| 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 | 44.2 | Very low | 50.4 | Low | 248 Ų | 248 | 142.9 Ų | 142.9 | 100% | 1.222 | 84% | 0.835 | S | S | * | * | 0 | 100.8 | 0 | -68.3 | 160.3 | 77.1 | 0 | 0 | 107.4 | |||||
| 2 | S | 49.8 | Very low | 50.4 | Low | 111 Ų | 111 | 137.9 Ų | 137.9 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | -118.4 | 112.6 | 173.2 | 52.9 | 0 | 0 | 0 | 0 | 107.9 | V4 | S2-V4 PolarHBondContact O-N 2.9Š| ||
| 3 | L | 48.3 | Very low | 50.1 | Low | 175 Ų | 175 | 138.7 Ų | 138.7 | 92% | 0.916 | 81% | 0.812 | S | S | * | * | trans | -62.8 | 116.4 | 173.9 | -100.5 | 78.9 | 0 | 0 | 0 | 109 | ||||
| 4 | V | 60.1 | Low | 49.8 | Very low | 118 Ų | 118 | 137 Ų | 137 | 72% | 0.715 | 81% | 0.811 | S | S | * | * | trans | -90.8 | 109.6 | 162.5 | 177.5 | 0 | 0 | 0 | 0 | 106.4 | S2 Y6 | S2-V4 PolarHBondContact O-N 2.9Å; V4-Y6 PolarHBondContact O-N 3.08Å | ||
| 5 | A | 55.9 | Low | 49.4 | Very low | 95 Ų | 95 | 138 Ų | 138 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -72 | 115.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | G7 | A5-G7 PolarHBondContact O-N 3.04Š| ||
| 6 | Y | 55.8 | Low | 49 | Very low | 217 Ų | 217 | 138.1 Ų | 138.1 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | -75.1 | 117.6 | 167 | -85.7 | -100.4 | 0 | 0 | 0 | 108.6 | V4 S8 | V4-Y6 PolarHBondContact O-N 3.08Å; Y6-S8 PolarHBondContact O-N 3.22Å | ||
| 7 | G | 52.6 | Low | 48.2 | Very low | 83 Ų | 83 | 137.4 Ų | 137.4 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -65.9 | 95.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | A5 S9 | A5-G7 PolarHBondContact O-N 3.04Å; G7-S9 PolarHBondContact O-N 3.15Å | ||
| 8 | S | 44.5 | Very low | 47.9 | Very low | 108 Ų | 108 | 135.5 Ų | 135.5 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | trans | -87 | 88.9 | 164.7 | -165.7 | 0 | 0 | 0 | 0 | 107.4 | Y6 D10 | Y6-S8 PolarHBondContact O-N 3.22Å; S8-D10 VanDerWaalsContact C-N 3.27Å; S8-D10 PolarHBondContact O-N 2.84Å; S8-D10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | S | 47.7 | Very low | 47.1 | Very low | 118 Ų | 118 | 135.4 Ų | 135.4 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -82.1 | 85.2 | 164 | -87.3 | 0 | 0 | 0 | 0 | 108.4 | G7 E11 | G7-S9 PolarHBondContact O-N 3.15Å; S9-E11 PolarHBondContact O-N 3.06Å | ||
| 10 | D | 53.5 | Low | 46.6 | Very low | 120 Ų | 120 | 134.7 Ų | 134.7 | 64% | 0.642 | 79% | 0.794 | S | S | * | * | trans | -75 | 91.9 | 156.5 | -173.8 | 82.4 | 0 | 0 | 0 | 107.1 | S8 S12 | S8-D10 VanDerWaalsContact C-N 3.27Å; S8-D10 PolarHBondContact O-N 2.84Å; S8-D10 VanDerWaalsContact O-N 3.15Å; D10-S12 VanDerWaalsContact C-N 3.28Å; D10-S12 PolarHBondContact O-N 2.8Å; D10-S12 PolarHBondContact OD2-OG 3.26Å | ||
| 11 | E | 42 | Very low | 46.1 | Very low | 179 Ų | 179 | 132.8 Ų | 132.8 | 84% | 0.836 | 79% | 0.794 | S | S | * | * | trans | -85.9 | 81 | 170.9 | -164.5 | 70 | -151.6 | 0 | 0 | 107.5 | S9 D13 | S9-E11 PolarHBondContact O-N 3.06Å; E11-D13 PolarHBondContact O-N 2.98Å | ||
| 12 | S | 50.4 | Low | 45.5 | Very low | 83 Ų | 83 | 125.7 Ų | 125.7 | 58% | 0.58 | 77% | 0.774 | S | S | * | * | trans | -72.4 | 119.4 | 173.6 | -85.7 | 0 | 0 | 0 | 0 | 111 | D10 | D10-S12 VanDerWaalsContact C-N 3.28Å; D10-S12 PolarHBondContact O-N 2.8Å; D10-S12 PolarHBondContact OD2-OG 3.26Å | ||
| 13 | D | 46.4 | Very low | 44.9 | Very low | 148 Ų | 148 | 124.9 Ų | 124.9 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | -56.4 | 127.4 | 166 | -167.5 | 22 | 0 | 0 | 0 | 110.9 | E11 | E11-D13 PolarHBondContact O-N 2.98Š| ||
| 14 | S | 46.3 | Very low | 44.2 | Very low | 115 Ų | 115 | 125.8 Ų | 125.8 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | -125.6 | 114.1 | 172.8 | 54 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 15 | E | 43.7 | Very low | 43.4 | Very low | 152 Ų | 152 | 125.6 Ų | 125.6 | 71% | 0.71 | 78% | 0.778 | S | S | * | * | trans | -79.4 | 152.5 | 173.8 | -70.9 | -131.7 | 139.4 | 0 | 0 | 112.4 | ||||
| 16 | E | 42.3 | Very low | 42.8 | Very low | 139 Ų | 139 | 130.6 Ų | 130.6 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | trans | -12.9 | 142.3 | 169.6 | 46.5 | -115.4 | 66.4 | 0 | 0 | 122.8 | ||||
| 17 | T | 36.5 | Very low | 42.2 | Very low | 126 Ų | 126 | 126.6 Ų | 126.6 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | 177 | 128.7 | 99 | 36.3 | 0 | 0 | 0 | 0 | 115 | |||||
| 18 | S | 42.3 | Very low | 41.8 | Very low | 104 Ų | 104 | 128.8 Ų | 128.8 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | 61.6 | 127.3 | 144.2 | -50.5 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 19 | T | 33 | Very low | 42.1 | Very low | 134 Ų | 134 | 127.1 Ų | 127.1 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | -172.2 | 140.5 | 71.7 | 43.6 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 20 | S | 37.7 | Very low | 42.4 | Very low | 121 Ų | 121 | 124.9 Ų | 124.9 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | trans | 49 | 112.1 | 147.1 | -170.2 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 21 | A | 34.7 | Very low | 43.3 | Very low | 95 Ų | 95 | 121.2 Ų | 121.2 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | 173.5 | 130.4 | 107.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 22 | A | 32.7 | Very low | 44.7 | Very low | 98 Ų | 98 | 120 Ų | 120 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | 20.3 | 123.8 | 152.9 | 0 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 23 | A | 37.5 | Very low | 45.6 | Very low | 95 Ų | 95 | 124.3 Ų | 124.3 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | 52.3 | 109.5 | 131.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 24 | E | 33.7 | Very low | 46.9 | Very low | 193 Ų | 193 | 121.1 Ų | 121.1 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | 171 | 137.4 | 100.8 | -89.7 | -167.4 | 168.5 | 0 | 0 | 110.3 | |||||
| 25 | S | 43 | Very low | 48.1 | Very low | 115 Ų | 115 | 124.2 Ų | 124.2 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | trans | -69.8 | 128.7 | -176.9 | 52.7 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 26 | K | 43.3 | Very low | 49.7 | Very low | 200 Ų | 200 | 122.4 Ų | 122.4 | 87% | 0.87 | 76% | 0.761 | S | S | * | * | trans | -159.5 | 128.7 | 152.8 | -105.1 | 162.2 | -170.4 | 171.9 | 0 | 110.5 | S28 | K26-S28 PolarHBondContact O-N 3.11Š| ||
| 27 | P | 41.9 | Very low | 51 | Low | 133 Ų | 133 | 121.5 Ų | 121.5 | 86% | 0.864 | 77% | 0.767 | S | S | * | * | trans | -77.7 | 105.8 | 174.8 | 30.2 | -31.1 | 0 | 0 | 0 | 109.9 | G29 | P27-G29 VanDerWaalsContact C-N 3.33Å; P27-G29 PolarHBondContact O-N 3.01Å; P27-G29 VanDerWaalsContact O-N 3.08Å | ||
| 28 | S | 45.1 | Very low | 52.6 | Low | 129 Ų | 129 | 119.7 Ų | 119.7 | 90% | 0.902 | 77% | 0.765 | S | S | * | * | trans | -77.4 | 84.7 | 168.5 | -172.4 | 0 | 0 | 0 | 0 | 109.3 | K26 | K26-S28 PolarHBondContact O-N 3.11Š| ||
| 29 | G | 51.2 | Low | 53.6 | Low | 72 Ų | 72 | 120.9 Ų | 120.9 | 74% | 0.742 | 77% | 0.77 | S | S | * | * | trans | -98 | 68 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | P27 G31 | P27-G29 VanDerWaalsContact C-N 3.33Å; P27-G29 PolarHBondContact O-N 3.01Å; P27-G29 VanDerWaalsContact O-N 3.08Å; G29-G31 VanDerWaalsContact C-N 3.33Å; G29-G31 PolarHBondContact O-N 3.39Å | ||
| 30 | G | 54 | Low | 54.8 | Low | 71 Ų | 71 | 124.8 Ų | 124.8 | 73% | 0.732 | 78% | 0.776 | S | S | * | * | trans | -88.4 | 61.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 31 | G | 71.3 | Confident | 55.5 | Low | 43 Ų | 43 | 123.9 Ų | 123.9 | 44% | 0.443 | 78% | 0.776 | S | S | . | * | trans | -86.4 | 154.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | G29 F33 S34 | G29-G31 VanDerWaalsContact C-N 3.33Å; G29-G31 PolarHBondContact O-N 3.39Å; G31-F33 PolarHBondContact O-N 3.31Å; G31-S34 PolarHBondContact O-N 3.08Å; G31-S34 PolarHBondContact O-OG 3.32Å | ||
| 32 | L | 72.3 | Confident | 55.7 | Low | 155 Ų | 155 | 125.3 Ų | 125.3 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -48.3 | -11.6 | -178.8 | -63.2 | 166.5 | 0 | 0 | 0 | 116.1 | ||
| 33 | F | 69.7 | Low | 56 | Low | 172 Ų | 172 | 124.6 Ų | 124.6 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | G | 310 helix | trans | -84.1 | -9.7 | 176.2 | -61.2 | -77.7 | 0 | 0 | 0 | 114.1 | G31 F35 L36 | G31-F33 PolarHBondContact O-N 3.31Å; F33-F35 VanDerWaalsContact C-N 3.26Å; F33-F35 PolarHBondContact O-N 2.73Å; F33-L36 HydrophobicContact CD1-CD1 3.89Å; F33-L36 PolarHBondContact O-N 2.86Å |
| 34 | S | 72.5 | Confident | 56.1 | Low | 81 Ų | 81 | 126 Ų | 126 | 57% | 0.566 | 79% | 0.786 | S | S | * | * | G | 310 helix | trans | -74.4 | -14.2 | 175.1 | 59.1 | 0 | 0 | 0 | 0 | 113.9 | G31 L36 | G31-S34 PolarHBondContact O-N 3.08Å; G31-S34 PolarHBondContact O-OG 3.32Å; S34-L36 VanDerWaalsContact C-N 3.33Å |
| 35 | F | 72.6 | Confident | 56.2 | Low | 180 Ų | 180 | 121.3 Ų | 121.3 | 79% | 0.789 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -86.8 | -1.9 | 173.2 | -69.4 | -77.5 | 0 | 0 | 0 | 113.4 | F33 | F33-F35 VanDerWaalsContact C-N 3.26Å; F33-F35 PolarHBondContact O-N 2.73Å |
| 36 | L | 75.9 | Confident | 56 | Low | 114 Ų | 114 | 121 Ų | 121 | 60% | 0.597 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -89.6 | 133.3 | 176.3 | -62.3 | 176.8 | 0 | 0 | 0 | 110.3 | F33 S34 A38 | F33-L36 HydrophobicContact CD1-CD1 3.89Å; F33-L36 PolarHBondContact O-N 2.86Å; S34-L36 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 3.23Å |
| 37 | P | 69.2 | Low | 55.5 | Low | 120 Ų | 120 | 115.4 Ų | 115.4 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 129.2 | 172.4 | 24.9 | -31.2 | 0 | 0 | 0 | 109.9 | ||
| 38 | A | 71.1 | Confident | 55 | Low | 89 Ų | 89 | 112.8 Ų | 112.8 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 138.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L36 K40 | L36-A38 PolarHBondContact O-N 3.23Å; A38-K40 PolarHBondContact O-N 3.19Å |
| 39 | P | 63.3 | Low | 54.7 | Low | 128 Ų | 128 | 116.2 Ų | 116.2 | 83% | 0.831 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 130.9 | 179.6 | 26.7 | -33.4 | 0 | 0 | 0 | 110.7 | A41 | P39-A41 PolarHBondContact O-N 3.2Å; P39-A41 VanDerWaalsContact O-N 3.14Å |
| 40 | K | 58.1 | Low | 53.8 | Low | 216 Ų | 216 | 120.6 Ų | 120.6 | 94% | 0.939 | 78% | 0.781 | S | S | * | * | trans | -65.3 | 107.8 | 177.7 | -80.3 | 175.6 | 161.8 | 176.9 | 0 | 110.7 | A38 | A38-K40 PolarHBondContact O-N 3.19Š| ||
| 41 | A | 51.5 | Low | 52.9 | Low | 102 Ų | 102 | 124.2 Ų | 124.2 | 84% | 0.843 | 78% | 0.782 | S | S | * | * | trans | -79.1 | 119.8 | 159.2 | 0 | 0 | 0 | 0 | 0 | 109 | P39 | P39-A41 PolarHBondContact O-N 3.2Å; P39-A41 VanDerWaalsContact O-N 3.14Å | ||
| 42 | S | 40.7 | Very low | 51.2 | Low | 126 Ų | 126 | 126.3 Ų | 126.3 | 88% | 0.881 | 80% | 0.795 | S | S | * | * | trans | -79.8 | 126.7 | 168.1 | 54.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 43 | G | 38.2 | Very low | 49.3 | Very low | 82 Ų | 82 | 124.4 Ų | 124.4 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | 130.2 | 99.7 | 156.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 44 | S | 39.1 | Very low | 47.6 | Very low | 124 Ų | 124 | 127.7 Ų | 127.7 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -77.8 | 146.2 | 172.4 | 178.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 45 | A | 35.8 | Very low | 45.7 | Very low | 96 Ų | 96 | 127.9 Ų | 127.9 | 79% | 0.793 | 81% | 0.809 | S | S | * | * | 159.9 | 138.5 | 118.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 46 | A | 39.5 | Very low | 44 | Very low | 108 Ų | 108 | 128 Ų | 128 | 89% | 0.893 | 81% | 0.809 | S | S | * | * | trans | -86.8 | 147.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 47 | G | 32.7 | Very low | 42.1 | Very low | 83 Ų | 83 | 129.6 Ų | 129.6 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | trans | 118.7 | 116.3 | 150.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 48 | G | 32 | Very low | 40.3 | Very low | 77 Ų | 77 | 129.5 Ų | 129.5 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | 97.8 | 105.9 | 133.6 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 49 | K | 37.4 | Very low | 38.5 | Very low | 201 Ų | 201 | 130 Ų | 130 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | trans | 49.6 | 121.2 | 139.1 | -68.6 | -172.3 | 177.7 | -176.4 | 0 | 123.4 | ||||
| 50 | E | 32.9 | Very low | 37.1 | Very low | 165 Ų | 165 | 128.3 Ų | 128.3 | 77% | 0.771 | 82% | 0.821 | S | S | * | * | 66.3 | 133.7 | 125 | -69.8 | -85.6 | 166.7 | 0 | 0 | 123.1 | |||||
| 51 | I | 36 | Very low | 36.2 | Very low | 147 Ų | 147 | 127.6 Ų | 127.6 | 75% | 0.754 | 82% | 0.818 | S | S | * | * | trans | 92.2 | 110.7 | 150.3 | -60.5 | 154.7 | 0 | 0 | 0 | 120.7 | ||||
| 52 | A | 34 | Very low | 35.6 | Very low | 86 Ų | 86 | 132 Ų | 132 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | trans | 48.1 | 125 | 137.5 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 53 | S | 33.5 | Very low | 35.6 | Very low | 116 Ų | 116 | 131.4 Ų | 131.4 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | 149 | 121.2 | 107 | 60.5 | 0 | 0 | 0 | 0 | 114 | |||||
| 54 | R | 34.3 | Very low | 35.9 | Very low | 240 Ų | 240 | 134.4 Ų | 134.4 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | 4.5 | 118.2 | 142.2 | -169.1 | 83.3 | 160.6 | -168.6 | -4.8 | 118 | ||||
| 55 | A | 32.6 | Very low | 36.3 | Very low | 86 Ų | 86 | 132.3 Ų | 132.3 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | 155.6 | 121.7 | 114.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 56 | K | 36 | Very low | 36.9 | Very low | 182 Ų | 182 | 129.9 Ų | 129.9 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | 42.6 | 124 | 135.6 | -64.3 | -175.6 | 177.3 | -179.6 | 0 | 122.5 | ||||
| 57 | N | 36.1 | Very low | 38 | Very low | 148 Ų | 148 | 134.3 Ų | 134.3 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | 70.7 | 115.2 | 131.8 | -63.2 | 1.4 | 0 | 0 | 0 | 121.2 | ||||
| 58 | S | 32.6 | Very low | 39.3 | Very low | 118 Ų | 118 | 137.7 Ų | 137.7 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | 161.8 | 112.7 | 129.5 | 46.9 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 59 | A | 32.5 | Very low | 40.6 | Very low | 98 Ų | 98 | 139.2 Ų | 139.2 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | 76.8 | 130.6 | 91.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 60 | A | 34.1 | Very low | 41.5 | Very low | 94 Ų | 94 | 134.3 Ų | 134.3 | 78% | 0.777 | 79% | 0.788 | S | S | * | * | trans | 76.6 | 138 | 170.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 61 | K | 38 | Very low | 43.4 | Very low | 201 Ų | 201 | 132 Ų | 132 | 87% | 0.874 | 78% | 0.78 | S | S | * | * | cis | -163.7 | 139.2 | 8.8 | -117.6 | 165.5 | -176 | 178.6 | 0 | 107.7 | ||||
| 62 | E | 38.6 | Very low | 45.2 | Very low | 194 Ų | 194 | 130.8 Ų | 130.8 | 91% | 0.907 | 78% | 0.782 | S | S | * | * | trans | -72.7 | 142.8 | 162.3 | -68.1 | 168.7 | 164.1 | 0 | 0 | 109.8 | ||||
| 63 | S | 42.8 | Very low | 47 | Very low | 114 Ų | 114 | 136 Ų | 136 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -150 | 86.4 | 154.4 | 66.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 64 | T | 43.1 | Very low | 48.5 | Very low | 145 Ų | 145 | 136.3 Ų | 136.3 | 89% | 0.89 | 79% | 0.788 | S | S | * | * | trans | -143.5 | 108.1 | 149.4 | -40.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 65 | G | 48.2 | Very low | 50.2 | Low | 79 Ų | 79 | 134 Ų | 134 | 81% | 0.814 | 78% | 0.784 | S | S | * | * | trans | -70.8 | 139.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 66 | G | 47.9 | Very low | 51.9 | Low | 46 Ų | 46 | 139.8 Ų | 139.8 | 47% | 0.474 | 79% | 0.793 | S | S | . | * | trans | -147.8 | 141.1 | 164.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | L68 S69 | G66-L68 PolarHBondContact O-N 3.45Å; G66-S69 PolarHBondContact O-N 3.43Å | ||
| 67 | F | 62.4 | Low | 53.2 | Low | 200 Ų | 200 | 140.5 Ų | 140.5 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.7 | 5.1 | -171.6 | -89.2 | -103.3 | 0 | 0 | 0 | 118.5 | ||
| 68 | L | 59.6 | Low | 54.4 | Low | 155 Ų | 155 | 140.5 Ų | 140.5 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -5.5 | -178.9 | -57.7 | 176.8 | 0 | 0 | 0 | 113.6 | G66 | G66-L68 PolarHBondContact O-N 3.45Š|
| 69 | S | 60.2 | Low | 56.2 | Low | 108 Ų | 108 | 141.2 Ų | 141.2 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -8.9 | 179.5 | 60.6 | 0 | 0 | 0 | 0 | 114.7 | G66 L71 | G66-S69 PolarHBondContact O-N 3.43Å; S69-L71 VanDerWaalsContact C-N 3.35Å |
| 70 | S | 57.2 | Low | 58.2 | Low | 99 Ų | 99 | 142.3 Ų | 142.3 | 69% | 0.692 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -6.7 | 177.9 | 58 | 0 | 0 | 0 | 0 | 113.7 | ||
