG1 2.92Å; T254-R257 PolarHBondContact O-N 2.9Å; T254-S258 WeakPolarHBondContact O-CB 3.34Å; T254-S258 PolarHBondContact O-N 3.45Å |
| 255 | L | 89.8 | Confident | 84.2 | Confident | 101 Ų | 101 | 103.1 Ų | 103.1 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.1 | -47 | 170 | -74.2 | 173.6 | 0 | 0 | 0 | 111.2 | E251 R257 S258 L259 | E251-L255 WeakPolarHBondContact O-CB 3.34Å; E251-L255 VanDerWaalsContact O-CG 3.32Å; E251-L255 WeakPolarHBondContact O-CG 3.33Å; E251-L255 PolarHBondContact O-N 2.91Å; L255-R257 VanDerWaalsContact C-N 3.34Å; L255-R257 PolarHBondContact O-N 3.38Å; L255-S258 CarbonylContact O-C 3.54Å; L255-S258 WeakPolarHBondContact O-CA 3.43Å; L255-S258 WeakPolarHBondContact O-CB 3.38Å; L255-S258 PolarHBondContact O-N 2.93Å; L255-S258 VanDerWaalsContact O-N 3.09Å; L255-S258 PolarHBondContact O-OG 3.1Å; L255-L259 WeakPolarHBondContact O-CB 3.41Å; L255-L259 WeakPolarHBondContact O-CG 3.41Å; L255-L259 PolarHBondContact O-N 2.88Å |
| 256 | N | 85.5 | Confident | 82.3 | Confident | 81 Ų | 81 | 104.3 Ų | 104.3 | 43% | 0.433 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 175.7 | -166.6 | -63 | 0 | 0 | 0 | 110.4 | L252 S258 L259 Q260 | L252-N256 WeakPolarHBondContact O-CA 3.38Å; L252-N256 WeakPolarHBondContact O-CB 3.48Å; L252-N256 PolarHBondContact O-N 2.97Å; N256-S258 VanDerWaalsContact C-N 3.31Å; N256-S258 PolarHBondContact O-N 2.9Å; N256-L259 CarbonylContact O-C 3.52Å; N256-L259 PolarHBondContact O-N 3.33Å; N256-Q260 VanDerWaalsContact O-CB 3.25Å; N256-Q260 WeakPolarHBondContact O-CB 3.22Å; N256-Q260 VanDerWaalsContact O-CG 3.26Å; N256-Q260 WeakPolarHBondContact O-CG 3.3Å; N256-Q260 PolarHBondContact O-N 3.36Å; N256-Q260 WeakPolarHBondContact OD1-CG 3.42Å; N256-Q260 PolarHBondContact OD1-NE2 2.91Å; N256-Q260 VanDerWaalsContact OD1-NE2 3.08Å |
| 257 | R | 87.1 | Confident | 80.1 | Confident | 168 Ų | 168 | 100.3 Ų | 100.3 | 63% | 0.634 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.3 | -35.8 | 172.8 | -171.5 | 173.3 | -174.9 | 171.3 | 2.1 | 112.4 | R253 T254 L255 Q261 | R253-R257 VanDerWaalsContact O-CB 3.22Å; R253-R257 WeakPolarHBondContact O-CB 3.3Å; R253-R257 PolarHBondContact O-N 3.49Å; T254-R257 PolarHBondContact O-N 2.9Å; L255-R257 VanDerWaalsContact C-N 3.34Å; L255-R257 PolarHBondContact O-N 3.38Å; R257-Q261 WeakPolarHBondContact O-CB 3.25Å; R257-Q261 WeakPolarHBondContact O-CG 3.21Å; R257-Q261 PolarHBondContact O-N 3.21Å |
| 258 | S | 83 | Confident | 77.7 | Confident | 40 Ų | 40 | 107.5 Ų | 107.5 | 28% | 0.28 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71 | -36.2 | 175.1 | 82 | 0 | 0 | 0 | 0 | 112.1 | T254 L255 N256 Q261 K262 | T254-S258 WeakPolarHBondContact O-CB 3.34Å; T254-S258 PolarHBondContact O-N 3.45Å; L255-S258 CarbonylContact O-C 3.54Å; L255-S258 WeakPolarHBondContact O-CA 3.43Å; L255-S258 WeakPolarHBondContact O-CB 3.38Å; L255-S258 PolarHBondContact O-N 2.93Å; L255-S258 VanDerWaalsContact O-N 3.09Å; L255-S258 PolarHBondContact O-OG 3.1Å; N256-S258 VanDerWaalsContact C-N 3.31Å; N256-S258 PolarHBondContact O-N 2.9Å; S258-Q261 PolarHBondContact O-N 3.4Å; S258-K262 VanDerWaalsContact O-CG 3.3Å; S258-K262 WeakPolarHBondContact O-CG 3.34Å; S258-K262 PolarHBondContact O-N 2.89Å |
| 259 | L | 79.8 | Confident | 75.1 | Confident | 91 Ų | 91 | 112.4 Ų | 112.4 | 48% | 0.476 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -70 | -44.1 | 172.6 | -74.2 | 172.3 | 0 | 0 | 0 | 110.2 | L255 N256 Q261 K262 D263 | L255-L259 WeakPolarHBondContact O-CB 3.41Å; L255-L259 WeakPolarHBondContact O-CG 3.41Å; L255-L259 PolarHBondContact O-N 2.88Å; N256-L259 CarbonylContact O-C 3.52Å; N256-L259 PolarHBondContact O-N 3.33Å; L259-Q261 VanDerWaalsContact C-N 3.31Å; L259-Q261 PolarHBondContact O-N 2.84Å; L259-K262 HydrophobicContact CD2-CD 4.39Å; L259-K262 CarbonylContact O-C 3.45Å; L259-K262 WeakPolarHBondContact O-CA 3.41Å; L259-K262 VanDerWaalsContact O-CB 3.31Å; L259-K262 WeakPolarHBondContact O-CB 3.29Å; L259-K262 PolarHBondContact O-N 3.46Å; L259-D263 WeakPolarHBondContact O-CB 3.48Å; L259-D263 VanDerWaalsContact O-CG 3.27Å; L259-D263 PolarHBondContact O-N 3.43Å |
| 260 | Q | 78.7 | Confident | 72.6 | Confident | 104 Ų | 104 | 114.2 Ų | 114.2 | 49% | 0.486 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.7 | -35.3 | 170.9 | -77 | 177.1 | -13.4 | 0 | 0 | 111.7 | N256 D263 L264 | N256-Q260 VanDerWaalsContact O-CB 3.25Å; N256-Q260 WeakPolarHBondContact O-CB 3.22Å; N256-Q260 VanDerWaalsContact O-CG 3.26Å; N256-Q260 WeakPolarHBondContact O-CG 3.3Å; N256-Q260 PolarHBondContact O-N 3.36Å; N256-Q260 WeakPolarHBondContact OD1-CG 3.42Å; N256-Q260 PolarHBondContact OD1-NE2 2.91Å; N256-Q260 VanDerWaalsContact OD1-NE2 3.08Å; Q260-D263 CarbonylContact O-C 3.54Å; Q260-D263 PolarHBondContact O-N 3.49Å; Q260-L264 WeakPolarHBondContact O-CA 3.48Å; Q260-L264 WeakPolarHBondContact O-CB 3.42Å; Q260-L264 WeakPolarHBondContact O-CD1 3.23Å; Q260-L264 WeakPolarHBondContact O-CG 3.4Å; Q260-L264 PolarHBondContact O-N 3.45Å |
| 261 | Q | 75.9 | Confident | 69.9 | Low | 110 Ų | 110 | 116.5 Ų | 116.5 | 51% | 0.514 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.7 | -37.9 | 170.4 | -83.9 | -177.5 | -22.3 | 0 | 0 | 111.2 | R257 S258 L259 N265 | R257-Q261 WeakPolarHBondContact O-CB 3.25Å; R257-Q261 WeakPolarHBondContact O-CG 3.21Å; R257-Q261 PolarHBondContact O-N 3.21Å; S258-Q261 PolarHBondContact O-N 3.4Å; L259-Q261 VanDerWaalsContact C-N 3.31Å; L259-Q261 PolarHBondContact O-N 2.84Å; Q261-N265 VanDerWaalsContact O-CB 3.27Å; Q261-N265 WeakPolarHBondContact O-CB 3.32Å; Q261-N265 PolarHBondContact O-N 3.44Å; Q261-N265 PolarHBondContact O-ND2 2.88Å; Q261-N265 VanDerWaalsContact O-ND2 3.14Å; Q261-N265 PolarHBondContact O-OD1 3.38Å |
| 262 | K | 74.3 | Confident | 67.7 | Low | 120 Ų | 120 | 117.2 Ų | 117.2 | 52% | 0.522 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.6 | -37.8 | 170.5 | -71.5 | 168.5 | -178.6 | 173.9 | 0 | 111.6 | S258 L259 N265 L266 | S258-K262 VanDerWaalsContact O-CG 3.3Å; S258-K262 WeakPolarHBondContact O-CG 3.34Å; S258-K262 PolarHBondContact O-N 2.89Å; L259-K262 HydrophobicContact CD2-CD 4.39Å; L259-K262 CarbonylContact O-C 3.45Å; L259-K262 WeakPolarHBondContact O-CA 3.41Å; L259-K262 VanDerWaalsContact O-CB 3.31Å; L259-K262 WeakPolarHBondContact O-CB 3.29Å; L259-K262 PolarHBondContact O-N 3.46Å; K262-N265 CarbonylContact O-C 3.16Å; K262-N265 WeakPolarHBondContact O-CB 3.38Å; K262-N265 PolarHBondContact O-N 2.87Å; K262-L266 WeakPolarHBondContact O-CB 3.48Å; K262-L266 WeakPolarHBondContact O-CD1 3.37Å; K262-L266 WeakPolarHBondContact O-CG 3.33Å; K262-L266 PolarHBondContact O-N 3.02Å |
| 263 | D | 64.8 | Low | 65.3 | Low | 96 Ų | 96 | 118.4 Ų | 118.4 | 51% | 0.513 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -74.8 | -32.9 | 177.2 | -69.3 | -24 | 0 | 0 | 0 | 111 | L259 Q260 L266 G267 | L259-D263 WeakPolarHBondContact O-CB 3.48Å; L259-D263 VanDerWaalsContact O-CG 3.27Å; L259-D263 PolarHBondContact O-N 3.43Å; Q260-D263 CarbonylContact O-C 3.54Å; Q260-D263 PolarHBondContact O-N 3.49Å; D263-L266 CarbonylContact O-C 3.37Å; D263-L266 WeakPolarHBondContact O-CA 3.5Å; D263-L266 PolarHBondContact O-N 2.95Å; D263-L266 VanDerWaalsContact O-N 3.13Å; D263-G267 CarbonylContact O-C 3.48Å; D263-G267 WeakPolarHBondContact O-CA 3.32Å; D263-G267 PolarHBondContact O-N 3.22Å |
| 264 | L | 61.2 | Low | 62.3 | Low | 106 Ų | 106 | 115.7 Ų | 115.7 | 56% | 0.555 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -70 | -39.6 | 169.9 | -76.7 | 165.5 | 0 | 0 | 0 | 110 | Q260 L266 G267 E268 | Q260-L264 WeakPolarHBondContact O-CA 3.48Å; Q260-L264 WeakPolarHBondContact O-CB 3.42Å; Q260-L264 WeakPolarHBondContact O-CD1 3.23Å; Q260-L264 WeakPolarHBondContact O-CG 3.4Å; Q260-L264 PolarHBondContact O-N 3.45Å; L264-L266 PolarHBondContact O-N 3.29Å; L264-G267 PolarHBondContact O-N 3.42Å; L264-E268 WeakPolarHBondContact O-CG 3.38Å; L264-E268 PolarHBondContact O-N 2.95Å |
| 265 | N | 58.4 | Low | 60 | Low | 140 Ų | 140 | 118.8 Ų | 118.8 | 75% | 0.749 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.7 | -18.7 | 168.7 | -66.1 | -21.5 | 0 | 0 | 0 | 112.5 | Q261 K262 | Q261-N265 VanDerWaalsContact O-CB 3.27Å; Q261-N265 WeakPolarHBondContact O-CB 3.32Å; Q261-N265 PolarHBondContact O-N 3.44Å; Q261-N265 PolarHBondContact O-ND2 2.88Å; Q261-N265 VanDerWaalsContact O-ND2 3.14Å; Q261-N265 PolarHBondContact O-OD1 3.38Å; K262-N265 CarbonylContact O-C 3.16Å; K262-N265 WeakPolarHBondContact O-CB 3.38Å; K262-N265 PolarHBondContact O-N 2.87Å |
| 266 | L | 53.5 | Low | 57.3 | Low | 150 Ų | 150 | 122.1 Ų | 122.1 | 79% | 0.785 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.8 | 4.7 | 179.6 | -69 | 168.9 | 0 | 0 | 0 | 113 | K262 D263 L264 | K262-L266 WeakPolarHBondContact O-CB 3.48Å; K262-L266 WeakPolarHBondContact O-CD1 3.37Å; K262-L266 WeakPolarHBondContact O-CG 3.33Å; K262-L266 PolarHBondContact O-N 3.02Å; D263-L266 CarbonylContact O-C 3.37Å; D263-L266 WeakPolarHBondContact O-CA 3.5Å; D263-L266 PolarHBondContact O-N 2.95Å; D263-L266 VanDerWaalsContact O-N 3.13Å; L264-L266 PolarHBondContact O-N 3.29Å |
| 267 | G | 48.2 | Very low | 55 | Low | 37 Ų | 37 | 123.5 Ų | 123.5 | 38% | 0.381 | 65% | 0.645 | S | S | . | * | trans | -174.5 | 48.6 | -155.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D263 L264 E269 | D263-G267 CarbonylContact O-C 3.48Å; D263-G267 WeakPolarHBondContact O-CA 3.32Å; D263-G267 PolarHBondContact O-N 3.22Å; L264-G267 PolarHBondContact O-N 3.42Å; G267-E269 PolarHBondContact O-N 2.87Å | ||
| 268 | E | 44.4 | Very low | 53.3 | Low | 184 Ų | 184 | 124.4 Ų | 124.4 | 86% | 0.86 | 66% | 0.656 | S | S | * | * | trans | -61.5 | 42.1 | 153.2 | -64.9 | -171.9 | 143.4 | 0 | 0 | 112.1 | L264 | L264-E268 WeakPolarHBondContact O-CG 3.38Å; L264-E268 PolarHBondContact O-N 2.95Å | ||
| 269 | E | 39.4 | Very low | 51.7 | Low | 170 Ų | 170 | 128 Ų | 128 | 79% | 0.794 | 68% | 0.678 | S | S | * | * | trans | -140.2 | 115.1 | 174 | -69.1 | -159.3 | 171.4 | 0 | 0 | 111.2 | G267 | G267-E269 PolarHBondContact O-N 2.87Š| ||
| 270 | S | 41 | Very low | 50.3 | Low | 98 Ų | 98 | 131.8 Ų | 131.8 | 69% | 0.685 | 70% | 0.698 | S | S | * | * | trans | 103.2 | 92.5 | 153.3 | -39.7 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 271 | F | 35.7 | Very low | 49.3 | Very low | 186 Ų | 186 | 131.7 Ų | 131.7 | 82% | 0.816 | 71% | 0.709 | S | S | * | * | 64 | 101.6 | 81.3 | -69.7 | -69.8 | 0 | 0 | 0 | 112.4 | |||||
| 272 | L | 48.3 | Very low | 48.7 | Very low | 137 Ų | 137 | 132.3 Ų | 132.3 | 72% | 0.717 | 72% | 0.715 | S | S | * | * | 91.2 | 139.3 | 83 | -86.4 | -170.9 | 0 | 0 | 0 | 114.8 | |||||
| 273 | D | 39 | Very low | 48.5 | Very low | 130 Ų | 130 | 132.5 Ų | 132.5 | 70% | 0.695 | 72% | 0.721 | S | S | * | * | trans | 75.3 | 128.6 | 144.8 | -81.9 | -16.6 | 0 | 0 | 0 | 121.7 | ||||
| 274 | S | 30.2 | Very low | 48.4 | Very low | 117 Ų | 117 | 132 Ų | 132 | 82% | 0.818 | 73% | 0.726 | S | S | * | * | 176.7 | 146.7 | 84.2 | 45.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 275 | T | 42.3 | Very low | 48.7 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 79% | 0.791 | 73% | 0.725 | S | S | * | * | trans | -97.9 | 141.8 | 178.5 | 44.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 276 | H | 33 | Very low | 49.4 | Very low | 171 Ų | 171 | 129.5 Ų | 129.5 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | trans | -171.9 | 120.2 | 146.3 | -139 | 44.9 | 0 | 0 | 0 | 116.1 | ||||
