| 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 | 43.3 | Very low | 47 | Very low | 242 Ų | 242 | 149.3 Ų | 149.3 | 100% | 1.192 | 81% | 0.812 | S | S | * | * | 0 | 123 | 0 | -107.8 | 77.7 | 179.8 | 0 | 0 | 107.5 | |||||
| 2 | C | 40.9 | Very low | 47 | Very low | 103 Ų | 103 | 147.6 Ų | 147.6 | 70% | 0.696 | 81% | 0.81 | S | S | * | * | trans | -71 | 140.5 | 173.8 | -50.2 | 0 | 0 | 0 | 0 | 109.8 | I4 | C2-I4 HydrophobicContact CB-CD1 4.26Å; C2-I4 HydrophobicContact CB-CG1 4.41Å | ||
| 3 | D | 50.5 | Low | 47.1 | Very low | 174 Ų | 174 | 144.2 Ų | 144.2 | 93% | 0.93 | 80% | 0.803 | S | S | * | * | trans | -119.5 | 103.4 | 148.9 | -79.1 | -43.1 | 0 | 0 | 0 | 108 | ||||
| 4 | I | 53.1 | Low | 47.7 | Very low | 125 Ų | 125 | 142.6 Ų | 142.6 | 64% | 0.641 | 80% | 0.802 | S | S | * | * | trans | -90.4 | 164.5 | 169.6 | -77.4 | 163.9 | 0 | 0 | 0 | 107.1 | C2 | C2-I4 HydrophobicContact CB-CD1 4.26Å; C2-I4 HydrophobicContact CB-CG1 4.41Å | ||
| 5 | Y | 50.7 | Low | 47.8 | Very low | 211 Ų | 211 | 145.8 Ų | 145.8 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | trans | 104 | 87.1 | 176.1 | -60 | -72.1 | 0 | 0 | 0 | 113.5 | ||||
| 6 | S | 49.5 | Very low | 47.8 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | 55 | 117.7 | 79.9 | -75.2 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 7 | L | 43.4 | Very low | 48.1 | Very low | 161 Ų | 161 | 142.9 Ų | 142.9 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | -169 | 121.7 | 112.5 | -118.4 | 87.4 | 0 | 0 | 0 | 111.5 | |||||
| 8 | D | 43 | Very low | 48 | Very low | 121 Ų | 121 | 142.8 Ų | 142.8 | 65% | 0.647 | 79% | 0.793 | S | S | * | * | trans | 54.5 | 98 | 132.9 | -135.7 | 4.5 | 0 | 0 | 0 | 119.1 | ||||
| 9 | S | 44.9 | Very low | 48.1 | Very low | 125 Ų | 125 | 140 Ų | 140 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -113.7 | 101.7 | 156 | -92.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 10 | H | 47.3 | Very low | 48 | Very low | 146 Ų | 146 | 145 Ų | 145 | 68% | 0.676 | 79% | 0.79 | S | S | * | * | trans | -27.3 | 131.6 | 171.9 | -63.5 | -71.5 | 0 | 0 | 0 | 115.5 | V12 | H10-V12 PolarHBondContact O-N 2.82Š| ||
| 11 | C | 49.9 | Very low | 48 | Very low | 129 Ų | 129 | 142.3 Ų | 142.3 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | -48.6 | 100.1 | 161.4 | -22.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 12 | V | 47.8 | Very low | 48.3 | Very low | 129 Ų | 129 | 139.7 Ų | 139.7 | 78% | 0.782 | 77% | 0.774 | S | S | * | * | trans | -100.1 | 94 | 164.7 | -178.7 | 0 | 0 | 0 | 0 | 107.4 | H10 | H10-V12 PolarHBondContact O-N 2.82Š| ||
| 13 | S | 48.4 | Very low | 48.7 | Very low | 103 Ų | 103 | 142 Ų | 142 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 130.6 | 164.7 | -69.8 | 0 | 0 | 0 | 0 | 109.4 | Q15 | S13-Q15 PolarHBondContact O-N 3.2Š|
| 14 | P | 54.8 | Low | 48.9 | Very low | 123 Ų | 123 | 138.6 Ų | 138.6 | 80% | 0.799 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -64 | 134.6 | 171.2 | -16 | 29.1 | 0 | 0 | 0 | 109.5 | C16 | P14-C16 PolarHBondContact O-N 3.48Š|
| 15 | Q | 49.9 | Very low | 48.4 | Very low | 190 Ų | 190 | 136.9 Ų | 136.9 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 122.2 | 174.7 | -76.3 | 176.8 | -24.1 | 0 | 0 | 110.5 | S13 N17 | S13-Q15 PolarHBondContact O-N 3.2Å; Q15-N17 VanDerWaalsContact C-N 3.3Å; Q15-N17 PolarHBondContact O-N 2.98Å |
| 16 | C | 47.9 | Very low | 48.3 | Very low | 110 Ų | 110 | 133.8 Ų | 133.8 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | -66.8 | 85.3 | 168.1 | 48.1 | 0 | 0 | 0 | 0 | 110 | P14 M18 | P14-C16 PolarHBondContact O-N 3.48Å; C16-M18 PolarHBondContact O-N 3.49Å; C16-M18 VanDerWaalsContact O-N 3.07Å | ||