| 71 | L | 71.3 | Confident | 60.3 | Low | 116 Ų | 116 | 144 Ų | 144 | 61% | 0.607 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -85.9 | 133.1 | 175.9 | -77.9 | 83.5 | 0 | 0 | 0 | 110.2 | S69 K73 | S69-L71 VanDerWaalsContact C-N 3.35Å; L71-K73 PolarHBondContact O-N 3.15Å |
| 72 | P | 74.9 | Confident | 62.1 | Low | 121 Ų | 121 | 143.8 Ų | 143.8 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 129.8 | 176.8 | 24.4 | -32.4 | 0 | 0 | 0 | 109.7 | ||
| 73 | K | 70.8 | Confident | 63.9 | Low | 197 Ų | 197 | 141 Ų | 141 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 124.5 | 179 | -67.7 | 176 | 180 | 178.9 | 0 | 109.3 | L71 K75 | L71-K73 PolarHBondContact O-N 3.15Å; K73-K75 PolarHBondContact O-N 3.18Å; K73-K75 VanDerWaalsContact O-N 3.14Å |
| 74 | P | 64.4 | Low | 65.3 | Low | 121 Ų | 121 | 141.3 Ų | 141.3 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 120.5 | -179.3 | 24.9 | -32.4 | 0 | 0 | 0 | 108.9 | K76 | P74-K76 PolarHBondContact O-N 3.41Š|
| 75 | K | 71.8 | Confident | 66.5 | Low | 191 Ų | 191 | 140 Ų | 140 | 83% | 0.83 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 125.3 | 169.3 | -76.5 | -178.8 | 168.4 | -179.3 | 0 | 107.6 | K73 R77 | K73-K75 PolarHBondContact O-N 3.18Å; K73-K75 VanDerWaalsContact O-N 3.14Å; K75-R77 PolarHBondContact O-N 3.49Å |
| 76 | K | 66.8 | Low | 67.3 | Low | 209 Ų | 209 | 141.4 Ų | 141.4 | 91% | 0.909 | 76% | 0.761 | S | S | * | * | trans | -60.3 | 98.9 | 170.5 | -63.5 | -167.3 | 180 | -171.6 | 0 | 108.1 | P74 | P74-K76 PolarHBondContact O-N 3.41Š| ||
| 77 | R | 63.3 | Low | 68.3 | Low | 197 Ų | 197 | 148.5 Ų | 148.5 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | -91.2 | 119.7 | 164.3 | -64.2 | -175.5 | 79.2 | 173.6 | 1.9 | 106 | K75 E79 | K75-R77 PolarHBondContact O-N 3.49Å; R77-E79 PolarHBondContact O-N 2.83Å | ||
| 78 | T | 61.6 | Low | 68.1 | Low | 148 Ų | 148 | 146.5 Ų | 146.5 | 91% | 0.908 | 78% | 0.779 | S | S | * | * | trans | -79.6 | 32.6 | 175.2 | -34.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 79 | E | 71 | Confident | 68.2 | Low | 133 Ų | 133 | 147.6 Ų | 147.6 | 62% | 0.621 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -129 | 137 | -178.8 | -69.2 | -174.4 | 170 | 0 | 0 | 108.8 | R77 V81 | R77-E79 PolarHBondContact O-N 2.83Å; E79-V81 PolarHBondContact O-N 3.29Å |
| 80 | P | 75.4 | Confident | 67.8 | Low | 120 Ų | 120 | 152.7 Ų | 152.7 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -61.8 | 126.1 | -176.9 | 24.4 | -32.5 | 0 | 0 | 0 | 110.4 | K82 | P80-K82 PolarHBondContact O-N 3.14Š| ||
| 81 | V | 76.3 | Confident | 67.5 | Low | 129 Ų | 129 | 158.5 Ų | 158.5 | 78% | 0.782 | 79% | 0.789 | S | S | * | * | trans | -66.2 | 114.6 | 175.3 | 176.3 | 0 | 0 | 0 | 0 | 108.4 | E79 I83 | E79-V81 PolarHBondContact O-N 3.29Å; V81-I83 PolarHBondContact O-N 2.87Å | ||
| 82 | K | 77.1 | Confident | 66.4 | Low | 197 Ų | 197 | 159.5 Ų | 159.5 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | trans | -76.8 | 107.4 | 174.9 | -67.5 | 178.9 | 175.7 | 179.4 | 0 | 109 | P80 | P80-K82 PolarHBondContact O-N 3.14Š| ||
| 83 | I | 76.7 | Confident | 64.9 | Low | 137 Ų | 137 | 159 Ų | 159 | 70% | 0.703 | 80% | 0.795 | S | S | * | * | trans | -83.5 | 122.9 | 171.5 | -58.5 | 166.3 | 0 | 0 | 0 | 107.2 | V81 V85 | V81-I83 PolarHBondContact O-N 2.87Å; I83-V85 PolarHBondContact O-N 3.43Å | ||
| 84 | P | 71.6 | Confident | 64 | Low | 119 Ų | 119 | 157.6 Ų | 157.6 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | -68.1 | 114 | 174.6 | 26.7 | -31.3 | 0 | 0 | 0 | 109.5 | ||||
| 85 | V | 67.8 | Low | 63.5 | Low | 118 Ų | 118 | 156.6 Ų | 156.6 | 72% | 0.715 | 79% | 0.792 | S | S | * | * | trans | -80.5 | 127.8 | 176 | -179.6 | 0 | 0 | 0 | 0 | 108.4 | I83 Q87 | I83-V85 PolarHBondContact O-N 3.43Å; V85-Q87 PolarHBondContact O-N 3.35Å | ||
| 86 | P | 66.5 | Low | 61.8 | Low | 109 Ų | 109 | 153.7 Ų | 153.7 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | trans | -59.4 | 131.1 | 174.7 | 21.3 | -29.6 | 0 | 0 | 0 | 110.6 | L88 | P86-L88 PolarHBondContact O-N 2.83Å; P86-L88 VanDerWaalsContact O-N 3.14Å | ||
| 87 | Q | 67.9 | Low | 61 | Low | 195 Ų | 195 | 150.7 Ų | 150.7 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | trans | -64.3 | 111.2 | -177.8 | -71.2 | 176.4 | -24.1 | 0 | 0 | 110.3 | V85 | V85-Q87 PolarHBondContact O-N 3.35Š| ||
| 88 | L | 57.9 | Low | 60.4 | Low | 157 Ų | 157 | 147.9 Ų | 147.9 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -81.1 | 118.3 | 165.9 | -72.5 | 163 | 0 | 0 | 0 | 107.9 | P86 R90 | P86-L88 PolarHBondContact O-N 2.83Å; P86-L88 VanDerWaalsContact O-N 3.14Å; L88-R90 PolarHBondContact O-N 2.82Å | ||
| 89 | Q | 62.9 | Low | 60.2 | Low | 178 Ų | 178 | 148.6 Ų | 148.6 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -61.3 | 106.2 | 167.8 | -69.6 | -177.8 | -30.1 | 0 | 0 | 108.4 | R91 | Q89-R91 PolarHBondContact O-N 3.09Š| ||
| 90 | R | 51.3 | Low | 59.2 | Low | 216 Ų | 216 | 148.3 Ų | 148.3 | 82% | 0.815 | 78% | 0.783 | S | S | * | * | trans | -74.5 | 105.2 | 166.8 | -65.5 | -169.8 | 178 | -152.6 | -0.6 | 106.5 | L88 D92 | L88-R90 PolarHBondContact O-N 2.82Å; R90-D92 VanDerWaalsContact C-N 3.31Å; R90-D92 PolarHBondContact O-N 3.34Å | ||
| 91 | R | 49.4 | Very low | 58.2 | Low | 220 Ų | 220 | 148.4 Ų | 148.4 | 83% | 0.83 | 78% | 0.781 | S | S | * | * | trans | -73.3 | 99.4 | 158.8 | -80.2 | -164.7 | 175.6 | 98.7 | -0.7 | 105.7 | Q89 S93 | Q89-R91 PolarHBondContact O-N 3.09Å; R91-S93 PolarHBondContact O-N 2.67Å; R91-S93 VanDerWaalsContact O-N 3.15Å | ||
| 92 | D | 49.7 | Very low | 56.9 | Low | 137 Ų | 137 | 148.2 Ų | 148.2 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | trans | -71 | 99.3 | 162.7 | -51.1 | -39.7 | 0 | 0 | 0 | 105.7 | R90 | R90-D92 VanDerWaalsContact C-N 3.31Å; R90-D92 PolarHBondContact O-N 3.34Å | ||
| 93 | S | 42.2 | Very low | 55.8 | Low | 111 Ų | 111 | 148.2 Ų | 148.2 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | -132.3 | 74.8 | 162 | -73.3 | 0 | 0 | 0 | 0 | 105.8 | R91 | R91-S93 PolarHBondContact O-N 2.67Å; R91-S93 VanDerWaalsContact O-N 3.15Å | ||
| 94 | D | 51.8 | Low | 54.4 | Low | 167 Ų | 167 | 151.9 Ų | 151.9 | 89% | 0.893 | 79% | 0.793 | S | S | * | * | trans | -87.6 | 95.5 | 162.7 | -171 | 17 | 0 | 0 | 0 | 106 | ||||
| 95 | S | 54.7 | Low | 53.1 | Low | 100 Ų | 100 | 154.1 Ų | 154.1 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | trans | -166.2 | 86.4 | 177.5 | -171.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 96 | D | 36.6 | Very low | 51.9 | Low | 130 Ų | 130 | 156.5 Ų | 156.5 | 70% | 0.695 | 80% | 0.801 | S | S | * | * | 173.6 | 112.2 | 107 | -122.8 | 20.6 | 0 | 0 | 0 | 107.6 | D98 | D96-D98 PolarHBondContact O-N 2.94Š| |||
| 97 | D | 50 | Low | 51.1 | Low | 147 Ų | 147 | 157.3 Ų | 157.3 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | trans | -70.4 | 108.1 | 161.9 | -161.3 | -19.2 | 0 | 0 | 0 | 106.5 | ||||
| 98 | D | 50.6 | Low | 50.2 | Low | 138 Ų | 138 | 156.2 Ų | 156.2 | 74% | 0.738 | 80% | 0.799 | S | S | * | * | trans | -145.2 | 92 | 168.8 | -119.3 | -28.8 | 0 | 0 | 0 | 109.3 | D96 | D96-D98 PolarHBondContact O-N 2.94Š| ||
| 99 | E | 56.8 | Low | 49.4 | Very low | 162 Ų | 162 | 152.1 Ų | 152.1 | 76% | 0.757 | 80% | 0.795 | S | S | * | * | trans | -57.1 | 130 | 167.7 | -69.1 | -172.5 | 145.4 | 0 | 0 | 110.4 | V101 | E99-V101 PolarHBondContact O-N 2.79Š| ||
| 100 | P | 50.8 | Low | 48.8 | Very low | 128 Ų | 128 | 149.1 Ų | 149.1 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | trans | -75.1 | 103.6 | 176.8 | 28.9 | -32.4 | 0 | 0 | 0 | 110.6 | ||||
| 101 | V | 52.8 | Low | 48.9 | Very low | 122 Ų | 122 | 142.7 Ų | 142.7 | 74% | 0.739 | 80% | 0.801 | S | S | * | * | trans | -51.3 | 127.8 | 167.5 | 179.6 | 0 | 0 | 0 | 0 | 110.3 | E99 K103 | E99-V101 PolarHBondContact O-N 2.79Å; V101-K103 PolarHBondContact O-N 3.41Å; V101-K103 VanDerWaalsContact O-N 3.08Å | ||
| 102 | P | 49.9 | Very low | 49 | Very low | 125 Ų | 125 | 137.7 Ų | 137.7 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | trans | -70.5 | 108.3 | -176.9 | 27.4 | -33.9 | 0 | 0 | 0 | 111.2 | K104 | P102-K104 PolarHBondContact O-N 3.14Š| ||
| 103 | K | 53 | Low | 49.6 | Very low | 197 Ų | 197 | 134.7 Ų | 134.7 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | trans | -71.8 | 120.3 | 173.4 | -68.3 | 179.9 | 179.4 | 174.6 | 0 | 110.4 | V101 L105 | V101-K103 PolarHBondContact O-N 3.41Å; V101-K103 VanDerWaalsContact O-N 3.08Å; K103-L105 PolarHBondContact O-N 3.23Å | ||
| 104 | K | 48 | Very low | 50.4 | Low | 213 Ų | 213 | 134.9 Ų | 134.9 | 93% | 0.926 | 80% | 0.802 | S | S | * | * | trans | -51.8 | 122 | 167.7 | -102 | 174.8 | 170.7 | 175.7 | 0 | 110.3 | P102 Q106 | P102-K104 PolarHBondContact O-N 3.14Å; K104-Q106 PolarHBondContact O-N 3.43Å; K104-Q106 VanDerWaalsContact O-N 3.15Å | ||
| 105 | L | 44.4 | Very low | 51.7 | Low | 166 Ų | 166 | 128.8 Ų | 128.8 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | trans | -71 | 104.4 | 171.7 | -74.6 | 163.9 | 0 | 0 | 0 | 109.6 | K103 T107 | K103-L105 PolarHBondContact O-N 3.23Å; L105-T107 PolarHBondContact O-N 2.95Å | ||
| 106 | Q | 42.4 | Very low | 52.9 | Low | 169 Ų | 169 | 131.1 Ų | 131.1 | 79% | 0.79 | 78% | 0.783 | S | S | * | * | trans | -73.8 | 104.5 | 165.3 | -173.6 | 139.7 | 13.9 | 0 | 0 | 108.6 | K104 Q108 | K104-Q106 PolarHBondContact O-N 3.43Å; K104-Q106 VanDerWaalsContact O-N 3.15Å; Q106-Q108 HydrophobicContact CG-CG 4.46Å; Q106-Q108 PolarHBondContact O-N 3.03Å | ||
| 107 | T | 50.7 | Low | 54.8 | Low | 126 Ų | 126 | 129.6 Ų | 129.6 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | -69.4 | 96.7 | 169.5 | 50.4 | 0 | 0 | 0 | 0 | 109.4 | L105 | L105-T107 PolarHBondContact O-N 2.95Š| ||
| 108 | Q | 47.5 | Very low | 56 | Low | 171 Ų | 171 | 126.2 Ų | 126.2 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | trans | -94.9 | 113.9 | 148.8 | -63.9 | -164.6 | -11.2 | 0 | 0 | 105.3 | Q106 | Q106-Q108 HydrophobicContact CG-CG 4.46Å; Q106-Q108 PolarHBondContact O-N 3.03Å | ||
| 109 | G | 41 | Very low | 57.5 | Low | 72 Ų | 72 | 126.2 Ų | 126.2 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | 94 | 98.7 | 59.8 | 0 | 0 | 0 | 0 | 0 | 105 | |||||
| 110 | A | 50.7 | Low | 58.8 | Low | 114 Ų | 114 | 123.7 Ų | 123.7 | 94% | 0.942 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -55 | 138.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 111 | G | 53.3 | Low | 60.4 | Low | 81 Ų | 81 | 123.2 Ų | 123.2 | 84% | 0.835 | 76% | 0.757 | S | S | * | * | trans | 133.6 | 75.6 | 158.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 112 | S | 52.7 | Low | 61.7 | Low | 116 Ų | 116 | 126.2 Ų | 126.2 | 81% | 0.811 | 76% | 0.76 | S | S | * | * | trans | -173.7 | 115.9 | 138.7 | -165 | 0 | 0 | 0 | 0 | 109.2 | S114 | S112-S114 PolarHBondContact O-N 3.16Å; S112-S114 VanDerWaalsContact O-N 3.08Å | ||
| 113 | G | 61.8 | Low | 62.9 | Low | 73 Ų | 73 | 124.4 Ų | 124.4 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | trans | -78.3 | 83.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 114 | S | 59.4 | Low | 64 | Low | 115 Ų | 115 | 125 Ų | 125 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | trans | -144.9 | 80.6 | 170.8 | -179.1 | 0 | 0 | 0 | 0 | 110.1 | S112 | S112-S114 PolarHBondContact O-N 3.16Å; S112-S114 VanDerWaalsContact O-N 3.08Å | ||
| 115 | G | 78.4 | Confident | 65.1 | Low | 39 Ų | 39 | 122 Ų | 122 | 40% | 0.402 | 75% | 0.745 | S | S | . | * | S | Bend | trans | -169.8 | 153.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | S117 S118 | G115-S117 PolarHBondContact O-N 3.47Å; G115-S118 PolarHBondContact O-N 2.84Å; G115-S118 PolarHBondContact O-OG 3.45Å |
| 116 | L | 80.4 | Confident | 66 | Low | 150 Ų | 150 | 119.7 Ų | 119.7 | 79% | 0.785 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -48.4 | -25.6 | -175 | -69.9 | 166 | 0 | 0 | 0 | 114.4 | S118 I119 L120 | L116-S118 PolarHBondContact O-N 2.74Å; L116-I119 WeakPolarHBondContact O-CG2 3.14Å; L116-I119 PolarHBondContact O-N 3.33Å; L116-I119 VanDerWaalsContact O-N 3.11Å; L116-L120 PolarHBondContact O-N 3.46Å |
| 117 | S | 75.6 | Confident | 66.9 | Low | 98 Ų | 98 | 116.5 Ų | 116.5 | 69% | 0.685 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -63 | -18.4 | 172.7 | 52.4 | 0 | 0 | 0 | 0 | 115.4 | G115 | G115-S117 PolarHBondContact O-N 3.47Š|
| 118 | S | 75.3 | Confident | 67.3 | Low | 76 Ų | 76 | 116.5 Ų | 116.5 | 53% | 0.531 | 73% | 0.725 | S | S | . | * | G | 310 helix | trans | -84.5 | -19.3 | 173 | 69.7 | 0 | 0 | 0 | 0 | 113.2 | G115 L116 L120 | G115-S118 PolarHBondContact O-N 2.84Å; G115-S118 PolarHBondContact O-OG 3.45Å; L116-S118 PolarHBondContact O-N 2.74Å; S118-L120 VanDerWaalsContact C-N 3.32Å |
| 119 | I | 83.7 | Confident | 68 | Low | 137 Ų | 137 | 117.1 Ų | 117.1 | 70% | 0.703 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -18.8 | 173.9 | -126.6 | 75.6 | 0 | 0 | 0 | 111.4 | L116 | L116-I119 WeakPolarHBondContact O-CG2 3.14Å; L116-I119 PolarHBondContact O-N 3.33Å; L116-I119 VanDerWaalsContact O-N 3.11Å |
| 120 | L | 83.4 | Confident | 69 | Low | 109 Ų | 109 | 120.4 Ų | 120.4 | 57% | 0.571 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -87 | 142.4 | 178.2 | -61.5 | 177.2 | 0 | 0 | 0 | 110.7 | L116 S118 K122 | L116-L120 PolarHBondContact O-N 3.46Å; S118-L120 VanDerWaalsContact C-N 3.32Å; L120-K122 PolarHBondContact O-N 2.76Å |
| 121 | P | 84.5 | Confident | 69.6 | Low | 119 Ų | 119 | 123.1 Ų | 123.1 | 77% | 0.773 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 125.7 | 171.2 | -21.9 | 31.3 | 0 | 0 | 0 | 110 | ||
| 122 | K | 80.2 | Confident | 70.2 | Confident | 184 Ų | 184 | 126.8 Ų | 126.8 | 80% | 0.8 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 128.4 | -179.2 | -69.7 | 179.8 | -178.3 | 172.9 | 0 | 109.6 | L120 K124 | L120-K122 PolarHBondContact O-N 2.76Å; K122-K124 PolarHBondContact O-N 2.77Å |
| 123 | P | 75.5 | Confident | 71.1 | Confident | 87 Ų | 87 | 127.1 Ų | 127.1 | 57% | 0.565 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -65 | 135.9 | -177.4 | 25.3 | -33.2 | 0 | 0 | 0 | 110.1 | N125 L126 | P123-N125 PolarHBondContact O-N 3.24Å; P123-N125 VanDerWaalsContact O-N 3.14Å; P123-L126 HydrophobicContact CG-CD1 3.58Å; P123-L126 HydrophobicContact CG-CG 3.9Å; P123-L126 PolarHBondContact O-N 3.05Å |
| 124 | K | 74.7 | Confident | 71.6 | Confident | 210 Ų | 210 | 127.8 Ų | 127.8 | 91% | 0.913 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -6.6 | -169.6 | -65 | 179.7 | 176.9 | 178.3 | 0 | 114.8 | K122 | K122-K124 PolarHBondContact O-N 2.77Š|
| 125 | N | 70.8 | Confident | 72.4 | Confident | 149 Ų | 149 | 130.7 Ų | 130.7 | 80% | 0.797 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.1 | 33.3 | 179.4 | -56.2 | -44.7 | 0 | 0 | 0 | 112.4 | P123 T127 | P123-N125 PolarHBondContact O-N 3.24Å; P123-N125 VanDerWaalsContact O-N 3.14Å; N125-T127 PolarHBondContact O-N 3.05Å |
| 126 | L | 64.4 | Low | 72.3 | Confident | 119 Ų | 119 | 132.8 Ų | 132.8 | 62% | 0.623 | 70% | 0.698 | S | S | * | * | trans | -66.6 | 80.9 | 169.6 | -106.2 | 157.9 | 0 | 0 | 0 | 108.7 | P123 V128 | P123-L126 HydrophobicContact CG-CD1 3.58Å; P123-L126 HydrophobicContact CG-CG 3.9Å; P123-L126 PolarHBondContact O-N 3.05Å; L126-V128 VanDerWaalsContact C-N 3.3Å; L126-V128 PolarHBondContact O-N 3.24Å | ||
| 127 | T | 61.8 | Low | 72.3 | Confident | 102 Ų | 102 | 129 Ų | 129 | 63% | 0.626 | 68% | 0.682 | S | S | * | * | trans | -65 | 100.5 | 163.7 | 53.5 | 0 | 0 | 0 | 0 | 105.7 | N125 K129 | N125-T127 PolarHBondContact O-N 3.05Å; T127-K129 PolarHBondContact O-N 3.36Å | ||
| 128 | V | 57.5 | Low | 71.7 | Confident | 125 Ų | 125 | 129.9 Ų | 129.9 | 76% | 0.758 | 68% | 0.675 | S | S | * | * | trans | -39.9 | 125.2 | 162.6 | 174.2 | 0 | 0 | 0 | 0 | 106.7 | L126 E130 | L126-V128 VanDerWaalsContact C-N 3.3Å; L126-V128 PolarHBondContact O-N 3.24Å; V128-E130 VanDerWaalsContact C-N 3.29Å; V128-E130 PolarHBondContact O-N 2.88Å | ||
| 129 | K | 62.1 | Low | 71.3 | Confident | 185 Ų | 185 | 131.7 Ų | 131.7 | 80% | 0.804 | 68% | 0.683 | S | S | * | * | trans | -37.1 | 84.3 | -174.3 | -66.1 | 172.5 | 169.8 | -179.4 | 0 | 113 | T127 M131 | T127-K129 PolarHBondContact O-N 3.36Å; K129-M131 HydrophobicContact CB-CG 4.45Å; K129-M131 PolarHBondContact O-N 3.14Å | ||
| 130 | E | 62.3 | Low | 70.4 | Confident | 141 Ų | 141 | 131.3 Ų | 131.3 | 66% | 0.659 | 68% | 0.682 | S | S | * | * | trans | -81.3 | 93.9 | 160.9 | -78.3 | -173.6 | 164.9 | 0 | 0 | 104.9 | V128 D132 R133 | V128-E130 VanDerWaalsContact C-N 3.29Å; V128-E130 PolarHBondContact O-N 2.88Å; E130-D132 PolarHBondContact O-N 3.01Å; E130-D132 VanDerWaalsContact O-N 3.09Å; E130-R133 HydrophobicContact CB-CB 4.27Å; E130-R133 PolarHBondContact O-N 2.87Å | ||