| 277 | T | 36.2 | Very low | 50.4 | Low | 110 Ų | 110 | 128.3 Ų | 128.3 | 68% | 0.675 | 70% | 0.699 | S | S | * | * | trans | 44.1 | 129.2 | 138.7 | 60.8 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 278 | Q | 51 | Low | 51.5 | Low | 186 Ų | 186 | 133.2 Ų | 133.2 | 87% | 0.869 | 71% | 0.711 | S | S | * | * | trans | -63.3 | 164.7 | 163.3 | -82.5 | 175.9 | -18.3 | 0 | 0 | 114.9 | ||||
| 279 | P | 51.3 | Low | 53 | Low | 115 Ų | 115 | 127.9 Ų | 127.9 | 75% | 0.747 | 69% | 0.692 | S | S | * | * | -158.1 | 162.1 | 69.8 | 38.3 | -13.8 | 0 | 0 | 0 | 121.3 | |||||
| 280 | L | 49 | Very low | 54.9 | Low | 172 Ų | 172 | 125.4 Ų | 125.4 | 90% | 0.901 | 68% | 0.68 | S | S | * | * | trans | 36.8 | 95.7 | 146.9 | -60.4 | 165.5 | 0 | 0 | 0 | 121.2 | ||||
| 281 | S | 59 | Low | 56.7 | Low | 101 Ų | 101 | 123.4 Ų | 123.4 | 71% | 0.706 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -156.1 | -6.8 | 158.3 | -166.2 | 0 | 0 | 0 | 0 | 117 | ||
| 282 | L | 62.6 | Low | 58.7 | Low | 123 Ų | 123 | 118.1 Ų | 118.1 | 64% | 0.644 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -103.6 | -28 | -173.8 | -96.8 | 154 | 0 | 0 | 0 | 115.1 | E285 I286 | L282-E285 PolarHBondContact O-N 3.45Å; L282-I286 VanDerWaalsContact O-CG1 3.31Å; L282-I286 WeakPolarHBondContact O-CG1 3.36Å; L282-I286 PolarHBondContact O-N 3.25Å; L282-I286 VanDerWaalsContact O-N 3.13Å |
| 283 | L | 69.2 | Low | 60.4 | Low | 124 Ų | 124 | 118 Ų | 118 | 65% | 0.649 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -71 | -36.9 | -173 | -158.5 | 90.2 | 0 | 0 | 0 | 112.8 | E285 Q287 | L283-E285 VanDerWaalsContact C-N 3.3Å; L283-Q287 WeakPolarHBondContact O-CG 3.25Å; L283-Q287 PolarHBondContact O-N 3.46Å |
| 284 | S | 64.3 | Low | 62.3 | Low | 87 Ų | 87 | 114.1 Ų | 114.1 | 61% | 0.608 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67.3 | -33.2 | 175.5 | -179 | 0 | 0 | 0 | 0 | 111.9 | Q288 | S284-Q288 PolarHBondContact O-N 3.33Å |
| 285 | E | 67.8 | Low | 64.8 | Low | 115 Ų | 115 | 114.3 Ų | 114.3 | 54% | 0.537 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -72.6 | -42.6 | -179 | -159.8 | 169.2 | -161.9 | 0 | 0 | 110.3 | L282 L283 Q287 Q288 T289 | L282-E285 PolarHBondContact O-N 3.45Å; L283-E285 VanDerWaalsContact C-N 3.3Å; E285-Q287 PolarHBondContact O-N 3.5Å; E285-Q288 PolarHBondContact O-N 2.9Å; E285-T289 PolarHBondContact O-N 2.91Å; E285-T289 PolarHBondContact O-OG1 3.45Å; E285-T289 VanDerWaalsContact O-OG1 3.13Å |
| 286 | I | 72.1 | Confident | 66.9 | Low | 77 Ų | 77 | 114.1 Ų | 114.1 | 40% | 0.395 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -62.4 | -39.7 | 176.5 | -66.9 | 165.4 | 0 | 0 | 0 | 112 | L282 T289 Q290 | L282-I286 VanDerWaalsContact O-CG1 3.31Å; L282-I286 WeakPolarHBondContact O-CG1 3.36Å; L282-I286 PolarHBondContact O-N 3.25Å; L282-I286 VanDerWaalsContact O-N 3.13Å; I286-T289 WeakPolarHBondContact CA-OG1 3.49Å; I286-T289 PolarHBondContact O-OG1 2.96Å; I286-Q290 WeakPolarHBondContact O-CB 3.42Å; I286-Q290 VanDerWaalsContact O-CG 3.26Å; I286-Q290 WeakPolarHBondContact O-CG 3.46Å; I286-Q290 PolarHBondContact O-N 3.18Å; I286-Q290 VanDerWaalsContact O-N 3.09Å |
| 287 | Q | 75.3 | Confident | 69.4 | Low | 126 Ų | 126 | 108.9 Ų | 108.9 | 59% | 0.589 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.5 | -35.8 | 178 | -73.6 | 179.6 | -15.8 | 0 | 0 | 112.3 | L283 E285 A291 | L283-Q287 WeakPolarHBondContact O-CG 3.25Å; L283-Q287 PolarHBondContact O-N 3.46Å; E285-Q287 PolarHBondContact O-N 3.5Å; Q287-A291 PolarHBondContact O-N 3.49Å |
| 288 | Q | 71.2 | Confident | 71.7 | Confident | 139 Ų | 139 | 109.9 Ų | 109.9 | 65% | 0.65 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.3 | -38.7 | 178.6 | -155.5 | 169.9 | 26.6 | 0 | 0 | 111.5 | S284 E285 A291 T292 | S284-Q288 PolarHBondContact O-N 3.33Å; E285-Q288 PolarHBondContact O-N 2.9Å; Q288-A291 PolarHBondContact O-N 3.47Å; Q288-T292 PolarHBondContact O-N 3.09Å; Q288-T292 VanDerWaalsContact O-N 3.13Å; Q288-T292 PolarHBondContact O-OG1 2.98Å |
| 289 | T | 75.2 | Confident | 73.4 | Confident | 73 Ų | 73 | 103.7 Ų | 103.7 | 45% | 0.448 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66 | -39.4 | 175.2 | 49.1 | 0 | 0 | 0 | 0 | 112.8 | E285 I286 A291 T292 E293 | E285-T289 PolarHBondContact O-N 2.91Å; E285-T289 PolarHBondContact O-OG1 3.45Å; E285-T289 VanDerWaalsContact O-OG1 3.13Å; I286-T289 WeakPolarHBondContact CA-OG1 3.49Å; I286-T289 PolarHBondContact O-OG1 2.96Å; T289-A291 VanDerWaalsContact C-N 3.35Å; T289-A291 PolarHBondContact O-N 3.46Å; T289-T292 WeakPolarHBondContact CA-OG1 3.29Å; T289-T292 PolarHBondContact O-N 3.2Å; T289-T292 PolarHBondContact O-OG1 2.9Å; T289-E293 WeakPolarHBondContact O-CB 3.4Å; T289-E293 PolarHBondContact O-N 2.89Å |
| 290 | Q | 80.3 | Confident | 75.2 | Confident | 118 Ų | 118 | 101.7 Ų | 101.7 | 55% | 0.551 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.4 | -37.1 | 177 | -74.8 | 174.6 | -0.8 | 0 | 0 | 112.2 | I286 E293 A294 | I286-Q290 WeakPolarHBondContact O-CB 3.42Å; I286-Q290 VanDerWaalsContact O-CG 3.26Å; I286-Q290 WeakPolarHBondContact O-CG 3.46Å; I286-Q290 PolarHBondContact O-N 3.18Å; I286-Q290 VanDerWaalsContact O-N 3.09Å; Q290-E293 PolarHBondContact O-N 3.44Å; Q290-A294 WeakPolarHBondContact O-CB 3.41Å; Q290-A294 PolarHBondContact O-N 3.41Å |
| 291 | A | 77.3 | Confident | 77.1 | Confident | 55 Ų | 55 | 96.1 Ų | 96.1 | 46% | 0.455 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -67.6 | -40 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q287 Q288 T289 L295 | Q287-A291 PolarHBondContact O-N 3.49Å; Q288-A291 PolarHBondContact O-N 3.47Å; T289-A291 VanDerWaalsContact C-N 3.35Å; T289-A291 PolarHBondContact O-N 3.46Å; A291-L295 WeakPolarHBondContact O-CG 3.5Å; A291-L295 PolarHBondContact O-N 2.87Å |
| 292 | T | 78.6 | Confident | 78.4 | Confident | 75 Ų | 75 | 96.8 Ų | 96.8 | 46% | 0.46 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.2 | -37 | 175.6 | 50.9 | 0 | 0 | 0 | 0 | 112.6 | Q288 T289 L295 L296 | Q288-T292 PolarHBondContact O-N 3.09Å; Q288-T292 VanDerWaalsContact O-N 3.13Å; Q288-T292 PolarHBondContact O-OG1 2.98Å; T289-T292 WeakPolarHBondContact CA-OG1 3.29Å; T289-T292 PolarHBondContact O-N 3.2Å; T289-T292 PolarHBondContact O-OG1 2.9Å; T292-L295 PolarHBondContact O-N 2.89Å; T292-L296 WeakPolarHBondContact O-CG 3.35Å; T292-L296 PolarHBondContact O-N 3.48Å |
| 293 | E | 82.6 | Confident | 79.7 | Confident | 135 Ų | 135 | 96.4 Ų | 96.4 | 63% | 0.631 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68 | -40.8 | 178 | -169.2 | 172.6 | -167.2 | 0 | 0 | 111.7 | T289 Q290 L295 L296 A297 | T289-E293 WeakPolarHBondContact O-CB 3.4Å; T289-E293 PolarHBondContact O-N 2.89Å; Q290-E293 PolarHBondContact O-N 3.44Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.28Å; E293-L296 PolarHBondContact O-N 3.19Å; E293-A297 WeakPolarHBondContact O-CB 3.5Å; E293-A297 PolarHBondContact O-N 3.44Å |
| 294 | A | 80.4 | Confident | 80.7 | Confident | 49 Ų | 49 | 93 Ų | 93 | 41% | 0.405 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -39.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q290 A297 H298 | Q290-A294 WeakPolarHBondContact O-CB 3.41Å; Q290-A294 PolarHBondContact O-N 3.41Å; A294-A297 PolarHBondContact O-N 3.31Å; A294-H298 WeakPolarHBondContact O-CB 3.35Å; A294-H298 PolarHBondContact O-CD2 3.15Å; A294-H298 PolarHBondContact O-N 2.79Å |
| 295 | L | 82.3 | Confident | 81.9 | Confident | 121 Ų | 121 | 94.3 Ų | 94.3 | 63% | 0.634 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67 | -39.5 | 176.2 | -73.8 | 172.7 | 0 | 0 | 0 | 112.4 | A291 T292 E293 H298 S299 | A291-L295 WeakPolarHBondContact O-CG 3.5Å; A291-L295 PolarHBondContact O-N 2.87Å; T292-L295 PolarHBondContact O-N 2.89Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.28Å; L295-H298 PolarHBondContact O-N 2.88Å; L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 2.74Å |
| 296 | L | 87.1 | Confident | 82.9 | Confident | 125 Ų | 125 | 93.3 Ų | 93.3 | 65% | 0.654 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.5 | -39.9 | 175.7 | -70.4 | 172.9 | 0 | 0 | 0 | 111.8 | T292 E293 S299 S300 | T292-L296 WeakPolarHBondContact O-CG 3.35Å; T292-L296 PolarHBondContact O-N 3.48Å; E293-L296 PolarHBondContact O-N 3.19Å; L296-S299 PolarHBondContact O-N 2.86Å; L296-S300 WeakPolarHBondContact O-CB 3.38Å; L296-S300 PolarHBondContact O-N 3.19Å |
| 297 | A | 83.7 | Confident | 83.9 | Confident | 61 Ų | 61 | 95.8 Ų | 95.8 | 50% | 0.504 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E293 A294 S300 A301 | E293-A297 WeakPolarHBondContact O-CB 3.5Å; E293-A297 PolarHBondContact O-N 3.44Å; A294-A297 PolarHBondContact O-N 3.31Å; A297-S300 PolarHBondContact O-N 2.86Å; A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 2.84Å |
| 298 | H | 84.6 | Confident | 84.7 | Confident | 130 Ų | 130 | 94.4 Ų | 94.4 | 60% | 0.602 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.4 | -39.1 | 174.5 | -83.5 | -62.3 | 0 | 0 | 0 | 112.8 | A294 L295 S300 A301 L302 | A294-H298 WeakPolarHBondContact O-CB 3.35Å; A294-H298 PolarHBondContact O-CD2 3.15Å; A294-H298 PolarHBondContact O-N 2.79Å; L295-H298 PolarHBondContact O-N 2.88Å; H298-S300 VanDerWaalsContact C-N 3.35Å; H298-A301 PolarHBondContact O-N 3.41Å; H298-L302 WeakPolarHBondContact O-CB 3.37Å; H298-L302 WeakPolarHBondContact O-CG 3.22Å; H298-L302 PolarHBondContact O-N 3.45Å |
| 299 | S | 87.9 | Confident | 85.6 | Confident | 57 Ų | 57 | 91.7 Ų | 91.7 | 40% | 0.399 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 175.1 | -174.1 | 0 | 0 | 0 | 0 | 111.9 | L295 L296 L302 Q303 | L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 2.74Å; L296-S299 PolarHBondContact O-N 2.86Å; S299-L302 PolarHBondContact O-N 3.43Å; S299-Q303 WeakPolarHBondContact O-CG 3.46Å; S299-Q303 PolarHBondContact O-N 2.87Å |
| 300 | S | 89.2 | Confident | 86.4 | Confident | 73 Ų | 73 | 94 Ų | 94 | 51% | 0.51 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.9 | -40.4 | 177 | 177.2 | 0 | 0 | 0 | 0 | 111.9 | L296 A297 H298 L302 Q303 A304 | L296-S300 WeakPolarHBondContact O-CB 3.38Å; L296-S300 PolarHBondContact O-N 3.19Å; A297-S300 PolarHBondContact O-N 2.86Å; H298-S300 VanDerWaalsContact C-N 3.35Å; S300-L302 VanDerWaalsContact C-N 3.34Å; S300-L302 PolarHBondContact O-N 3.34Å; S300-Q303 PolarHBondContact O-N 3.32Å; S300-A304 PolarHBondContact O-N 2.9Å |
| 301 | A | 87.7 | Confident | 87 | Confident | 55 Ų | 55 | 91.2 Ų | 91.2 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.9 | -36.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A297 H298 K305 | A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 2.84Å; H298-A301 PolarHBondContact O-N 3.41Å; A301-K305 VanDerWaalsContact O-CG 3.31Å; A301-K305 WeakPolarHBondContact O-CG 3.2Å; A301-K305 PolarHBondContact O-N 3.38Å; A301-K305 VanDerWaalsContact O-N 3.13Å |
| 302 | L | 87.1 | Confident | 87.7 | Confident | 114 Ų | 114 | 93.4 Ų | 93.4 | 60% | 0.597 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.9 | -42.7 | 174.4 | -78.8 | 166 | 0 | 0 | 0 | 111.7 | H298 S299 S300 A304 K305 D306 | H298-L302 WeakPolarHBondContact O-CB 3.37Å; H298-L302 WeakPolarHBondContact O-CG 3.22Å; H298-L302 PolarHBondContact O-N 3.45Å; S299-L302 PolarHBondContact O-N 3.43Å; S300-L302 VanDerWaalsContact C-N 3.34Å; S300-L302 PolarHBondContact O-N 3.34Å; L302-A304 PolarHBondContact O-N 3.31Å; L302-K305 PolarHBondContact O-N 3.33Å; L302-K305 VanDerWaalsContact O-N 3.16Å; L302-D306 PolarHBondContact O-N 3.29Å |