| 17 | N | 51.8 | Low | 48.4 | Very low | 133 Ų | 133 | 137.3 Ų | 137.3 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | trans | -77.1 | 90.8 | 167.4 | -164.8 | -2 | 0 | 0 | 0 | 108.8 | Q15 S19 | Q15-N17 VanDerWaalsContact C-N 3.3Å; Q15-N17 PolarHBondContact O-N 2.98Å; N17-S19 PolarHBondContact O-N 3.43Å | ||
| 18 | M | 46 | Very low | 48.7 | Very low | 141 Ų | 141 | 139.2 Ų | 139.2 | 70% | 0.695 | 76% | 0.764 | S | S | * | * | trans | -78.4 | 71.1 | 167.7 | -68.3 | -66.3 | 121 | 0 | 0 | 109.1 | C16 W20 | C16-M18 PolarHBondContact O-N 3.49Å; C16-M18 VanDerWaalsContact O-N 3.07Å; M18-W20 PolarHBondContact O-N 3.13Å | ||
| 19 | S | 49.8 | Very low | 48.4 | Very low | 89 Ų | 89 | 142.2 Ų | 142.2 | 62% | 0.622 | 78% | 0.775 | S | S | * | * | trans | -72.3 | 95.5 | 164.8 | 58.3 | 0 | 0 | 0 | 0 | 108.1 | N17 A21 | N17-S19 PolarHBondContact O-N 3.43Å; S19-A21 PolarHBondContact O-N 3.33Å | ||
| 20 | W | 46.5 | Very low | 48.1 | Very low | 240 Ų | 240 | 140.4 Ų | 140.4 | 91% | 0.909 | 76% | 0.762 | S | S | * | * | trans | -69.5 | 75.9 | 162.2 | -72.4 | 82 | 0 | 0 | 0 | 108.4 | M18 M22 | M18-W20 PolarHBondContact O-N 3.13Å; W20-M22 PolarHBondContact O-N 3.32Å | ||
| 21 | A | 48.1 | Very low | 47.8 | Very low | 88 Ų | 88 | 140.8 Ų | 140.8 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | trans | -69.8 | 109.3 | 162.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | S19 E23 | S19-A21 PolarHBondContact O-N 3.33Å; A21-E23 PolarHBondContact O-N 2.7Å | ||
| 22 | M | 49.6 | Very low | 47.5 | Very low | 188 Ų | 188 | 144.1 Ų | 144.1 | 93% | 0.926 | 77% | 0.768 | S | S | * | * | trans | -59.6 | 104.1 | 163.4 | -96.5 | 170.5 | 68.7 | 0 | 0 | 107.3 | W20 P24 | W20-M22 PolarHBondContact O-N 3.32Å; M22-P24 WeakPolarHBondContact O-CD 3.47Å | ||
| 23 | E | 50.3 | Low | 47.2 | Very low | 151 Ų | 151 | 145.9 Ų | 145.9 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | -67.8 | 123.7 | 167.3 | -159.7 | -144.6 | 154 | 0 | 0 | 108.1 | A21 A25 | A21-E23 PolarHBondContact O-N 2.7Å; E23-A25 PolarHBondContact O-N 2.85Å | ||
| 24 | P | 53.6 | Low | 46.6 | Very low | 103 Ų | 103 | 144.8 Ų | 144.8 | 67% | 0.669 | 78% | 0.778 | S | S | * | * | trans | -68.3 | 120.7 | 169.2 | 26.4 | -29.5 | 0 | 0 | 0 | 108.4 | M22 N26 | M22-P24 WeakPolarHBondContact O-CD 3.47Å; P24-N26 PolarHBondContact O-N 2.92Å | ||
| 25 | A | 43.6 | Very low | 45.7 | Very low | 89 Ų | 89 | 142.6 Ų | 142.6 | 74% | 0.736 | 78% | 0.777 | S | S | * | * | trans | -54.4 | 109.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | E23 F27 | E23-A25 PolarHBondContact O-N 2.85Å; A25-F27 PolarHBondContact O-N 3.31Å | ||
| 26 | N | 49 | Very low | 45.7 | Very low | 145 Ų | 145 | 139.2 Ų | 139.2 | 78% | 0.775 | 77% | 0.772 | S | S | * | * | trans | -70.3 | 77.1 | 170.1 | -73 | -54.8 | 0 | 0 | 0 | 109.5 | P24 | P24-N26 PolarHBondContact O-N 2.92Š| ||
| 27 | F | 50.5 | Low | 45.2 | Very low | 180 Ų | 180 | 142 Ų | 142 | 79% | 0.789 | 77% | 0.774 | S | S | * | * | trans | -102.5 | 65.1 | 172.2 | -159.8 | -89.5 | 0 | 0 | 0 | 108.3 | A25 | A25-F27 PolarHBondContact O-N 3.31Š| ||
| 28 | Y | 50.8 | Low | 44.4 | Very low | 200 Ų | 200 | 144.8 Ų | 144.8 | 78% | 0.784 | 78% | 0.783 | S | S | * | * | trans | 171.8 | 94.6 | 152.7 | -102 | -74.8 | 0 | 0 | 0 | 108.5 | ||||
| 29 | E | 36.7 | Very low | 43.9 | Very low | 185 Ų | 185 | 141.9 Ų | 141.9 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | -131.5 | 90.2 | 153.6 | -152.6 | 167.3 | -152.4 | 0 | 0 | 107.8 | N31 | E29-N31 PolarHBondContact O-N 3.49Š| ||