| 131 | M | 64.6 | Low | 69.5 | Low | 170 Ų | 170 | 129.6 Ų | 129.6 | 84% | 0.837 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | -11 | -176.1 | -65.4 | 175.4 | 59.5 | 0 | 0 | 112.8 | K129 | K129-M131 HydrophobicContact CB-CG 4.45Å; K129-M131 PolarHBondContact O-N 3.14Å |
| 132 | D | 65.9 | Low | 68.7 | Low | 158 Ų | 158 | 132 Ų | 132 | 85% | 0.845 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.2 | 8 | -175.9 | -58.8 | -37.7 | 0 | 0 | 0 | 114 | E130 P134 | E130-D132 PolarHBondContact O-N 3.01Å; E130-D132 VanDerWaalsContact O-N 3.09Å; D132-P134 WeakPolarHBondContact O-CD 3.43Å |
| 133 | R | 71.6 | Confident | 67.7 | Low | 124 Ų | 124 | 134 Ų | 134 | 47% | 0.468 | 68% | 0.677 | S | S | . | * | S | Bend | trans | -81.5 | 118.8 | 175.7 | -165.1 | 166.6 | -174.7 | -108 | -3.8 | 109.3 | E130 L135 | E130-R133 HydrophobicContact CB-CB 4.27Å; E130-R133 PolarHBondContact O-N 2.87Å; R133-L135 PolarHBondContact O-N 3.4Å |
| 134 | P | 71.2 | Confident | 66.7 | Low | 87 Ų | 87 | 134.9 Ų | 134.9 | 57% | 0.565 | 68% | 0.683 | S | S | * | * | trans | -58.8 | 131.2 | 179.3 | 25.8 | -34.9 | 0 | 0 | 0 | 108.9 | D132 I136 | D132-P134 WeakPolarHBondContact O-CD 3.43Å; P134-I136 HydrophobicContact CB-CD1 3.97Å; P134-I136 HydrophobicContact CB-CG1 4.06Å; P134-I136 HydrophobicContact CG-CD1 4.09Å; P134-I136 PolarHBondContact O-N 3.29Å | ||
| 135 | L | 75.8 | Confident | 65.4 | Low | 176 Ų | 176 | 132.5 Ų | 132.5 | 92% | 0.921 | 68% | 0.68 | S | S | * | * | trans | -70.1 | 49.3 | -179.3 | -112.5 | 71.8 | 0 | 0 | 0 | 111.5 | R133 P137 | R133-L135 PolarHBondContact O-N 3.4Å; L135-P137 WeakPolarHBondContact O-CD 3.36Å | ||
| 136 | I | 76.1 | Confident | 64.3 | Low | 82 Ų | 82 | 133.1 Ų | 133.1 | 42% | 0.421 | 68% | 0.682 | S | S | . | * | trans | -86.1 | 114.8 | 177.5 | -59.5 | 168 | 0 | 0 | 0 | 106 | P134 H138 L140 T141 | P134-I136 HydrophobicContact CB-CD1 3.97Å; P134-I136 HydrophobicContact CB-CG1 4.06Å; P134-I136 HydrophobicContact CG-CD1 4.09Å; P134-I136 PolarHBondContact O-N 3.29Å; I136-H138 PolarHBondContact O-N 2.84Å; I136-L140 HydrophobicContact CG2-CB 3.61Å; I136-L140 HydrophobicContact CG2-CD1 4.17Å; I136-L140 HydrophobicContact CG2-CG 4.47Å; I136-T141 HydrophobicContact CB-CG2 4.01Å; I136-T141 HydrophobicContact CG2-CG2 3.51Å | ||
| 137 | P | 80.6 | Confident | 63.2 | Low | 70 Ų | 70 | 137 Ų | 137 | 46% | 0.455 | 69% | 0.694 | S | S | . | * | trans | -56.6 | 141.1 | 176.9 | 24.1 | -33.9 | 0 | 0 | 0 | 109.4 | L135 T139 L140 | L135-P137 WeakPolarHBondContact O-CD 3.36Å; P137-T139 PolarHBondContact O-N 3.43Å; P137-L140 HydrophobicContact CG-CD1 3.82Å; P137-L140 HydrophobicContact CG-CG 4.04Å; P137-L140 PolarHBondContact O-N 2.73Å | ||
| 138 | H | 64.2 | Low | 62.4 | Low | 117 Ų | 117 | 136.3 Ų | 136.3 | 54% | 0.542 | 70% | 0.698 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.9 | -10.8 | -178 | -78 | -79 | 0 | 0 | 0 | 114.5 | I136 L140 K142 | I136-H138 PolarHBondContact O-N 2.84Å; H138-L140 VanDerWaalsContact C-N 3.33Å; H138-K142 WeakPolarHBondContact O-CG 3.49Å |
| 139 | T | 67 | Low | 61.8 | Low | 115 Ų | 115 | 136.4 Ų | 136.4 | 71% | 0.706 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -27.1 | 170.4 | 53.3 | 0 | 0 | 0 | 0 | 113.1 | P137 | P137-T139 PolarHBondContact O-N 3.43Š|
| 140 | L | 65 | Low | 61.2 | Low | 129 Ų | 129 | 137 Ų | 137 | 68% | 0.675 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -18.5 | -177.6 | -62.2 | 178.8 | 0 | 0 | 0 | 113.3 | I136 P137 H138 | I136-L140 HydrophobicContact CG2-CB 3.61Å; I136-L140 HydrophobicContact CG2-CD1 4.17Å; I136-L140 HydrophobicContact CG2-CG 4.47Å; P137-L140 HydrophobicContact CG-CD1 3.82Å; P137-L140 HydrophobicContact CG-CG 4.04Å; P137-L140 PolarHBondContact O-N 2.73Å; H138-L140 VanDerWaalsContact C-N 3.33Å |
| 141 | T | 64.8 | Low | 60.3 | Low | 72 Ų | 72 | 136.7 Ų | 136.7 | 44% | 0.442 | 71% | 0.714 | S | S | . | * | S | Bend | trans | -94.5 | -5.2 | -178.9 | 68 | 0 | 0 | 0 | 0 | 113.8 | I136 R143 | I136-T141 HydrophobicContact CB-CG2 4.01Å; I136-T141 HydrophobicContact CG2-CG2 3.51Å; T141-R143 PolarHBondContact O-N 2.86Å; T141-R143 VanDerWaalsContact O-N 3.13Å |
| 142 | K | 67.1 | Low | 59 | Low | 169 Ų | 169 | 132.2 Ų | 132.2 | 74% | 0.735 | 71% | 0.712 | S | S | * | * | trans | -80.8 | 88.5 | 173.5 | -73.7 | -83.8 | -178.9 | 176.4 | 0 | 109 | H138 | H138-K142 WeakPolarHBondContact O-CG 3.49Š| ||
| 143 | R | 59.9 | Low | 57.6 | Low | 227 Ų | 227 | 129.9 Ų | 129.9 | 86% | 0.857 | 72% | 0.715 | S | S | * | * | trans | -66.3 | 129 | 158.5 | -72.9 | -174 | -179.7 | 176.6 | 1.1 | 107.8 | T141 D145 | T141-R143 PolarHBondContact O-N 2.86Å; T141-R143 VanDerWaalsContact O-N 3.13Å; R143-D145 PolarHBondContact O-N 2.76Å | ||
| 144 | P | 52.6 | Low | 56 | Low | 106 Ų | 106 | 128.9 Ų | 128.9 | 69% | 0.688 | 73% | 0.733 | S | S | * | * | trans | -65.5 | 121.1 | 166.4 | 26.1 | -30.4 | 0 | 0 | 0 | 108 | L146 | P144-L146 PolarHBondContact O-N 3.48Š| ||
| 145 | D | 48.2 | Very low | 54.7 | Low | 160 Ų | 160 | 129.5 Ų | 129.5 | 86% | 0.856 | 75% | 0.745 | S | S | * | * | trans | -61.2 | 101.1 | 167.8 | -70 | -43.1 | 0 | 0 | 0 | 107.9 | R143 K147 | R143-D145 PolarHBondContact O-N 2.76Å; D145-K147 VanDerWaalsContact C-N 3.28Å; D145-K147 PolarHBondContact O-N 3.33Å | ||
| 146 | L | 47.9 | Very low | 53.6 | Low | 162 Ų | 162 | 127.4 Ų | 127.4 | 85% | 0.848 | 74% | 0.742 | S | S | * | * | trans | -67.4 | 92.5 | 171.4 | -69.7 | 175.9 | 0 | 0 | 0 | 107.9 | P144 A148 | P144-L146 PolarHBondContact O-N 3.48Å; L146-A148 PolarHBondContact O-N 3.02Å; L146-A148 VanDerWaalsContact O-N 3.11Å | ||
| 147 | K | 41.8 | Very low | 51.7 | Low | 201 Ų | 201 | 126.7 Ų | 126.7 | 87% | 0.874 | 76% | 0.755 | S | S | * | * | trans | -61.7 | 110.8 | 163.1 | -166.2 | 166.4 | -176.1 | 173.8 | 0 | 107.5 | D145 | D145-K147 VanDerWaalsContact C-N 3.28Å; D145-K147 PolarHBondContact O-N 3.33Å | ||
| 148 | A | 45 | Very low | 49.8 | Very low | 86 Ų | 86 | 131.1 Ų | 131.1 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 134.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113 | L146 | L146-A148 PolarHBondContact O-N 3.02Å; L146-A148 VanDerWaalsContact O-N 3.11Å |
| 149 | P | 43.5 | Very low | 48.9 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 131.2 | 164.3 | 31.9 | -28.2 | 0 | 0 | 0 | 110.7 | ||
| 150 | K | 50 | Low | 47.7 | Very low | 199 Ų | 199 | 131.5 Ų | 131.5 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -69 | 152.3 | 170 | -71.6 | 178.4 | 176.5 | 177.2 | 0 | 110.8 | ||
| 151 | P | 44.4 | Very low | 46.9 | Very low | 133 Ų | 133 | 131 Ų | 131 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 141.1 | -179.5 | 34.2 | -31.9 | 0 | 0 | 0 | 111.1 | ||
| 152 | G | 36.8 | Very low | 46.2 | Very low | 76 Ų | 76 | 133.2 Ų | 133.2 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | -165.4 | 96.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 153 | A | 35.8 | Very low | 45.8 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 91% | 0.909 | 81% | 0.807 | S | S | * | * | trans | 55 | 127.9 | 149.6 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 154 | A | 38.9 | Very low | 45.8 | Very low | 103 Ų | 103 | 121 Ų | 121 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | -83.9 | 153.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 155 | A | 44.5 | Very low | 46.4 | Very low | 99 Ų | 99 | 121.2 Ų | 121.2 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -156.9 | 158.1 | 143.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 156 | P | 51.6 | Low | 47.1 | Very low | 132 Ų | 132 | 118.2 Ų | 118.2 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | trans | -113.6 | 159.2 | -143.3 | 37.1 | -25 | 0 | 0 | 0 | 115.3 | ||||
| 157 | G | 36.3 | Very low | 48.1 | Very low | 68 Ų | 68 | 112.9 Ų | 112.9 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | trans | 169.5 | 96.7 | 164.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 158 | L | 40.4 | Very low | 49.4 | Very low | 163 Ų | 163 | 108.5 Ų | 108.5 | 85% | 0.853 | 75% | 0.751 | S | S | * | * | trans | 42.3 | 120.1 | 133.9 | -59.2 | 163.6 | 0 | 0 | 0 | 117.6 | ||||
| 159 | L | 45.5 | Very low | 50.7 | Low | 161 Ų | 161 | 112.3 Ų | 112.3 | 84% | 0.843 | 75% | 0.751 | S | S | * | * | cis | -156.5 | 151.1 | 34.9 | -69.1 | 168.9 | 0 | 0 | 0 | 110.6 | ||||
| 160 | G | 42.2 | Very low | 52.2 | Low | 79 Ų | 79 | 109.2 Ų | 109.2 | 81% | 0.814 | 74% | 0.736 | S | S | * | * | trans | -60 | 160.6 | 179 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 161 | S | 48.2 | Very low | 53.3 | Low | 119 Ų | 119 | 102.3 Ų | 102.3 | 83% | 0.832 | 72% | 0.716 | S | S | * | * | cis | -144.1 | 122.2 | 47.1 | -169.7 | 0 | 0 | 0 | 0 | 110.9 | A163 | S161-A163 VanDerWaalsContact C-N 3.31Å; S161-A163 PolarHBondContact O-N 3.14Å | ||
| 162 | S | 50.3 | Low | 54.9 | Low | 118 Ų | 118 | 98.9 Ų | 98.9 | 83% | 0.825 | 70% | 0.699 | S | S | * | * | trans | -73 | 85.8 | 171.8 | 62.9 | 0 | 0 | 0 | 0 | 109.4 | S164 | S162-S164 PolarHBondContact O-N 3.47Å; S162-S164 VanDerWaalsContact O-N 3.14Å | ||
| 163 | A | 58.5 | Low | 57.1 | Low | 56 Ų | 56 | 103 Ų | 103 | 46% | 0.463 | 70% | 0.695 | S | S | . | * | trans | -63.8 | 113.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | S161 A167 I168 | S161-A163 VanDerWaalsContact C-N 3.31Å; S161-A163 PolarHBondContact O-N 3.14Å; A163-A167 HydrophobicContact CB-CB 4.27Å; A163-I168 HydrophobicContact CB-CG1 4.33Å | ||
| 164 | S | 58.7 | Low | 59.2 | Low | 82 Ų | 82 | 100.9 Ų | 100.9 | 57% | 0.573 | 67% | 0.674 | S | S | * | * | trans | -49.2 | 144.2 | 176.8 | -73 | 0 | 0 | 0 | 0 | 110.1 | S162 S166 A167 | S162-S164 PolarHBondContact O-N 3.47Å; S162-S164 VanDerWaalsContact O-N 3.14Å; S164-S166 PolarHBondContact O-N 3.46Å; S164-A167 WeakPolarHBondContact O-CB 3.35Å; S164-A167 PolarHBondContact O-N 2.99Å | ||
| 165 | P | 66.9 | Low | 61.1 | Low | 112 Ų | 112 | 98.1 Ų | 98.1 | 73% | 0.727 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -54.3 | -25.5 | -173.9 | 18.8 | -31.7 | 0 | 0 | 0 | 114.1 | K169 | P165-K169 PolarHBondContact O-N 3.32Å |
| 166 | S | 62.9 | Low | 62.9 | Low | 97 Ų | 97 | 96.3 Ų | 96.3 | 68% | 0.678 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.7 | -33.7 | 170.6 | -79.9 | 0 | 0 | 0 | 0 | 114.6 | S164 K169 A170 | S164-S166 PolarHBondContact O-N 3.46Å; S166-K169 PolarHBondContact O-N 2.85Å; S166-A170 WeakPolarHBondContact O-CB 3.27Å; S166-A170 PolarHBondContact O-N 3.11Å |
| 167 | A | 68.1 | Low | 64.3 | Low | 49 Ų | 49 | 95 Ų | 95 | 41% | 0.405 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -71.2 | -37.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A163 S164 K169 A170 A171 | A163-A167 HydrophobicContact CB-CB 4.27Å; S164-A167 WeakPolarHBondContact O-CB 3.35Å; S164-A167 PolarHBondContact O-N 2.99Å; A167-K169 VanDerWaalsContact C-N 3.35Å; A167-A170 PolarHBondContact O-N 2.84Å; A167-A171 VanDerWaalsContact O-CB 3.27Å; A167-A171 WeakPolarHBondContact O-CB 3.33Å; A167-A171 PolarHBondContact O-N 2.8Å |
| 168 | I | 68.4 | Low | 66.5 | Low | 110 Ų | 110 | 98.5 Ų | 98.5 | 56% | 0.564 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -65.7 | -41.1 | 174.5 | -58.9 | 173.5 | 0 | 0 | 0 | 110 | A163 A172 | A163-I168 HydrophobicContact CB-CG1 4.33Å; I168-A172 VanDerWaalsContact O-CB 3.3Å; I168-A172 WeakPolarHBondContact O-CB 3.26Å; I168-A172 PolarHBondContact O-N 3.17Å |
| 169 | K | 73.3 | Confident | 68.5 | Low | 166 Ų | 166 | 94.4 Ų | 94.4 | 72% | 0.722 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -68.6 | -37.8 | 177.4 | -165.1 | 172.8 | -176 | -178.4 | 0 | 112.5 | P165 S166 A167 K173 | P165-K169 PolarHBondContact O-N 3.32Å; S166-K169 PolarHBondContact O-N 2.85Å; A167-K169 VanDerWaalsContact C-N 3.35Å; K169-K173 WeakPolarHBondContact O-CB 3.5Å; K169-K173 PolarHBondContact O-N 2.86Å; K169-K173 VanDerWaalsContact O-N 3.1Å |
| 170 | A | 74.8 | Confident | 70.1 | Confident | 61 Ų | 61 | 89.4 Ų | 89.4 | 50% | 0.504 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.9 | -44.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S166 A167 K173 S174 | S166-A170 WeakPolarHBondContact O-CB 3.27Å; S166-A170 PolarHBondContact O-N 3.11Å; A167-A170 PolarHBondContact O-N 2.84Å; A170-K173 PolarHBondContact O-N 3.29Å; A170-S174 PolarHBondContact O-N 3.41Å; A170-S174 PolarHBondContact O-OG 3.32Å |
| 171 | A | 73.4 | Confident | 71.6 | Confident | 55 Ų | 55 | 92.7 Ų | 92.7 | 46% | 0.455 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.9 | -39.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A167 K173 S174 A175 | A167-A171 VanDerWaalsContact O-CB 3.27Å; A167-A171 WeakPolarHBondContact O-CB 3.33Å; A167-A171 PolarHBondContact O-N 2.8Å; A171-K173 VanDerWaalsContact C-N 3.34Å; A171-K173 PolarHBondContact O-N 3.27Å; A171-S174 WeakPolarHBondContact CA-OG 3.47Å; A171-S174 PolarHBondContact O-N 2.98Å; A171-S174 PolarHBondContact O-OG 3.37Å; A171-A175 VanDerWaalsContact O-CB 3.27Å; A171-A175 WeakPolarHBondContact O-CB 3.28Å; A171-A175 PolarHBondContact O-N 2.86Å |
| 172 | A | 78.4 | Confident | 72.8 | Confident | 60 Ų | 60 | 93.9 Ų | 93.9 | 50% | 0.496 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.9 | -39.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | I168 A175 A176 | I168-A172 VanDerWaalsContact O-CB 3.3Å; I168-A172 WeakPolarHBondContact O-CB 3.26Å; I168-A172 PolarHBondContact O-N 3.17Å; A172-A175 PolarHBondContact O-N 3.18Å; A172-A176 WeakPolarHBondContact O-CB 3.3Å; A172-A176 PolarHBondContact O-N 2.71Å |
| 173 | K | 81.6 | Confident | 73.5 | Confident | 163 Ų | 163 | 92.7 Ų | 92.7 | 71% | 0.709 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -70.6 | -37.9 | 177.9 | -167.1 | 172.4 | -179.8 | 177.4 | 0 | 112.3 | K169 A170 A171 L177 | K169-K173 WeakPolarHBondContact O-CB 3.5Å; K169-K173 PolarHBondContact O-N 2.86Å; K169-K173 VanDerWaalsContact O-N 3.1Å; A170-K173 PolarHBondContact O-N 3.29Å; A171-K173 VanDerWaalsContact C-N 3.34Å; A171-K173 PolarHBondContact O-N 3.27Å; K173-L177 PolarHBondContact O-N 2.83Å; K173-L177 VanDerWaalsContact O-N 3.13Å |
| 174 | S | 79.6 | Confident | 73.7 | Confident | 65 Ų | 65 | 93.3 Ų | 93.3 | 46% | 0.455 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -69.9 | -36.7 | 174.4 | 60.3 | 0 | 0 | 0 | 0 | 112.3 | A170 A171 L177 Q178 | A170-S174 PolarHBondContact O-N 3.41Å; A170-S174 PolarHBondContact O-OG 3.32Å; A171-S174 WeakPolarHBondContact CA-OG 3.47Å; A171-S174 PolarHBondContact O-N 2.98Å; A171-S174 PolarHBondContact O-OG 3.37Å; S174-L177 PolarHBondContact O-N 3.43Å; S174-Q178 PolarHBondContact O-N 2.87Å |
| 175 | A | 80.6 | Confident | 73.9 | Confident | 46 Ų | 46 | 93 Ų | 93 | 38% | 0.38 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.1 | -43.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A171 A172 L177 Q178 V179 | A171-A175 VanDerWaalsContact O-CB 3.27Å; A171-A175 WeakPolarHBondContact O-CB 3.28Å; A171-A175 PolarHBondContact O-N 2.86Å; A172-A175 PolarHBondContact O-N 3.18Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 2.83Å; A175-Q178 PolarHBondContact O-N 2.83Å; A175-V179 WeakPolarHBondContact O-CG2 3.3Å; A175-V179 PolarHBondContact O-N 3.48Å |
| 176 | A | 81.3 | Confident | 73.3 | Confident | 61 Ų | 61 | 95.2 Ų | 95.2 | 50% | 0.504 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.7 | -38.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | A172 V179 A180 | A172-A176 WeakPolarHBondContact O-CB 3.3Å; A172-A176 PolarHBondContact O-N 2.71Å; A176-V179 PolarHBondContact O-N 2.66Å; A176-A180 WeakPolarHBondContact O-CB 3.22Å; A176-A180 PolarHBondContact O-N 2.94Å |
| 177 | L | 81.1 | Confident | 72.9 | Confident | 104 Ų | 104 | 96.3 Ų | 96.3 | 55% | 0.545 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -70.9 | -35.1 | 177.9 | -153.4 | 157.6 | 0 | 0 | 0 | 111.9 | K173 S174 A175 K181 | K173-L177 PolarHBondContact O-N 2.83Å; K173-L177 VanDerWaalsContact O-N 3.13Å; S174-L177 PolarHBondContact O-N 3.43Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 2.83Å; L177-K181 HydrophobicContact CD2-CD 4.19Å; L177-K181 HydrophobicContact CD2-CG 4.39Å; L177-K181 PolarHBondContact O-N 3.18Å |
| 178 | Q | 82.3 | Confident | 72.1 | Confident | 141 Ų | 141 | 102.5 Ų | 102.5 | 66% | 0.659 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.6 | -41.1 | 172.6 | -77.9 | 179.8 | -11.9 | 0 | 0 | 112.3 | S174 A175 K181 Q182 | S174-Q178 PolarHBondContact O-N 2.87Å; A175-Q178 PolarHBondContact O-N 2.83Å; Q178-K181 PolarHBondContact O-N 2.97Å; Q178-Q182 PolarHBondContact O-N 3.42Å; Q178-Q182 VanDerWaalsContact O-N 3.08Å |