| 303 | Q | 90.7 | Very high | 88.4 | Confident | 115 Ų | 115 | 95.9 Ų | 95.9 | 54% | 0.537 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 175.2 | -76 | 175.1 | -17.5 | 0 | 0 | 112.3 | S299 S300 K305 D306 E307 | S299-Q303 WeakPolarHBondContact O-CG 3.46Å; S299-Q303 PolarHBondContact O-N 2.87Å; S300-Q303 PolarHBondContact O-N 3.32Å; Q303-K305 VanDerWaalsContact C-N 3.26Å; Q303-K305 PolarHBondContact O-N 2.86Å; Q303-D306 PolarHBondContact O-N 2.93Å; Q303-E307 WeakPolarHBondContact O-CG 3.45Å; Q303-E307 PolarHBondContact O-N 2.87Å |
| 304 | A | 89.8 | Confident | 88.8 | Confident | 52 Ų | 52 | 94.3 Ų | 94.3 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.6 | -34.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | S300 L302 E308 | S300-A304 PolarHBondContact O-N 2.9Å; L302-A304 PolarHBondContact O-N 3.31Å; A304-E308 PolarHBondContact O-N 2.78Å |
| 305 | K | 88.6 | Confident | 89.5 | Confident | 116 Ų | 116 | 97 Ų | 97 | 50% | 0.504 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -71.4 | -37.4 | 175.4 | -71.9 | -73.1 | 160.6 | -160 | 0 | 112.4 | A301 L302 Q303 E307 E308 I309 | A301-K305 VanDerWaalsContact O-CG 3.31Å; A301-K305 WeakPolarHBondContact O-CG 3.2Å; A301-K305 PolarHBondContact O-N 3.38Å; A301-K305 VanDerWaalsContact O-N 3.13Å; L302-K305 PolarHBondContact O-N 3.33Å; L302-K305 VanDerWaalsContact O-N 3.16Å; Q303-K305 VanDerWaalsContact C-N 3.26Å; Q303-K305 PolarHBondContact O-N 2.86Å; K305-E307 VanDerWaalsContact C-N 3.35Å; K305-E308 IonicContact NZ-OE2 3.08Å; K305-E308 PolarHBondContact NZ-OE2 3.37Å; K305-E308 PolarHBondContact O-N 3.24Å; K305-I309 WeakPolarHBondContact O-CB 3.32Å; K305-I309 WeakPolarHBondContact O-CD1 3.45Å; K305-I309 WeakPolarHBondContact O-CG1 3.09Å; K305-I309 PolarHBondContact O-N 3.35Å |
| 306 | D | 90.1 | Very high | 89.9 | Confident | 93 Ų | 93 | 95.8 Ų | 95.8 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66 | -37.8 | 174.7 | -74.9 | -33.2 | 0 | 0 | 0 | 111.9 | L302 Q303 I309 Q310 | L302-D306 PolarHBondContact O-N 3.29Å; Q303-D306 PolarHBondContact O-N 2.93Å; D306-I309 PolarHBondContact O-N 3.45Å; D306-Q310 WeakPolarHBondContact O-CG 3.45Å; D306-Q310 PolarHBondContact O-N 2.99Å |
| 307 | E | 92.4 | Very high | 90.2 | Very high | 129 Ų | 129 | 94.5 Ų | 94.5 | 60% | 0.603 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.8 | -43.3 | 173.4 | -71.2 | 172.8 | -174.8 | 0 | 0 | 112.1 | Q303 K305 I309 Q310 A311 | Q303-E307 WeakPolarHBondContact O-CG 3.45Å; Q303-E307 PolarHBondContact O-N 2.87Å; K305-E307 VanDerWaalsContact C-N 3.35Å; E307-I309 VanDerWaalsContact C-N 3.35Å; E307-I309 PolarHBondContact O-N 2.89Å; E307-Q310 PolarHBondContact O-N 3.35Å; E307-A311 PolarHBondContact O-N 3.27Å |
| 308 | E | 91.9 | Very high | 90.5 | Very high | 97 Ų | 97 | 94 Ų | 94 | 45% | 0.453 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 175 | -171.4 | 179.9 | -173.4 | 0 | 0 | 111.5 | A304 K305 Q310 A311 L312 | A304-E308 PolarHBondContact O-N 2.78Å; K305-E308 IonicContact NZ-OE2 3.08Å; K305-E308 PolarHBondContact NZ-OE2 3.37Å; K305-E308 PolarHBondContact O-N 3.24Å; E308-Q310 VanDerWaalsContact C-N 3.33Å; E308-Q310 PolarHBondContact O-N 2.86Å; E308-A311 PolarHBondContact O-N 2.85Å; E308-L312 WeakPolarHBondContact O-CG 3.4Å; E308-L312 PolarHBondContact O-N 2.91Å |
| 309 | I | 90.8 | Very high | 90.9 | Very high | 82 Ų | 82 | 92.7 Ų | 92.7 | 42% | 0.421 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.7 | -37.2 | 175.5 | -70.8 | 165.6 | 0 | 0 | 0 | 111.3 | K305 D306 E307 K313 | K305-I309 WeakPolarHBondContact O-CB 3.32Å; K305-I309 WeakPolarHBondContact O-CD1 3.45Å; K305-I309 WeakPolarHBondContact O-CG1 3.09Å; K305-I309 PolarHBondContact O-N 3.35Å; D306-I309 PolarHBondContact O-N 3.45Å; E307-I309 VanDerWaalsContact C-N 3.35Å; E307-I309 PolarHBondContact O-N 2.89Å; I309-K313 HydrophobicContact CG2-CD 4.29Å; I309-K313 VanDerWaalsContact O-CG 3.29Å; I309-K313 WeakPolarHBondContact O-CG 3.43Å; I309-K313 PolarHBondContact O-N 2.89Å; I309-K313 VanDerWaalsContact O-N 3.14Å |
| 310 | Q | 92.2 | Very high | 91 | Very high | 123 Ų | 123 | 94.8 Ų | 94.8 | 58% | 0.575 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.7 | -45.9 | 175.3 | -76 | 177.8 | 2.2 | 0 | 0 | 111.4 | D306 E307 E308 L312 K313 D314 | D306-Q310 WeakPolarHBondContact O-CG 3.45Å; D306-Q310 PolarHBondContact O-N 2.99Å; E307-Q310 PolarHBondContact O-N 3.35Å; E308-Q310 VanDerWaalsContact C-N 3.33Å; E308-Q310 PolarHBondContact O-N 2.86Å; Q310-L312 VanDerWaalsContact C-N 3.35Å; Q310-L312 PolarHBondContact O-N 3.33Å; Q310-K313 WeakPolarHBondContact O-CB 3.29Å; Q310-K313 PolarHBondContact O-N 3.06Å; Q310-K313 VanDerWaalsContact O-N 3.11Å; Q310-D314 PolarHBondContact O-N 3.47Å |
| 311 | A | 92.4 | Very high | 91.1 | Very high | 59 Ų | 59 | 97.9 Ų | 97.9 | 49% | 0.488 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.7 | -44.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | E307 E308 K313 D314 E315 | E307-A311 PolarHBondContact O-N 3.27Å; E308-A311 PolarHBondContact O-N 2.85Å; A311-K313 VanDerWaalsContact C-N 3.32Å; A311-K313 PolarHBondContact O-N 3.44Å; A311-D314 PolarHBondContact O-N 3.21Å; A311-E315 PolarHBondContact O-N 3.21Å |
| 312 | L | 92.1 | Very high | 91.4 | Very high | 100 Ų | 100 | 101 Ų | 101 | 52% | 0.524 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -32.8 | 176.8 | -70.4 | 173.8 | 0 | 0 | 0 | 112.9 | E308 Q310 L316 | E308-L312 WeakPolarHBondContact O-CG 3.4Å; E308-L312 PolarHBondContact O-N 2.91Å; Q310-L312 VanDerWaalsContact C-N 3.35Å; Q310-L312 PolarHBondContact O-N 3.33Å; L312-L316 WeakPolarHBondContact O-CB 3.39Å; L312-L316 PolarHBondContact O-N 3.36Å |
| 313 | K | 92 | Very high | 91.4 | Very high | 128 Ų | 128 | 101.2 Ų | 101.2 | 56% | 0.557 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.6 | -39.8 | 174.5 | -78.1 | 171.9 | -179.3 | 173.5 | 0 | 111.6 | I309 Q310 A311 L316 Q317 | I309-K313 HydrophobicContact CG2-CD 4.29Å; I309-K313 VanDerWaalsContact O-CG 3.29Å; I309-K313 WeakPolarHBondContact O-CG 3.43Å; I309-K313 PolarHBondContact O-N 2.89Å; I309-K313 VanDerWaalsContact O-N 3.14Å; Q310-K313 WeakPolarHBondContact O-CB 3.29Å; Q310-K313 PolarHBondContact O-N 3.06Å; Q310-K313 VanDerWaalsContact O-N 3.11Å; A311-K313 VanDerWaalsContact C-N 3.32Å; A311-K313 PolarHBondContact O-N 3.44Å; K313-L316 PolarHBondContact O-N 3.46Å; K313-Q317 WeakPolarHBondContact O-CG 3.37Å; K313-Q317 PolarHBondContact O-N 2.82Å |
| 314 | D | 92.8 | Very high | 91.4 | Very high | 101 Ų | 101 | 102 Ų | 102 | 54% | 0.54 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.2 | -39.8 | 178.8 | -69.3 | -16.7 | 0 | 0 | 0 | 111.5 | Q310 A311 Q317 S318 | Q310-D314 PolarHBondContact O-N 3.47Å; A311-D314 PolarHBondContact O-N 3.21Å; D314-Q317 PolarHBondContact O-N 2.87Å; D314-S318 PolarHBondContact O-N 3.47Å |
| 315 | E | 93.6 | Very high | 91.3 | Very high | 107 Ų | 107 | 102.7 Ų | 102.7 | 50% | 0.5 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.7 | -37.6 | 174.5 | -171.8 | 167.4 | -165.8 | 0 | 0 | 112.4 | A311 Q317 S318 Q319 | A311-E315 PolarHBondContact O-N 3.21Å; E315-Q317 VanDerWaalsContact C-N 3.31Å; E315-Q317 PolarHBondContact O-N 2.9Å; E315-S318 WeakPolarHBondContact CA-OG 3.49Å; E315-S318 PolarHBondContact O-N 3.4Å; E315-S318 PolarHBondContact O-OG 2.82Å; E315-Q319 WeakPolarHBondContact O-CG 3.31Å; E315-Q319 PolarHBondContact O-N 3.16Å |
| 316 | L | 91.9 | Very high | 91.1 | Very high | 95 Ų | 95 | 101.3 Ų | 101.3 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.5 | -37.4 | 174.3 | -161.2 | 152.5 | 0 | 0 | 0 | 111.1 | L312 K313 Q320 | L312-L316 WeakPolarHBondContact O-CB 3.39Å; L312-L316 PolarHBondContact O-N 3.36Å; K313-L316 PolarHBondContact O-N 3.46Å; L316-Q320 HydrophobicContact CD2-CG 4.14Å; L316-Q320 WeakPolarHBondContact O-CB 3.47Å; L316-Q320 VanDerWaalsContact O-CG 3.29Å; L316-Q320 WeakPolarHBondContact O-CG 3.32Å; L316-Q320 PolarHBondContact O-N 3.31Å |
| 317 | Q | 92.3 | Very high | 90.9 | Very high | 97 Ų | 97 | 106.2 Ų | 106.2 | 45% | 0.453 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.6 | -36.2 | 173.8 | -74.3 | -178.2 | 19.5 | 0 | 0 | 112.9 | K313 D314 E315 K321 | K313-Q317 WeakPolarHBondContact O-CG 3.37Å; K313-Q317 PolarHBondContact O-N 2.82Å; D314-Q317 PolarHBondContact O-N 2.87Å; E315-Q317 VanDerWaalsContact C-N 3.31Å; E315-Q317 PolarHBondContact O-N 2.9Å; Q317-K321 WeakPolarHBondContact O-CG 3.19Å; Q317-K321 PolarHBondContact O-N 3.3Å; Q317-K321 VanDerWaalsContact O-N 3.14Å |
| 318 | S | 91.1 | Very high | 90.3 | Very high | 52 Ų | 52 | 105.3 Ų | 105.3 | 36% | 0.364 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.6 | -43.8 | 175.3 | 64.6 | 0 | 0 | 0 | 0 | 111.3 | D314 E315 Q320 K321 E322 | D314-S318 PolarHBondContact O-N 3.47Å; E315-S318 WeakPolarHBondContact CA-OG 3.49Å; E315-S318 PolarHBondContact O-N 3.4Å; E315-S318 PolarHBondContact O-OG 2.82Å; S318-Q320 VanDerWaalsContact C-N 3.33Å; S318-Q320 PolarHBondContact O-N 2.94Å; S318-K321 PolarHBondContact O-N 2.93Å; S318-E322 PolarHBondContact O-N 3.17Å |
| 319 | Q | 91.8 | Very high | 89.7 | Confident | 101 Ų | 101 | 106.8 Ų | 106.8 | 47% | 0.472 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.4 | -39.6 | 175 | -71.3 | 180 | 3.6 | 0 | 0 | 112.3 | E315 K321 E322 L323 | E315-Q319 WeakPolarHBondContact O-CG 3.31Å; E315-Q319 PolarHBondContact O-N 3.16Å; Q319-K321 PolarHBondContact O-N 3.29Å; Q319-E322 PolarHBondContact O-N 3.41Å; Q319-L323 WeakPolarHBondContact O-CB 3.29Å; Q319-L323 WeakPolarHBondContact O-CG 3.36Å; Q319-L323 PolarHBondContact O-N 3.28Å |
| 320 | Q | 91.3 | Very high | 88.9 | Confident | 102 Ų | 102 | 107.2 Ų | 107.2 | 48% | 0.477 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 174.6 | -78.8 | 176.4 | -12 | 0 | 0 | 112.2 | L316 S318 L323 E324 | L316-Q320 HydrophobicContact CD2-CG 4.14Å; L316-Q320 WeakPolarHBondContact O-CB 3.47Å; L316-Q320 VanDerWaalsContact O-CG 3.29Å; L316-Q320 WeakPolarHBondContact O-CG 3.32Å; L316-Q320 PolarHBondContact O-N 3.31Å; S318-Q320 VanDerWaalsContact C-N 3.33Å; S318-Q320 PolarHBondContact O-N 2.94Å; Q320-L323 PolarHBondContact O-N 2.87Å; Q320-E324 WeakPolarHBondContact O-CG 3.31Å; Q320-E324 PolarHBondContact O-N 3.03Å |
| 321 | K | 91.8 | Very high | 88.1 | Confident | 138 Ų | 138 | 107 Ų | 107 | 60% | 0.6 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.3 | -39.7 | 176.4 | -71.5 | 170.8 | -176.8 | 169.6 | 0 | 112.2 | Q317 S318 Q319 E324 S325 | Q317-K321 WeakPolarHBondContact O-CG 3.19Å; Q317-K321 PolarHBondContact O-N 3.3Å; Q317-K321 VanDerWaalsContact O-N 3.14Å; S318-K321 PolarHBondContact O-N 2.93Å; Q319-K321 PolarHBondContact O-N 3.29Å; K321-E324 PolarHBondContact O-N 2.88Å; K321-S325 PolarHBondContact O-N 2.86Å |
| 322 | E | 91.9 | Very high | 86.9 | Confident | 119 Ų | 119 | 108.2 Ų | 108.2 | 56% | 0.556 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.2 | -45.4 | 174.9 | -74.5 | 178.1 | -175.7 | 0 | 0 | 111.3 | S318 Q319 E324 S325 L326 | S318-E322 PolarHBondContact O-N 3.17Å; Q319-E322 PolarHBondContact O-N 3.41Å; E322-E324 VanDerWaalsContact C-N 3.31Å; E322-E324 PolarHBondContact O-N 2.96Å; E322-S325 WeakPolarHBondContact CA-OG 3.37Å; E322-S325 PolarHBondContact O-N 3.19Å; E322-S325 VanDerWaalsContact O-N 3.15Å; E322-S325 PolarHBondContact O-OG 2.83Å; E322-L326 WeakPolarHBondContact O-CG 3.19Å; E322-L326 PolarHBondContact O-N 2.86Å |