| 30 | S | 38.6 | Very low | 43.5 | Very low | 86 Ų | 86 | 144.3 Ų | 144.3 | 60% | 0.601 | 80% | 0.8 | S | S | * | * | trans | -75.8 | 114.6 | 167.2 | -57.5 | 0 | 0 | 0 | 0 | 107.4 | K32 | S30-K32 PolarHBondContact O-N 3.44Š| ||
| 31 | N | 39.4 | Very low | 42.7 | Very low | 154 Ų | 154 | 138.7 Ų | 138.7 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -49.6 | 102.8 | 168.8 | -93 | 15.5 | 0 | 0 | 0 | 110.3 | E29 | E29-N31 PolarHBondContact O-N 3.49Š| ||
| 32 | K | 43.9 | Very low | 42.3 | Very low | 199 Ų | 199 | 143.9 Ų | 143.9 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | trans | -98.2 | 97.5 | 158.6 | -75.5 | -163.6 | 179.1 | -172.4 | 0 | 107.9 | S30 | S30-K32 PolarHBondContact O-N 3.44Š| ||
| 33 | L | 42.9 | Very low | 42.1 | Very low | 166 Ų | 166 | 140.9 Ų | 140.9 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -126.8 | 116.4 | 157.6 | -80.6 | 169 | 0 | 0 | 0 | 108.5 | ||||
| 34 | G | 35 | Very low | 41.3 | Very low | 80 Ų | 80 | 136.8 Ų | 136.8 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | 57.3 | 114.2 | 147.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 35 | G | 36.4 | Very low | 40.5 | Very low | 77 Ų | 77 | 138 Ų | 138 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | -77.7 | -167.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 36 | P | 48.7 | Very low | 40.6 | Very low | 119 Ų | 119 | 145.4 Ų | 145.4 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | cis | -137.5 | 163.7 | 10.6 | 40.8 | -22.1 | 0 | 0 | 0 | 117.7 | ||||
| 37 | Q | 39.1 | Very low | 40.1 | Very low | 170 Ų | 170 | 143.5 Ų | 143.5 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | 65.2 | 112.1 | 141.2 | -66.1 | -93.9 | 9.2 | 0 | 0 | 121.6 | ||||
| 38 | Q | 34.8 | Very low | 39.5 | Very low | 191 Ų | 191 | 143.1 Ų | 143.1 | 89% | 0.893 | 83% | 0.826 | S | S | * | * | 150 | 137.5 | 113.6 | -81.9 | -166.4 | 4.5 | 0 | 0 | 112.1 | |||||
| 39 | G | 33.7 | Very low | 38.8 | Very low | 79 Ų | 79 | 136.7 Ų | 136.7 | 81% | 0.814 | 82% | 0.821 | S | S | * | * | trans | 140 | 77.2 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 40 | V | 41.7 | Very low | 38.7 | Very low | 141 Ų | 141 | 135 Ų | 135 | 86% | 0.855 | 82% | 0.822 | S | S | * | * | trans | -55.6 | 136.6 | 165.6 | 163.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 41 | S | 29.6 | Very low | 38.7 | Very low | 121 Ų | 121 | 134 Ų | 134 | 85% | 0.846 | 83% | 0.827 | S | S | * | * | trans | -173.1 | 111.1 | 138 | -77.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 42 | K | 39.6 | Very low | 38.6 | Very low | 198 Ų | 198 | 136.2 Ų | 136.2 | 86% | 0.861 | 83% | 0.832 | S | S | * | * | trans | -93.9 | 153.4 | 154.8 | -131.9 | 171.7 | -177.2 | 169.7 | 0 | 106.3 | ||||
| 43 | P | 45.6 | Very low | 38.5 | Very low | 125 Ų | 125 | 134.9 Ų | 134.9 | 81% | 0.812 | 83% | 0.829 | S | S | * | * | -140.6 | 173.7 | 75.9 | 27.7 | -5.2 | 0 | 0 | 0 | 111 | |||||
| 44 | G | 34.8 | Very low | 38.6 | Very low | 64 Ų | 64 | 131.3 Ų | 131.3 | 66% | 0.66 | 82% | 0.818 | S | S | * | * | cis | 101.3 | 114.8 | 24.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 45 | S | 35.6 | Very low | 38.9 | Very low | 129 Ų | 129 | 133.4 Ų | 133.4 | 90% | 0.902 | 82% | 0.815 | S | S | * | * | trans | 90.3 | 107.2 | 159.1 | -69.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 46 | R | 47.1 | Very low | 39.5 | Very low | 245 Ų | 245 | 139.1 Ų | 139.1 | 93% | 0.925 | 82% | 0.823 | S | S | * | * | trans | -9 | 141.4 | 135.4 | -62.5 | 173.4 | 155.9 | 174.5 | -8.5 | 118.2 | ||||
| 47 | A | 37 | Very low | 39.9 | Very low | 105 Ų | 105 | 139.3 Ų | 139.3 | 87% | 0.868 | 82% | 0.822 | S | S | * | * | trans | -156.1 | 133.8 | 137.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 48 | D | 37.9 | Very low | 40.3 | Very low | 171 Ų | 171 | 139.4 Ų | 139.4 | 91% | 0.914 | 82% | 0.822 | S | S | * | * | trans | -68.3 | 153.4 | 173.6 | -90.6 | -66.9 | 0 | 0 | 0 | 113.7 | ||||