| 179 | V | 82.8 | Confident | 71.4 | Confident | 78 Ų | 78 | 104.7 Ų | 104.7 | 47% | 0.473 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.1 | -43.1 | 175.3 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | A175 A176 K181 Q182 I183 | A175-V179 WeakPolarHBondContact O-CG2 3.3Å; A175-V179 PolarHBondContact O-N 3.48Å; A176-V179 PolarHBondContact O-N 2.66Å; V179-K181 VanDerWaalsContact C-N 3.3Å; V179-K181 PolarHBondContact O-N 3.48Å; V179-Q182 WeakPolarHBondContact O-CB 3.47Å; V179-Q182 PolarHBondContact O-N 2.81Å; V179-Q182 VanDerWaalsContact O-N 3.1Å; V179-I183 HydrophobicContact CG1-CD1 3.85Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CG1 3.43Å; V179-I183 PolarHBondContact O-N 3.43Å |
| 180 | A | 77.9 | Confident | 70.2 | Confident | 55 Ų | 55 | 103.7 Ų | 103.7 | 46% | 0.455 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -61.1 | -37.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A176 I183 A184 | A176-A180 WeakPolarHBondContact O-CB 3.22Å; A176-A180 PolarHBondContact O-N 2.94Å; A180-I183 PolarHBondContact O-N 3.19Å; A180-A184 WeakPolarHBondContact O-CB 3.45Å; A180-A184 PolarHBondContact O-N 2.87Å |
| 181 | K | 75 | Confident | 68.8 | Low | 148 Ų | 148 | 109.6 Ų | 109.6 | 64% | 0.643 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.6 | -32.5 | 173.6 | -84.6 | -176.2 | 163.2 | -171.8 | 0 | 113.4 | L177 Q178 V179 A185 | L177-K181 HydrophobicContact CD2-CD 4.19Å; L177-K181 HydrophobicContact CD2-CG 4.39Å; L177-K181 PolarHBondContact O-N 3.18Å; Q178-K181 PolarHBondContact O-N 2.97Å; V179-K181 VanDerWaalsContact C-N 3.3Å; V179-K181 PolarHBondContact O-N 3.48Å; K181-A185 WeakPolarHBondContact O-CB 3.37Å; K181-A185 PolarHBondContact O-N 3.25Å |
| 182 | Q | 72.4 | Confident | 67.4 | Low | 145 Ų | 145 | 115.7 Ų | 115.7 | 68% | 0.678 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -68.6 | -43 | 173.8 | -104.5 | 176.9 | -31.2 | 0 | 0 | 111.6 | Q178 V179 A185 E186 | Q178-Q182 PolarHBondContact O-N 3.42Å; Q178-Q182 VanDerWaalsContact O-N 3.08Å; V179-Q182 WeakPolarHBondContact O-CB 3.47Å; V179-Q182 PolarHBondContact O-N 2.81Å; V179-Q182 VanDerWaalsContact O-N 3.1Å; Q182-A185 PolarHBondContact O-N 3.39Å; Q182-E186 PolarHBondContact O-N 2.85Å |
| 183 | I | 65.4 | Low | 66 | Low | 92 Ų | 92 | 119.6 Ų | 119.6 | 47% | 0.472 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -64.7 | -43.5 | 177.8 | -62.2 | 163.7 | 0 | 0 | 0 | 110.6 | V179 A180 A185 E186 D187 | V179-I183 HydrophobicContact CG1-CD1 3.85Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CG1 3.43Å; V179-I183 PolarHBondContact O-N 3.43Å; A180-I183 PolarHBondContact O-N 3.19Å; I183-A185 PolarHBondContact O-N 3.13Å; I183-E186 PolarHBondContact O-N 3.22Å; I183-E186 VanDerWaalsContact O-N 3.15Å; I183-D187 PolarHBondContact O-N 2.87Å |
| 184 | A | 62.6 | Low | 64.4 | Low | 70 Ų | 70 | 119.6 Ų | 119.6 | 58% | 0.579 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -66.6 | -20.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | A180 | A180-A184 WeakPolarHBondContact O-CB 3.45Å; A180-A184 PolarHBondContact O-N 2.87Å |
| 185 | A | 62.6 | Low | 63.1 | Low | 75 Ų | 75 | 121 Ų | 121 | 62% | 0.62 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -87.3 | -20.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | K181 Q182 I183 | K181-A185 WeakPolarHBondContact O-CB 3.37Å; K181-A185 PolarHBondContact O-N 3.25Å; Q182-A185 PolarHBondContact O-N 3.39Å; I183-A185 PolarHBondContact O-N 3.13Å |
| 186 | E | 55.1 | Low | 62.1 | Low | 159 Ų | 159 | 124.8 Ų | 124.8 | 74% | 0.743 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -85.6 | -25.1 | 178.9 | -159.7 | 177.6 | -168.2 | 0 | 0 | 112.4 | Q182 I183 Q188 | Q182-E186 PolarHBondContact O-N 2.85Å; I183-E186 PolarHBondContact O-N 3.22Å; I183-E186 VanDerWaalsContact O-N 3.15Å; E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.48Å |
| 187 | D | 53.8 | Low | 61 | Low | 120 Ų | 120 | 129.5 Ų | 129.5 | 64% | 0.642 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -77.6 | -1.6 | -179.9 | -98 | -14.1 | 0 | 0 | 0 | 115.4 | I183 N189 | I183-D187 PolarHBondContact O-N 2.87Å; D187-N189 PolarHBondContact O-N 3.47Å |
| 188 | Q | 50.8 | Low | 60.3 | Low | 178 Ų | 178 | 130.1 Ų | 130.1 | 83% | 0.832 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -76.2 | -1.2 | 176.7 | -81.6 | -121.6 | -1.3 | 0 | 0 | 114.5 | E186 | E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.48Å |
| 189 | N | 54.8 | Low | 59.6 | Low | 157 Ų | 157 | 133.9 Ų | 133.9 | 84% | 0.84 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -123.1 | 13.1 | -174.1 | -141.4 | 48.5 | 0 | 0 | 0 | 114.5 | D187 | D187-N189 PolarHBondContact O-N 3.47Š|
| 190 | N | 47.8 | Very low | 58.2 | Low | 144 Ų | 144 | 139.5 Ų | 139.5 | 77% | 0.77 | 72% | 0.718 | S | S | * | * | trans | -136.4 | 81.2 | 172.2 | -113.6 | -20.8 | 0 | 0 | 0 | 109 | E192 | N190-E192 PolarHBondContact O-N 3.21Š| ||
| 191 | E | 45.9 | Very low | 57.3 | Low | 186 Ų | 186 | 141.1 Ų | 141.1 | 87% | 0.869 | 73% | 0.726 | S | S | * | * | trans | -80.9 | 91.7 | 173.8 | -170.3 | 178.3 | -150.1 | 0 | 0 | 108.8 | ||||
| 192 | E | 44.3 | Very low | 56 | Low | 182 Ų | 182 | 141.4 Ų | 141.4 | 85% | 0.85 | 73% | 0.734 | S | S | * | * | trans | -149.1 | 100.8 | 152.7 | -136.5 | 166.3 | -163.6 | 0 | 0 | 108.4 | N190 I194 | N190-E192 PolarHBondContact O-N 3.21Å; E192-I194 PolarHBondContact O-N 3.17Å | ||
| 193 | D | 48.5 | Very low | 54.7 | Low | 142 Ų | 142 | 142.4 Ų | 142.4 | 76% | 0.759 | 74% | 0.739 | S | S | * | * | trans | -55 | 113.1 | -173.7 | -70 | -55.3 | 0 | 0 | 0 | 112.8 | ||||
| 194 | I | 48.2 | Very low | 53.7 | Low | 163 Ų | 163 | 144.9 Ų | 144.9 | 84% | 0.836 | 75% | 0.753 | S | S | * | * | trans | -117.1 | 84 | 159.6 | -61.1 | 162.3 | 0 | 0 | 0 | 106.8 | E192 | E192-I194 PolarHBondContact O-N 3.17Š| ||
| 195 | T | 51.7 | Low | 53.2 | Low | 94 Ų | 94 | 149.2 Ų | 149.2 | 58% | 0.577 | 77% | 0.766 | S | S | * | * | trans | -62.9 | 129.3 | 166.2 | 51.8 | 0 | 0 | 0 | 0 | 108.7 | Q197 | T195-Q197 VanDerWaalsContact C-N 3.35Å; T195-Q197 PolarHBondContact O-N 3.26Å | ||
| 196 | P | 60.2 | Low | 52.1 | Low | 127 Ų | 127 | 149.8 Ų | 149.8 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | trans | -68.5 | 93.9 | 175.2 | 26.9 | -32 | 0 | 0 | 0 | 109.3 | N198 | P196-N198 PolarHBondContact O-N 3.48Š| ||
| 197 | Q | 57.6 | Low | 51.4 | Low | 159 Ų | 159 | 150.4 Ų | 150.4 | 74% | 0.743 | 77% | 0.769 | S | S | * | * | trans | -65.7 | 116.5 | 176.5 | -159.7 | 70.8 | 0.3 | 0 | 0 | 109 | T195 Y199 | T195-Q197 VanDerWaalsContact C-N 3.35Å; T195-Q197 PolarHBondContact O-N 3.26Å; Q197-Y199 PolarHBondContact O-N 3.07Å; Q197-Y199 VanDerWaalsContact O-N 3.13Å | ||
| 198 | N | 66.6 | Low | 50.8 | Low | 118 Ų | 118 | 150.3 Ų | 150.3 | 63% | 0.631 | 78% | 0.775 | S | S | * | * | trans | -72.8 | 102.1 | 179.6 | -154 | 2 | 0 | 0 | 0 | 108.7 | P196 F200 S201 | P196-N198 PolarHBondContact O-N 3.48Å; N198-F200 PolarHBondContact O-N 3.07Å; N198-S201 PolarHBondContact O-N 3.29Å | ||
| 199 | Y | 67.8 | Low | 50.1 | Low | 219 Ų | 219 | 149.2 Ų | 149.2 | 86% | 0.859 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 0.9 | -170.4 | -138.1 | -89.9 | 0 | 0 | 0 | 115.3 | Q197 | Q197-Y199 PolarHBondContact O-N 3.07Å; Q197-Y199 VanDerWaalsContact O-N 3.13Å |
| 200 | F | 52.8 | Low | 49.5 | Very low | 196 Ų | 196 | 147.3 Ų | 147.3 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.5 | 4.1 | 179.4 | -82.6 | -81 | 0 | 0 | 0 | 114.1 | N198 L202 | N198-F200 PolarHBondContact O-N 3.07Å; F200-L202 PolarHBondContact O-N 3.42Å |
| 201 | S | 58.6 | Low | 49.2 | Very low | 89 Ų | 89 | 148.1 Ų | 148.1 | 62% | 0.622 | 77% | 0.774 | S | S | * | * | trans | -91.7 | 93.1 | 167.9 | -63.7 | 0 | 0 | 0 | 0 | 107.6 | N198 | N198-S201 PolarHBondContact O-N 3.29Š| ||
| 202 | L | 48.1 | Very low | 48.7 | Very low | 155 Ų | 155 | 146 Ų | 146 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -53 | 142.6 | 164.7 | -69.4 | 166.9 | 0 | 0 | 0 | 108.6 | F200 D204 | F200-L202 PolarHBondContact O-N 3.42Å; L202-D204 PolarHBondContact O-N 2.88Å | ||
| 203 | E | 44.5 | Very low | 48.4 | Very low | 165 Ų | 165 | 143 Ų | 143 | 77% | 0.771 | 77% | 0.767 | S | S | * | * | trans | -51.4 | 110.9 | 174.3 | -67.9 | 94.5 | 174.9 | 0 | 0 | 109.9 | D205 | E203-D205 PolarHBondContact O-N 2.97Š| ||
| 204 | D | 45.6 | Very low | 48 | Very low | 145 Ų | 145 | 142.2 Ų | 142.2 | 78% | 0.775 | 77% | 0.77 | S | S | * | * | trans | -78.4 | 78.2 | 167.8 | -153.7 | 3.7 | 0 | 0 | 0 | 106.5 | L202 S206 | L202-D204 PolarHBondContact O-N 2.88Å; D204-S206 PolarHBondContact O-N 2.98Å | ||
| 205 | D | 51.3 | Low | 47.4 | Very low | 160 Ų | 160 | 142.1 Ų | 142.1 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -65.4 | 85.4 | 167.6 | -95.4 | -22 | 0 | 0 | 0 | 108.1 | E203 | E203-D205 PolarHBondContact O-N 2.97Š| ||
| 206 | S | 40.4 | Very low | 46.6 | Very low | 88 Ų | 88 | 143.9 Ų | 143.9 | 62% | 0.615 | 78% | 0.78 | S | S | * | * | trans | -126.3 | 94.6 | 164.3 | 55.9 | 0 | 0 | 0 | 0 | 110.7 | D204 | D204-S206 PolarHBondContact O-N 2.98Š| ||
| 207 | Q | 39.8 | Very low | 45.5 | Very low | 172 Ų | 172 | 144.5 Ų | 144.5 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -45.9 | 137.1 | 160 | -148.4 | 172 | -87.3 | 0 | 0 | 110.5 | L209 | Q207-L209 PolarHBondContact O-N 3.41Š| ||
| 208 | P | 41.4 | Very low | 45 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -79 | 123.1 | -174 | 30.5 | -32.6 | 0 | 0 | 0 | 111 | ||||
| 209 | L | 35.8 | Very low | 43.6 | Very low | 156 Ų | 156 | 145 Ų | 145 | 82% | 0.817 | 79% | 0.785 | S | S | * | * | trans | -134 | 147.1 | 163.4 | -70.9 | 179.7 | 0 | 0 | 0 | 111 | Q207 | Q207-L209 PolarHBondContact O-N 3.41Š| ||
| 210 | P | 41.8 | Very low | 42.6 | Very low | 116 Ų | 116 | 139.5 Ų | 139.5 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | -92.7 | 157.7 | -152.9 | 36.3 | -36.3 | 0 | 0 | 0 | 115.8 | ||||
| 211 | D | 41.7 | Very low | 41.4 | Very low | 161 Ų | 161 | 135.1 Ų | 135.1 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | 25.7 | 104.8 | 151.4 | -92.7 | -12.7 | 0 | 0 | 0 | 118.6 | ||||
| 212 | V | 37.2 | Very low | 40.3 | Very low | 142 Ų | 142 | 135.5 Ų | 135.5 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | trans | -151.7 | 131.9 | 140.5 | -175.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 213 | V | 38 | Very low | 40.3 | Very low | 118 Ų | 118 | 134 Ų | 134 | 72% | 0.715 | 79% | 0.785 | S | S | * | * | trans | -56 | 151.7 | -179.3 | -73.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 214 | P | 38.8 | Very low | 39.8 | Very low | 127 Ų | 127 | 131.3 Ų | 131.3 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -89.3 | 123.8 | 171 | 31.6 | -26 | 0 | 0 | 0 | 112.1 | ||||
| 215 | I | 35.3 | Very low | 39.4 | Very low | 161 Ų | 161 | 133.1 Ų | 133.1 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -102.4 | 109.3 | 164.7 | -78.3 | 170.8 | 0 | 0 | 0 | 109.1 | ||||
| 216 | V | 35 | Very low | 39.4 | Very low | 130 Ų | 130 | 130.6 Ų | 130.6 | 79% | 0.788 | 79% | 0.786 | S | S | * | * | trans | 2 | 127.1 | 144 | -178.7 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 217 | D | 37.1 | Very low | 38.9 | Very low | 140 Ų | 140 | 132.7 Ų | 132.7 | 75% | 0.749 | 80% | 0.799 | S | S | * | * | trans | -55.8 | 154.8 | 165.9 | -143.5 | -3.4 | 0 | 0 | 0 | 113.6 | ||||
| 218 | P | 47.8 | Very low | 39.1 | Very low | 120 Ų | 120 | 129.8 Ų | 129.8 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | -146.9 | 135.4 | 110.9 | 32.5 | -14.5 | 0 | 0 | 0 | 117.3 | |||||
| 219 | E | 36.1 | Very low | 38.6 | Very low | 168 Ų | 168 | 134.4 Ų | 134.4 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -23.3 | 177 | 145.4 | -130.3 | -150.6 | 147.2 | 0 | 0 | 118.4 | ||||
| 220 | P | 46.7 | Very low | 38.3 | Very low | 103 Ų | 103 | 132.3 Ų | 132.3 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | -125.7 | 160.6 | -62.2 | 32.6 | -15.9 | 0 | 0 | 0 | 113.4 | |||||
| 221 | A | 29.4 | Very low | 38.3 | Very low | 105 Ų | 105 | 131.2 Ų | 131.2 | 87% | 0.868 | 79% | 0.794 | S | S | * | * | trans | -158.3 | 132.3 | 156.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 222 | A | 33.7 | Very low | 38 | Very low | 96 Ų | 96 | 128.4 Ų | 128.4 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -109.6 | -170.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 223 | P | 49.7 | Very low | 37.9 | Very low | 125 Ų | 125 | 129 Ų | 129 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | cis | -128.6 | 159.1 | -34 | 32.2 | -15 | 0 | 0 | 0 | 112.4 | ||||
| 224 | A | 33.7 | Very low | 38 | Very low | 107 Ų | 107 | 132.1 Ų | 132.1 | 88% | 0.884 | 80% | 0.798 | S | S | * | * | trans | -158.7 | 128 | 158.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 225 | E | 35.9 | Very low | 38.5 | Very low | 184 Ų | 184 | 131.1 Ų | 131.1 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -91.5 | -170.7 | 177.1 | -133.4 | -172.7 | -158.7 | 0 | 0 | 109.6 | ||||
| 226 | P | 52.9 | Low | 38.4 | Very low | 106 Ų | 106 | 126.9 Ų | 126.9 | 69% | 0.688 | 79% | 0.787 | S | S | * | * | -118.4 | 178.8 | -85.1 | 31.2 | -10.1 | 0 | 0 | 0 | 112 | |||||
| 227 | C | 29 | Very low | 38.7 | Very low | 132 Ų | 132 | 129.2 Ų | 129.2 | 89% | 0.892 | 79% | 0.79 | S | S | * | * | trans | -149.9 | 150.4 | 153.4 | -95.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 228 | P | 43.6 | Very low | 39 | Very low | 112 Ų | 112 | 128 Ų | 128 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -115.7 | -173.9 | -157.2 | 37.2 | -20.2 | 0 | 0 | 0 | 113.6 | ||||
| 229 | Y | 30.7 | Very low | 38.7 | Very low | 213 Ų | 213 | 129.8 Ų | 129.8 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | trans | 82.8 | 137 | 156.9 | -134.1 | -122.6 | 0 | 0 | 0 | 113.7 | ||||
| 230 | V | 30.6 | Very low | 39.6 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 68% | 0.679 | 79% | 0.794 | S | S | * | * | cis | -158.8 | 141 | 42.7 | -160.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 231 | A | 41.4 | Very low | 40.1 | Very low | 93 Ų | 93 | 127 Ų | 127 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -85.5 | 141.8 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 232 | A | 35.7 | Very low | 40.9 | Very low | 103 Ų | 103 | 128.5 Ų | 128.5 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -138.2 | 117.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 233 | D | 35.2 | Very low | 41.3 | Very low | 153 Ų | 153 | 130.4 Ų | 130.4 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | -63.2 | 151.6 | 170.8 | -70.4 | -53 | 0 | 0 | 0 | 113 | ||||
| 234 | E | 40.7 | Very low | 40.9 | Very low | 184 Ų | 184 | 133.8 Ų | 133.8 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | -179.1 | 159.1 | 119 | -99.1 | -93.8 | 121.7 | 0 | 0 | 112.3 | |||||
| 235 | P | 47.9 | Very low | 41.2 | Very low | 106 Ų | 106 | 132 Ų | 132 | 69% | 0.688 | 78% | 0.783 | S | S | * | * | trans | -106.9 | 158.1 | -141.5 | 41.3 | -37.6 | 0 | 0 | 0 | 113.8 | ||||
| 236 | G | 34 | Very low | 41.2 | Very low | 72 Ų | 72 | 126.9 Ų | 126.9 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -161.2 | 69.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 237 | Q | 41.7 | Very low | 40.6 | Very low | 179 Ų | 179 | 127.8 Ų | 127.8 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | 59.9 | 101.2 | 144 | -57.1 | -170.3 | -9.8 | 0 | 0 | 119.6 | ||||
| 238 | S | 42 | Very low | 41.1 | Very low | 115 Ų | 115 | 128.2 Ų | 128.2 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -46.9 | 126.2 | 149.9 | 49.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 239 | N | 42.6 | Very low | 41 | Very low | 158 Ų | 158 | 131.7 Ų | 131.7 | 85% | 0.845 | 79% | 0.789 | S | S | * | * | trans | -127 | 77.2 | 154.9 | -85.4 | -59.2 | 0 | 0 | 0 | 108.4 | ||||
| 240 | A | 53.6 | Low | 41.2 | Very low | 91 Ų | 91 | 125 Ų | 125 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | -113.1 | 116.1 | 161.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 241 | P | 58.8 | Low | 41.4 | Very low | 120 Ų | 120 | 124.3 Ų | 124.3 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | trans | -76.6 | 131 | 175 | 28.1 | -30.8 | 0 | 0 | 0 | 111.5 | ||||
| 242 | L | 46.5 | Very low | 41.5 | Very low | 137 Ų | 137 | 125.8 Ų | 125.8 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | trans | 56.4 | 96.1 | 151.2 | -97.5 | 58 | 0 | 0 | 0 | 116.3 | F244 | L242-F244 HydrophobicContact CD2-CE2 4.21Š| ||
| 243 | D | 42 | Very low | 41.7 | Very low | 137 Ų | 137 | 124.4 Ų | 124.4 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | 32.9 | 97 | 77.3 | -164.1 | 20.2 | 0 | 0 | 0 | 115.4 | G245 | D243-G245 PolarHBondContact OD1-N 3.19Š| |||
| 244 | F | 40 | Very low | 41.8 | Very low | 195 Ų | 195 | 127.8 Ų | 127.8 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | trans | -133.1 | 76.7 | 141.7 | -78.6 | -80.8 | 0 | 0 | 0 | 107.8 | L242 | L242-F244 HydrophobicContact CD2-CE2 4.21Š| ||