| 323 | L | 88.2 | Confident | 85.3 | Confident | 119 Ų | 119 | 110.3 Ų | 110.3 | 62% | 0.623 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.2 | -38.9 | 175.4 | -72.6 | 175.6 | 0 | 0 | 0 | 112.5 | Q319 Q320 R327 | Q319-L323 WeakPolarHBondContact O-CB 3.29Å; Q319-L323 WeakPolarHBondContact O-CG 3.36Å; Q319-L323 PolarHBondContact O-N 3.28Å; Q320-L323 PolarHBondContact O-N 2.87Å; L323-R327 VanDerWaalsContact O-CB 3.23Å; L323-R327 WeakPolarHBondContact O-CB 3.33Å; L323-R327 PolarHBondContact O-N 3.44Å |
| 324 | E | 90.3 | Very high | 83.7 | Confident | 132 Ų | 132 | 113.7 Ų | 113.7 | 62% | 0.617 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.4 | -41.9 | 173.6 | -75.6 | 178.3 | 177.3 | 0 | 0 | 112 | Q320 K321 E322 R327 E328 | Q320-E324 WeakPolarHBondContact O-CG 3.31Å; Q320-E324 PolarHBondContact O-N 3.03Å; K321-E324 PolarHBondContact O-N 2.88Å; E322-E324 VanDerWaalsContact C-N 3.31Å; E322-E324 PolarHBondContact O-N 2.96Å; E324-R327 PolarHBondContact O-N 3.17Å; E324-E328 PolarHBondContact O-N 2.86Å |
| 325 | S | 88.8 | Confident | 81.7 | Confident | 67 Ų | 67 | 111 Ų | 111 | 47% | 0.469 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.7 | -45 | 175.5 | 65.6 | 0 | 0 | 0 | 0 | 112.8 | K321 E322 R327 E328 E329 | K321-S325 PolarHBondContact O-N 2.86Å; E322-S325 WeakPolarHBondContact CA-OG 3.37Å; E322-S325 PolarHBondContact O-N 3.19Å; E322-S325 VanDerWaalsContact O-N 3.15Å; E322-S325 PolarHBondContact O-OG 2.83Å; S325-R327 VanDerWaalsContact C-N 3.25Å; S325-R327 PolarHBondContact O-N 3.17Å; S325-E328 PolarHBondContact O-N 3.47Å; S325-E329 WeakPolarHBondContact O-CB 3.47Å; S325-E329 PolarHBondContact O-N 2.86Å |
| 326 | L | 84.5 | Confident | 79.9 | Confident | 87 Ų | 87 | 107.6 Ų | 107.6 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -36.1 | 176.1 | -70.7 | 172 | 0 | 0 | 0 | 110.9 | E322 E329 I330 | E322-L326 WeakPolarHBondContact O-CG 3.19Å; E322-L326 PolarHBondContact O-N 2.86Å; L326-E329 PolarHBondContact O-N 2.79Å; L326-I330 WeakPolarHBondContact O-CB 3.24Å; L326-I330 WeakPolarHBondContact O-CD1 3.37Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 2.85Å |
| 327 | R | 84.1 | Confident | 77.9 | Confident | 196 Ų | 196 | 109 Ų | 109 | 74% | 0.74 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -68.9 | -38.9 | 177.8 | -168.1 | 174.2 | -171.6 | -136.1 | 2.2 | 112.6 | L323 E324 S325 K331 | L323-R327 VanDerWaalsContact O-CB 3.23Å; L323-R327 WeakPolarHBondContact O-CB 3.33Å; L323-R327 PolarHBondContact O-N 3.44Å; E324-R327 PolarHBondContact O-N 3.17Å; S325-R327 VanDerWaalsContact C-N 3.25Å; S325-R327 PolarHBondContact O-N 3.17Å; R327-K331 PolarHBondContact O-N 2.93Å |
| 328 | E | 81.6 | Confident | 76.1 | Confident | 109 Ų | 109 | 110.1 Ų | 110.1 | 51% | 0.509 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -69.4 | -35.4 | 172.7 | -72.5 | -62.7 | 144.9 | 0 | 0 | 111.7 | E324 S325 I330 K331 P332 | E324-E328 PolarHBondContact O-N 2.86Å; S325-E328 PolarHBondContact O-N 3.47Å; E328-I330 VanDerWaalsContact C-N 3.34Å; E328-I330 PolarHBondContact O-N 2.77Å; E328-K331 VanDerWaalsContact O-CB 3.25Å; E328-K331 WeakPolarHBondContact O-CB 3.46Å; E328-K331 PolarHBondContact O-N 3.39Å; E328-K331 IonicContact OE1-NZ 3.52Å; E328-K331 PolarHBondContact OE1-NZ 2.77Å; E328-K331 WeakPolarHBondContact OE2-CD 3.33Å; E328-K331 IonicContact OE2-NZ 2.78Å; E328-K331 PolarHBondContact OE2-NZ 3.23Å; E328-P332 WeakPolarHBondContact O-CD 3.43Å |
| 329 | E | 78.2 | Confident | 74.5 | Confident | 129 Ų | 129 | 114.8 Ų | 114.8 | 60% | 0.603 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.4 | -33.7 | 175 | -164.8 | 172 | -155.8 | 0 | 0 | 112.5 | S325 L326 P332 F333 | S325-E329 WeakPolarHBondContact O-CB 3.47Å; S325-E329 PolarHBondContact O-N 2.86Å; L326-E329 PolarHBondContact O-N 2.79Å; E329-P332 WeakPolarHBondContact O-CD 3.36Å; E329-P332 WeakPolarHBondContact O-CG 3.43Å; E329-F333 VanDerWaalsContact O-CD2 3.29Å; E329-F333 WeakPolarHBondContact O-CD2 3.3Å; E329-F333 WeakPolarHBondContact O-CE2 3.45Å |
| 330 | I | 74.8 | Confident | 73.2 | Confident | 90 Ų | 90 | 113.4 Ų | 113.4 | 46% | 0.462 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -79.9 | -21.7 | 176.8 | -67 | 164.6 | 0 | 0 | 0 | 112.7 | L326 E328 F333 R334 | L326-I330 WeakPolarHBondContact O-CB 3.24Å; L326-I330 WeakPolarHBondContact O-CD1 3.37Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 2.85Å; E328-I330 VanDerWaalsContact C-N 3.34Å; E328-I330 PolarHBondContact O-N 2.77Å; I330-F333 WeakPolarHBondContact O-CB 3.34Å; I330-F333 PolarHBondContact O-N 3.1Å; I330-F333 VanDerWaalsContact O-N 3.1Å; I330-R334 PolarHBondContact O-N 2.72Å |
| 331 | K | 75.8 | Confident | 72.1 | Confident | 119 Ų | 119 | 115.6 Ų | 115.6 | 52% | 0.517 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -56 | -42.8 | -177.6 | -155.4 | 173.5 | -177.4 | 177.3 | 0 | 115 | R327 E328 F333 R334 G335 | R327-K331 PolarHBondContact O-N 2.93Å; E328-K331 VanDerWaalsContact O-CB 3.25Å; E328-K331 WeakPolarHBondContact O-CB 3.46Å; E328-K331 PolarHBondContact O-N 3.39Å; E328-K331 IonicContact OE1-NZ 3.52Å; E328-K331 PolarHBondContact OE1-NZ 2.77Å; E328-K331 WeakPolarHBondContact OE2-CD 3.33Å; E328-K331 IonicContact OE2-NZ 2.78Å; E328-K331 PolarHBondContact OE2-NZ 3.23Å; K331-F333 VanDerWaalsContact C-N 3.31Å; K331-F333 PolarHBondContact O-N 2.87Å; K331-R334 PolarHBondContact O-N 2.89Å; K331-G335 PolarHBondContact O-N 3.48Å |
| 332 | P | 66.4 | Low | 71.3 | Confident | 84 Ų | 84 | 112.3 Ų | 112.3 | 55% | 0.545 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.4 | -31.2 | 174.5 | 22.1 | -32.4 | 0 | 0 | 0 | 113.5 | E328 E329 G335 G336 | E328-P332 WeakPolarHBondContact O-CD 3.43Å; E329-P332 WeakPolarHBondContact O-CD 3.36Å; E329-P332 WeakPolarHBondContact O-CG 3.43Å; P332-G335 PolarHBondContact O-N 3.39Å; P332-G336 PolarHBondContact O-N 3.39Å; P332-G336 VanDerWaalsContact O-N 3.09Å |
| 333 | F | 58.7 | Low | 70.8 | Confident | 144 Ų | 144 | 109.7 Ų | 109.7 | 63% | 0.632 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.6 | -33 | 177.9 | -62.7 | -81.6 | 0 | 0 | 0 | 112.2 | E329 I330 K331 G335 | E329-F333 VanDerWaalsContact O-CD2 3.29Å; E329-F333 WeakPolarHBondContact O-CD2 3.3Å; E329-F333 WeakPolarHBondContact O-CE2 3.45Å; I330-F333 WeakPolarHBondContact O-CB 3.34Å; I330-F333 PolarHBondContact O-N 3.1Å; I330-F333 VanDerWaalsContact O-N 3.1Å; K331-F333 VanDerWaalsContact C-N 3.31Å; K331-F333 PolarHBondContact O-N 2.87Å; F333-G335 VanDerWaalsContact C-N 3.34Å; F333-G335 PolarHBondContact O-N 3.44Å |
| 334 | R | 57.2 | Low | 70.4 | Confident | 199 Ų | 199 | 108.6 Ų | 108.6 | 75% | 0.751 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -73.6 | -21.6 | 178 | -162.2 | -175.2 | -69.9 | -103.7 | 0.5 | 113.9 | I330 K331 | I330-R334 PolarHBondContact O-N 2.72Å; K331-R334 PolarHBondContact O-N 2.89Å |
| 335 | G | 51.8 | Low | 70.1 | Confident | 45 Ų | 45 | 108.5 Ų | 108.5 | 46% | 0.464 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -101.3 | -25.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115 | K331 P332 F333 | K331-G335 PolarHBondContact O-N 3.48Å; P332-G335 PolarHBondContact O-N 3.39Å; F333-G335 VanDerWaalsContact C-N 3.34Å; F333-G335 PolarHBondContact O-N 3.44Å |
| 336 | G | 54.6 | Low | 70.1 | Confident | 35 Ų | 35 | 108 Ų | 108 | 36% | 0.361 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -81.9 | -28.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | P332 N338 Q339 S340 | P332-G336 PolarHBondContact O-N 3.39Å; P332-G336 VanDerWaalsContact O-N 3.09Å; G336-N338 VanDerWaalsContact C-N 3.3Å; G336-N338 PolarHBondContact O-N 3.47Å; G336-Q339 PolarHBondContact O-N 2.92Å; G336-S340 PolarHBondContact O-N 3.46Å |
| 337 | E | 50.9 | Low | 70.5 | Confident | 124 Ų | 124 | 109.2 Ų | 109.2 | 58% | 0.579 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -58.3 | -42.5 | 179.9 | -73.7 | 177.7 | 159.2 | 0 | 0 | 111.2 | Q339 S340 Y341 | E337-Q339 VanDerWaalsContact C-N 3.34Å; E337-Q339 PolarHBondContact O-N 3.03Å; E337-S340 PolarHBondContact O-N 3.3Å; E337-Y341 HydrophobicContact CB-CD2 4.28Å; E337-Y341 HydrophobicContact CB-CE2 4.43Å; E337-Y341 WeakPolarHBondContact O-CB 3.35Å; E337-Y341 WeakPolarHBondContact O-CD2 3.18Å; E337-Y341 PolarHBondContact O-N 3.27Å |
| 338 | N | 54.8 | Low | 70.9 | Confident | 122 Ų | 122 | 103.9 Ų | 103.9 | 65% | 0.652 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.1 | -27.8 | -176.6 | -68.4 | -26.8 | 0 | 0 | 0 | 114.6 | G336 S342 | G336-N338 VanDerWaalsContact C-N 3.3Å; G336-N338 PolarHBondContact O-N 3.47Å; N338-S342 WeakPolarHBondContact O-CB 3.25Å; N338-S342 PolarHBondContact O-N 2.96Å |
| 339 | Q | 57.3 | Low | 71.4 | Confident | 150 Ų | 150 | 101.1 Ų | 101.1 | 70% | 0.701 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -80.7 | -36.9 | 179.6 | -71 | 179.4 | 1.4 | 0 | 0 | 112.3 | G336 E337 S343 | G336-Q339 PolarHBondContact O-N 2.92Å; E337-Q339 VanDerWaalsContact C-N 3.34Å; E337-Q339 PolarHBondContact O-N 3.03Å; Q339-S343 WeakPolarHBondContact O-CB 3.21Å; Q339-S343 PolarHBondContact O-N 3.41Å; Q339-S343 VanDerWaalsContact O-N 3.17Å; Q339-S343 PolarHBondContact O-OG 3.12Å |
| 340 | S | 63.9 | Low | 72.2 | Confident | 72 Ų | 72 | 100.8 Ų | 100.8 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -72.9 | -41.6 | 176.6 | -168.6 | 0 | 0 | 0 | 0 | 111.7 | G336 E337 S343 L344 | G336-S340 PolarHBondContact O-N 3.46Å; E337-S340 PolarHBondContact O-N 3.3Å; S340-S343 PolarHBondContact O-N 2.87Å; S340-L344 WeakPolarHBondContact O-CG 3.2Å; S340-L344 PolarHBondContact O-N 2.98Å; S340-L344 VanDerWaalsContact O-N 3.07Å |
| 341 | Y | 69.2 | Low | 73.2 | Confident | 147 Ų | 147 | 100.8 Ų | 100.8 | 58% | 0.576 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.9 | -43.3 | 175.4 | -83.3 | -73.9 | 0 | 0 | 0 | 111.9 | E337 S343 L344 E345 | E337-Y341 HydrophobicContact CB-CD2 4.28Å; E337-Y341 HydrophobicContact CB-CE2 4.43Å; E337-Y341 WeakPolarHBondContact O-CB 3.35Å; E337-Y341 WeakPolarHBondContact O-CD2 3.18Å; E337-Y341 PolarHBondContact O-N 3.27Å; Y341-S343 VanDerWaalsContact C-N 3.31Å; Y341-S343 PolarHBondContact O-N 2.71Å; Y341-L344 PolarHBondContact O-N 2.81Å; Y341-E345 WeakPolarHBondContact O-CB 3.47Å; Y341-E345 VanDerWaalsContact O-CG 3.28Å; Y341-E345 WeakPolarHBondContact O-CG 3.4Å; Y341-E345 PolarHBondContact O-N 2.94Å |
| 342 | S | 75.4 | Confident | 74.1 | Confident | 70 Ų | 70 | 102.9 Ų | 102.9 | 49% | 0.49 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 176.9 | -177.4 | 0 | 0 | 0 | 0 | 112.8 | N338 S346 | N338-S342 WeakPolarHBondContact O-CB 3.25Å; N338-S342 PolarHBondContact O-N 2.96Å; S342-S346 WeakPolarHBondContact O-CB 3.42Å; S342-S346 PolarHBondContact O-N 2.92Å |
| 343 | S | 79.6 | Confident | 75.6 | Confident | 63 Ų | 63 | 105.2 Ų | 105.2 | 44% | 0.441 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.9 | -47.9 | 175.9 | -59.4 | 0 | 0 | 0 | 0 | 111.4 | Q339 S340 Y341 E345 S346 E347 | Q339-S343 WeakPolarHBondContact O-CB 3.21Å; Q339-S343 PolarHBondContact O-N 3.41Å; Q339-S343 VanDerWaalsContact O-N 3.17Å; Q339-S343 PolarHBondContact O-OG 3.12Å; S340-S343 PolarHBondContact O-N 2.87Å; Y341-S343 VanDerWaalsContact C-N 3.31Å; Y341-S343 PolarHBondContact O-N 2.71Å; S343-E345 PolarHBondContact O-N 3.34Å; S343-S346 WeakPolarHBondContact O-CB 3.45Å; S343-S346 PolarHBondContact O-N 2.98Å; S343-S346 VanDerWaalsContact O-N 3.17Å; S343-S346 PolarHBondContact O-OG 2.86Å; S343-E347 PolarHBondContact O-N 3.46Å |