| 49 | G | 36 | Very low | 40.7 | Very low | 66 Ų | 66 | 137.9 Ų | 137.9 | 68% | 0.68 | 82% | 0.819 | S | S | * | * | 113.8 | 132.1 | 123.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 50 | V | 34.5 | Very low | 41.3 | Very low | 148 Ų | 148 | 139.4 Ų | 139.4 | 90% | 0.897 | 82% | 0.818 | S | S | * | * | trans | 84.7 | 108.2 | 155.3 | -169.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 51 | G | 38.7 | Very low | 41.7 | Very low | 67 Ų | 67 | 138.6 Ų | 138.6 | 69% | 0.691 | 81% | 0.813 | S | S | * | * | 81.3 | 121.5 | 92 | 0 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 52 | E | 37.9 | Very low | 42.6 | Very low | 199 Ų | 199 | 138.9 Ų | 138.9 | 93% | 0.93 | 81% | 0.81 | S | S | * | * | -165.6 | 174.1 | 51.3 | -72.2 | -179 | 156.6 | 0 | 0 | 110.1 | |||||
| 53 | E | 42.1 | Very low | 42.9 | Very low | 171 Ų | 171 | 135.1 Ų | 135.1 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -58.8 | 159.4 | -174.3 | -168.3 | -147.6 | 132.8 | 0 | 0 | 116.8 | ||||
| 54 | S | 45.6 | Very low | 43 | Very low | 91 Ų | 91 | 134.3 Ų | 134.3 | 64% | 0.636 | 80% | 0.799 | S | S | * | * | trans | 74.5 | 109.9 | 159.8 | -77.2 | 0 | 0 | 0 | 0 | 116 | ||||
| 55 | T | 41.2 | Very low | 44.1 | Very low | 125 Ų | 125 | 135.9 Ų | 135.9 | 77% | 0.767 | 81% | 0.805 | S | S | * | * | -172.4 | 114.3 | 79.5 | -58.4 | 0 | 0 | 0 | 0 | 109.1 | V57 | T55-V57 PolarHBondContact O-N 2.89Š| |||
| 56 | M | 47.4 | Very low | 44.9 | Very low | 197 Ų | 197 | 138.3 Ų | 138.3 | 97% | 0.97 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | 57.2 | -172.4 | -166 | -165.4 | -71.4 | 0 | 0 | 112.3 | ||
| 57 | V | 57.3 | Low | 45.1 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 74% | 0.739 | 80% | 0.797 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.2 | -9.7 | -179.6 | -173.5 | 0 | 0 | 0 | 0 | 114.8 | T55 | T55-V57 PolarHBondContact O-N 2.89Š|
| 58 | E | 48.5 | Very low | 46 | Very low | 173 Ų | 173 | 137.7 Ų | 137.7 | 81% | 0.808 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -118.1 | 33.2 | -166.6 | -139.4 | 176.2 | -173.5 | 0 | 0 | 115.6 | ||
| 59 | L | 42.1 | Very low | 46.9 | Very low | 158 Ų | 158 | 133.4 Ų | 133.4 | 83% | 0.827 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -116.5 | -0.9 | 173.8 | -73.3 | 167 | 0 | 0 | 0 | 113.9 | ||
| 60 | S | 47.5 | Very low | 48.3 | Very low | 112 Ų | 112 | 138.6 Ų | 138.6 | 78% | 0.783 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -86.7 | -7.1 | -174.7 | -61.8 | 0 | 0 | 0 | 0 | 115 | ||
| 61 | T | 50.1 | Low | 49.7 | Very low | 123 Ų | 123 | 135.2 Ų | 135.2 | 76% | 0.755 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -116.4 | 9.2 | -169.7 | 50.9 | 0 | 0 | 0 | 0 | 115.4 | ||
| 62 | T | 48.4 | Very low | 51.3 | Low | 127 Ų | 127 | 136.3 Ų | 136.3 | 78% | 0.779 | 76% | 0.76 | S | S | * | * | trans | -139.2 | 44.1 | -179.3 | -6.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 63 | T | 45.8 | Very low | 53 | Low | 120 Ų | 120 | 132.9 Ų | 132.9 | 74% | 0.736 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -107.5 | 120.5 | 162.5 | -39.7 | 0 | 0 | 0 | 0 | 108.3 | A65 | T63-A65 PolarHBondContact O-N 2.9Š|
| 64 | P | 48.5 | Very low | 54.8 | Low | 108 Ų | 108 | 129.5 Ų | 129.5 | 70% | 0.701 | 73% | 0.734 | S | S | * | * | trans | -59.9 | 131.8 | 177.9 | -16.2 | 28.9 | 0 | 0 | 0 | 109.6 | M66 | P64-M66 PolarHBondContact O-N 3.37Š| ||