| 245 | G | 40.6 | Very low | 41.5 | Very low | 70 Ų | 70 | 126.3 Ų | 126.3 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | trans | -68.5 | 125.5 | 149.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | D243 | D243-G245 PolarHBondContact OD1-N 3.19Š| ||
| 246 | G | 35.5 | Very low | 40.8 | Very low | 76 Ų | 76 | 123.8 Ų | 123.8 | 78% | 0.784 | 78% | 0.776 | S | S | * | * | trans | -165.7 | 66.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 247 | S | 40.6 | Very low | 40.8 | Very low | 126 Ų | 126 | 128.2 Ų | 128.2 | 88% | 0.881 | 78% | 0.778 | S | S | * | * | trans | -61.4 | 130.7 | 170.6 | -44.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 248 | N | 39.4 | Very low | 40.5 | Very low | 140 Ų | 140 | 129.7 Ų | 129.7 | 75% | 0.749 | 78% | 0.777 | S | S | * | * | trans | -167.4 | 101.4 | 147.1 | -143 | -8.3 | 0 | 0 | 0 | 106.2 | ||||
| 249 | E | 40.8 | Very low | 40.3 | Very low | 185 Ų | 185 | 129.5 Ų | 129.5 | 86% | 0.864 | 77% | 0.767 | S | S | * | * | 52.1 | 124.6 | 89.5 | -139.3 | 167.5 | -165.6 | 0 | 0 | 113.3 | |||||
| 250 | G | 34.8 | Very low | 39.7 | Very low | 72 Ų | 72 | 129.2 Ų | 129.2 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | 115.2 | 87.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 251 | A | 34.7 | Very low | 39 | Very low | 99 Ų | 99 | 135.2 Ų | 135.2 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | 88.9 | 119 | 86.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 252 | S | 45.3 | Very low | 38.2 | Very low | 123 Ų | 123 | 137.1 Ų | 137.1 | 86% | 0.86 | 76% | 0.764 | S | S | * | * | trans | -7.8 | 145.7 | 149.4 | -49.6 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 253 | A | 38.3 | Very low | 37.8 | Very low | 74 Ų | 74 | 139 Ų | 139 | 61% | 0.612 | 77% | 0.769 | S | S | * | * | trans | 140.4 | 126.5 | 144.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 254 | W | 38.1 | Very low | 38.1 | Very low | 225 Ų | 225 | 137.8 Ų | 137.8 | 85% | 0.852 | 77% | 0.769 | S | S | * | * | cis | -157.9 | 134.8 | 44.4 | -69 | 80.6 | 0 | 0 | 0 | 105.5 | ||||
| 255 | D | 33.6 | Very low | 38 | Very low | 153 Ų | 153 | 137.2 Ų | 137.2 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | 50.3 | 134.6 | 75.8 | -162.5 | 37.4 | 0 | 0 | 0 | 114 | |||||
| 256 | G | 34.7 | Very low | 37.7 | Very low | 52 Ų | 52 | 138.5 Ų | 138.5 | 54% | 0.536 | 77% | 0.774 | S | S | . | * | trans | 111.9 | 90.9 | 163.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 257 | Q | 33 | Very low | 37.5 | Very low | 166 Ų | 166 | 138.2 Ų | 138.2 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | 29.4 | 119.1 | 115 | -167.3 | 169.2 | -15.1 | 0 | 0 | 118.1 | D259 | Q257-D259 PolarHBondContact NE2-OD2 3.28Š| |||
| 258 | Y | 36.2 | Very low | 37.6 | Very low | 210 Ų | 210 | 138.7 Ų | 138.7 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | -119.3 | 92.6 | 160 | -104.8 | -89.7 | 0 | 0 | 0 | 110.4 | Y261 | Y258-Y261 HydrophobicContact CE1-CE2 4.45Š| ||
| 259 | D | 36.4 | Very low | 37.3 | Very low | 111 Ų | 111 | 140.4 Ų | 140.4 | 59% | 0.594 | 78% | 0.775 | S | S | * | * | trans | -82.2 | 153.5 | 151.3 | -89.7 | -59.2 | 0 | 0 | 0 | 109.2 | Q257 | Q257-D259 PolarHBondContact NE2-OD2 3.28Š| ||
| 260 | Q | 31.3 | Very low | 36.9 | Very low | 152 Ų | 152 | 136.3 Ų | 136.3 | 71% | 0.71 | 76% | 0.763 | S | S | * | * | trans | 76.6 | 99.5 | 140.6 | -162.8 | 153.2 | 41.9 | 0 | 0 | 120 | ||||
| 261 | Y | 37.8 | Very low | 36.9 | Very low | 217 Ų | 217 | 141.9 Ų | 141.9 | 85% | 0.851 | 77% | 0.767 | S | S | * | * | trans | -134 | 93.2 | 131.8 | -73.5 | -76.7 | 0 | 0 | 0 | 110.3 | Y258 | Y258-Y261 HydrophobicContact CE1-CE2 4.45Š| ||
| 262 | Q | 42.3 | Very low | 37.5 | Very low | 160 Ų | 160 | 141.7 Ų | 141.7 | 75% | 0.748 | 76% | 0.758 | S | S | * | * | trans | -94.9 | 142.3 | 144.2 | -74.7 | 178.4 | 5.8 | 0 | 0 | 107.3 | ||||
| 263 | Q | 39.4 | Very low | 36.9 | Very low | 175 Ų | 175 | 144.4 Ų | 144.4 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | -178.8 | 159.6 | 145.2 | -85.4 | -39.4 | -24.9 | 0 | 0 | 108 | ||||
| 264 | P | 48.3 | Very low | 36.6 | Very low | 112 Ų | 112 | 144.2 Ų | 144.2 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | -130.1 | 174.7 | -72 | 26.9 | -3.7 | 0 | 0 | 0 | 113.8 | |||||
| 265 | M | 37.3 | Very low | 36.4 | Very low | 184 Ų | 184 | 143.1 Ų | 143.1 | 91% | 0.906 | 76% | 0.759 | S | S | * | * | trans | -53.5 | 149.4 | 168.7 | -83.9 | -93.2 | 173.4 | 0 | 0 | 115.7 | ||||
| 266 | A | 33.3 | Very low | 36.7 | Very low | 96 Ų | 96 | 145 Ų | 145 | 79% | 0.793 | 76% | 0.756 | S | S | * | * | 167.8 | 131.3 | 120.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 267 | G | 32.3 | Very low | 36.7 | Very low | 71 Ų | 71 | 149.9 Ų | 149.9 | 73% | 0.732 | 77% | 0.77 | S | S | * | * | trans | -77.2 | -177.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 268 | P | 41.9 | Very low | 36.9 | Very low | 136 Ų | 136 | 145.9 Ų | 145.9 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | -138.5 | 159.4 | 126.3 | 33 | -17.8 | 0 | 0 | 0 | 115 | |||||
| 269 | E | 34.3 | Very low | 37.4 | Very low | 175 Ų | 175 | 141.3 Ų | 141.3 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -66.9 | 150.8 | 171.9 | -77.1 | -163.4 | 141.4 | 0 | 0 | 115.1 | ||||
| 270 | T | 32.6 | Very low | 37.3 | Very low | 99 Ų | 99 | 146.8 Ų | 146.8 | 61% | 0.607 | 78% | 0.775 | S | S | * | * | trans | 27.1 | 145.2 | 135.4 | 66.6 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 271 | F | 33.8 | Very low | 38 | Very low | 189 Ų | 189 | 149.3 Ų | 149.3 | 83% | 0.829 | 78% | 0.78 | S | S | * | * | trans | 96.1 | 154.4 | 154.9 | -65.8 | -73 | 0 | 0 | 0 | 119.7 | ||||
| 272 | P | 46.4 | Very low | 37.9 | Very low | 96 Ų | 96 | 146.6 Ų | 146.6 | 62% | 0.623 | 78% | 0.775 | S | S | * | * | cis | -138.7 | -171.1 | -35.5 | 39.7 | -22.3 | 0 | 0 | 0 | 113.6 | ||||
| 273 | E | 33.3 | Very low | 37.7 | Very low | 180 Ų | 180 | 144.8 Ų | 144.8 | 84% | 0.841 | 77% | 0.77 | S | S | * | * | trans | 64.7 | 116.2 | 162.2 | -109 | 80.4 | -163.6 | 0 | 0 | 117 | ||||
| 274 | G | 33 | Very low | 38.2 | Very low | 70 Ų | 70 | 142.5 Ų | 142.5 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | 91 | 134.4 | 64 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 275 | Y | 33.7 | Very low | 37.4 | Very low | 201 Ų | 201 | 144.6 Ų | 144.6 | 79% | 0.788 | 78% | 0.776 | S | S | * | * | trans | 92.7 | 82.5 | 155.4 | -130.2 | -106.4 | 0 | 0 | 0 | 119.3 | ||||
| 276 | Y | 38.8 | Very low | 38.1 | Very low | 193 Ų | 193 | 141.5 Ų | 141.5 | 76% | 0.757 | 77% | 0.769 | S | S | * | * | -171.8 | 104.7 | 103.6 | -115.9 | -79.8 | 0 | 0 | 0 | 110.8 | |||||
| 277 | D | 35.9 | Very low | 38.3 | Very low | 155 Ų | 155 | 145.5 Ų | 145.5 | 83% | 0.829 | 77% | 0.772 | S | S | * | * | trans | -72.5 | 124.1 | 160 | -156.1 | -0.7 | 0 | 0 | 0 | 107.6 | ||||
| 278 | A | 36.4 | Very low | 38.7 | Very low | 82 Ų | 82 | 150 Ų | 150 | 68% | 0.678 | 78% | 0.778 | S | S | * | * | trans | -156.7 | 113 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 279 | P | 47.3 | Very low | 38.4 | Very low | 113 Ų | 113 | 148.7 Ų | 148.7 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -85.6 | 130.9 | 178.9 | 33.5 | -29.9 | 0 | 0 | 0 | 109.9 | ||||
| 280 | Y | 34.8 | Very low | 38.6 | Very low | 227 Ų | 227 | 148.8 Ų | 148.8 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | -112.9 | 100.8 | 158.3 | -116.7 | -89 | 0 | 0 | 0 | 109.1 | Q282 | Y280-Q282 PolarHBondContact O-N 2.95Š| ||
| 281 | Y | 44.5 | Very low | 39.2 | Very low | 205 Ų | 205 | 149.1 Ų | 149.1 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -57.7 | 124.4 | 160 | -117.5 | -97.3 | 0 | 0 | 0 | 108.6 | ||||
| 282 | Q | 36.8 | Very low | 39.7 | Very low | 160 Ų | 160 | 147.5 Ų | 147.5 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | -148.4 | 92.3 | 153.8 | -160.5 | 78.3 | 15.7 | 0 | 0 | 108.9 | Y280 | Y280-Q282 PolarHBondContact O-N 2.95Š| ||
| 283 | N | 37.9 | Very low | 39.9 | Very low | 122 Ų | 122 | 147.8 Ų | 147.8 | 65% | 0.652 | 79% | 0.788 | S | S | * | * | trans | 27.5 | 136.2 | 156.2 | -59 | -51.2 | 0 | 0 | 0 | 121.7 | ||||
| 284 | P | 50 | Low | 40.8 | Very low | 127 Ų | 127 | 144.5 Ų | 144.5 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -77.1 | 132.3 | 171.3 | 33.5 | -31.2 | 0 | 0 | 0 | 110.7 | ||||
| 285 | D | 31.8 | Very low | 41.5 | Very low | 156 Ų | 156 | 146.3 Ų | 146.3 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | trans | -131.2 | 118.9 | 162.9 | -153.1 | 4.5 | 0 | 0 | 0 | 108.6 | ||||
| 286 | P | 52.3 | Low | 42.6 | Very low | 118 Ų | 118 | 140.6 Ų | 140.6 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | trans | -100.2 | 86.3 | -166.5 | 37 | -30.5 | 0 | 0 | 0 | 111.8 | ||||
| 287 | E | 37.1 | Very low | 43.5 | Very low | 181 Ų | 181 | 134.8 Ų | 134.8 | 85% | 0.846 | 75% | 0.753 | S | S | * | * | trans | -164.2 | 99.9 | 165.7 | -133.9 | 174.7 | 172.8 | 0 | 0 | 111.5 | ||||
| 288 | L | 40.7 | Very low | 44.6 | Very low | 165 Ų | 165 | 131.4 Ų | 131.4 | 86% | 0.864 | 74% | 0.738 | S | S | * | * | trans | 149.8 | 77.1 | 156.2 | -85.7 | 148.5 | 0 | 0 | 0 | 110.1 | E290 | L288-E290 PolarHBondContact O-N 2.68Š| ||
| 289 | A | 34.3 | Very low | 45.7 | Very low | 108 Ų | 108 | 134.6 Ų | 134.6 | 89% | 0.893 | 74% | 0.741 | S | S | * | * | trans | -77.7 | 94 | 163.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 290 | E | 39.8 | Very low | 46.3 | Very low | 178 Ų | 178 | 133.6 Ų | 133.6 | 83% | 0.832 | 73% | 0.725 | S | S | * | * | trans | -79.5 | 129.1 | 156.6 | -72.4 | -141.4 | 159 | 0 | 0 | 108.7 | L288 E292 | L288-E290 PolarHBondContact O-N 2.68Å; E290-E292 PolarHBondContact O-N 3.38Å | ||
| 291 | A | 44.7 | Very low | 47.7 | Very low | 106 Ų | 106 | 128.9 Ų | 128.9 | 88% | 0.876 | 72% | 0.715 | S | S | * | * | trans | -68.5 | 99.6 | -177 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 292 | E | 43.8 | Very low | 49.2 | Very low | 155 Ų | 155 | 123.5 Ų | 123.5 | 72% | 0.724 | 70% | 0.701 | S | S | * | * | trans | -62.4 | 144.9 | 156.2 | -116.2 | -147.5 | 144.3 | 0 | 0 | 109.8 | E290 | E290-E292 PolarHBondContact O-N 3.38Š| ||
| 293 | P | 51.2 | Low | 50.9 | Low | 101 Ų | 101 | 122.3 Ų | 122.3 | 66% | 0.656 | 70% | 0.695 | S | S | * | * | trans | -59.8 | 139.3 | 174.1 | 27.8 | -33.1 | 0 | 0 | 0 | 109 | D295 | P293-D295 PolarHBondContact O-N 3.38Š| ||
| 294 | P | 50.9 | Low | 52.5 | Low | 112 Ų | 112 | 118.6 Ų | 118.6 | 73% | 0.727 | 69% | 0.685 | S | S | * | * | trans | -59.3 | 109.4 | -175.8 | 24.9 | -33.4 | 0 | 0 | 0 | 108.9 | S296 | P294-S296 PolarHBondContact O-N 3.38Š| ||
| 295 | D | 49.5 | Very low | 53.7 | Low | 108 Ų | 108 | 117.1 Ų | 117.1 | 58% | 0.578 | 67% | 0.666 | S | S | * | * | trans | -52.8 | 130 | 177.3 | -142.4 | -6.4 | 0 | 0 | 0 | 107.8 | P293 S297 T298 | P293-D295 PolarHBondContact O-N 3.38Å; D295-S297 PolarHBondContact O-N 2.86Å; D295-T298 WeakPolarHBondContact O-CB 3.44Å; D295-T298 PolarHBondContact O-N 2.87Å; D295-T298 PolarHBondContact O-OG1 3.37Å | ||
| 296 | S | 55.5 | Low | 55.6 | Low | 81 Ų | 81 | 112 Ų | 112 | 57% | 0.566 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.5 | -25.5 | -172.3 | 59.8 | 0 | 0 | 0 | 0 | 114 | P294 T298 M299 F300 | P294-S296 PolarHBondContact O-N 3.38Å; S296-T298 VanDerWaalsContact C-N 3.27Å; S296-T298 PolarHBondContact O-N 3.3Å; S296-M299 PolarHBondContact O-N 2.94Å; S296-F300 WeakPolarHBondContact O-CD2 3.43Å; S296-F300 WeakPolarHBondContact O-CE2 3.33Å |
| 297 | S | 57.1 | Low | 56.5 | Low | 70 Ų | 70 | 115.5 Ų | 115.5 | 49% | 0.49 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -51.5 | -39.1 | 171.2 | -169.3 | 0 | 0 | 0 | 0 | 113.8 | D295 M299 F300 D301 | D295-S297 PolarHBondContact O-N 2.86Å; S297-M299 PolarHBondContact O-N 2.84Å; S297-F300 PolarHBondContact O-N 3.31Å; S297-D301 PolarHBondContact O-N 2.9Å |
| 298 | T | 60.1 | Low | 58.3 | Low | 85 Ų | 85 | 113.9 Ų | 113.9 | 52% | 0.521 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -65.7 | -23.3 | -178.7 | 60 | 0 | 0 | 0 | 0 | 113.5 | D295 S296 | D295-T298 WeakPolarHBondContact O-CB 3.44Å; D295-T298 PolarHBondContact O-N 2.87Å; D295-T298 PolarHBondContact O-OG1 3.37Å; S296-T298 VanDerWaalsContact C-N 3.27Å; S296-T298 PolarHBondContact O-N 3.3Å |
| 299 | M | 59.5 | Low | 59.8 | Low | 149 Ų | 149 | 107.4 Ų | 107.4 | 73% | 0.734 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -85.4 | -23.7 | -178.2 | -130.7 | 156.9 | 177.4 | 0 | 0 | 112.6 | S296 S297 | S296-M299 PolarHBondContact O-N 2.94Å; S297-M299 PolarHBondContact O-N 2.84Å |
| 300 | F | 59.2 | Low | 61.5 | Low | 91 Ų | 91 | 103.7 Ų | 103.7 | 40% | 0.399 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -80.3 | -26.4 | 175.3 | -65.7 | -79.2 | 0 | 0 | 0 | 113 | S296 S297 F321 | S296-F300 WeakPolarHBondContact O-CD2 3.43Å; S296-F300 WeakPolarHBondContact O-CE2 3.33Å; S297-F300 PolarHBondContact O-N 3.31Å; F300-F321 HydrophobicContact CE1-CE1 4.49Å; F300-F321 AromaticContact CE1-CE2 3.96Å; F300-F321 HydrophobicContact CE1-CE2 3.96Å; F300-F321 AromaticContact CE1-CZ 3.43Å; F300-F321 HydrophobicContact CE1-CZ 3.43Å; F300-F321 VanDerWaalsContact CE1-CZ 3.43Å; F300-F321 HydrophobicContact CE2-CZ 4.45Å; F300-F321 HydrophobicContact CZ-CE1 4.19Å; F300-F321 AromaticContact CZ-CE2 3.61Å; F300-F321 HydrophobicContact CZ-CE2 3.61Å; F300-F321 AromaticContact CZ-CZ 3.24Å; F300-F321 HydrophobicContact CZ-CZ 3.24Å |
| 301 | D | 64.9 | Low | 63 | Low | 129 Ų | 129 | 105.4 Ų | 105.4 | 69% | 0.69 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -89.8 | -2.5 | 176.6 | -81.2 | -19.6 | 0 | 0 | 0 | 113.6 | S297 E303 | S297-D301 PolarHBondContact O-N 2.9Å; D301-E303 PolarHBondContact O-N 3.36Å |
| 302 | D | 75 | Confident | 64.1 | Low | 92 Ų | 92 | 110.6 Ų | 110.6 | 49% | 0.492 | 57% | 0.571 | S | S | . | * | trans | -63 | 113.4 | 178.7 | -169.4 | 15.8 | 0 | 0 | 0 | 110.5 | G304 F305 M306 | D302-G304 PolarHBondContact O-N 3.39Å; D302-F305 HydrophobicContact CB-CB 4.48Å; D302-F305 PolarHBondContact O-N 3.02Å; D302-M306 PolarHBondContact O-N 3.25Å; D302-M306 VanDerWaalsContact O-N 3.12Å | ||
| 303 | E | 73.1 | Confident | 65 | Low | 135 Ų | 135 | 106.5 Ų | 106.5 | 63% | 0.631 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -55.1 | -30.4 | -177.3 | -165.8 | -165.6 | 147.4 | 0 | 0 | 111 | D301 M306 R307 | D301-E303 PolarHBondContact O-N 3.36Å; E303-M306 PolarHBondContact O-N 3.5Å; E303-R307 WeakPolarHBondContact O-CB 3.21Å; E303-R307 PolarHBondContact O-N 3.3Å; E303-R307 IonicContact OE1-NH1 4Å |
| 304 | G | 72.9 | Confident | 65.7 | Low | 43 Ų | 43 | 108.9 Ų | 108.9 | 44% | 0.443 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.7 | -47.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | D302 R307 L308 | D302-G304 PolarHBondContact O-N 3.39Å; G304-R307 PolarHBondContact O-N 3.45Å; G304-L308 PolarHBondContact O-N 2.86Å; G304-L308 VanDerWaalsContact O-N 3.13Å |
| 305 | F | 73.6 | Confident | 66.3 | Low | 96 Ų | 96 | 107.2 Ų | 107.2 | 42% | 0.421 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.2 | -42 | 177.7 | -173.1 | -102 | 0 | 0 | 0 | 111.1 | D302 R307 L308 Q309 | D302-F305 HydrophobicContact CB-CB 4.48Å; D302-F305 PolarHBondContact O-N 3.02Å; F305-R307 VanDerWaalsContact C-N 3.25Å; F305-R307 PolarHBondContact O-N 2.87Å; F305-L308 PolarHBondContact O-N 2.77Å; F305-L308 VanDerWaalsContact O-N 3.14Å; F305-Q309 PolarHBondContact O-N 2.83Å |
| 306 | M | 71.4 | Confident | 67.1 | Low | 48 Ų | 48 | 110.5 Ų | 110.5 | 24% | 0.236 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -61.8 | -31 | 176 | -78.7 | -69.3 | -139.4 | 0 | 0 | 113.4 | D302 E303 Q309 R314 | D302-M306 PolarHBondContact O-N 3.25Å; D302-M306 VanDerWaalsContact O-N 3.12Å; E303-M306 PolarHBondContact O-N 3.5Å; M306-Q309 PolarHBondContact O-NE2 3.06Å; M306-Q309 PolarHBondContact SD-NE2 3.38Å; M306-R314 HydrophobicContact CE-CG 4.25Å; M306-R314 VanDerWaalsContact CE-NE 3.26Å; M306-R314 HydrophobicContact SD-CG 3.91Å; M306-R314 PolarHBondContact SD-NE 2.77Å |
| 307 | R | 73 | Confident | 67.6 | Low | 193 Ų | 193 | 111.5 Ų | 111.5 | 73% | 0.728 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -79.7 | -28.9 | 177.2 | -155.6 | 150.6 | 84.3 | -169.8 | 9.4 | 112.4 | E303 G304 F305 | E303-R307 WeakPolarHBondContact O-CB 3.21Å; E303-R307 PolarHBondContact O-N 3.3Å; E303-R307 IonicContact OE1-NH1 4Å; G304-R307 PolarHBondContact O-N 3.45Å; F305-R307 VanDerWaalsContact C-N 3.25Å; F305-R307 PolarHBondContact O-N 2.87Å |
| 308 | L | 75.1 | Confident | 68.2 | Low | 147 Ų | 147 | 117.7 Ų | 117.7 | 77% | 0.77 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -73.6 | -38 | 179.3 | -172 | 64.7 | 0 | 0 | 0 | 113.2 | G304 F305 G310 | G304-L308 PolarHBondContact O-N 2.86Å; G304-L308 VanDerWaalsContact O-N 3.13Å; F305-L308 PolarHBondContact O-N 2.77Å; F305-L308 VanDerWaalsContact O-N 3.14Å; L308-G310 PolarHBondContact O-N 3.29Å; L308-G310 VanDerWaalsContact O-N 3.13Å |