| 344 | L | 81.1 | Confident | 77.4 | Confident | 96 Ų | 96 | 103.9 Ų | 103.9 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.3 | -40 | 176.6 | -71.5 | 171.8 | 0 | 0 | 0 | 112.4 | S340 Y341 S346 E347 L348 | S340-L344 WeakPolarHBondContact O-CG 3.2Å; S340-L344 PolarHBondContact O-N 2.98Å; S340-L344 VanDerWaalsContact O-N 3.07Å; Y341-L344 PolarHBondContact O-N 2.81Å; L344-S346 VanDerWaalsContact C-N 3.3Å; L344-S346 PolarHBondContact O-N 3.44Å; L344-E347 PolarHBondContact O-N 2.96Å; L344-L348 WeakPolarHBondContact O-CB 3.35Å; L344-L348 PolarHBondContact O-N 3.18Å |
| 345 | E | 84.3 | Confident | 79.2 | Confident | 131 Ų | 131 | 101.5 Ų | 101.5 | 61% | 0.612 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.4 | -39.3 | 173.9 | -76.4 | 176.9 | 174.1 | 0 | 0 | 111.7 | Y341 S343 L348 A349 | Y341-E345 WeakPolarHBondContact O-CB 3.47Å; Y341-E345 VanDerWaalsContact O-CG 3.28Å; Y341-E345 WeakPolarHBondContact O-CG 3.4Å; Y341-E345 PolarHBondContact O-N 2.94Å; S343-E345 PolarHBondContact O-N 3.34Å; E345-L348 PolarHBondContact O-N 2.77Å; E345-A349 WeakPolarHBondContact O-CB 3.33Å; E345-A349 PolarHBondContact O-N 3.46Å |
| 346 | S | 88.8 | Confident | 81.4 | Confident | 55 Ų | 55 | 105.2 Ų | 105.2 | 39% | 0.385 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.1 | -38.1 | 176.5 | 85 | 0 | 0 | 0 | 0 | 112.6 | S342 S343 L344 K350 | S342-S346 WeakPolarHBondContact O-CB 3.42Å; S342-S346 PolarHBondContact O-N 2.92Å; S343-S346 WeakPolarHBondContact O-CB 3.45Å; S343-S346 PolarHBondContact O-N 2.98Å; S343-S346 VanDerWaalsContact O-N 3.17Å; S343-S346 PolarHBondContact O-OG 2.86Å; L344-S346 VanDerWaalsContact C-N 3.3Å; L344-S346 PolarHBondContact O-N 3.44Å; S346-K350 WeakPolarHBondContact O-CG 3.43Å; S346-K350 PolarHBondContact O-N 2.83Å |
| 347 | E | 91.6 | Very high | 83.4 | Confident | 113 Ų | 113 | 106.5 Ų | 106.5 | 53% | 0.528 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.7 | -42.8 | 175.4 | -72.7 | -178.1 | 176.5 | 0 | 0 | 111.2 | S343 L344 A349 K350 V351 | S343-E347 PolarHBondContact O-N 3.46Å; L344-E347 PolarHBondContact O-N 2.96Å; E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 2.87Å; E347-K350 WeakPolarHBondContact O-CB 3.46Å; E347-K350 PolarHBondContact O-N 3.38Å; E347-K350 VanDerWaalsContact O-N 3.14Å; E347-V351 WeakPolarHBondContact O-CG2 3.36Å; E347-V351 PolarHBondContact O-N 3.21Å |
| 348 | L | 92.3 | Very high | 85.6 | Confident | 84 Ų | 84 | 105.6 Ų | 105.6 | 44% | 0.44 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.6 | -37 | 177.6 | -147.2 | 171.9 | 0 | 0 | 0 | 111.1 | L344 E345 R352 | L344-L348 WeakPolarHBondContact O-CB 3.35Å; L344-L348 PolarHBondContact O-N 3.18Å; E345-L348 PolarHBondContact O-N 2.77Å; L348-R352 HydrophobicContact CD2-CG 4.05Å; L348-R352 VanDerWaalsContact CD2-NE 3.34Å; L348-R352 WeakPolarHBondContact O-CB 3.39Å; L348-R352 VanDerWaalsContact O-CG 3.32Å; L348-R352 WeakPolarHBondContact O-CG 3.14Å; L348-R352 PolarHBondContact O-N 3.48Å |
| 349 | A | 93.4 | Very high | 87.6 | Confident | 52 Ų | 52 | 103.6 Ų | 103.6 | 43% | 0.43 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.3 | -43.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E345 E347 R352 Q353 | E345-A349 WeakPolarHBondContact O-CB 3.33Å; E345-A349 PolarHBondContact O-N 3.46Å; E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 2.87Å; A349-R352 PolarHBondContact O-N 3.34Å; A349-Q353 PolarHBondContact O-N 3.49Å |
| 350 | K | 95 | Very high | 89.5 | Confident | 121 Ų | 121 | 101.5 Ų | 101.5 | 53% | 0.526 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.2 | -47 | 174.9 | -72.1 | 170.6 | -174.6 | 172.3 | 0 | 111.9 | S346 E347 R352 Q353 E354 | S346-K350 WeakPolarHBondContact O-CG 3.43Å; S346-K350 PolarHBondContact O-N 2.83Å; E347-K350 WeakPolarHBondContact O-CB 3.46Å; E347-K350 PolarHBondContact O-N 3.38Å; E347-K350 VanDerWaalsContact O-N 3.14Å; K350-R352 VanDerWaalsContact C-N 3.29Å; K350-R352 PolarHBondContact O-N 2.86Å; K350-Q353 WeakPolarHBondContact O-CB 3.49Å; K350-Q353 PolarHBondContact O-N 3.11Å; K350-Q353 VanDerWaalsContact O-N 3.1Å; K350-E354 WeakPolarHBondContact O-CG 3.33Å; K350-E354 PolarHBondContact O-N 2.94Å |
| 351 | V | 94.7 | Very high | 91.1 | Very high | 90 Ų | 90 | 103.6 Ų | 103.6 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 178 | 172 | 0 | 0 | 0 | 0 | 111.4 | E347 K355 | E347-V351 WeakPolarHBondContact O-CG2 3.36Å; E347-V351 PolarHBondContact O-N 3.21Å; V351-K355 WeakPolarHBondContact O-CB 3.38Å; V351-K355 PolarHBondContact O-N 3.43Å |
| 352 | R | 95.4 | Very high | 92.4 | Very high | 164 Ų | 164 | 101.7 Ų | 101.7 | 62% | 0.619 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.2 | -44.6 | 173.6 | -77.5 | 176.4 | -179.9 | 143.6 | 1.6 | 111.9 | L348 A349 K350 K355 E356 | L348-R352 HydrophobicContact CD2-CG 4.05Å; L348-R352 VanDerWaalsContact CD2-NE 3.34Å; L348-R352 WeakPolarHBondContact O-CB 3.39Å; L348-R352 VanDerWaalsContact O-CG 3.32Å; L348-R352 WeakPolarHBondContact O-CG 3.14Å; L348-R352 PolarHBondContact O-N 3.48Å; A349-R352 PolarHBondContact O-N 3.34Å; K350-R352 VanDerWaalsContact C-N 3.29Å; K350-R352 PolarHBondContact O-N 2.86Å; R352-K355 PolarHBondContact O-N 2.88Å; R352-E356 PolarHBondContact O-N 3.49Å |
| 353 | Q | 96.9 | Very high | 93.5 | Very high | 133 Ų | 133 | 102.6 Ų | 102.6 | 62% | 0.621 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.3 | -45.7 | 177.4 | -174.5 | 178.9 | 3.3 | 0 | 0 | 111.5 | A349 K350 K355 E356 T357 | A349-Q353 PolarHBondContact O-N 3.49Å; K350-Q353 WeakPolarHBondContact O-CB 3.49Å; K350-Q353 PolarHBondContact O-N 3.11Å; K350-Q353 VanDerWaalsContact O-N 3.1Å; Q353-K355 PolarHBondContact O-N 2.94Å; Q353-E356 PolarHBondContact O-N 2.9Å; Q353-T357 WeakPolarHBondContact O-CG2 3.49Å; Q353-T357 PolarHBondContact O-N 3.22Å; Q353-T357 PolarHBondContact O-OG1 3.36Å |
| 354 | E | 96.8 | Very high | 94.3 | Very high | 116 Ų | 116 | 103.3 Ų | 103.3 | 54% | 0.542 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 176.2 | -73.8 | 174.1 | -170.2 | 0 | 0 | 111.3 | K350 E356 T357 L358 | K350-E354 WeakPolarHBondContact O-CG 3.33Å; K350-E354 PolarHBondContact O-N 2.94Å; E354-E356 VanDerWaalsContact C-N 3.3Å; E354-E356 PolarHBondContact O-N 2.88Å; E354-T357 WeakPolarHBondContact CA-OG1 3.39Å; E354-T357 PolarHBondContact O-N 3.08Å; E354-T357 PolarHBondContact O-OG1 3.42Å; E354-L358 WeakPolarHBondContact O-CB 3.49Å; E354-L358 WeakPolarHBondContact O-CG 3.44Å; E354-L358 PolarHBondContact O-N 3.46Å |
| 355 | K | 96.3 | Very high | 95.1 | Very high | 148 Ų | 148 | 103.1 Ų | 103.1 | 64% | 0.643 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -55.5 | -45.1 | 174.2 | -178.8 | -174 | 176 | -177.7 | 0 | 111.7 | V351 R352 Q353 L358 T359 | V351-K355 WeakPolarHBondContact O-CB 3.38Å; V351-K355 PolarHBondContact O-N 3.43Å; R352-K355 PolarHBondContact O-N 2.88Å; Q353-K355 PolarHBondContact O-N 2.94Å; K355-L358 PolarHBondContact O-N 2.98Å; K355-T359 WeakPolarHBondContact O-CB 3.24Å; K355-T359 PolarHBondContact O-N 2.94Å; K355-T359 PolarHBondContact O-OG1 3.35Å |
| 356 | E | 96.6 | Very high | 95.7 | Very high | 124 Ų | 124 | 101.1 Ų | 101.1 | 58% | 0.579 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.2 | -41.6 | -180 | -169.1 | 161.3 | -168.1 | 0 | 0 | 111.8 | R352 Q353 E354 T359 Q360 | R352-E356 PolarHBondContact O-N 3.49Å; Q353-E356 PolarHBondContact O-N 2.9Å; E354-E356 VanDerWaalsContact C-N 3.3Å; E354-E356 PolarHBondContact O-N 2.88Å; E356-T359 PolarHBondContact O-N 2.88Å; E356-Q360 WeakPolarHBondContact O-CG 3.32Å; E356-Q360 PolarHBondContact O-N 3.05Å |
| 357 | T | 97.2 | Very high | 96.1 | Very high | 61 Ų | 61 | 104 Ų | 104 | 37% | 0.374 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.8 | -43.4 | 175 | 61.2 | 0 | 0 | 0 | 0 | 112.6 | Q353 E354 T359 Q360 Q361 | Q353-T357 WeakPolarHBondContact O-CG2 3.49Å; Q353-T357 PolarHBondContact O-N 3.22Å; Q353-T357 PolarHBondContact O-OG1 3.36Å; E354-T357 WeakPolarHBondContact CA-OG1 3.39Å; E354-T357 PolarHBondContact O-N 3.08Å; E354-T357 PolarHBondContact O-OG1 3.42Å; T357-T359 VanDerWaalsContact C-N 3.32Å; T357-T359 PolarHBondContact O-N 2.68Å; T357-Q360 PolarHBondContact O-N 2.95Å; T357-Q361 WeakPolarHBondContact O-CG 3.49Å; T357-Q361 PolarHBondContact O-N 3.17Å |
| 358 | L | 96.8 | Very high | 96.4 | Very high | 105 Ų | 105 | 104.7 Ų | 104.7 | 55% | 0.55 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 175.8 | -71.9 | 173.9 | 0 | 0 | 0 | 111.4 | E354 K355 Q361 L362 | E354-L358 WeakPolarHBondContact O-CB 3.49Å; E354-L358 WeakPolarHBondContact O-CG 3.44Å; E354-L358 PolarHBondContact O-N 3.46Å; K355-L358 PolarHBondContact O-N 2.98Å; L358-Q361 PolarHBondContact O-N 2.97Å; L358-L362 WeakPolarHBondContact O-CB 3.28Å; L358-L362 PolarHBondContact O-N 3.35Å |
| 359 | T | 96.4 | Very high | 96.6 | Very high | 80 Ų | 80 | 108.2 Ų | 108.2 | 49% | 0.491 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 176 | -55.1 | 0 | 0 | 0 | 0 | 110.9 | K355 E356 T357 L362 L363 | K355-T359 WeakPolarHBondContact O-CB 3.24Å; K355-T359 PolarHBondContact O-N 2.94Å; K355-T359 PolarHBondContact O-OG1 3.35Å; E356-T359 PolarHBondContact O-N 2.88Å; T357-T359 VanDerWaalsContact C-N 3.32Å; T357-T359 PolarHBondContact O-N 2.68Å; T359-L362 PolarHBondContact O-N 3.47Å; T359-L363 WeakPolarHBondContact O-CB 3.48Å; T359-L363 PolarHBondContact O-N 3.17Å |
| 360 | Q | 97.3 | Very high | 96.8 | Very high | 106 Ų | 106 | 109.1 Ų | 109.1 | 50% | 0.495 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.5 | -41.6 | 174.6 | -72.9 | 175 | 11.7 | 0 | 0 | 112.1 | E356 T357 L363 N364 | E356-Q360 WeakPolarHBondContact O-CG 3.32Å; E356-Q360 PolarHBondContact O-N 3.05Å; T357-Q360 PolarHBondContact O-N 2.95Å; Q360-L363 PolarHBondContact O-N 2.84Å; Q360-N364 WeakPolarHBondContact O-CB 3.37Å; Q360-N364 VanDerWaalsContact O-CG 3.25Å; Q360-N364 PolarHBondContact O-N 2.99Å; Q360-N364 PolarHBondContact O-ND2 2.95Å |
| 361 | Q | 97.6 | Very high | 96.9 | Very high | 117 Ų | 117 | 106.7 Ų | 106.7 | 55% | 0.547 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.9 | -44.4 | 175.1 | -75 | 177.8 | -6.7 | 0 | 0 | 111.8 | T357 L358 N364 T365 | T357-Q361 WeakPolarHBondContact O-CG 3.49Å; T357-Q361 PolarHBondContact O-N 3.17Å; L358-Q361 PolarHBondContact O-N 2.97Å; Q361-N364 PolarHBondContact O-N 2.85Å; Q361-T365 WeakPolarHBondContact O-CB 3.48Å; Q361-T365 PolarHBondContact O-N 3.45Å; Q361-T365 PolarHBondContact O-OG1 3.28Å |
| 362 | L | 97.3 | Very high | 97.1 | Very high | 106 Ų | 106 | 107.6 Ų | 107.6 | 56% | 0.555 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.8 | -47.3 | 175.7 | 179.8 | 65.4 | 0 | 0 | 0 | 110.9 | L358 T359 N364 T365 I366 | L358-L362 WeakPolarHBondContact O-CB 3.28Å; L358-L362 PolarHBondContact O-N 3.35Å; T359-L362 PolarHBondContact O-N 3.47Å; L362-N364 VanDerWaalsContact C-N 3.32Å; L362-N364 PolarHBondContact O-N 2.91Å; L362-T365 WeakPolarHBondContact O-CB 3.22Å; L362-T365 PolarHBondContact O-N 2.85Å; L362-T365 VanDerWaalsContact O-N 3.14Å; L362-I366 HydrophobicContact CD1-CD1 4.25Å; L362-I366 HydrophobicContact CD1-CG1 4.43Å; L362-I366 HydrophobicContact CG-CD1 3.94Å; L362-I366 VanDerWaalsContact O-CG1 3.32Å; L362-I366 WeakPolarHBondContact O-CG1 3.42Å; L362-I366 PolarHBondContact O-N 3.41Å |