| 65 | A | 56.2 | Low | 56.4 | Low | 97 Ų | 97 | 131.2 Ų | 131.2 | 80% | 0.802 | 73% | 0.731 | S | S | * | * | trans | -45.7 | 103 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | T63 | T63-A65 PolarHBondContact O-N 2.9Š| ||
| 66 | M | 53.1 | Low | 58.2 | Low | 179 Ų | 179 | 128.2 Ų | 128.2 | 88% | 0.882 | 72% | 0.715 | S | S | * | * | trans | -109 | 109.7 | 166.3 | -72.9 | -81.3 | -69.9 | 0 | 0 | 104.8 | P64 | P64-M66 PolarHBondContact O-N 3.37Š| ||
| 67 | Y | 50.9 | Low | 59.7 | Low | 199 Ų | 199 | 126.1 Ų | 126.1 | 78% | 0.78 | 70% | 0.703 | S | S | * | * | trans | 91.7 | 69.5 | 179.2 | -112.6 | -97.3 | 0 | 0 | 0 | 116.7 | D69 | Y67-D69 HydrophobicContact CD1-CB 3.44Å; Y67-D69 VanDerWaalsContact CD1-CB 3.44Å; Y67-D69 HydrophobicContact CE1-CB 3.21Å; Y67-D69 WeakPolarHBondContact CE1-OD2 3.35Å; Y67-D69 HydrophobicContact CG-CB 4.39Å; Y67-D69 PolarHBondContact OH-OD2 3.26Å | ||
| 68 | D | 56.7 | Low | 60.9 | Low | 138 Ų | 138 | 127 Ų | 127 | 74% | 0.738 | 69% | 0.694 | S | S | * | * | trans | -96.8 | 72.9 | 152.7 | -146.6 | 13.4 | 0 | 0 | 0 | 106.8 | ||||
| 69 | D | 57.2 | Low | 62.4 | Low | 81 Ų | 81 | 123.4 Ų | 123.4 | 43% | 0.433 | 68% | 0.679 | S | S | . | * | trans | -101.2 | 81.1 | 176.8 | -158.4 | 8.5 | 0 | 0 | 0 | 106.8 | Y67 S71 | Y67-D69 HydrophobicContact CD1-CB 3.44Å; Y67-D69 VanDerWaalsContact CD1-CB 3.44Å; Y67-D69 HydrophobicContact CE1-CB 3.21Å; Y67-D69 WeakPolarHBondContact CE1-OD2 3.35Å; Y67-D69 HydrophobicContact CG-CB 4.39Å; Y67-D69 PolarHBondContact OH-OD2 3.26Å; D69-S71 PolarHBondContact O-N 2.95Å | ||
| 70 | E | 64 | Low | 64.1 | Low | 175 Ų | 175 | 120.8 Ų | 120.8 | 82% | 0.818 | 67% | 0.666 | S | S | * | * | trans | -69.3 | 34.9 | 175.6 | -57.9 | -111.9 | 122.7 | 0 | 0 | 111.6 | ||||
| 71 | S | 63.9 | Low | 65.5 | Low | 77 Ų | 77 | 118.8 Ų | 118.8 | 54% | 0.538 | 65% | 0.652 | S | S | . | * | trans | -101.4 | 21 | 174.6 | 90.7 | 0 | 0 | 0 | 0 | 111.9 | D69 I73 | D69-S71 PolarHBondContact O-N 2.95Å; S71-I73 PolarHBondContact O-N 3.43Å | ||
| 72 | A | 72.2 | Confident | 66.3 | Low | 90 Ų | 90 | 116.3 Ų | 116.3 | 74% | 0.744 | 63% | 0.633 | S | S | * | * | trans | -57.3 | 118.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | D74 | A72-D74 PolarHBondContact O-N 3.41Š| ||
| 73 | I | 73.8 | Confident | 67 | Low | 128 Ų | 128 | 114.5 Ų | 114.5 | 66% | 0.656 | 62% | 0.622 | S | S | * | * | trans | -61.7 | 111.6 | 179.1 | -65.8 | 167.9 | 0 | 0 | 0 | 107 | S71 F75 | S71-I73 PolarHBondContact O-N 3.43Å; I73-F75 HydrophobicContact CB-CE2 3.94Å; I73-F75 HydrophobicContact CB-CZ 3.98Å; I73-F75 HydrophobicContact CG2-CD1 4.15Å; I73-F75 HydrophobicContact CG2-CD2 4.25Å; I73-F75 HydrophobicContact CG2-CE1 3.72Å; I73-F75 HydrophobicContact CG2-CE2 3.83Å; I73-F75 HydrophobicContact CG2-CG 4.4Å; I73-F75 HydrophobicContact CG2-CZ 3.54Å; I73-F75 WeakPolarHBondContact O-CD2 3.49Å; I73-F75 WeakPolarHBondContact O-CE2 3.36Å; I73-F75 PolarHBondContact O-N 2.97Å; I73-F75 VanDerWaalsContact O-N 3.14Å | ||
| 74 | D | 80.6 | Confident | 67.8 | Low | 99 Ų | 99 | 112.8 Ų | 112.8 | 53% | 0.529 | 61% | 0.614 | S | S | . | * | trans | -75.7 | 99.7 | 177.1 | -179.2 | 15.9 | 0 | 0 | 0 | 109.5 | A72 S76 | A72-D74 PolarHBondContact O-N 3.41Å; D74-S76 PolarHBondContact O-N 3.46Å; D74-S76 WeakPolarHBondContact OD1-CB 3.47Å; D74-S76 PolarHBondContact OD1-N 2.8Å; D74-S76 PolarHBondContact OD1-OG 2.95Å | ||