| 309 | Q | 70.3 | Confident | 68.8 | Low | 28 Ų | 28 | 116.9 Ų | 116.9 | 13% | 0.131 | 57% | 0.574 | C | S | . | * | S | Bend | trans | -65.8 | -15.3 | 177.7 | 86.8 | -162.8 | -44.3 | 0 | 0 | 113 | F305 M306 N313 R314 | F305-Q309 PolarHBondContact O-N 2.83Å; M306-Q309 PolarHBondContact O-NE2 3.06Å; M306-Q309 PolarHBondContact SD-NE2 3.38Å; Q309-N313 WeakPolarHBondContact O-CB 3.4Å; Q309-N313 PolarHBondContact O-ND2 3Å; Q309-N313 VanDerWaalsContact O-ND2 3.14Å; Q309-R314 VanDerWaalsContact CD-CA 3.49Å; Q309-R314 HydrophobicContact CG-CB 4.48Å |
| 310 | G | 70.6 | Confident | 69.8 | Low | 30 Ų | 30 | 117.9 Ų | 117.9 | 31% | 0.309 | 57% | 0.574 | S | S | . | * | trans | 74.2 | 159.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114 | L308 R312 N313 | L308-G310 PolarHBondContact O-N 3.29Å; L308-G310 VanDerWaalsContact O-N 3.13Å; G310-R312 PolarHBondContact O-N 3.05Å; G310-N313 PolarHBondContact O-N 3.12Å | ||
| 311 | K | 72.2 | Confident | 70.5 | Confident | 215 Ų | 215 | 120.5 Ų | 120.5 | 94% | 0.935 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | -15.6 | -171.5 | -163.3 | 162.4 | -178.1 | 176 | 0 | 114.7 | ||
| 312 | R | 67.9 | Low | 71.2 | Confident | 215 Ų | 215 | 120.6 Ų | 120.6 | 81% | 0.811 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | -15.4 | -173.7 | -166.8 | 162.9 | 62.9 | 96.3 | 1.1 | 114.5 | G310 | G310-R312 PolarHBondContact O-N 3.05Š|
| 313 | N | 62.6 | Low | 71.4 | Confident | 69 Ų | 69 | 124.1 Ų | 124.1 | 37% | 0.369 | 60% | 0.599 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.6 | 0.7 | -175.9 | -53.5 | -26.8 | 0 | 0 | 0 | 114 | Q309 G310 G315 K316 E317 | Q309-N313 WeakPolarHBondContact O-CB 3.4Å; Q309-N313 PolarHBondContact O-ND2 3Å; Q309-N313 VanDerWaalsContact O-ND2 3.14Å; G310-N313 PolarHBondContact O-N 3.12Å; N313-G315 PolarHBondContact O-N 2.98Å; N313-G315 VanDerWaalsContact O-N 3.08Å; N313-K316 PolarHBondContact O-N 3.07Å; N313-E317 VanDerWaalsContact CB-OE1 3.31Å; N313-E317 WeakPolarHBondContact CB-OE1 3.11Å |
| 314 | R | 64.9 | Low | 71.6 | Confident | 150 Ų | 150 | 123 Ų | 123 | 57% | 0.566 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | 112.3 | 176.7 | -159.8 | 152.6 | -168.6 | 177.8 | 5.4 | 110.8 | M306 Q309 | M306-R314 HydrophobicContact CE-CG 4.25Å; M306-R314 VanDerWaalsContact CE-NE 3.26Å; M306-R314 HydrophobicContact SD-CG 3.91Å; M306-R314 PolarHBondContact SD-NE 2.77Å; Q309-R314 VanDerWaalsContact CD-CA 3.49Å; Q309-R314 HydrophobicContact CG-CB 4.48Å |
| 315 | G | 65.1 | Low | 72.1 | Confident | 77 Ų | 77 | 127.6 Ų | 127.6 | 79% | 0.794 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 88.6 | 14.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | N313 | N313-G315 PolarHBondContact O-N 2.98Å; N313-G315 VanDerWaalsContact O-N 3.08Å |
| 316 | K | 65.2 | Low | 72.1 | Confident | 177 Ų | 177 | 125.4 Ų | 125.4 | 77% | 0.77 | 61% | 0.608 | S | S | * | * | trans | -115.4 | 1.6 | 178.4 | -63.4 | -177.4 | -178.3 | -179.5 | 0 | 114.4 | N313 | N313-K316 PolarHBondContact O-N 3.07Š| ||
| 317 | E | 66.3 | Low | 72.2 | Confident | 103 Ų | 103 | 129.6 Ų | 129.6 | 48% | 0.481 | 63% | 0.632 | S | S | . | * | trans | -101.6 | 104.8 | -174.3 | -55 | -173.2 | -165.6 | 0 | 0 | 108.6 | N313 V319 | N313-E317 VanDerWaalsContact CB-OE1 3.31Å; N313-E317 WeakPolarHBondContact CB-OE1 3.11Å; E317-V319 VanDerWaalsContact C-N 3.34Å; E317-V319 HydrophobicContact CB-CG2 4.41Å; E317-V319 PolarHBondContact O-N 3.36Å | ||
| 318 | E | 70.4 | Confident | 72.2 | Confident | 199 Ų | 199 | 126 Ų | 126 | 93% | 0.93 | 63% | 0.627 | S | S | * | * | trans | -72.5 | 93.6 | 166.8 | -170.2 | 176.3 | -177.7 | 0 | 0 | 107.3 | K320 | E318-K320 PolarHBondContact O-N 3.47Å; E318-K320 VanDerWaalsContact O-N 3.07Å | ||
| 319 | V | 72.6 | Confident | 72 | Confident | 68 Ų | 68 | 125.6 Ų | 125.6 | 41% | 0.412 | 62% | 0.621 | S | S | . | * | trans | -74.7 | 101.3 | -176.2 | -173.1 | 0 | 0 | 0 | 0 | 108.9 | E317 F321 | E317-V319 VanDerWaalsContact C-N 3.34Å; E317-V319 HydrophobicContact CB-CG2 4.41Å; E317-V319 PolarHBondContact O-N 3.36Å; V319-F321 HydrophobicContact CB-CD2 4.48Å; V319-F321 HydrophobicContact CB-CE2 3.75Å; V319-F321 HydrophobicContact CB-CZ 3.77Å; V319-F321 HydrophobicContact CG1-CD1 4.17Å; V319-F321 HydrophobicContact CG1-CD2 4.2Å; V319-F321 HydrophobicContact CG1-CE1 3.65Å; V319-F321 HydrophobicContact CG1-CE2 3.68Å; V319-F321 HydrophobicContact CG1-CG 4.4Å; V319-F321 HydrophobicContact CG1-CZ 3.35Å; V319-F321 WeakPolarHBondContact O-CD2 3.46Å; V319-F321 WeakPolarHBondContact O-CE2 3.48Å; V319-F321 PolarHBondContact O-N 3.41Å; V319-F321 VanDerWaalsContact O-N 3.17Å | ||
| 320 | K | 79.9 | Confident | 71.6 | Confident | 171 Ų | 171 | 129.1 Ų | 129.1 | 74% | 0.743 | 64% | 0.64 | S | S | * | * | trans | -76.7 | 97.5 | 169.6 | -173.7 | 176.6 | -179 | 175.8 | 0 | 109.1 | E318 L322 | E318-K320 PolarHBondContact O-N 3.47Å; E318-K320 VanDerWaalsContact O-N 3.07Å; K320-L322 PolarHBondContact O-N 3.08Å; K320-L322 VanDerWaalsContact O-N 3.11Å | ||
| 321 | F | 73.7 | Confident | 71.4 | Confident | 146 Ų | 146 | 129.7 Ų | 129.7 | 64% | 0.64 | 64% | 0.639 | S | S | * | * | trans | -66.1 | 108.9 | 173.7 | -63.9 | -82.3 | 0 | 0 | 0 | 109.8 | F300 V319 | F300-F321 HydrophobicContact CE1-CE1 4.49Å; F300-F321 AromaticContact CE1-CE2 3.96Å; F300-F321 HydrophobicContact CE1-CE2 3.96Å; F300-F321 AromaticContact CE1-CZ 3.43Å; F300-F321 HydrophobicContact CE1-CZ 3.43Å; F300-F321 VanDerWaalsContact CE1-CZ 3.43Å; F300-F321 HydrophobicContact CE2-CZ 4.45Å; F300-F321 HydrophobicContact CZ-CE1 4.19Å; F300-F321 AromaticContact CZ-CE2 3.61Å; F300-F321 HydrophobicContact CZ-CE2 3.61Å; F300-F321 AromaticContact CZ-CZ 3.24Å; F300-F321 HydrophobicContact CZ-CZ 3.24Å; V319-F321 HydrophobicContact CB-CD2 4.48Å; V319-F321 HydrophobicContact CB-CE2 3.75Å; V319-F321 HydrophobicContact CB-CZ 3.77Å; V319-F321 HydrophobicContact CG1-CD1 4.17Å; V319-F321 HydrophobicContact CG1-CD2 4.2Å; V319-F321 HydrophobicContact CG1-CE1 3.65Å; V319-F321 HydrophobicContact CG1-CE2 3.68Å; V319-F321 HydrophobicContact CG1-CG 4.4Å; V319-F321 HydrophobicContact CG1-CZ 3.35Å; V319-F321 WeakPolarHBondContact O-CD2 3.46Å; V319-F321 WeakPolarHBondContact O-CE2 3.48Å; V319-F321 PolarHBondContact O-N 3.41Å; V319-F321 VanDerWaalsContact O-N 3.17Å | ||
| 322 | L | 79.6 | Confident | 71.6 | Confident | 130 Ų | 130 | 121.1 Ų | 121.1 | 68% | 0.681 | 61% | 0.613 | S | S | * | * | trans | -95.6 | 113.5 | 168.6 | -74.1 | 141.1 | 0 | 0 | 0 | 107.2 | K320 I324 | K320-L322 PolarHBondContact O-N 3.08Å; K320-L322 VanDerWaalsContact O-N 3.11Å; L322-I324 HydrophobicContact CB-CG1 4.38Å; L322-I324 PolarHBondContact O-N 3.19Å | ||
| 323 | E | 79.6 | Confident | 72 | Confident | 166 Ų | 166 | 115.2 Ų | 115.2 | 78% | 0.776 | 60% | 0.597 | S | S | * | * | trans | -71.9 | 92.3 | 173.5 | -169.8 | -171.5 | 163 | 0 | 0 | 109.1 | K325 | E323-K325 PolarHBondContact O-N 3.21Š| ||
| 324 | I | 77.8 | Confident | 72.7 | Confident | 113 Ų | 113 | 118.4 Ų | 118.4 | 58% | 0.579 | 61% | 0.61 | S | S | * | * | trans | -88.3 | 105 | 176.6 | -60.2 | 170.2 | 0 | 0 | 0 | 107.8 | L322 G326 Q329 | L322-I324 HydrophobicContact CB-CG1 4.38Å; L322-I324 PolarHBondContact O-N 3.19Å; I324-G326 PolarHBondContact O-N 3.13Å; I324-Q329 HydrophobicContact CG2-CG 4.01Å | ||
| 325 | K | 82.6 | Confident | 73.2 | Confident | 139 Ų | 139 | 117.3 Ų | 117.3 | 60% | 0.604 | 61% | 0.611 | S | S | * | * | trans | -68.9 | 128 | 170.2 | -68.5 | -177 | -179.5 | 173 | 0 | 109.1 | E323 D327 D328 | E323-K325 PolarHBondContact O-N 3.21Å; K325-D327 PolarHBondContact O-N 3.46Å; K325-D327 VanDerWaalsContact O-N 3.14Å; K325-D328 WeakPolarHBondContact O-CB 3.33Å; K325-D328 PolarHBondContact O-N 3.26Å | ||
| 326 | G | 74.1 | Confident | 73.6 | Confident | 49 Ų | 49 | 122.7 Ų | 122.7 | 51% | 0.505 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -58.9 | -26.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | I324 Q329 L330 | I324-G326 PolarHBondContact O-N 3.13Å; G326-Q329 PolarHBondContact O-N 2.8Å; G326-L330 PolarHBondContact O-N 3.33Å |
| 327 | D | 72.8 | Confident | 74.2 | Confident | 137 Ų | 137 | 119 Ų | 119 | 73% | 0.733 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.5 | -33.1 | 176.3 | -159.2 | 39.7 | 0 | 0 | 0 | 112.5 | K325 L330 S331 | K325-D327 PolarHBondContact O-N 3.46Å; K325-D327 VanDerWaalsContact O-N 3.14Å; D327-L330 PolarHBondContact O-N 3.04Å; D327-S331 PolarHBondContact O-N 3.47Å |
| 328 | D | 73.9 | Confident | 74.7 | Confident | 117 Ų | 117 | 117.4 Ų | 117.4 | 63% | 0.626 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -72.5 | -32 | 178.6 | -168.4 | 40.9 | 0 | 0 | 0 | 112 | K325 L330 S331 | K325-D328 WeakPolarHBondContact O-CB 3.33Å; K325-D328 PolarHBondContact O-N 3.26Å; D328-L330 VanDerWaalsContact C-N 3.34Å; D328-L330 PolarHBondContact O-N 3.37Å; D328-S331 PolarHBondContact O-N 3.49Å; D328-S331 PolarHBondContact O-OG 3.27Å |
| 329 | Q | 69.4 | Low | 75.1 | Confident | 139 Ų | 139 | 114.6 Ų | 114.6 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.3 | -34.1 | 172.5 | -92.7 | -166.2 | -18.3 | 0 | 0 | 113.1 | I324 G326 | I324-Q329 HydrophobicContact CG2-CG 4.01Å; G326-Q329 PolarHBondContact O-N 2.8Å |
| 330 | L | 63.3 | Low | 75.3 | Confident | 101 Ų | 101 | 113 Ų | 113 | 53% | 0.529 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -79.1 | -24 | -179.2 | -70.8 | 163.5 | 0 | 0 | 0 | 112.1 | G326 D327 D328 G332 N333 Q334 | G326-L330 PolarHBondContact O-N 3.33Å; D327-L330 PolarHBondContact O-N 3.04Å; D328-L330 VanDerWaalsContact C-N 3.34Å; D328-L330 PolarHBondContact O-N 3.37Å; L330-G332 VanDerWaalsContact C-N 3.31Å; L330-G332 PolarHBondContact O-N 2.82Å; L330-N333 PolarHBondContact O-N 3.26Å; L330-Q334 VanDerWaalsContact O-CB 3.29Å; L330-Q334 WeakPolarHBondContact O-CB 3.21Å; L330-Q334 PolarHBondContact O-N 3.06Å |
| 331 | S | 65.9 | Low | 75.2 | Confident | 42 Ų | 42 | 111 Ų | 111 | 29% | 0.294 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -57.7 | -44.3 | 176.6 | 80.9 | 0 | 0 | 0 | 0 | 111.6 | D327 D328 Q335 | D327-S331 PolarHBondContact O-N 3.47Å; D328-S331 PolarHBondContact O-N 3.49Å; D328-S331 PolarHBondContact O-OG 3.27Å; S331-Q335 WeakPolarHBondContact O-CB 3.39Å; S331-Q335 WeakPolarHBondContact O-CG 3.05Å; S331-Q335 PolarHBondContact O-N 2.94Å |
| 332 | G | 75.8 | Confident | 75 | Confident | 36 Ų | 36 | 107.4 Ų | 107.4 | 37% | 0.371 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.1 | -42.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L330 Q335 W336 | L330-G332 VanDerWaalsContact C-N 3.31Å; L330-G332 PolarHBondContact O-N 2.82Å; G332-Q335 PolarHBondContact O-N 2.92Å; G332-W336 WeakPolarHBondContact O-CB 3.24Å; G332-W336 PolarHBondContact O-N 3.11Å |
| 333 | N | 77.5 | Confident | 74.7 | Confident | 91 Ų | 91 | 105.3 Ų | 105.3 | 49% | 0.487 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68.7 | -41.1 | 178.5 | -169 | 11.9 | 0 | 0 | 0 | 111.7 | L330 Q335 W336 M337 | L330-N333 PolarHBondContact O-N 3.26Å; N333-Q335 VanDerWaalsContact C-N 3.34Å; N333-Q335 PolarHBondContact O-N 2.87Å; N333-W336 PolarHBondContact O-N 3.14Å; N333-M337 WeakPolarHBondContact O-CB 3.4Å; N333-M337 WeakPolarHBondContact O-CG 3.22Å; N333-M337 PolarHBondContact O-N 3.13Å |
| 334 | Q | 76 | Confident | 74.2 | Confident | 135 Ų | 135 | 101.6 Ų | 101.6 | 63% | 0.631 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.5 | -39.9 | 175.7 | -171.2 | 176 | 9.7 | 0 | 0 | 111.3 | L330 T338 | L330-Q334 VanDerWaalsContact O-CB 3.29Å; L330-Q334 WeakPolarHBondContact O-CB 3.21Å; L330-Q334 PolarHBondContact O-N 3.06Å; Q334-T338 VanDerWaalsContact O-CB 3.24Å; Q334-T338 WeakPolarHBondContact O-CB 3.24Å; Q334-T338 PolarHBondContact O-N 3.5Å; Q334-T338 PolarHBondContact O-OG1 3.14Å |
| 335 | Q | 75.8 | Confident | 73.7 | Confident | 128 Ų | 128 | 102.2 Ų | 102.2 | 60% | 0.598 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.3 | -41.8 | 172.1 | -72.3 | 169 | 24.8 | 0 | 0 | 111.5 | S331 G332 N333 T338 K339 | S331-Q335 WeakPolarHBondContact O-CB 3.39Å; S331-Q335 WeakPolarHBondContact O-CG 3.05Å; S331-Q335 PolarHBondContact O-N 2.94Å; G332-Q335 PolarHBondContact O-N 2.92Å; N333-Q335 VanDerWaalsContact C-N 3.34Å; N333-Q335 PolarHBondContact O-N 2.87Å; Q335-T338 PolarHBondContact O-N 3.24Å; Q335-K339 WeakPolarHBondContact O-CB 3.32Å; Q335-K339 PolarHBondContact O-N 2.98Å |
| 336 | W | 73.6 | Confident | 72.8 | Confident | 189 Ų | 189 | 99 Ų | 99 | 72% | 0.716 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.1 | -40.2 | 179.1 | -144.4 | 79.9 | 0 | 0 | 0 | 112.4 | G332 N333 S340 | G332-W336 WeakPolarHBondContact O-CB 3.24Å; G332-W336 PolarHBondContact O-N 3.11Å; N333-W336 PolarHBondContact O-N 3.14Å; W336-S340 VanDerWaalsContact O-CB 3.24Å; W336-S340 WeakPolarHBondContact O-CB 3.37Å; W336-S340 PolarHBondContact O-N 3.33Å; W336-S340 PolarHBondContact O-OG 3.17Å |
| 337 | M | 77.1 | Confident | 72.2 | Confident | 99 Ų | 99 | 100.8 Ų | 100.8 | 49% | 0.488 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.7 | -50 | 172.2 | -72.7 | -69.4 | -72.8 | 0 | 0 | 110.6 | N333 K339 S340 I341 | N333-M337 WeakPolarHBondContact O-CB 3.4Å; N333-M337 WeakPolarHBondContact O-CG 3.22Å; N333-M337 PolarHBondContact O-N 3.13Å; M337-K339 VanDerWaalsContact C-N 3.31Å; M337-K339 PolarHBondContact O-N 3.28Å; M337-S340 WeakPolarHBondContact CA-OG 3.35Å; M337-S340 PolarHBondContact O-N 3.3Å; M337-S340 PolarHBondContact O-OG 2.99Å; M337-I341 HydrophobicContact CB-CD1 4.48Å; M337-I341 HydrophobicContact CE-CD1 4.49Å; M337-I341 WeakPolarHBondContact O-CB 3.18Å; M337-I341 VanDerWaalsContact O-CD1 3.3Å; M337-I341 WeakPolarHBondContact O-CD1 3.29Å; M337-I341 WeakPolarHBondContact O-CG1 3.36Å; M337-I341 PolarHBondContact O-N 3Å |
| 338 | T | 77.8 | Confident | 71.4 | Confident | 70 Ų | 70 | 105.8 Ų | 105.8 | 43% | 0.429 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.7 | -42.3 | 179 | -55.6 | 0 | 0 | 0 | 0 | 111.2 | Q334 Q335 S342 | Q334-T338 VanDerWaalsContact O-CB 3.24Å; Q334-T338 WeakPolarHBondContact O-CB 3.24Å; Q334-T338 PolarHBondContact O-N 3.5Å; Q334-T338 PolarHBondContact O-OG1 3.14Å; Q335-T338 PolarHBondContact O-N 3.24Å; T338-S342 WeakPolarHBondContact O-CB 3.43Å; T338-S342 PolarHBondContact O-N 3.45Å; T338-S342 PolarHBondContact O-OG 2.85Å |
| 339 | K | 79.3 | Confident | 70.8 | Confident | 140 Ų | 140 | 104.9 Ų | 104.9 | 61% | 0.609 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66 | -45.9 | 176.8 | -170.4 | 174.8 | 179.2 | -177.6 | 0 | 111.6 | Q335 M337 I341 S342 E343 | Q335-K339 WeakPolarHBondContact O-CB 3.32Å; Q335-K339 PolarHBondContact O-N 2.98Å; M337-K339 VanDerWaalsContact C-N 3.31Å; M337-K339 PolarHBondContact O-N 3.28Å; K339-I341 VanDerWaalsContact C-N 3.31Å; K339-I341 PolarHBondContact O-N 3.27Å; K339-S342 PolarHBondContact O-N 3.07Å; K339-E343 WeakPolarHBondContact O-CB 3.19Å; K339-E343 PolarHBondContact O-N 2.91Å |
| 340 | S | 75.6 | Confident | 70.2 | Confident | 35 Ų | 35 | 101.9 Ų | 101.9 | 25% | 0.245 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -70.8 | -23.5 | -179.8 | 62.5 | 0 | 0 | 0 | 0 | 114.5 | W336 M337 | W336-S340 VanDerWaalsContact O-CB 3.24Å; W336-S340 WeakPolarHBondContact O-CB 3.37Å; W336-S340 PolarHBondContact O-N 3.33Å; W336-S340 PolarHBondContact O-OG 3.17Å; M337-S340 WeakPolarHBondContact CA-OG 3.35Å; M337-S340 PolarHBondContact O-N 3.3Å; M337-S340 PolarHBondContact O-OG 2.99Å |
| 341 | I | 77.3 | Confident | 69.9 | Low | 129 Ų | 129 | 104.8 Ų | 104.8 | 66% | 0.662 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -81.8 | -36.6 | 173.2 | -67.1 | 162.7 | 0 | 0 | 0 | 111 | M337 K339 | M337-I341 HydrophobicContact CB-CD1 4.48Å; M337-I341 HydrophobicContact CE-CD1 4.49Å; M337-I341 WeakPolarHBondContact O-CB 3.18Å; M337-I341 VanDerWaalsContact O-CD1 3.3Å; M337-I341 WeakPolarHBondContact O-CD1 3.29Å; M337-I341 WeakPolarHBondContact O-CG1 3.36Å; M337-I341 PolarHBondContact O-N 3Å; K339-I341 VanDerWaalsContact C-N 3.31Å; K339-I341 PolarHBondContact O-N 3.27Å |
| 342 | S | 71.4 | Confident | 69.8 | Low | 70 Ų | 70 | 107.2 Ų | 107.2 | 49% | 0.49 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -85.8 | -28.5 | -176.4 | -53.1 | 0 | 0 | 0 | 0 | 113.3 | T338 K339 E344 | T338-S342 WeakPolarHBondContact O-CB 3.43Å; T338-S342 PolarHBondContact O-N 3.45Å; T338-S342 PolarHBondContact O-OG 2.85Å; K339-S342 PolarHBondContact O-N 3.07Å; S342-E344 PolarHBondContact O-N 2.62Å |