| 363 | L | 97.9 | Very high | 97.1 | Very high | 90 Ų | 90 | 102.7 Ų | 102.7 | 47% | 0.471 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.4 | -43.8 | 177.9 | -176.4 | 67.8 | 0 | 0 | 0 | 111.6 | T359 Q360 T365 I366 K367 | T359-L363 WeakPolarHBondContact O-CB 3.48Å; T359-L363 PolarHBondContact O-N 3.17Å; Q360-L363 PolarHBondContact O-N 2.84Å; L363-T365 VanDerWaalsContact C-N 3.34Å; L363-I366 PolarHBondContact O-N 3.34Å; L363-K367 WeakPolarHBondContact O-CG 3.32Å; L363-K367 PolarHBondContact O-N 3.3Å |
| 364 | N | 97.4 | Very high | 97.1 | Very high | 78 Ų | 78 | 102.1 Ų | 102.1 | 42% | 0.417 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 176 | -71.6 | -20 | 0 | 0 | 0 | 111.2 | Q360 Q361 L362 I366 K367 H368 | Q360-N364 WeakPolarHBondContact O-CB 3.37Å; Q360-N364 VanDerWaalsContact O-CG 3.25Å; Q360-N364 PolarHBondContact O-N 2.99Å; Q360-N364 PolarHBondContact O-ND2 2.95Å; Q361-N364 PolarHBondContact O-N 2.85Å; L362-N364 VanDerWaalsContact C-N 3.32Å; L362-N364 PolarHBondContact O-N 2.91Å; N364-I366 PolarHBondContact O-N 3.3Å; N364-K367 WeakPolarHBondContact O-CB 3.31Å; N364-K367 PolarHBondContact O-N 2.82Å; N364-H368 PolarHBondContact O-N 3.41Å; N364-H368 PolarHBondContact O-ND1 3.22Å |
| 365 | T | 97.6 | Very high | 97.2 | Very high | 92 Ų | 92 | 102.1 Ų | 102.1 | 56% | 0.564 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.7 | -42.1 | 177.5 | -52.4 | 0 | 0 | 0 | 0 | 111.5 | Q361 L362 L363 H368 K369 | Q361-T365 WeakPolarHBondContact O-CB 3.48Å; Q361-T365 PolarHBondContact O-N 3.45Å; Q361-T365 PolarHBondContact O-OG1 3.28Å; L362-T365 WeakPolarHBondContact O-CB 3.22Å; L362-T365 PolarHBondContact O-N 2.85Å; L362-T365 VanDerWaalsContact O-N 3.14Å; L363-T365 VanDerWaalsContact C-N 3.34Å; T365-H368 PolarHBondContact O-N 2.88Å; T365-K369 WeakPolarHBondContact O-CB 3.33Å; T365-K369 PolarHBondContact O-N 3.17Å |
| 366 | I | 96.7 | Very high | 97.2 | Very high | 88 Ų | 88 | 99.4 Ų | 99.4 | 45% | 0.451 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.5 | -46.6 | 174.2 | -69 | 167.1 | 0 | 0 | 0 | 110.1 | L362 L363 N364 H368 K369 V370 | L362-I366 HydrophobicContact CD1-CD1 4.25Å; L362-I366 HydrophobicContact CD1-CG1 4.43Å; L362-I366 HydrophobicContact CG-CD1 3.94Å; L362-I366 VanDerWaalsContact O-CG1 3.32Å; L362-I366 WeakPolarHBondContact O-CG1 3.42Å; L362-I366 PolarHBondContact O-N 3.41Å; L363-I366 PolarHBondContact O-N 3.34Å; N364-I366 PolarHBondContact O-N 3.3Å; I366-H368 PolarHBondContact O-N 2.89Å; I366-K369 PolarHBondContact O-N 2.92Å; I366-V370 HydrophobicContact CG2-CG2 4.36Å; I366-V370 WeakPolarHBondContact O-CG2 3.14Å; I366-V370 PolarHBondContact O-N 3.45Å |
| 367 | K | 96.5 | Very high | 97.2 | Very high | 115 Ų | 115 | 97 Ų | 97 | 50% | 0.5 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.4 | -46.8 | 176.4 | -73.3 | 173 | -179.4 | 175.7 | 0 | 111.9 | L363 N364 K369 V370 V371 | L363-K367 WeakPolarHBondContact O-CG 3.32Å; L363-K367 PolarHBondContact O-N 3.3Å; N364-K367 WeakPolarHBondContact O-CB 3.31Å; N364-K367 PolarHBondContact O-N 2.82Å; K367-K369 VanDerWaalsContact C-N 3.35Å; K367-K369 PolarHBondContact O-N 3.39Å; K367-V370 PolarHBondContact O-N 3.06Å; K367-V371 WeakPolarHBondContact O-CG2 3.35Å; K367-V371 PolarHBondContact O-N 3.44Å |
| 368 | H | 97.3 | Very high | 97.2 | Very high | 129 Ų | 129 | 96.3 Ų | 96.3 | 60% | 0.597 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.6 | -41.7 | 176.7 | -73.1 | 81.3 | 0 | 0 | 0 | 111.8 | N364 T365 I366 V370 V371 L372 | N364-H368 PolarHBondContact O-N 3.41Å; N364-H368 PolarHBondContact O-ND1 3.22Å; T365-H368 PolarHBondContact O-N 2.88Å; I366-H368 PolarHBondContact O-N 2.89Å; H368-V370 VanDerWaalsContact C-N 3.32Å; H368-V370 PolarHBondContact O-N 3.42Å; H368-V371 PolarHBondContact O-N 3.21Å; H368-L372 WeakPolarHBondContact O-CG 3.36Å; H368-L372 PolarHBondContact O-N 3.48Å |
| 369 | K | 97.6 | Very high | 97.2 | Very high | 157 Ų | 157 | 99.1 Ų | 99.1 | 68% | 0.683 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.8 | -38.2 | 176.1 | -171.3 | 179.8 | 178.2 | -175.3 | 0 | 112.1 | T365 I366 K367 S373 | T365-K369 WeakPolarHBondContact O-CB 3.33Å; T365-K369 PolarHBondContact O-N 3.17Å; I366-K369 PolarHBondContact O-N 2.92Å; K367-K369 VanDerWaalsContact C-N 3.35Å; K367-K369 PolarHBondContact O-N 3.39Å; K369-S373 WeakPolarHBondContact O-CB 3.34Å; K369-S373 PolarHBondContact O-N 3.41Å |
| 370 | V | 97.9 | Very high | 97.3 | Very high | 72 Ų | 72 | 99.2 Ų | 99.2 | 44% | 0.436 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.7 | -45.3 | 175 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | I366 K367 H368 S373 Q374 | I366-V370 HydrophobicContact CG2-CG2 4.36Å; I366-V370 WeakPolarHBondContact O-CG2 3.14Å; I366-V370 PolarHBondContact O-N 3.45Å; K367-V370 PolarHBondContact O-N 3.06Å; H368-V370 VanDerWaalsContact C-N 3.32Å; H368-V370 PolarHBondContact O-N 3.42Å; V370-S373 WeakPolarHBondContact O-CB 3.45Å; V370-S373 PolarHBondContact O-N 3.42Å; V370-Q374 WeakPolarHBondContact O-CG 3.28Å; V370-Q374 PolarHBondContact O-N 3.48Å |
| 371 | V | 97.6 | Very high | 97.2 | Very high | 70 Ų | 70 | 100.8 Ų | 100.8 | 42% | 0.424 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.4 | -48 | 176.7 | 172.7 | 0 | 0 | 0 | 0 | 111 | K367 H368 S373 Q374 E375 | K367-V371 WeakPolarHBondContact O-CG2 3.35Å; K367-V371 PolarHBondContact O-N 3.44Å; H368-V371 PolarHBondContact O-N 3.21Å; V371-S373 VanDerWaalsContact C-N 3.28Å; V371-S373 PolarHBondContact O-N 3.23Å; V371-Q374 WeakPolarHBondContact O-CB 3.39Å; V371-Q374 PolarHBondContact O-N 2.95Å; V371-Q374 VanDerWaalsContact O-N 3.1Å; V371-E375 WeakPolarHBondContact O-CG 3.41Å; V371-E375 PolarHBondContact O-N 3.19Å |
| 372 | L | 97.2 | Very high | 97.3 | Very high | 108 Ų | 108 | 100.4 Ų | 100.4 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.2 | -36.3 | 176.8 | -71.4 | 170.3 | 0 | 0 | 0 | 112.5 | H368 E375 L376 | H368-L372 WeakPolarHBondContact O-CG 3.36Å; H368-L372 PolarHBondContact O-N 3.48Å; L372-E375 PolarHBondContact O-N 2.84Å; L372-L376 WeakPolarHBondContact O-CB 3.41Å; L372-L376 PolarHBondContact O-N 2.87Å |
| 373 | S | 96.3 | Very high | 97.2 | Very high | 61 Ų | 61 | 98.7 Ų | 98.7 | 43% | 0.427 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 174.2 | -167.3 | 0 | 0 | 0 | 0 | 111.3 | K369 V370 V371 L376 D377 | K369-S373 WeakPolarHBondContact O-CB 3.34Å; K369-S373 PolarHBondContact O-N 3.41Å; V370-S373 WeakPolarHBondContact O-CB 3.45Å; V370-S373 PolarHBondContact O-N 3.42Å; V371-S373 VanDerWaalsContact C-N 3.28Å; V371-S373 PolarHBondContact O-N 3.23Å; S373-L376 PolarHBondContact O-N 2.96Å; S373-D377 PolarHBondContact O-N 2.94Å |
| 374 | Q | 97.2 | Very high | 97.1 | Very high | 121 Ų | 121 | 102.4 Ų | 102.4 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.9 | -40.6 | 177.3 | -70.4 | 172.7 | -12.6 | 0 | 0 | 112 | V370 V371 L376 D377 A378 | V370-Q374 WeakPolarHBondContact O-CG 3.28Å; V370-Q374 PolarHBondContact O-N 3.48Å; V371-Q374 WeakPolarHBondContact O-CB 3.39Å; V371-Q374 PolarHBondContact O-N 2.95Å; V371-Q374 VanDerWaalsContact O-N 3.1Å; Q374-L376 VanDerWaalsContact C-N 3.31Å; Q374-L376 PolarHBondContact O-N 3.4Å; Q374-D377 PolarHBondContact O-N 3.07Å; Q374-A378 WeakPolarHBondContact O-CB 3.43Å; Q374-A378 PolarHBondContact O-N 3.01Å |
| 375 | E | 97.6 | Very high | 97.1 | Very high | 116 Ų | 116 | 105.1 Ų | 105.1 | 54% | 0.542 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.2 | -39 | 174.6 | -71.5 | 176.4 | 179.6 | 0 | 0 | 111.7 | V371 L372 A378 W379 | V371-E375 WeakPolarHBondContact O-CG 3.41Å; V371-E375 PolarHBondContact O-N 3.19Å; L372-E375 PolarHBondContact O-N 2.84Å; E375-A378 PolarHBondContact O-N 3.49Å; E375-W379 WeakPolarHBondContact O-CB 3.25Å; E375-W379 PolarHBondContact O-N 3.35Å |
| 376 | L | 97.4 | Very high | 97.1 | Very high | 91 Ų | 91 | 103.4 Ų | 103.4 | 48% | 0.476 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.3 | -42.5 | 176.3 | -173.9 | 146.4 | 0 | 0 | 0 | 111.6 | L372 S373 Q374 W379 Q380 | L372-L376 WeakPolarHBondContact O-CB 3.41Å; L372-L376 PolarHBondContact O-N 2.87Å; S373-L376 PolarHBondContact O-N 2.96Å; Q374-L376 VanDerWaalsContact C-N 3.31Å; Q374-L376 PolarHBondContact O-N 3.4Å; L376-W379 PolarHBondContact O-N 2.89Å; L376-Q380 HydrophobicContact CD2-CG 4.22Å; L376-Q380 WeakPolarHBondContact O-CG 3.29Å; L376-Q380 PolarHBondContact O-N 2.92Å |
| 377 | D | 96.8 | Very high | 97 | Very high | 74 Ų | 74 | 103.2 Ų | 103.2 | 40% | 0.396 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 175.5 | -67.7 | -26.8 | 0 | 0 | 0 | 110.9 | S373 Q374 W379 Q380 E381 | S373-D377 PolarHBondContact O-N 2.94Å; Q374-D377 PolarHBondContact O-N 3.07Å; D377-W379 PolarHBondContact O-N 3.27Å; D377-Q380 WeakPolarHBondContact O-CB 3.44Å; D377-Q380 PolarHBondContact O-N 3.4Å; D377-E381 WeakPolarHBondContact O-CG 3.47Å; D377-E381 PolarHBondContact O-N 3.28Å |
| 378 | A | 96.4 | Very high | 96.9 | Very high | 46 Ų | 46 | 102.5 Ų | 102.5 | 38% | 0.38 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.2 | -43.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | Q374 E375 Q380 E381 D382 | Q374-A378 WeakPolarHBondContact O-CB 3.43Å; Q374-A378 PolarHBondContact O-N 3.01Å; E375-A378 PolarHBondContact O-N 3.49Å; A378-Q380 VanDerWaalsContact C-N 3.31Å; A378-Q380 PolarHBondContact O-N 3.43Å; A378-E381 PolarHBondContact O-N 3.39Å; A378-D382 PolarHBondContact O-N 2.98Å |
| 379 | W | 97.6 | Very high | 96.8 | Very high | 164 Ų | 164 | 100.8 Ų | 100.8 | 62% | 0.621 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.1 | -36.6 | 175.9 | -174.8 | 80.9 | 0 | 0 | 0 | 112.5 | E375 L376 D377 D382 M383 | E375-W379 WeakPolarHBondContact O-CB 3.25Å; E375-W379 PolarHBondContact O-N 3.35Å; L376-W379 PolarHBondContact O-N 2.89Å; D377-W379 PolarHBondContact O-N 3.27Å; W379-D382 PolarHBondContact O-N 3.14Å; W379-M383 HydrophobicContact CD2-CG 3.99Å; W379-M383 HydrophobicContact CE3-CG 4.14Å; W379-M383 HydrophobicContact CH2-CG 3.73Å; W379-M383 HydrophobicContact CH2-SD 4.49Å; W379-M383 HydrophobicContact CZ2-CG 3.53Å; W379-M383 HydrophobicContact CZ2-SD 4.04Å; W379-M383 HydrophobicContact CZ3-CG 4.02Å; W379-M383 WeakPolarHBondContact O-CB 3.25Å; W379-M383 PolarHBondContact O-N 2.86Å |
| 380 | Q | 97.3 | Very high | 96.6 | Very high | 82 Ų | 82 | 97.4 Ų | 97.4 | 38% | 0.383 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 174 | -74.1 | -177.2 | 7.6 | 0 | 0 | 111.9 | L376 D377 A378 M383 R384 | L376-Q380 HydrophobicContact CD2-CG 4.22Å; L376-Q380 WeakPolarHBondContact O-CG 3.29Å; L376-Q380 PolarHBondContact O-N 2.92Å; D377-Q380 WeakPolarHBondContact O-CB 3.44Å; D377-Q380 PolarHBondContact O-N 3.4Å; A378-Q380 VanDerWaalsContact C-N 3.31Å; A378-Q380 PolarHBondContact O-N 3.43Å; Q380-M383 PolarHBondContact O-N 3.14Å; Q380-R384 WeakPolarHBondContact O-CB 3.35Å; Q380-R384 WeakPolarHBondContact O-CG 3.4Å; Q380-R384 PolarHBondContact O-N 2.92Å |