| 75 | F | 78.5 | Confident | 68.2 | Low | 128 Ų | 128 | 111 Ų | 111 | 56% | 0.561 | 60% | 0.601 | S | S | * | * | trans | -76.8 | -5.8 | 177.3 | -65.7 | -78.4 | 0 | 0 | 0 | 113 | I73 Q77 Y78 I79 | I73-F75 HydrophobicContact CB-CE2 3.94Å; I73-F75 HydrophobicContact CB-CZ 3.98Å; I73-F75 HydrophobicContact CG2-CD1 4.15Å; I73-F75 HydrophobicContact CG2-CD2 4.25Å; I73-F75 HydrophobicContact CG2-CE1 3.72Å; I73-F75 HydrophobicContact CG2-CE2 3.83Å; I73-F75 HydrophobicContact CG2-CG 4.4Å; I73-F75 HydrophobicContact CG2-CZ 3.54Å; I73-F75 WeakPolarHBondContact O-CD2 3.49Å; I73-F75 WeakPolarHBondContact O-CE2 3.36Å; I73-F75 PolarHBondContact O-N 2.97Å; I73-F75 VanDerWaalsContact O-N 3.14Å; F75-Q77 VanDerWaalsContact C-N 3.29Å; F75-Q77 PolarHBondContact O-N 2.73Å; F75-Y78 PolarHBondContact O-N 3.16Å; F75-I79 HydrophobicContact CB-CD1 4.42Å; F75-I79 WeakPolarHBondContact O-CG1 3.41Å; F75-I79 PolarHBondContact O-N 3.29Å | ||
| 76 | S | 80.7 | Confident | 68.1 | Low | 62 Ų | 62 | 111.7 Ų | 111.7 | 43% | 0.434 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -59.7 | -41.4 | -177.9 | -46 | 0 | 0 | 0 | 0 | 111.1 | D74 Y78 I79 D80 | D74-S76 PolarHBondContact O-N 3.46Å; D74-S76 WeakPolarHBondContact OD1-CB 3.47Å; D74-S76 PolarHBondContact OD1-N 2.8Å; D74-S76 PolarHBondContact OD1-OG 2.95Å; S76-Y78 VanDerWaalsContact C-N 3.31Å; S76-Y78 PolarHBondContact O-N 2.9Å; S76-I79 PolarHBondContact O-N 3.42Å; S76-D80 WeakPolarHBondContact O-CB 3.27Å; S76-D80 PolarHBondContact O-N 3.26Å |
| 77 | Q | 78.4 | Confident | 68.2 | Low | 152 Ų | 152 | 111.2 Ų | 111.2 | 71% | 0.71 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -62.8 | -34.4 | 176.3 | -72.4 | -177.2 | 10.7 | 0 | 0 | 113.5 | F75 S81 | F75-Q77 VanDerWaalsContact C-N 3.29Å; F75-Q77 PolarHBondContact O-N 2.73Å; Q77-S81 WeakPolarHBondContact O-CB 3.47Å; Q77-S81 PolarHBondContact O-N 2.88Å |
| 78 | Y | 81.1 | Confident | 68.3 | Low | 142 Ų | 142 | 105.9 Ų | 105.9 | 56% | 0.557 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -74.7 | -39.4 | 177.1 | 176 | -97.3 | 0 | 0 | 0 | 111.6 | F75 S76 S81 M82 | F75-Y78 PolarHBondContact O-N 3.16Å; S76-Y78 VanDerWaalsContact C-N 3.31Å; S76-Y78 PolarHBondContact O-N 2.9Å; Y78-S81 PolarHBondContact O-N 2.88Å; Y78-M82 HydrophobicContact CE1-CE 4.43Å; Y78-M82 HydrophobicContact CE1-CG 4.27Å; Y78-M82 HydrophobicContact CE1-SD 3.98Å; Y78-M82 HydrophobicContact CE2-CE 4.42Å; Y78-M82 PolarHBondContact O-N 3.41Å; Y78-M82 WeakPolarHBondContact OH-CE 3.45Å |
| 79 | I | 80.3 | Confident | 68.3 | Low | 96 Ų | 96 | 106.5 Ų | 106.5 | 49% | 0.492 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.9 | -49.8 | 176.3 | -66.3 | 167.2 | 0 | 0 | 0 | 109.6 | F75 S76 S81 M82 T83 | F75-I79 HydrophobicContact CB-CD1 4.42Å; F75-I79 WeakPolarHBondContact O-CG1 3.41Å; F75-I79 PolarHBondContact O-N 3.29Å; S76-I79 PolarHBondContact O-N 3.42Å; I79-S81 VanDerWaalsContact C-N 3.31Å; I79-S81 PolarHBondContact O-N 3.43Å; I79-M82 PolarHBondContact O-N 2.93Å; I79-M82 VanDerWaalsContact O-N 3.1Å; I79-T83 WeakPolarHBondContact O-CG2 3.38Å; I79-T83 PolarHBondContact O-N 3.31Å; I79-T83 PolarHBondContact O-OG1 3.48Å |
| 80 | D | 78 | Confident | 68.3 | Low | 103 Ų | 103 | 107.1 Ų | 107.1 | 55% | 0.551 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -64.5 | -35.4 | 177.9 | -69.1 | -18.7 | 0 | 0 | 0 | 112.2 | S76 M82 T83 S84 | S76-D80 WeakPolarHBondContact O-CB 3.27Å; S76-D80 PolarHBondContact O-N 3.26Å; D80-M82 VanDerWaalsContact C-N 3.33Å; D80-M82 PolarHBondContact O-N 3.1Å; D80-T83 WeakPolarHBondContact CA-OG1 3.36Å; D80-T83 PolarHBondContact O-N 3.03Å; D80-T83 PolarHBondContact O-OG1 3.32Å; D80-T83 VanDerWaalsContact O-OG1 3.08Å; D80-S84 VanDerWaalsContact O-CB 3.24Å; D80-S84 WeakPolarHBondContact O-CB 3.33Å; D80-S84 PolarHBondContact O-N 3.32Å; D80-S84 PolarHBondContact O-OG 3.48Å |