| 343 | E | 72.2 | Confident | 69.1 | Low | 87 Ų | 87 | 112.6 Ų | 112.6 | 41% | 0.407 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -70.6 | 115.9 | 176.4 | -171.4 | -178.2 | 172.6 | 0 | 0 | 109.6 | K339 K345 N385 | K339-E343 WeakPolarHBondContact O-CB 3.19Å; K339-E343 PolarHBondContact O-N 2.91Å; E343-K345 PolarHBondContact O-N 2.76Å; E343-N385 WeakPolarHBondContact CG-ND2 3.45Å |
| 344 | E | 69.8 | Low | 68.4 | Low | 88 Ų | 88 | 113.1 Ų | 113.1 | 41% | 0.411 | 54% | 0.539 | S | S | . | . | trans | -69.7 | 97.4 | 174.1 | -171.2 | -176.7 | 166.4 | 0 | 0 | 108 | S342 Q346 N385 | S342-E344 PolarHBondContact O-N 2.62Å; E344-Q346 PolarHBondContact O-N 3.13Å; E344-N385 WeakPolarHBondContact CB-OD1 3.32Å; E344-N385 PolarHBondContact N-OD1 2.89Å; E344-N385 PolarHBondContact O-ND2 3.11Å | ||
| 345 | K | 67.4 | Low | 67.9 | Low | 126 Ų | 126 | 115 Ų | 115 | 55% | 0.548 | 54% | 0.54 | S | S | . | . | trans | -73.4 | 129 | 173.3 | -65.3 | -178.5 | -175.7 | 177.6 | 0 | 108.1 | E343 T347 | E343-K345 PolarHBondContact O-N 2.76Å; K345-T347 PolarHBondContact O-N 2.82Å | ||
| 346 | Q | 63.9 | Low | 67.5 | Low | 72 Ų | 72 | 112.5 Ų | 112.5 | 34% | 0.336 | 55% | 0.549 | S | S | . | . | trans | -35.6 | 116.2 | 171.9 | -166.6 | 160.5 | 75.3 | 0 | 0 | 109.1 | E344 R348 I381 | E344-Q346 PolarHBondContact O-N 3.13Å; Q346-R348 PolarHBondContact O-N 2.85Å; Q346-R348 VanDerWaalsContact O-N 3.11Å; Q346-I381 HydrophobicContact CB-CD1 3.76Å; Q346-I381 HydrophobicContact CG-CD1 3.38Å | ||
| 347 | T | 60.2 | Low | 67.5 | Low | 85 Ų | 85 | 107.6 Ų | 107.6 | 52% | 0.521 | 54% | 0.536 | S | S | . | . | trans | -42.8 | 125.3 | -173.1 | 58.9 | 0 | 0 | 0 | 0 | 108.2 | K345 Q349 | K345-T347 PolarHBondContact O-N 2.82Å; T347-Q349 PolarHBondContact O-N 3.03Å; T347-Q349 PolarHBondContact OG1-NE2 3.33Å | ||
| 348 | R | 56.9 | Low | 68 | Low | 243 Ų | 243 | 106.3 Ų | 106.3 | 92% | 0.917 | 53% | 0.529 | S | S | * | . | trans | -65.6 | 74.5 | -174.9 | -77.2 | -179.8 | 162.4 | -100.2 | 1.4 | 109.3 | Q346 S350 | Q346-R348 PolarHBondContact O-N 2.85Å; Q346-R348 VanDerWaalsContact O-N 3.11Å; R348-S350 PolarHBondContact O-N 3.13Å | ||
| 349 | Q | 60 | Low | 68.5 | Low | 97 Ų | 97 | 103.1 Ų | 103.1 | 45% | 0.453 | 51% | 0.51 | S | S | . | . | trans | -68.1 | 121 | 170.6 | -61.5 | -54.7 | -39.5 | 0 | 0 | 105.8 | T347 Y351 R354 | T347-Q349 PolarHBondContact O-N 3.03Å; T347-Q349 PolarHBondContact OG1-NE2 3.33Å; Q349-Y351 PolarHBondContact O-N 3.07Å; Q349-R354 HydrophobicContact CB-CG 4.35Å | ||
| 350 | S | 56.5 | Low | 69.1 | Low | 77 Ų | 77 | 100.6 Ų | 100.6 | 54% | 0.538 | 51% | 0.506 | S | S | . | . | trans | -47.2 | 135.1 | 178.6 | -64.8 | 0 | 0 | 0 | 0 | 110.2 | R348 S352 K353 R354 | R348-S350 PolarHBondContact O-N 3.13Å; S350-S352 PolarHBondContact O-N 3.45Å; S350-K353 PolarHBondContact O-N 2.84Å; S350-R354 PolarHBondContact O-N 3.33Å | ||
| 351 | Y | 57.5 | Low | 69.8 | Low | 162 Ų | 162 | 100.8 Ų | 100.8 | 64% | 0.635 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -49.3 | -31.3 | -174.2 | -175 | -96.9 | 0 | 0 | 0 | 113.5 | Q349 K353 R354 R355 | Q349-Y351 PolarHBondContact O-N 3.07Å; Y351-K353 PolarHBondContact O-N 3.33Å; Y351-R354 PolarHBondContact O-N 2.81Å; Y351-R355 VanDerWaalsContact CZ-NH1 3.3Å; Y351-R355 PolarHBondContact OH-NH1 3.21Å |
| 352 | S | 63.8 | Low | 70.5 | Confident | 92 Ų | 92 | 100.6 Ų | 100.6 | 64% | 0.643 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.6 | -37.3 | 174.7 | 55 | 0 | 0 | 0 | 0 | 114 | S350 R354 | S350-S352 PolarHBondContact O-N 3.45Å; S352-R354 VanDerWaalsContact C-N 3.34Å |
| 353 | K | 60.8 | Low | 71.5 | Confident | 150 Ų | 150 | 99.3 Ų | 99.3 | 65% | 0.652 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -79.4 | -17.6 | 177.2 | -64.1 | -174.4 | 177.8 | -176.8 | 0 | 112.7 | S350 Y351 | S350-K353 PolarHBondContact O-N 2.84Å; Y351-K353 PolarHBondContact O-N 3.33Å |
| 354 | R | 63.9 | Low | 72.5 | Confident | 101 Ų | 101 | 100.6 Ų | 100.6 | 38% | 0.381 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -76.2 | -21.1 | 179.6 | -52.3 | -161.4 | 88.4 | -170 | 7.5 | 113.3 | Q349 S350 Y351 S352 G356 Q358 | Q349-R354 HydrophobicContact CB-CG 4.35Å; S350-R354 PolarHBondContact O-N 3.33Å; Y351-R354 PolarHBondContact O-N 2.81Å; S352-R354 VanDerWaalsContact C-N 3.34Å; R354-G356 VanDerWaalsContact C-N 3.35Å; R354-Q358 WeakPolarHBondContact O-CG 3.29Å |
| 355 | R | 64.6 | Low | 73.7 | Confident | 176 Ų | 176 | 106.6 Ų | 106.6 | 66% | 0.664 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | -32.5 | 178.7 | -79.3 | -70.5 | -150.9 | -100.7 | -2 | 113 | Y351 | Y351-R355 VanDerWaalsContact CZ-NH1 3.3Å; Y351-R355 PolarHBondContact OH-NH1 3.21Å |
| 356 | G | 67.8 | Low | 75.1 | Confident | 75 Ų | 75 | 107.3 Ų | 107.3 | 77% | 0.773 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -23.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | R354 | R354-G356 VanDerWaalsContact C-N 3.35Š|
| 357 | D | 73.8 | Confident | 76.6 | Confident | 85 Ų | 85 | 109.6 Ų | 109.6 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -91.4 | 0.1 | -176.5 | -155.5 | 33.9 | 0 | 0 | 0 | 112.8 | K377 | D357-K377 IonicContact OD2-NZ 3.56Å; D357-K377 PolarHBondContact OD2-NZ 3.43Å |
| 358 | Q | 88.2 | Confident | 78.3 | Confident | 72 Ų | 72 | 109 Ų | 109 | 34% | 0.336 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -90.3 | 124.5 | 179.4 | -80.5 | -70 | -25 | 0 | 0 | 110.8 | R354 T360 H374 | R354-Q358 WeakPolarHBondContact O-CG 3.29Å; Q358-T360 PolarHBondContact O-N 2.96Å; Q358-H374 PolarHBondContact NE2-NE2 3.38Å |
| 359 | P | 87.4 | Confident | 80 | Confident | 4 Ų | 4 | 103.7 Ų | 103.7 | 3% | 0.026 | 51% | 0.509 | C | S | . | . | P | Polyproline II helix | trans | -65.2 | 135.3 | -179.1 | 21.7 | -30.4 | 0 | 0 | 0 | 111.4 | Q363 R364 Y371 H374 | P359-Q363 HydrophobicContact CB-CB 4.21Å; P359-R364 HydrophobicContact CB-CG 4.3Å; P359-R364 HydrophobicContact CG-CG 4.33Å; P359-R364 PolarHBondContact O-NE 3.42Å; P359-Y371 HydrophobicContact CB-CD2 4.18Å; P359-Y371 HydrophobicContact CG-CD2 3.77Å; P359-H374 HydrophobicContact CG-CB 3.84Å; P359-H374 WeakPolarHBondContact CG-ND1 3.31Å |
| 360 | T | 91.8 | Very high | 81.6 | Confident | 86 Ų | 86 | 102.3 Ų | 102.3 | 53% | 0.528 | 51% | 0.508 | S | S | . | . | P | Polyproline II helix | trans | -60.8 | 153.3 | 177.1 | -65.5 | 0 | 0 | 0 | 0 | 111.5 | Q358 Q362 Q363 R364 | Q358-T360 PolarHBondContact O-N 2.96Å; T360-Q362 VanDerWaalsContact C-N 3.29Å; T360-Q362 PolarHBondContact O-N 3.14Å; T360-Q363 WeakPolarHBondContact O-CA 3.4Å; T360-Q363 VanDerWaalsContact O-CB 3.31Å; T360-Q363 WeakPolarHBondContact O-CB 3.42Å; T360-Q363 PolarHBondContact O-N 3.36Å; T360-R364 WeakPolarHBondContact O-CG 3.4Å; T360-R364 PolarHBondContact O-N 2.87Å |
| 361 | G | 91.3 | Very high | 83.5 | Confident | 40 Ų | 40 | 101.1 Ų | 101.1 | 41% | 0.412 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -53.8 | -39 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | R364 R365 | G361-R364 PolarHBondContact O-N 3.4Å; G361-R365 VanDerWaalsContact O-CG 3.3Å; G361-R365 WeakPolarHBondContact O-CG 3.3Å; G361-R365 PolarHBondContact O-N 2.87Å |
| 362 | Q | 91.1 | Very high | 85.3 | Confident | 124 Ų | 124 | 97.2 Ų | 97.2 | 58% | 0.579 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -66.2 | -38.2 | 173.1 | -68.7 | -164.3 | 12.4 | 0 | 0 | 112.9 | T360 R364 R365 K366 | T360-Q362 VanDerWaalsContact C-N 3.29Å; T360-Q362 PolarHBondContact O-N 3.14Å; Q362-R364 VanDerWaalsContact C-N 3.31Å; Q362-R364 PolarHBondContact O-N 3.13Å; Q362-R365 PolarHBondContact O-N 3.32Å; Q362-K366 WeakPolarHBondContact O-CB 3.13Å; Q362-K366 PolarHBondContact O-N 3.28Å |
| 363 | Q | 93.1 | Very high | 86.7 | Confident | 43 Ų | 43 | 97.8 Ų | 97.8 | 20% | 0.201 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 177.5 | -70.7 | 169.2 | -24 | 0 | 0 | 110.9 | P359 T360 H367 Q368 Y371 | P359-Q363 HydrophobicContact CB-CB 4.21Å; T360-Q363 WeakPolarHBondContact O-CA 3.4Å; T360-Q363 VanDerWaalsContact O-CB 3.31Å; T360-Q363 WeakPolarHBondContact O-CB 3.42Å; T360-Q363 PolarHBondContact O-N 3.36Å; Q363-H367 PolarHBondContact O-N 3.14Å; Q363-H367 VanDerWaalsContact O-N 3.14Å; Q363-Q368 HydrophobicContact CB-CB 4.18Å; Q363-Q368 HydrophobicContact CG-CB 4.23Å; Q363-Q368 PolarHBondContact O-N 3.28Å; Q363-Y371 WeakPolarHBondContact O-CB 3.44Å |
| 364 | R | 93.6 | Very high | 88.2 | Confident | 114 Ų | 114 | 91.5 Ų | 91.5 | 43% | 0.43 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63 | -51.4 | 173.8 | -61.8 | 177.5 | -177.1 | -150.6 | -7.2 | 111.5 | P359 T360 G361 Q362 K366 H367 Y371 | P359-R364 HydrophobicContact CB-CG 4.3Å; P359-R364 HydrophobicContact CG-CG 4.33Å; P359-R364 PolarHBondContact O-NE 3.42Å; T360-R364 WeakPolarHBondContact O-CG 3.4Å; T360-R364 PolarHBondContact O-N 2.87Å; G361-R364 PolarHBondContact O-N 3.4Å; Q362-R364 VanDerWaalsContact C-N 3.31Å; Q362-R364 PolarHBondContact O-N 3.13Å; R364-K366 VanDerWaalsContact C-N 3.34Å; R364-K366 PolarHBondContact O-N 3.15Å; R364-H367 PolarHBondContact O-N 3.21Å; R364-Y371 HydrophobicContact CB-CD2 4.11Å; R364-Y371 HydrophobicContact CB-CE2 4.26Å; R364-Y371 HydrophobicContact CG-CD2 3.62Å; R364-Y371 HydrophobicContact CG-CE2 3.9Å; R364-Y371 HydrophobicContact CG-CG 4.36Å |
| 365 | R | 94.6 | Very high | 89.6 | Confident | 214 Ų | 214 | 89.2 Ų | 89.2 | 81% | 0.808 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.3 | -34.4 | -177.8 | -70.3 | 173.7 | -173.8 | -177.2 | 2.2 | 113.6 | G361 Q362 | G361-R365 VanDerWaalsContact O-CG 3.3Å; G361-R365 WeakPolarHBondContact O-CG 3.3Å; G361-R365 PolarHBondContact O-N 2.87Å; Q362-R365 PolarHBondContact O-N 3.32Å |
| 366 | K | 96.6 | Very high | 90.9 | Very high | 141 Ų | 141 | 83.3 Ų | 83.3 | 61% | 0.613 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | 4.7 | -178.6 | -68.7 | -177.3 | 175.8 | 179.1 | 0 | 113.5 | Q362 R364 Q368 | Q362-K366 WeakPolarHBondContact O-CB 3.13Å; Q362-K366 PolarHBondContact O-N 3.28Å; R364-K366 VanDerWaalsContact C-N 3.34Å; R364-K366 PolarHBondContact O-N 3.15Å; K366-Q368 HydrophobicContact CB-CG 3.93Å; K366-Q368 PolarHBondContact O-N 3.33Å |
| 367 | H | 94.3 | Very high | 91.9 | Very high | 120 Ų | 120 | 84.1 Ų | 84.1 | 56% | 0.556 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.5 | 45.4 | -174.3 | -57.9 | -63.1 | 0 | 0 | 0 | 113.2 | Q363 R364 Y371 | Q363-H367 PolarHBondContact O-N 3.14Å; Q363-H367 VanDerWaalsContact O-N 3.14Å; R364-H367 PolarHBondContact O-N 3.21Å; H367-Y371 AromaticContact ND1-CD1 3.86Å; H367-Y371 AromaticContact ND1-CE1 3.59Å |
| 368 | Q | 96.1 | Very high | 92.4 | Very high | 74 Ų | 74 | 83.5 Ų | 83.5 | 35% | 0.346 | 41% | 0.408 | S | S | . | . | trans | -67.5 | 158.5 | 179.8 | -66.7 | -174.4 | 1.2 | 0 | 0 | 110.9 | Q363 K366 T370 Y371 L372 | Q363-Q368 HydrophobicContact CB-CB 4.18Å; Q363-Q368 HydrophobicContact CG-CB 4.23Å; Q363-Q368 PolarHBondContact O-N 3.28Å; K366-Q368 HydrophobicContact CB-CG 3.93Å; K366-Q368 PolarHBondContact O-N 3.33Å; Q368-T370 PolarHBondContact O-N 2.68Å; Q368-T370 VanDerWaalsContact O-N 3.13Å; Q368-Y371 WeakPolarHBondContact O-CA 3.49Å; Q368-Y371 WeakPolarHBondContact O-CB 3.33Å; Q368-Y371 PolarHBondContact O-N 3.35Å; Q368-L372 PolarHBondContact O-N 3.45Å | ||
| 369 | I | 93.6 | Very high | 92.6 | Very high | 130 Ų | 130 | 85.6 Ų | 85.6 | 67% | 0.667 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -51.1 | -42.5 | -176.7 | -63.5 | 167.9 | 0 | 0 | 0 | 111.5 | Y371 L372 I373 | I369-Y371 VanDerWaalsContact C-N 3.31Å; I369-Y371 PolarHBondContact O-N 3Å; I369-L372 PolarHBondContact O-N 3.5Å; I369-L372 VanDerWaalsContact O-N 3.13Å; I369-I373 HydrophobicContact CG2-CD1 3.6Å; I369-I373 HydrophobicContact CG2-CG1 4.1Å; I369-I373 WeakPolarHBondContact O-CB 3.24Å; I369-I373 VanDerWaalsContact O-CG1 3.26Å; I369-I373 WeakPolarHBondContact O-CG1 3.33Å; I369-I373 PolarHBondContact O-N 2.9Å |
| 370 | T | 94.2 | Very high | 92.7 | Very high | 69 Ų | 69 | 89.7 Ų | 89.7 | 42% | 0.423 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -57.1 | -41.5 | 175.9 | -47.8 | 0 | 0 | 0 | 0 | 113 | Q368 H374 | Q368-T370 PolarHBondContact O-N 2.68Å; Q368-T370 VanDerWaalsContact O-N 3.13Å; T370-H374 WeakPolarHBondContact O-CB 3.33Å; T370-H374 PolarHBondContact O-N 3.29Å |
| 371 | Y | 94.9 | Very high | 92.4 | Very high | 51 Ų | 51 | 87 Ų | 87 | 20% | 0.2 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -69.3 | -40.9 | 175.8 | 173.1 | -108.7 | 0 | 0 | 0 | 111.8 | P359 Q363 R364 H367 Q368 I369 H374 Q375 | P359-Y371 HydrophobicContact CB-CD2 4.18Å; P359-Y371 HydrophobicContact CG-CD2 3.77Å; Q363-Y371 WeakPolarHBondContact O-CB 3.44Å; R364-Y371 HydrophobicContact CB-CD2 4.11Å; R364-Y371 HydrophobicContact CB-CE2 4.26Å; R364-Y371 HydrophobicContact CG-CD2 3.62Å; R364-Y371 HydrophobicContact CG-CE2 3.9Å; R364-Y371 HydrophobicContact CG-CG 4.36Å; H367-Y371 AromaticContact ND1-CD1 3.86Å; H367-Y371 AromaticContact ND1-CE1 3.59Å; Q368-Y371 WeakPolarHBondContact O-CA 3.49Å; Q368-Y371 WeakPolarHBondContact O-CB 3.33Å; Q368-Y371 PolarHBondContact O-N 3.35Å; I369-Y371 VanDerWaalsContact C-N 3.31Å; I369-Y371 PolarHBondContact O-N 3Å; Y371-H374 PolarHBondContact O-N 2.96Å; Y371-Q375 WeakPolarHBondContact O-CB 3.18Å; Y371-Q375 PolarHBondContact O-N 2.74Å |
| 372 | L | 95.7 | Very high | 92.2 | Very high | 80 Ų | 80 | 90.7 Ų | 90.7 | 42% | 0.419 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.7 | -40 | 177.9 | -64.4 | 176.3 | 0 | 0 | 0 | 112.1 | Q368 I369 Q375 A376 | Q368-L372 PolarHBondContact O-N 3.45Å; I369-L372 PolarHBondContact O-N 3.5Å; I369-L372 VanDerWaalsContact O-N 3.13Å; L372-Q375 PolarHBondContact O-N 2.91Å; L372-A376 VanDerWaalsContact O-CB 3.27Å; L372-A376 WeakPolarHBondContact O-CB 3.46Å; L372-A376 PolarHBondContact O-N 3.2Å |
| 373 | I | 93.2 | Very high | 92.1 | Very high | 104 Ų | 104 | 90.2 Ų | 90.2 | 53% | 0.533 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.7 | -48.7 | 173.6 | -70.5 | 167.9 | 0 | 0 | 0 | 109.8 | I369 Q375 A376 K377 | I369-I373 HydrophobicContact CG2-CD1 3.6Å; I369-I373 HydrophobicContact CG2-CG1 4.1Å; I369-I373 WeakPolarHBondContact O-CB 3.24Å; I369-I373 VanDerWaalsContact O-CG1 3.26Å; I369-I373 WeakPolarHBondContact O-CG1 3.33Å; I369-I373 PolarHBondContact O-N 2.9Å; I373-Q375 VanDerWaalsContact C-N 3.33Å; I373-Q375 PolarHBondContact O-N 3.18Å; I373-A376 PolarHBondContact O-N 3.26Å; I373-K377 VanDerWaalsContact O-CB 3.23Å; I373-K377 WeakPolarHBondContact O-CB 3.27Å; I373-K377 PolarHBondContact O-N 3.47Å |
| 374 | H | 92.1 | Very high | 91.9 | Very high | 19 Ų | 19 | 92 Ų | 92 | 9% | 0.088 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -59.9 | -44.2 | 177.7 | 174 | -100.4 | 0 | 0 | 0 | 111.5 | Q358 P359 T370 Y371 A376 K377 E378 | Q358-H374 PolarHBondContact NE2-NE2 3.38Å; P359-H374 HydrophobicContact CG-CB 3.84Å; P359-H374 WeakPolarHBondContact CG-ND1 3.31Å; T370-H374 WeakPolarHBondContact O-CB 3.33Å; T370-H374 PolarHBondContact O-N 3.29Å; Y371-H374 PolarHBondContact O-N 2.96Å; H374-A376 PolarHBondContact O-N 3.49Å; H374-K377 PolarHBondContact O-N 2.94Å; H374-E378 IonicContact CD2-OE1 2.81Å; H374-E378 IonicContact CE1-OE1 2.87Å; H374-E378 PolarHBondContact CE1-OE1 3.28Å; H374-E378 IonicContact CE1-OE2 3.36Å; H374-E378 PolarHBondContact CE1-OE2 3.44Å; H374-E378 IonicContact ND1-OE2 3.98Å; H374-E378 IonicContact NE2-OE1 3.98Å; H374-E378 PolarHBondContact NE2-OE1 3.04Å; H374-E378 IonicContact NE2-OE2 2.76Å; H374-E378 WeakPolarHBondContact O-CG 3.21Å; H374-E378 PolarHBondContact O-N 2.81Å |
| 375 | Q | 93.6 | Very high | 91.7 | Very high | 52 Ų | 52 | 87.8 Ų | 87.8 | 24% | 0.243 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -65.4 | -39 | 176.7 | -159.1 | -169.5 | 41.6 | 0 | 0 | 112.7 | Y371 L372 I373 R379 | Y371-Q375 WeakPolarHBondContact O-CB 3.18Å; Y371-Q375 PolarHBondContact O-N 2.74Å; L372-Q375 PolarHBondContact O-N 2.91Å; I373-Q375 VanDerWaalsContact C-N 3.33Å; I373-Q375 PolarHBondContact O-N 3.18Å; Q375-R379 VanDerWaalsContact CD-CZ 3.47Å; Q375-R379 VanDerWaalsContact CD-NH1 3.26Å; Q375-R379 VanDerWaalsContact CG-NH1 3.35Å; Q375-R379 WeakPolarHBondContact O-CG 3.23Å; Q375-R379 PolarHBondContact O-N 3.48Å; Q375-R379 VanDerWaalsContact OE1-NH1 3.09Å |
| 376 | A | 91.2 | Very high | 91.5 | Very high | 53 Ų | 53 | 81.9 Ų | 81.9 | 44% | 0.438 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.7 | -42.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111 | L372 I373 H374 E378 R379 E380 | L372-A376 VanDerWaalsContact O-CB 3.27Å; L372-A376 WeakPolarHBondContact O-CB 3.46Å; L372-A376 PolarHBondContact O-N 3.2Å; I373-A376 PolarHBondContact O-N 3.26Å; H374-A376 PolarHBondContact O-N 3.49Å; A376-E378 VanDerWaalsContact C-N 3.33Å; A376-E378 PolarHBondContact O-N 3.22Å; A376-R379 CarbonylContact O-C 3.58Å; A376-R379 PolarHBondContact O-N 2.81Å; A376-E380 WeakPolarHBondContact O-CB 3.42Å; A376-E380 PolarHBondContact O-N 3.15Å |