| 381 | E | 97.1 | Very high | 96.4 | Very high | 139 Ų | 139 | 97 Ų | 97 | 65% | 0.65 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.7 | -45.8 | 175.1 | -72.1 | -178.9 | 175.8 | 0 | 0 | 111.5 | D377 A378 M383 R384 F385 | D377-E381 WeakPolarHBondContact O-CG 3.47Å; D377-E381 PolarHBondContact O-N 3.28Å; A378-E381 PolarHBondContact O-N 3.39Å; E381-M383 PolarHBondContact O-N 3.38Å; E381-R384 WeakPolarHBondContact O-CB 3.42Å; E381-R384 PolarHBondContact O-N 3.44Å; E381-F385 WeakPolarHBondContact O-CB 3.39Å; E381-F385 PolarHBondContact O-N 2.95Å |
| 382 | D | 97.8 | Very high | 96.2 | Very high | 110 Ų | 110 | 98.5 Ų | 98.5 | 59% | 0.588 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.3 | -45.2 | 175.8 | -77.3 | -17.1 | 0 | 0 | 0 | 111.6 | A378 W379 R384 F385 V386 | A378-D382 PolarHBondContact O-N 2.98Å; W379-D382 PolarHBondContact O-N 3.14Å; D382-R384 PolarHBondContact O-N 2.97Å; D382-F385 WeakPolarHBondContact O-CB 3.46Å; D382-F385 PolarHBondContact O-N 3.45Å; D382-V386 WeakPolarHBondContact O-CG2 3.26Å; D382-V386 PolarHBondContact O-N 3.48Å |
| 383 | M | 96.1 | Very high | 95.9 | Very high | 70 Ų | 70 | 97.9 Ų | 97.9 | 35% | 0.345 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.3 | -41 | 176.5 | -83.1 | -59.9 | -56.6 | 0 | 0 | 112.4 | W379 Q380 E381 F385 V386 I387 | W379-M383 HydrophobicContact CD2-CG 3.99Å; W379-M383 HydrophobicContact CE3-CG 4.14Å; W379-M383 HydrophobicContact CH2-CG 3.73Å; W379-M383 HydrophobicContact CH2-SD 4.49Å; W379-M383 HydrophobicContact CZ2-CG 3.53Å; W379-M383 HydrophobicContact CZ2-SD 4.04Å; W379-M383 HydrophobicContact CZ3-CG 4.02Å; W379-M383 WeakPolarHBondContact O-CB 3.25Å; W379-M383 PolarHBondContact O-N 2.86Å; Q380-M383 PolarHBondContact O-N 3.14Å; E381-M383 PolarHBondContact O-N 3.38Å; M383-F385 VanDerWaalsContact C-N 3.28Å; M383-F385 PolarHBondContact O-N 2.92Å; M383-V386 PolarHBondContact O-N 3.18Å; M383-I387 HydrophobicContact CE-CD1 4.34Å; M383-I387 HydrophobicContact CE-CG1 4.47Å; M383-I387 WeakPolarHBondContact O-CB 3.23Å; M383-I387 WeakPolarHBondContact O-CD1 3.27Å; M383-I387 WeakPolarHBondContact O-CG1 3.44Å; M383-I387 PolarHBondContact O-N 2.92Å |
| 384 | R | 95.6 | Very high | 95.6 | Very high | 167 Ų | 167 | 102 Ų | 102 | 63% | 0.63 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.2 | -41.6 | 173.2 | -75.7 | 168.8 | -178.8 | -109.8 | 3.7 | 110.8 | Q380 E381 D382 I387 N388 | Q380-R384 WeakPolarHBondContact O-CB 3.35Å; Q380-R384 WeakPolarHBondContact O-CG 3.4Å; Q380-R384 PolarHBondContact O-N 2.92Å; E381-R384 WeakPolarHBondContact O-CB 3.42Å; E381-R384 PolarHBondContact O-N 3.44Å; D382-R384 PolarHBondContact O-N 2.97Å; R384-I387 PolarHBondContact O-N 3.34Å; R384-N388 WeakPolarHBondContact O-CB 3.44Å; R384-N388 PolarHBondContact O-N 2.86Å; R384-N388 PolarHBondContact O-ND2 3.35Å |
| 385 | F | 97.1 | Very high | 95.1 | Very high | 135 Ų | 135 | 100.5 Ų | 100.5 | 59% | 0.592 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.6 | -47.7 | 176.4 | -175 | -93.2 | 0 | 0 | 0 | 111.7 | E381 D382 M383 I387 N388 Q389 | E381-F385 WeakPolarHBondContact O-CB 3.39Å; E381-F385 PolarHBondContact O-N 2.95Å; D382-F385 WeakPolarHBondContact O-CB 3.46Å; D382-F385 PolarHBondContact O-N 3.45Å; M383-F385 VanDerWaalsContact C-N 3.28Å; M383-F385 PolarHBondContact O-N 2.92Å; F385-I387 PolarHBondContact O-N 3.08Å; F385-N388 PolarHBondContact O-N 2.98Å; F385-Q389 WeakPolarHBondContact O-CB 3.31Å; F385-Q389 PolarHBondContact O-N 2.89Å |
| 386 | V | 97.2 | Very high | 94.6 | Very high | 57 Ų | 57 | 100 Ų | 100 | 35% | 0.345 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | D382 M383 Q389 Q390 | D382-V386 WeakPolarHBondContact O-CG2 3.26Å; D382-V386 PolarHBondContact O-N 3.48Å; M383-V386 PolarHBondContact O-N 3.18Å; V386-Q389 PolarHBondContact O-N 3.37Å; V386-Q390 HydrophobicContact CG1-CG 4.46Å; V386-Q390 WeakPolarHBondContact O-CB 3.48Å; V386-Q390 WeakPolarHBondContact O-CG 3.29Å; V386-Q390 PolarHBondContact O-N 3.39Å |
| 387 | I | 95 | Very high | 94.1 | Very high | 84 Ų | 84 | 100.9 Ų | 100.9 | 43% | 0.431 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.5 | -48.6 | 177.1 | -70 | 164.9 | 0 | 0 | 0 | 110.2 | M383 R384 F385 Q389 Q390 V391 | M383-I387 HydrophobicContact CE-CD1 4.34Å; M383-I387 HydrophobicContact CE-CG1 4.47Å; M383-I387 WeakPolarHBondContact O-CB 3.23Å; M383-I387 WeakPolarHBondContact O-CD1 3.27Å; M383-I387 WeakPolarHBondContact O-CG1 3.44Å; M383-I387 PolarHBondContact O-N 2.92Å; R384-I387 PolarHBondContact O-N 3.34Å; F385-I387 PolarHBondContact O-N 3.08Å; I387-Q389 VanDerWaalsContact C-N 3.31Å; I387-Q389 PolarHBondContact O-N 2.9Å; I387-Q390 PolarHBondContact O-N 2.85Å; I387-V391 HydrophobicContact CG2-CG2 4.39Å; I387-V391 VanDerWaalsContact O-CG2 3.32Å; I387-V391 WeakPolarHBondContact O-CG2 3.36Å; I387-V391 PolarHBondContact O-N 3.33Å |
| 388 | N | 95.2 | Very high | 93.4 | Very high | 100 Ų | 100 | 103.7 Ų | 103.7 | 54% | 0.535 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.6 | -41.8 | 178 | -73.4 | -20.7 | 0 | 0 | 0 | 111.5 | R384 F385 V391 L392 | R384-N388 WeakPolarHBondContact O-CB 3.44Å; R384-N388 PolarHBondContact O-N 2.86Å; R384-N388 PolarHBondContact O-ND2 3.35Å; F385-N388 PolarHBondContact O-N 2.98Å; N388-V391 PolarHBondContact O-N 2.93Å; N388-L392 WeakPolarHBondContact O-CB 3.26Å; N388-L392 WeakPolarHBondContact O-CG 3.46Å; N388-L392 PolarHBondContact O-N 3.47Å |
| 389 | Q | 94.6 | Very high | 92.7 | Very high | 92 Ų | 92 | 107.3 Ų | 107.3 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 175.7 | -169.9 | 177.6 | 37.4 | 0 | 0 | 111.7 | F385 V386 I387 L392 Q393 | F385-Q389 WeakPolarHBondContact O-CB 3.31Å; F385-Q389 PolarHBondContact O-N 2.89Å; V386-Q389 PolarHBondContact O-N 3.37Å; I387-Q389 VanDerWaalsContact C-N 3.31Å; I387-Q389 PolarHBondContact O-N 2.9Å; Q389-L392 PolarHBondContact O-N 2.73Å; Q389-Q393 WeakPolarHBondContact O-CB 3.4Å; Q389-Q393 VanDerWaalsContact O-CG 3.26Å; Q389-Q393 WeakPolarHBondContact O-CG 3.35Å; Q389-Q393 PolarHBondContact O-N 3.39Å |
| 390 | Q | 92.8 | Very high | 91.9 | Very high | 87 Ų | 87 | 105 Ų | 105 | 41% | 0.407 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.4 | -37.8 | 175.6 | -75 | -177.8 | 10.1 | 0 | 0 | 112.5 | V386 I387 R394 | V386-Q390 HydrophobicContact CG1-CG 4.46Å; V386-Q390 WeakPolarHBondContact O-CB 3.48Å; V386-Q390 WeakPolarHBondContact O-CG 3.29Å; V386-Q390 PolarHBondContact O-N 3.39Å; I387-Q390 PolarHBondContact O-N 2.85Å; Q390-R394 WeakPolarHBondContact O-CB 3.46Å; Q390-R394 WeakPolarHBondContact O-CG 3.35Å; Q390-R394 PolarHBondContact O-N 2.91Å |
| 391 | V | 94.1 | Very high | 90.9 | Very high | 63 Ų | 63 | 107.3 Ų | 107.3 | 38% | 0.382 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.1 | -49.9 | 175.2 | 170.6 | 0 | 0 | 0 | 0 | 109.9 | I387 N388 Q393 R394 E395 | I387-V391 HydrophobicContact CG2-CG2 4.39Å; I387-V391 VanDerWaalsContact O-CG2 3.32Å; I387-V391 WeakPolarHBondContact O-CG2 3.36Å; I387-V391 PolarHBondContact O-N 3.33Å; N388-V391 PolarHBondContact O-N 2.93Å; V391-Q393 PolarHBondContact O-N 2.78Å; V391-R394 PolarHBondContact O-N 3.37Å; V391-E395 WeakPolarHBondContact O-CG 3.47Å; V391-E395 PolarHBondContact O-N 3.09Å |
| 392 | L | 93.7 | Very high | 89.7 | Confident | 101 Ų | 101 | 106.7 Ų | 106.7 | 53% | 0.529 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 177 | -72.3 | 171.7 | 0 | 0 | 0 | 112 | N388 Q389 R394 E395 E396 | N388-L392 WeakPolarHBondContact O-CB 3.26Å; N388-L392 WeakPolarHBondContact O-CG 3.46Å; N388-L392 PolarHBondContact O-N 3.47Å; Q389-L392 PolarHBondContact O-N 2.73Å; L392-R394 PolarHBondContact O-N 2.84Å; L392-E395 PolarHBondContact O-N 2.84Å; L392-E396 WeakPolarHBondContact O-CG 3.48Å; L392-E396 PolarHBondContact O-N 3.39Å |
| 393 | Q | 91.4 | Very high | 88.4 | Confident | 96 Ų | 96 | 107.2 Ų | 107.2 | 45% | 0.449 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.8 | -43.7 | 175.4 | -77.2 | 176.5 | 1 | 0 | 0 | 111.8 | Q389 V391 E395 E396 E397 | Q389-Q393 WeakPolarHBondContact O-CB 3.4Å; Q389-Q393 VanDerWaalsContact O-CG 3.26Å; Q389-Q393 WeakPolarHBondContact O-CG 3.35Å; Q389-Q393 PolarHBondContact O-N 3.39Å; V391-Q393 PolarHBondContact O-N 2.78Å; Q393-E395 VanDerWaalsContact C-N 3.33Å; Q393-E395 PolarHBondContact O-N 3.37Å; Q393-E396 PolarHBondContact O-N 3.04Å; Q393-E397 WeakPolarHBondContact O-CB 3.36Å; Q393-E397 WeakPolarHBondContact O-CG 3.49Å; Q393-E397 PolarHBondContact O-N 2.84Å |
| 394 | R | 90.1 | Very high | 87 | Confident | 146 Ų | 146 | 110.4 Ų | 110.4 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.7 | -38.3 | 175.4 | -79.4 | -172.9 | -178.8 | 117 | -0.3 | 112.1 | Q390 V391 L392 K398 | Q390-R394 WeakPolarHBondContact O-CB 3.46Å; Q390-R394 WeakPolarHBondContact O-CG 3.35Å; Q390-R394 PolarHBondContact O-N 2.91Å; V391-R394 PolarHBondContact O-N 3.37Å; L392-R394 PolarHBondContact O-N 2.84Å; R394-K398 WeakPolarHBondContact O-CB 3.36Å; R394-K398 WeakPolarHBondContact O-CG 3.17Å; R394-K398 PolarHBondContact O-N 3.36Å |
| 395 | E | 86.8 | Confident | 85.3 | Confident | 91 Ų | 91 | 109.3 Ų | 109.3 | 43% | 0.425 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.5 | -42.3 | 175.5 | -74.1 | -178.8 | -178.8 | 0 | 0 | 112 | V391 L392 Q393 K398 K399 | V391-E395 WeakPolarHBondContact O-CG 3.47Å; V391-E395 PolarHBondContact O-N 3.09Å; L392-E395 PolarHBondContact O-N 2.84Å; Q393-E395 VanDerWaalsContact C-N 3.33Å; Q393-E395 PolarHBondContact O-N 3.37Å; E395-K398 PolarHBondContact O-N 2.86Å; E395-K399 WeakPolarHBondContact O-CB 3.49Å; E395-K399 WeakPolarHBondContact O-CG 3.44Å; E395-K399 PolarHBondContact O-N 3.43Å |
| 396 | E | 86.6 | Confident | 83.4 | Confident | 106 Ų | 106 | 106.3 Ų | 106.3 | 50% | 0.495 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.8 | -40.6 | 173.6 | -76.2 | -173 | -170.9 | 0 | 0 | 112.3 | L392 Q393 K398 K399 K400 | L392-E396 WeakPolarHBondContact O-CG 3.48Å; L392-E396 PolarHBondContact O-N 3.39Å; Q393-E396 PolarHBondContact O-N 3.04Å; E396-K398 VanDerWaalsContact C-N 3.34Å; E396-K399 PolarHBondContact O-N 2.94Å; E396-K400 VanDerWaalsContact O-CB 3.29Å; E396-K400 WeakPolarHBondContact O-CB 3.49Å; E396-K400 WeakPolarHBondContact O-CG 3.31Å; E396-K400 PolarHBondContact O-N 2.85Å; E396-K400 IonicContact OE2-NZ 3.07Å |
| 397 | E | 86 | Confident | 81.5 | Confident | 108 Ų | 108 | 108 Ų | 108 | 51% | 0.505 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 173.9 | -78.5 | -175.2 | 179 | 0 | 0 | 111.7 | Q393 K401 | Q393-E397 WeakPolarHBondContact O-CB 3.36Å; Q393-E397 WeakPolarHBondContact O-CG 3.49Å; Q393-E397 PolarHBondContact O-N 2.84Å; E397-K401 WeakPolarHBondContact O-CB 3.49Å; E397-K401 VanDerWaalsContact O-CG 3.22Å; E397-K401 WeakPolarHBondContact O-CG 3.32Å; E397-K401 PolarHBondContact O-N 3.47Å |
| 398 | K | 83.8 | Confident | 79.4 | Confident | 133 Ų | 133 | 110 Ų | 110 | 58% | 0.578 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.6 | -49.4 | 172.8 | -77.5 | 173.2 | -179.5 | -177.1 | 0 | 110.7 | R394 E395 E396 K400 K401 E402 | R394-K398 WeakPolarHBondContact O-CB 3.36Å; R394-K398 WeakPolarHBondContact O-CG 3.17Å; R394-K398 PolarHBondContact O-N 3.36Å; E395-K398 PolarHBondContact O-N 2.86Å; E396-K398 VanDerWaalsContact C-N 3.34Å; K398-K400 PolarHBondContact O-N 2.89Å; K398-K401 WeakPolarHBondContact O-CB 3.32Å; K398-K401 PolarHBondContact O-N 2.82Å; K398-K401 VanDerWaalsContact O-N 3.17Å; K398-E402 WeakPolarHBondContact O-CG 3.48Å; K398-E402 PolarHBondContact O-N 3.31Å |