| 81 | S | 76.8 | Confident | 67.5 | Low | 71 Ų | 71 | 102.8 Ų | 102.8 | 50% | 0.497 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.9 | -32.7 | 173.7 | -175.2 | 0 | 0 | 0 | 0 | 112.6 | Q77 Y78 I79 S84 V85 | Q77-S81 WeakPolarHBondContact O-CB 3.47Å; Q77-S81 PolarHBondContact O-N 2.88Å; Y78-S81 PolarHBondContact O-N 2.88Å; I79-S81 VanDerWaalsContact C-N 3.31Å; I79-S81 PolarHBondContact O-N 3.43Å; S81-S84 PolarHBondContact O-OG 2.93Å; S81-S84 VanDerWaalsContact O-OG 3.14Å; S81-V85 WeakPolarHBondContact O-CG2 3.41Å |
| 82 | M | 66.9 | Low | 66.8 | Low | 71 Ų | 71 | 103.1 Ų | 103.1 | 35% | 0.35 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -77.5 | -34.3 | 175.8 | -87.5 | -150.6 | 156.4 | 0 | 0 | 113 | Y78 I79 D80 L90 | Y78-M82 HydrophobicContact CE1-CE 4.43Å; Y78-M82 HydrophobicContact CE1-CG 4.27Å; Y78-M82 HydrophobicContact CE1-SD 3.98Å; Y78-M82 HydrophobicContact CE2-CE 4.42Å; Y78-M82 PolarHBondContact O-N 3.41Å; Y78-M82 WeakPolarHBondContact OH-CE 3.45Å; I79-M82 PolarHBondContact O-N 2.93Å; I79-M82 VanDerWaalsContact O-N 3.1Å; D80-M82 VanDerWaalsContact C-N 3.33Å; D80-M82 PolarHBondContact O-N 3.1Å; M82-L90 HydrophobicContact CB-CD1 4.18Å |
| 83 | T | 64.4 | Low | 66.1 | Low | 89 Ų | 89 | 104.4 Ų | 104.4 | 55% | 0.546 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -76.5 | -24.6 | 177.5 | 59.9 | 0 | 0 | 0 | 0 | 112.7 | I79 D80 V85 L90 | I79-T83 WeakPolarHBondContact O-CG2 3.38Å; I79-T83 PolarHBondContact O-N 3.31Å; I79-T83 PolarHBondContact O-OG1 3.48Å; D80-T83 WeakPolarHBondContact CA-OG1 3.36Å; D80-T83 PolarHBondContact O-N 3.03Å; D80-T83 PolarHBondContact O-OG1 3.32Å; D80-T83 VanDerWaalsContact O-OG1 3.08Å; T83-V85 VanDerWaalsContact C-N 3.32Å; T83-V85 PolarHBondContact O-N 2.96Å; T83-L90 HydrophobicContact CG2-CD1 4.31Å |
| 84 | S | 61.7 | Low | 65.4 | Low | 83 Ų | 83 | 105 Ų | 105 | 58% | 0.58 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -3.5 | 178.7 | 66.3 | 0 | 0 | 0 | 0 | 115 | D80 S81 P86 | D80-S84 VanDerWaalsContact O-CB 3.24Å; D80-S84 WeakPolarHBondContact O-CB 3.33Å; D80-S84 PolarHBondContact O-N 3.32Å; D80-S84 PolarHBondContact O-OG 3.48Å; S81-S84 PolarHBondContact O-OG 2.93Å; S81-S84 VanDerWaalsContact O-OG 3.14Å; S84-P86 VanDerWaalsContact O-CD 3.23Å; S84-P86 WeakPolarHBondContact O-CD 3.39Å |
| 85 | V | 56.3 | Low | 64.4 | Low | 71 Ų | 71 | 106.8 Ų | 106.8 | 43% | 0.43 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -73.5 | 112 | 178.1 | -176.2 | 0 | 0 | 0 | 0 | 109.7 | S81 T83 N87 L88 | S81-V85 WeakPolarHBondContact O-CG2 3.41Å; T83-V85 VanDerWaalsContact C-N 3.32Å; T83-V85 PolarHBondContact O-N 2.96Å; V85-N87 PolarHBondContact O-N 3.41Å; V85-N87 VanDerWaalsContact O-N 3.12Å; V85-L88 HydrophobicContact CB-CB 3.98Å; V85-L88 HydrophobicContact CG1-CB 4.12Å; V85-L88 PolarHBondContact O-N 3.49Å; V85-L88 VanDerWaalsContact O-N 3.15Å |
| 86 | P | 54.6 | Low | 63.6 | Low | 112 Ų | 112 | 105.6 Ų | 105.6 | 73% | 0.727 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | 114.5 | 179.3 | 29.8 | -31 | 0 | 0 | 0 | 108.9 | S84 | S84-P86 VanDerWaalsContact O-CD 3.23Å; S84-P86 WeakPolarHBondContact O-CD 3.39Å |
| 87 | N | 54.5 | Low | 62.8 | Low | 169 Ų | 169 | 106.7 Ų | 106.7 | 90% | 0.904 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 101.1 | 1.9 | -172.8 | -69.1 | -77.9 | 0 | 0 | 0 | 117.4 | V85 E89 | V85-N87 PolarHBondContact O-N 3.41Å; V85-N87 VanDerWaalsContact O-N 3.12Å; N87-E89 PolarHBondContact O-N 2.68Å |
| 88 | L | 54 | Low | 62.1 | Low | 86 Ų | 86 | 104.8 Ų | 104.8 | 45% | 0.45 | 56% | 0.561 | S | S | . | * | trans | -90.7 | 83.6 | 164.6 | -154.6 | 68.1 | 0 | 0 | 0 | 108.2 | V85 L90 | V85-L88 HydrophobicContact CB-CB 3.98Å; V85-L88 HydrophobicContact CG1-CB 4.12Å; V85-L88 PolarHBondContact O-N 3.49Å; V85-L88 VanDerWaalsContact O-N 3.15Å; L88-L90 HydrophobicContact CD2-CD1 4.46Å; L88-L90 HydrophobicContact CD2-CD2 4.44Å; L88-L90 HydrophobicContact CD2-CG 4.22Å; L88-L90 HydrophobicContact CG-CG 4.27Å; L88-L90 PolarHBondContact O-N 2.88Å | ||