| 377 | K | 89.1 | Confident | 91.1 | Very high | 91 Ų | 91 | 83.8 Ų | 83.8 | 40% | 0.396 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.8 | -38.1 | 176.6 | -175.7 | 178 | -176.4 | 177.1 | 0 | 112.2 | D357 I373 H374 | D357-K377 IonicContact OD2-NZ 3.56Å; D357-K377 PolarHBondContact OD2-NZ 3.43Å; I373-K377 VanDerWaalsContact O-CB 3.23Å; I373-K377 WeakPolarHBondContact O-CB 3.27Å; I373-K377 PolarHBondContact O-N 3.47Å; H374-K377 PolarHBondContact O-N 2.94Å |
| 378 | E | 85.6 | Confident | 90.8 | Very high | 72 Ų | 72 | 80 Ų | 80 | 34% | 0.336 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -67.4 | -46.8 | 173.2 | -74 | -177.6 | 163.8 | 0 | 0 | 111.5 | H374 A376 E380 I381 | H374-E378 IonicContact CD2-OE1 2.81Å; H374-E378 IonicContact CE1-OE1 2.87Å; H374-E378 PolarHBondContact CE1-OE1 3.28Å; H374-E378 IonicContact CE1-OE2 3.36Å; H374-E378 PolarHBondContact CE1-OE2 3.44Å; H374-E378 IonicContact ND1-OE2 3.98Å; H374-E378 IonicContact NE2-OE1 3.98Å; H374-E378 PolarHBondContact NE2-OE1 3.04Å; H374-E378 IonicContact NE2-OE2 2.76Å; H374-E378 WeakPolarHBondContact O-CG 3.21Å; H374-E378 PolarHBondContact O-N 2.81Å; A376-E378 VanDerWaalsContact C-N 3.33Å; A376-E378 PolarHBondContact O-N 3.22Å; E378-E380 VanDerWaalsContact C-N 3.3Å; E378-E380 PolarHBondContact O-N 3.45Å; E378-I381 PolarHBondContact O-N 3.38Å |
| 379 | R | 91.9 | Very high | 90.5 | Very high | 116 Ų | 116 | 82.2 Ų | 82.2 | 44% | 0.438 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.7 | -29.2 | 176 | -72.6 | -165.8 | -161.4 | 97.7 | -5.5 | 113.9 | Q375 A376 I381 E382 L383 | Q375-R379 VanDerWaalsContact CD-CZ 3.47Å; Q375-R379 VanDerWaalsContact CD-NH1 3.26Å; Q375-R379 VanDerWaalsContact CG-NH1 3.35Å; Q375-R379 WeakPolarHBondContact O-CG 3.23Å; Q375-R379 PolarHBondContact O-N 3.48Å; Q375-R379 VanDerWaalsContact OE1-NH1 3.09Å; A376-R379 CarbonylContact O-C 3.58Å; A376-R379 PolarHBondContact O-N 2.81Å; R379-I381 VanDerWaalsContact C-N 3.26Å; R379-I381 PolarHBondContact O-N 3.37Å; R379-E382 PolarHBondContact O-N 3Å; R379-L383 WeakPolarHBondContact O-CB 3.26Å; R379-L383 VanDerWaalsContact O-CG 3.32Å; R379-L383 WeakPolarHBondContact O-CG 3.47Å; R379-L383 PolarHBondContact O-N 2.95Å |
| 380 | E | 88.9 | Confident | 90.5 | Very high | 91 Ų | 91 | 80.8 Ų | 80.8 | 43% | 0.425 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.8 | -41.5 | 178.9 | -173.4 | -167.3 | 159.8 | 0 | 0 | 110.8 | A376 E378 L383 K384 | A376-E380 WeakPolarHBondContact O-CB 3.42Å; A376-E380 PolarHBondContact O-N 3.15Å; E378-E380 VanDerWaalsContact C-N 3.3Å; E378-E380 PolarHBondContact O-N 3.45Å; E380-L383 PolarHBondContact O-N 2.92Å; E380-K384 HydrophobicContact CG-CD 4.23Å; E380-K384 WeakPolarHBondContact O-CB 3.35Å; E380-K384 VanDerWaalsContact O-CG 3.29Å; E380-K384 WeakPolarHBondContact O-CG 3.36Å; E380-K384 PolarHBondContact O-N 3.13Å; E380-K384 WeakPolarHBondContact OE1-CE 3.38Å; E380-K384 IonicContact OE1-NZ 2.68Å; E380-K384 PolarHBondContact OE1-NZ 3.1Å |
| 381 | I | 85.4 | Confident | 90.4 | Very high | 28 Ų | 28 | 85.3 Ų | 85.3 | 14% | 0.144 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -69.3 | -42 | 179.8 | -70.7 | 153 | 0 | 0 | 0 | 110.9 | Q346 E378 R379 L383 K384 N385 | Q346-I381 HydrophobicContact CB-CD1 3.76Å; Q346-I381 HydrophobicContact CG-CD1 3.38Å; E378-I381 PolarHBondContact O-N 3.38Å; R379-I381 VanDerWaalsContact C-N 3.26Å; R379-I381 PolarHBondContact O-N 3.37Å; I381-L383 VanDerWaalsContact C-N 3.35Å; I381-L383 PolarHBondContact O-N 3.43Å; I381-K384 PolarHBondContact O-N 3.24Å; I381-N385 WeakPolarHBondContact O-CB 3.39Å; I381-N385 PolarHBondContact O-N 3.49Å; I381-N385 PolarHBondContact O-ND2 3.44Å |
| 382 | E | 87.4 | Confident | 90.1 | Very high | 119 Ų | 119 | 86.8 Ų | 86.8 | 56% | 0.556 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -61.4 | -44 | 173.5 | -65 | 175.8 | -176.7 | 0 | 0 | 111.4 | R379 N385 N386 | R379-E382 PolarHBondContact O-N 3Å; E382-N385 PolarHBondContact O-N 2.94Å; E382-N386 WeakPolarHBondContact O-CB 3.44Å; E382-N386 PolarHBondContact O-N 3.3Å; E382-N386 PolarHBondContact O-ND2 3.49Å |
| 383 | L | 89 | Confident | 89.9 | Confident | 114 Ų | 114 | 85.9 Ų | 85.9 | 60% | 0.597 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -64.8 | -39.8 | 177.8 | -76.4 | 170.4 | 0 | 0 | 0 | 112.1 | R379 E380 I381 N386 W387 | R379-L383 WeakPolarHBondContact O-CB 3.26Å; R379-L383 VanDerWaalsContact O-CG 3.32Å; R379-L383 WeakPolarHBondContact O-CG 3.47Å; R379-L383 PolarHBondContact O-N 2.95Å; E380-L383 PolarHBondContact O-N 2.92Å; I381-L383 VanDerWaalsContact C-N 3.35Å; I381-L383 PolarHBondContact O-N 3.43Å; L383-N386 PolarHBondContact O-N 2.92Å; L383-W387 VanDerWaalsContact O-CB 3.24Å; L383-W387 WeakPolarHBondContact O-CB 3.47Å; L383-W387 PolarHBondContact O-N 3.43Å |
| 384 | K | 88.8 | Confident | 89.9 | Confident | 79 Ų | 79 | 89.4 Ų | 89.4 | 34% | 0.343 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 174.7 | -79.5 | 171.9 | 167.7 | 174.6 | 0 | 111.6 | E380 I381 W387 A388 | E380-K384 HydrophobicContact CG-CD 4.23Å; E380-K384 WeakPolarHBondContact O-CB 3.35Å; E380-K384 VanDerWaalsContact O-CG 3.29Å; E380-K384 WeakPolarHBondContact O-CG 3.36Å; E380-K384 PolarHBondContact O-N 3.13Å; E380-K384 WeakPolarHBondContact OE1-CE 3.38Å; E380-K384 IonicContact OE1-NZ 2.68Å; E380-K384 PolarHBondContact OE1-NZ 3.1Å; I381-K384 PolarHBondContact O-N 3.24Å; K384-W387 PolarHBondContact O-N 3.3Å; K384-A388 WeakPolarHBondContact O-CB 3.43Å; K384-A388 PolarHBondContact O-N 2.74Å |
| 385 | N | 88.7 | Confident | 89.8 | Confident | 26 Ų | 26 | 96.9 Ų | 96.9 | 14% | 0.139 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -63.4 | -45.2 | 176.7 | -72.4 | -21 | 0 | 0 | 0 | 111.6 | E343 E344 I381 E382 W387 A388 E389 | E343-N385 WeakPolarHBondContact CG-ND2 3.45Å; E344-N385 WeakPolarHBondContact CB-OD1 3.32Å; E344-N385 PolarHBondContact N-OD1 2.89Å; E344-N385 PolarHBondContact O-ND2 3.11Å; I381-N385 WeakPolarHBondContact O-CB 3.39Å; I381-N385 PolarHBondContact O-N 3.49Å; I381-N385 PolarHBondContact O-ND2 3.44Å; E382-N385 PolarHBondContact O-N 2.94Å; N385-W387 VanDerWaalsContact C-N 3.31Å; N385-W387 PolarHBondContact O-N 2.76Å; N385-A388 PolarHBondContact O-N 3.34Å; N385-E389 WeakPolarHBondContact O-CB 3.43Å; N385-E389 PolarHBondContact O-N 3.02Å |
| 386 | N | 90.3 | Very high | 89.7 | Confident | 91 Ų | 91 | 100.1 Ų | 100.1 | 49% | 0.487 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.3 | -38.4 | 175.3 | -71 | -25.2 | 0 | 0 | 0 | 112 | E382 L383 N390 | E382-N386 WeakPolarHBondContact O-CB 3.44Å; E382-N386 PolarHBondContact O-N 3.3Å; E382-N386 PolarHBondContact O-ND2 3.49Å; L383-N386 PolarHBondContact O-N 2.92Å; N386-N390 WeakPolarHBondContact O-CB 3.49Å; N386-N390 PolarHBondContact O-N 2.96Å |
| 387 | W | 89.9 | Confident | 89.9 | Confident | 180 Ų | 180 | 100.3 Ų | 100.3 | 68% | 0.682 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -68.1 | -42.4 | 177.1 | -173.8 | 61.9 | 0 | 0 | 0 | 111.6 | L383 K384 N385 R391 | L383-W387 VanDerWaalsContact O-CB 3.24Å; L383-W387 WeakPolarHBondContact O-CB 3.47Å; L383-W387 PolarHBondContact O-N 3.43Å; K384-W387 PolarHBondContact O-N 3.3Å; N385-W387 VanDerWaalsContact C-N 3.31Å; N385-W387 PolarHBondContact O-N 2.76Å; W387-R391 WeakPolarHBondContact O-CB 3.32Å; W387-R391 PolarHBondContact O-N 2.93Å |
| 388 | A | 87.9 | Confident | 90.1 | Very high | 40 Ų | 40 | 100.8 Ų | 100.8 | 33% | 0.331 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.1 | -44.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | K384 N385 R391 M392 | K384-A388 WeakPolarHBondContact O-CB 3.43Å; K384-A388 PolarHBondContact O-N 2.74Å; N385-A388 PolarHBondContact O-N 3.34Å; A388-R391 PolarHBondContact O-N 2.92Å; A388-M392 WeakPolarHBondContact O-CB 3.38Å; A388-M392 WeakPolarHBondContact O-CG 3.31Å; A388-M392 PolarHBondContact O-N 3.25Å |
| 389 | E | 89.6 | Confident | 90.4 | Very high | 121 Ų | 121 | 101.5 Ų | 101.5 | 57% | 0.565 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.9 | -51 | 176.2 | -175.9 | 169.8 | -156.6 | 0 | 0 | 111.1 | N385 R391 M392 T393 | N385-E389 WeakPolarHBondContact O-CB 3.43Å; N385-E389 PolarHBondContact O-N 3.02Å; E389-R391 VanDerWaalsContact C-N 3.26Å; E389-R391 PolarHBondContact O-N 3.25Å; E389-M392 CarbonylContact O-C 3.53Å; E389-M392 WeakPolarHBondContact O-CA 3.3Å; E389-M392 WeakPolarHBondContact O-CB 3.42Å; E389-M392 PolarHBondContact O-N 3.26Å; E389-T393 PolarHBondContact O-N 3.34Å; E389-T393 PolarHBondContact O-OG1 3.1Å; E389-T393 VanDerWaalsContact O-OG1 3.05Å |
| 390 | N | 93.3 | Very high | 90.6 | Very high | 100 Ų | 100 | 103.1 Ų | 103.1 | 54% | 0.535 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.7 | -38.2 | 178.5 | -164.4 | -21.2 | 0 | 0 | 0 | 111.4 | N386 T393 R394 | N386-N390 WeakPolarHBondContact O-CB 3.49Å; N386-N390 PolarHBondContact O-N 2.96Å; N390-T393 PolarHBondContact O-N 3.29Å; N390-R394 VanDerWaalsContact O-CB 3.3Å; N390-R394 WeakPolarHBondContact O-CB 3.42Å; N390-R394 PolarHBondContact O-N 3.33Å |
| 391 | R | 92.5 | Very high | 90.9 | Very high | 164 Ų | 164 | 105 Ų | 105 | 62% | 0.619 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64 | -42 | 173 | -170.4 | 174.3 | -173.7 | 89.9 | 2.4 | 111.8 | W387 A388 E389 R394 R395 | W387-R391 WeakPolarHBondContact O-CB 3.32Å; W387-R391 PolarHBondContact O-N 2.93Å; A388-R391 PolarHBondContact O-N 2.92Å; E389-R391 VanDerWaalsContact C-N 3.26Å; E389-R391 PolarHBondContact O-N 3.25Å; R391-R394 PolarHBondContact O-N 3.37Å; R391-R395 WeakPolarHBondContact O-CB 3.41Å; R391-R395 PolarHBondContact O-N 2.98Å |
| 392 | M | 88 | Confident | 91.3 | Very high | 82 Ų | 82 | 106.9 Ų | 106.9 | 40% | 0.404 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.4 | -45.3 | 175.2 | -78.9 | -63.7 | -70.3 | 0 | 0 | 111.9 | A388 E389 R394 R395 Q396 | A388-M392 WeakPolarHBondContact O-CB 3.38Å; A388-M392 WeakPolarHBondContact O-CG 3.31Å; A388-M392 PolarHBondContact O-N 3.25Å; E389-M392 CarbonylContact O-C 3.53Å; E389-M392 WeakPolarHBondContact O-CA 3.3Å; E389-M392 WeakPolarHBondContact O-CB 3.42Å; E389-M392 PolarHBondContact O-N 3.26Å; M392-R394 VanDerWaalsContact C-N 3.33Å; M392-R394 PolarHBondContact O-N 3.22Å; M392-R395 CarbonylContact O-C 3.57Å; M392-R395 WeakPolarHBondContact O-CB 3.45Å; M392-R395 PolarHBondContact O-N 2.96Å; M392-R395 VanDerWaalsContact O-N 3.16Å; M392-Q396 WeakPolarHBondContact O-CB 3.35Å; M392-Q396 VanDerWaalsContact O-CG 3.3Å; M392-Q396 WeakPolarHBondContact O-CG 3.36Å; M392-Q396 PolarHBondContact O-N 2.91Å |
| 393 | T | 90.8 | Very high | 90.3 | Very high | 62 Ų | 62 | 110.2 Ų | 110.2 | 38% | 0.38 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.9 | -40.8 | 175.7 | -54.5 | 0 | 0 | 0 | 0 | 111.2 | E389 N390 Q396 T397 | E389-T393 PolarHBondContact O-N 3.34Å; E389-T393 PolarHBondContact O-OG1 3.1Å; E389-T393 VanDerWaalsContact O-OG1 3.05Å; N390-T393 PolarHBondContact O-N 3.29Å; T393-Q396 PolarHBondContact O-N 3.06Å; T393-T397 WeakPolarHBondContact O-CB 3.42Å; T393-T397 PolarHBondContact O-N 3.14Å; T393-T397 PolarHBondContact O-OG1 3.08Å |
| 394 | R | 93 | Very high | 90.4 | Very high | 178 Ų | 178 | 110 Ų | 110 | 67% | 0.672 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.1 | -45.8 | 173.2 | -175.2 | 179.7 | -73.7 | 179.9 | -4.4 | 110.8 | N390 R391 M392 Q396 T397 Q398 | N390-R394 VanDerWaalsContact O-CB 3.3Å; N390-R394 WeakPolarHBondContact O-CB 3.42Å; N390-R394 PolarHBondContact O-N 3.33Å; R391-R394 PolarHBondContact O-N 3.37Å; M392-R394 VanDerWaalsContact C-N 3.33Å; M392-R394 PolarHBondContact O-N 3.22Å; R394-Q396 PolarHBondContact O-N 3.01Å; R394-T397 PolarHBondContact O-N 3.24Å; R394-Q398 WeakPolarHBondContact O-CB 3.35Å; R394-Q398 PolarHBondContact O-N 3.02Å |
| 395 | R | 91.6 | Very high | 90.5 | Very high | 175 Ų | 175 | 111.6 Ų | 111.6 | 66% | 0.66 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.7 | -39.6 | 176.2 | -171.1 | -178.7 | -180 | -172.8 | 0.5 | 112.4 | R391 M392 A399 | R391-R395 WeakPolarHBondContact O-CB 3.41Å; R391-R395 PolarHBondContact O-N 2.98Å; M392-R395 CarbonylContact O-C 3.57Å; M392-R395 WeakPolarHBondContact O-CB 3.45Å; M392-R395 PolarHBondContact O-N 2.96Å; M392-R395 VanDerWaalsContact O-N 3.16Å; R395-A399 VanDerWaalsContact O-CB 3.28Å; R395-A399 WeakPolarHBondContact O-CB 3.49Å; R395-A399 PolarHBondContact O-N 2.95Å |
| 396 | Q | 91.6 | Very high | 90.6 | Very high | 121 Ų | 121 | 116.4 Ų | 116.4 | 57% | 0.565 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.8 | -42 | 175.2 | -74.1 | 173.7 | 6.6 | 0 | 0 | 111.3 | M392 T393 R394 A399 K400 | M392-Q396 WeakPolarHBondContact O-CB 3.35Å; M392-Q396 VanDerWaalsContact O-CG 3.3Å; M392-Q396 WeakPolarHBondContact O-CG 3.36Å; M392-Q396 PolarHBondContact O-N 2.91Å; T393-Q396 PolarHBondContact O-N 3.06Å; R394-Q396 PolarHBondContact O-N 3.01Å; Q396-A399 PolarHBondContact O-N 3.45Å; Q396-K400 VanDerWaalsContact O-CB 3.27Å; Q396-K400 WeakPolarHBondContact O-CB 3.38Å; Q396-K400 PolarHBondContact O-N 3.26Å |
| 397 | T | 93.9 | Very high | 90.6 | Very high | 57 Ų | 57 | 117.9 Ų | 117.9 | 35% | 0.35 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.4 | -47.2 | 176.6 | -56.8 | 0 | 0 | 0 | 0 | 110.3 | T393 R394 A399 K400 Y401 | T393-T397 WeakPolarHBondContact O-CB 3.42Å; T393-T397 PolarHBondContact O-N 3.14Å; T393-T397 PolarHBondContact O-OG1 3.08Å; R394-T397 PolarHBondContact O-N 3.24Å; T397-A399 VanDerWaalsContact C-N 3.33Å; T397-A399 PolarHBondContact O-N 3.36Å; T397-K400 PolarHBondContact O-N 3.14Å; T397-K400 VanDerWaalsContact O-N 3.14Å; T397-Y401 HydrophobicContact CG2-CD2 3.67Å; T397-Y401 HydrophobicContact CG2-CE2 4.04Å; T397-Y401 VanDerWaalsContact O-CD2 3.26Å; T397-Y401 WeakPolarHBondContact O-CD2 3.27Å; T397-Y401 PolarHBondContact O-N 3.41Å |
| 398 | Q | 94.9 | Very high | 90.6 | Very high | 100 Ų | 100 | 114 Ų | 114 | 47% | 0.467 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.2 | -40 | 174.8 | -175.4 | 177.5 | 25.5 | 0 | 0 | 111.7 | R394 K400 G402 F403 | R394-Q398 WeakPolarHBondContact O-CB 3.35Å; R394-Q398 PolarHBondContact O-N 3.02Å; Q398-K400 VanDerWaalsContact C-N 3.33Å; Q398-G402 WeakPolarHBondContact O-CA 3.43Å; Q398-G402 PolarHBondContact O-N 3.08Å; Q398-F403 WeakPolarHBondContact CG-O 3.3Å |
| 399 | A | 92 | Very high | 90.8 | Very high | 87 Ų | 87 | 118.9 Ų | 118.9 | 72% | 0.719 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -67.4 | -35 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R395 Q396 T397 | R395-A399 VanDerWaalsContact O-CB 3.28Å; R395-A399 WeakPolarHBondContact O-CB 3.49Å; R395-A399 PolarHBondContact O-N 2.95Å; Q396-A399 PolarHBondContact O-N 3.45Å; T397-A399 VanDerWaalsContact C-N 3.33Å; T397-A399 PolarHBondContact O-N 3.36Å |
| 400 | K | 95.8 | Very high | 90.9 | Very high | 150 Ų | 150 | 118.8 Ų | 118.8 | 65% | 0.652 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -75.8 | -36.8 | -179.3 | -174.6 | 172.1 | 179 | -174.7 | 0 | 112.7 | Q396 T397 Q398 | Q396-K400 VanDerWaalsContact O-CB 3.27Å; Q396-K400 WeakPolarHBondContact O-CB 3.38Å; Q396-K400 PolarHBondContact O-N 3.26Å; T397-K400 PolarHBondContact O-N 3.14Å; T397-K400 VanDerWaalsContact O-N 3.14Å; Q398-K400 VanDerWaalsContact C-N 3.33Å |
| 401 | Y | 95.5 | Very high | 90.7 | Very high | 130 Ų | 130 | 120.2 Ų | 120.2 | 51% | 0.51 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -119.9 | -6.2 | -171.1 | -54.1 | -70.2 | 0 | 0 | 0 | 114.6 | T397 F403 | T397-Y401 HydrophobicContact CG2-CD2 3.67Å; T397-Y401 HydrophobicContact CG2-CE2 4.04Å; T397-Y401 VanDerWaalsContact O-CD2 3.26Å; T397-Y401 WeakPolarHBondContact O-CD2 3.27Å; T397-Y401 PolarHBondContact O-N 3.41Å; Y401-F403 VanDerWaalsContact C-N 3.31Å; Y401-F403 HydrophobicContact CG-CE1 4.12Å; Y401-F403 WeakPolarHBondContact O-CD1 3.27Å; Y401-F403 PolarHBondContact O-N 3.22Å |
| 402 | G | 91.8 | Very high | 90.6 | Very high | 68 Ų | 68 | 116.6 Ų | 116.6 | 70% | 0.701 | 58% | 0.576 | S | S | * | * | trans | 76.2 | 4.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q398 | Q398-G402 WeakPolarHBondContact O-CA 3.43Å; Q398-G402 PolarHBondContact O-N 3.08Å | ||
| 403 | F | 67.9 | Low | 90.8 | Very high | 189 Ų | 189 | 119.7 Ų | 119.7 | 83% | 0.829 | 59% | 0.591 | S | S | * | * | trans | -114 | 0 | 179 | 61.6 | -102.4 | 0 | 0 | 0 | 113.1 | Q398 Y401 | Q398-F403 WeakPolarHBondContact CG-O 3.3Å; Y401-F403 VanDerWaalsContact C-N 3.31Å; Y401-F403 HydrophobicContact CG-CE1 4.12Å; Y401-F403 WeakPolarHBondContact O-CD1 3.27Å; Y401-F403 PolarHBondContact O-N 3.22Å |
Retrieved 403 of 403 residues in 107.1 ms
(Link to these results)