| 399 | K | 81.6 | Confident | 77 | Confident | 123 Ų | 123 | 107.9 Ų | 107.9 | 54% | 0.535 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.4 | -73.2 | 174.6 | -177.7 | 173.6 | 0 | 112.2 | E395 E396 K401 E402 E403 | E395-K399 WeakPolarHBondContact O-CB 3.49Å; E395-K399 WeakPolarHBondContact O-CG 3.44Å; E395-K399 PolarHBondContact O-N 3.43Å; E396-K399 PolarHBondContact O-N 2.94Å; K399-K401 VanDerWaalsContact C-N 3.33Å; K399-K401 PolarHBondContact O-N 3.35Å; K399-E402 PolarHBondContact O-N 2.83Å; K399-E403 WeakPolarHBondContact O-CB 3.35Å; K399-E403 WeakPolarHBondContact O-CG 3.2Å; K399-E403 PolarHBondContact O-N 3.13Å |
| 400 | K | 81 | Confident | 74.9 | Confident | 114 Ų | 114 | 110.7 Ų | 110.7 | 50% | 0.496 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.5 | -33.1 | 175.6 | -77.4 | 173.5 | -179 | 161.3 | 0 | 112.4 | E396 K398 K404 | E396-K400 VanDerWaalsContact O-CB 3.29Å; E396-K400 WeakPolarHBondContact O-CB 3.49Å; E396-K400 WeakPolarHBondContact O-CG 3.31Å; E396-K400 PolarHBondContact O-N 2.85Å; E396-K400 IonicContact OE2-NZ 3.07Å; K398-K400 PolarHBondContact O-N 2.89Å; K400-K404 WeakPolarHBondContact O-CB 3.4Å; K400-K404 WeakPolarHBondContact O-CG 3.15Å; K400-K404 PolarHBondContact O-N 2.84Å |
| 401 | K | 74.9 | Confident | 72.8 | Confident | 131 Ų | 131 | 115 Ų | 115 | 57% | 0.57 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.9 | -42.9 | 172.2 | -77.7 | 173.1 | -174.6 | 174.4 | 0 | 110.8 | E397 K398 K399 K404 E405 | E397-K401 WeakPolarHBondContact O-CB 3.49Å; E397-K401 VanDerWaalsContact O-CG 3.22Å; E397-K401 WeakPolarHBondContact O-CG 3.32Å; E397-K401 PolarHBondContact O-N 3.47Å; K398-K401 WeakPolarHBondContact O-CB 3.32Å; K398-K401 PolarHBondContact O-N 2.82Å; K398-K401 VanDerWaalsContact O-N 3.17Å; K399-K401 VanDerWaalsContact C-N 3.33Å; K399-K401 PolarHBondContact O-N 3.35Å; K401-K404 PolarHBondContact O-N 2.89Å; K401-E405 VanDerWaalsContact O-CB 3.31Å; K401-E405 WeakPolarHBondContact O-CB 3.25Å; K401-E405 WeakPolarHBondContact O-CG 3.37Å; K401-E405 PolarHBondContact O-N 3.46Å |
| 402 | E | 71.9 | Confident | 70.4 | Confident | 126 Ų | 126 | 121.3 Ų | 121.3 | 59% | 0.589 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.6 | -40.6 | 174.8 | -71.8 | 171.7 | 178.9 | 0 | 0 | 112.1 | K398 K399 E405 S406 | K398-E402 WeakPolarHBondContact O-CG 3.48Å; K398-E402 PolarHBondContact O-N 3.31Å; K399-E402 PolarHBondContact O-N 2.83Å; E402-E405 PolarHBondContact O-N 3.41Å; E402-S406 WeakPolarHBondContact O-CB 3.41Å; E402-S406 PolarHBondContact O-N 2.94Å |
| 403 | E | 70.8 | Confident | 67.9 | Low | 122 Ų | 122 | 121.7 Ų | 121.7 | 57% | 0.57 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.9 | -36.4 | 174.3 | -74 | 175.7 | 177.6 | 0 | 0 | 112.7 | K399 S406 T407 | K399-E403 WeakPolarHBondContact O-CB 3.35Å; K399-E403 WeakPolarHBondContact O-CG 3.2Å; K399-E403 PolarHBondContact O-N 3.13Å; E403-S406 WeakPolarHBondContact CA-OG 3.46Å; E403-S406 PolarHBondContact O-N 3.44Å; E403-S406 PolarHBondContact O-OG 3.03Å; E403-T407 WeakPolarHBondContact O-CB 3.25Å; E403-T407 WeakPolarHBondContact O-CG2 3.46Å; E403-T407 PolarHBondContact O-N 3.09Å; E403-T407 PolarHBondContact O-OG1 3.44Å |
| 404 | K | 67.3 | Low | 65.9 | Low | 136 Ų | 136 | 126.8 Ų | 126.8 | 59% | 0.591 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.7 | -36.4 | 172.4 | -78.5 | 177.4 | -179.4 | -178.3 | 0 | 111.5 | K400 K401 T407 F408 | K400-K404 WeakPolarHBondContact O-CB 3.4Å; K400-K404 WeakPolarHBondContact O-CG 3.15Å; K400-K404 PolarHBondContact O-N 2.84Å; K401-K404 PolarHBondContact O-N 2.89Å; K404-T407 WeakPolarHBondContact CA-OG1 3.23Å; K404-T407 PolarHBondContact O-OG1 3.05Å; K404-F408 WeakPolarHBondContact O-CB 3.24Å; K404-F408 PolarHBondContact O-N 2.93Å |
| 405 | E | 60.3 | Low | 63.4 | Low | 144 Ų | 144 | 125.3 Ų | 125.3 | 67% | 0.673 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -69.6 | -33.4 | 172.7 | -79 | -179.9 | 173.4 | 0 | 0 | 111.9 | K401 E402 G409 | K401-E405 VanDerWaalsContact O-CB 3.31Å; K401-E405 WeakPolarHBondContact O-CB 3.25Å; K401-E405 WeakPolarHBondContact O-CG 3.37Å; K401-E405 PolarHBondContact O-N 3.46Å; E402-E405 PolarHBondContact O-N 3.41Å; E405-G409 WeakPolarHBondContact O-CA 3.28Å; E405-G409 PolarHBondContact O-N 2.95Å |
| 406 | S | 55.4 | Low | 61.5 | Low | 73 Ų | 73 | 128.2 Ų | 128.2 | 51% | 0.51 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -73.3 | -33.8 | 173.9 | 78.7 | 0 | 0 | 0 | 0 | 112.8 | E402 E403 L410 | E402-S406 WeakPolarHBondContact O-CB 3.41Å; E402-S406 PolarHBondContact O-N 2.94Å; E403-S406 WeakPolarHBondContact CA-OG 3.46Å; E403-S406 PolarHBondContact O-N 3.44Å; E403-S406 PolarHBondContact O-OG 3.03Å; S406-L410 WeakPolarHBondContact O-CD1 3.39Å |
| 407 | T | 58.3 | Low | 59.2 | Low | 93 Ų | 93 | 134.9 Ų | 134.9 | 57% | 0.571 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -83.3 | -38.8 | 177.3 | 51.5 | 0 | 0 | 0 | 0 | 113.5 | E403 K404 | E403-T407 WeakPolarHBondContact O-CB 3.25Å; E403-T407 WeakPolarHBondContact O-CG2 3.46Å; E403-T407 PolarHBondContact O-N 3.09Å; E403-T407 PolarHBondContact O-OG1 3.44Å; K404-T407 WeakPolarHBondContact CA-OG1 3.23Å; K404-T407 PolarHBondContact O-OG1 3.05Å |
| 408 | F | 49.8 | Very low | 57.4 | Low | 125 Ų | 125 | 136.4 Ų | 136.4 | 55% | 0.548 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -77.9 | -19.9 | 170.5 | -90.5 | -94.4 | 0 | 0 | 0 | 113.3 | K404 L410 Q411 R412 | K404-F408 WeakPolarHBondContact O-CB 3.24Å; K404-F408 PolarHBondContact O-N 2.93Å; F408-L410 PolarHBondContact O-N 3.02Å; F408-Q411 PolarHBondContact O-N 3.46Å; F408-R412 HydrophobicContact CD1-CB 4.44Å; F408-R412 PolarHBondContact O-N 3.25Å; F408-R412 VanDerWaalsContact O-N 3.12Å |
| 409 | G | 46.6 | Very low | 55.2 | Low | 55 Ų | 55 | 139.9 Ų | 139.9 | 57% | 0.567 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -16.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | E405 | E405-G409 WeakPolarHBondContact O-CA 3.28Å; E405-G409 PolarHBondContact O-N 2.95Å |
| 410 | L | 49.3 | Very low | 53.1 | Low | 151 Ų | 151 | 137.3 Ų | 137.3 | 79% | 0.791 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -11.2 | 169.9 | -89.6 | 87.5 | 0 | 0 | 0 | 114.6 | S406 F408 | S406-L410 WeakPolarHBondContact O-CD1 3.39Å; F408-L410 PolarHBondContact O-N 3.02Å |
| 411 | Q | 49.1 | Very low | 51.5 | Low | 178 Ų | 178 | 141.7 Ų | 141.7 | 83% | 0.832 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.7 | 0.8 | -172.5 | -73.2 | -149.9 | -43 | 0 | 0 | 117.6 | F408 | F408-Q411 PolarHBondContact O-N 3.46Š|
| 412 | R | 43.7 | Very low | 49.7 | Very low | 196 Ų | 196 | 139.1 Ų | 139.1 | 74% | 0.74 | 73% | 0.732 | S | S | * | * | trans | -141.1 | 59.6 | -175.5 | -147.8 | 173.5 | 170.7 | -163.3 | -3.5 | 115.5 | F408 | F408-R412 HydrophobicContact CD1-CB 4.44Å; F408-R412 PolarHBondContact O-N 3.25Å; F408-R412 VanDerWaalsContact O-N 3.12Å | ||
| 413 | S | 40.3 | Very low | 48.2 | Very low | 109 Ų | 109 | 136.5 Ų | 136.5 | 76% | 0.762 | 74% | 0.739 | S | S | * | * | trans | -90.1 | 103.9 | 155.1 | -49.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 414 | K | 50.8 | Low | 47 | Very low | 202 Ų | 202 | 140.3 Ų | 140.3 | 88% | 0.878 | 75% | 0.754 | S | S | * | * | trans | 154.3 | 100.2 | 149.1 | -83.5 | 165.4 | -167.1 | -169.3 | 0 | 109.9 | ||||
| 415 | S | 36.9 | Very low | 46.2 | Very low | 116 Ų | 116 | 137.5 Ų | 137.5 | 81% | 0.811 | 76% | 0.763 | S | S | * | * | trans | -179.9 | 104.9 | 140.5 | 177.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 416 | L | 46.9 | Very low | 45.9 | Very low | 152 Ų | 152 | 139.2 Ų | 139.2 | 80% | 0.796 | 77% | 0.769 | S | S | * | * | trans | -9.7 | 134.9 | 143.1 | -98.1 | 144.2 | 0 | 0 | 0 | 117.1 | ||||
| 417 | R | 39.3 | Very low | 45.4 | Very low | 245 Ų | 245 | 145.7 Ų | 145.7 | 93% | 0.925 | 79% | 0.788 | S | S | * | * | -169.3 | 125.4 | 119.7 | -106.1 | 175.9 | -164.7 | 179.3 | 5.6 | 113.2 | |||||
| 418 | V | 46.5 | Very low | 44.9 | Very low | 141 Ų | 141 | 146.7 Ų | 146.7 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | trans | -89.2 | 129.7 | 158 | 168.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 419 | K | 38.4 | Very low | 44.7 | Very low | 205 Ų | 205 | 146.1 Ų | 146.1 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | trans | -174.5 | 108.5 | 154.6 | -155.6 | 166.7 | 179.1 | 175.6 | 0 | 105.6 | ||||
| 420 | G | 37.8 | Very low | 44.7 | Very low | 69 Ų | 69 | 150.8 Ų | 150.8 | 71% | 0.711 | 82% | 0.822 | S | S | * | * | 102.6 | 107.3 | 65.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 421 | E | 46.1 | Very low | 44.8 | Very low | 206 Ų | 206 | 153.8 Ų | 153.8 | 96% | 0.963 | 83% | 0.829 | S | S | * | * | trans | 10 | 137.6 | 164.9 | -71.6 | 176.6 | 128.6 | 0 | 0 | 121.2 | ||||
| 422 | G | 38 | Very low | 44.7 | Very low | 77 Ų | 77 | 154.5 Ų | 154.5 | 79% | 0.794 | 83% | 0.829 | S | S | * | * | trans | 174.2 | 81.8 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 423 | G | 40.8 | Very low | 44.8 | Very low | 72 Ų | 72 | 152.2 Ų | 152.2 | 74% | 0.742 | 83% | 0.832 | S | S | * | * | 70.7 | 121.2 | 128.2 | 0 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 424 | K | 46.1 | Very low | 44.9 | Very low | 201 Ų | 201 | 160.8 Ų | 160.8 | 87% | 0.874 | 86% | 0.855 | S | S | * | * | trans | 85 | 114 | 134.2 | -66.7 | 174.5 | 175.7 | 176.8 | 0 | 118.2 | ||||
| 425 | G | 49.8 | Very low | 44.6 | Very low | 77 Ų | 77 | 158.7 Ų | 158.7 | 79% | 0.794 | 85% | 0.854 | S | S | * | * | trans | -59.6 | 144.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 426 | F | 54.8 | Low | 45 | Very low | 181 Ų | 181 | 160.9 Ų | 160.9 | 79% | 0.794 | 86% | 0.856 | S | S | * | * | S | Bend | trans | -120.8 | 10.4 | -174.8 | -119.8 | -86.9 | 0 | 0 | 0 | 113.8 | ||
| 427 | F | 45 | Very low | 44.9 | Very low | 209 Ų | 209 | 161.4 Ų | 161.4 | 92% | 0.917 | 86% | 0.859 | S | S | * | * | trans | -136.3 | 47.1 | -176.7 | -67.6 | -73.8 | 0 | 0 | 0 | 114.8 | ||||
| 428 | S | 46.5 | Very low | 45.2 | Very low | 113 Ų | 113 | 156.5 Ų | 156.5 | 79% | 0.79 | 86% | 0.856 | S | S | * | * | trans | -128.9 | 74.7 | 165.9 | 65.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 429 | S | 45.5 | Very low | 45.1 | Very low | 114 Ų | 114 | 157.5 Ų | 157.5 | 80% | 0.797 | 86% | 0.856 | S | S | * | * | trans | -162.8 | 21.7 | 165.2 | 60.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 430 | L | 47.5 | Very low | 45.6 | Very low | 153 Ų | 153 | 154.3 Ų | 154.3 | 80% | 0.801 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -111.7 | 15.3 | -174.8 | -119.4 | 142.6 | 0 | 0 | 0 | 116.7 | ||
| 431 | F | 50 | Low | 46.1 | Very low | 213 Ų | 213 | 160.4 Ų | 160.4 | 93% | 0.934 | 86% | 0.863 | S | S | * | * | trans | -137.5 | 92.3 | 162 | -71.3 | -77.6 | 0 | 0 | 0 | 109.5 | ||||
| 432 | K | 47.4 | Very low | 46.1 | Very low | 193 Ų | 193 | 156.9 Ų | 156.9 | 84% | 0.839 | 86% | 0.856 | S | S | * | * | trans | -132.2 | 102.2 | 161.2 | -161.9 | 173.1 | -174 | 177.7 | 0 | 107 | ||||
| 433 | D | 46.6 | Very low | 46.8 | Very low | 149 Ų | 149 | 163.6 Ų | 163.6 | 80% | 0.797 | 86% | 0.861 | S | S | * | * | trans | 22.5 | 115 | 155.8 | -56.3 | -30.4 | 0 | 0 | 0 | 118 | ||||
| 434 | K | 41.7 | Very low | 47.4 | Very low | 288 Ų | 288 | 171.9 Ų | 171.9 | 100% | 1.252 | 87% | 0.872 | S | S | * | * | -159.1 | 0 | 125.8 | -106.7 | 176.6 | -172.7 | -175.3 | 0 | 111.2 |
Retrieved 434 of 434 residues in 92.3 ms
(Link to these results)