| 89 | E | 57.2 | Low | 61.7 | Low | 152 Ų | 152 | 102.7 Ų | 102.7 | 71% | 0.71 | 56% | 0.56 | S | S | * | * | trans | -59.8 | 85.1 | 160.5 | -89.6 | -166.2 | 179.3 | 0 | 0 | 107.6 | N87 C91 N92 | N87-E89 PolarHBondContact O-N 2.68Å; E89-C91 PolarHBondContact O-N 3.37Å; E89-N92 PolarHBondContact OE2-ND2 2.86Å | ||
| 90 | L | 55.9 | Low | 60.7 | Low | 94 Ų | 94 | 105 Ų | 105 | 49% | 0.492 | 57% | 0.566 | S | S | . | * | trans | -66.8 | 90.1 | 161.6 | -78.8 | 162.7 | 0 | 0 | 0 | 105.9 | M82 T83 L88 | M82-L90 HydrophobicContact CB-CD1 4.18Å; T83-L90 HydrophobicContact CG2-CD1 4.31Å; L88-L90 HydrophobicContact CD2-CD1 4.46Å; L88-L90 HydrophobicContact CD2-CD2 4.44Å; L88-L90 HydrophobicContact CD2-CG 4.22Å; L88-L90 HydrophobicContact CG-CG 4.27Å; L88-L90 PolarHBondContact O-N 2.88Å | ||
| 91 | C | 46.9 | Very low | 60 | Low | 83 Ų | 83 | 104.7 Ų | 104.7 | 56% | 0.561 | 57% | 0.565 | S | S | * | * | trans | 40.6 | 96.7 | 165.4 | -62.3 | 0 | 0 | 0 | 0 | 114.7 | E89 D93 F96 | E89-C91 PolarHBondContact O-N 3.37Å; C91-D93 PolarHBondContact O-N 2.93Å; C91-F96 HydrophobicContact CB-CE2 4.25Å | ||
| 92 | N | 51 | Low | 59.1 | Low | 85 Ų | 85 | 104.9 Ų | 104.9 | 46% | 0.455 | 56% | 0.563 | S | S | . | * | trans | -24.3 | 101.7 | 157.4 | -70 | -84.7 | 0 | 0 | 0 | 112.7 | E89 E94 L95 | E89-N92 PolarHBondContact OE2-ND2 2.86Å; N92-E94 PolarHBondContact O-N 3.43Å; N92-L95 PolarHBondContact O-N 2.95Å | ||
| 93 | D | 56.5 | Low | 58.6 | Low | 116 Ų | 116 | 106.7 Ų | 106.7 | 62% | 0.62 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | -22.6 | 178.4 | -74 | -37.3 | 0 | 0 | 0 | 111.7 | C91 L95 F96 L97 | C91-D93 PolarHBondContact O-N 2.93Å; D93-L95 PolarHBondContact O-N 3.37Å; D93-F96 PolarHBondContact O-N 3.1Å; D93-L97 HydrophobicContact CB-CD1 3.99Å; D93-L97 WeakPolarHBondContact O-CD1 3.41Å; D93-L97 PolarHBondContact O-N 2.83Å |
| 94 | E | 58.2 | Low | 57.9 | Low | 141 Ų | 141 | 110.6 Ų | 110.6 | 66% | 0.659 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -54.6 | -33 | 177.4 | -62 | -60.8 | 135.5 | 0 | 0 | 113.7 | N92 | N92-E94 PolarHBondContact O-N 3.43Å |
| 95 | L | 60.8 | Low | 57.3 | Low | 137 Ų | 137 | 114.6 Ų | 114.6 | 72% | 0.717 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -75.9 | -26.1 | 177.3 | -72.9 | 170 | 0 | 0 | 0 | 112.7 | N92 D93 | N92-L95 PolarHBondContact O-N 2.95Å; D93-L95 PolarHBondContact O-N 3.37Å |
| 96 | F | 61.2 | Low | 56.8 | Low | 102 Ų | 102 | 119.8 Ų | 119.8 | 45% | 0.447 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -89.4 | -26 | 178.3 | -69.8 | -77.1 | 0 | 0 | 0 | 112.6 | C91 D93 D98 L99 F100 | C91-F96 HydrophobicContact CB-CE2 4.25Å; D93-F96 PolarHBondContact O-N 3.1Å; F96-D98 VanDerWaalsContact C-N 3.3Å; F96-D98 PolarHBondContact O-N 3.31Å; F96-L99 HydrophobicContact CD1-CD2 4.38Å; F96-L99 PolarHBondContact O-N 3.16Å; F96-F100 PolarHBondContact O-N 3.33Å |
| 97 | L | 63.5 | Low | 56.6 | Low | 86 Ų | 86 | 122 Ų | 122 | 45% | 0.45 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -57.2 | -44.5 | 173.2 | -95.7 | 77.3 | 0 | 0 | 0 | 111 | D93 F100 N101 | D93-L97 HydrophobicContact CB-CD1 3.99Å; D93-L97 WeakPolarHBondContact O-CD1 3.41Å; D93-L97 PolarHBondContact O-N 2.83Å; L97-F100 PolarHBondContact O-N 2.96Å; L97-N101 VanDerWaalsContact O-CB 3.26Å; L97-N101 WeakPolarHBondContact O-CB 3.4Å; L97-N101 PolarHBondContact O-N 2.93Å; L97-N101 PolarHBondContact O-ND2 3.18Å |
| 98 | D | 65.1 | Low | 56.2 | Low | 111 Ų | 111 | 117.5 Ų | 117.5 | 59% | 0.594 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -70.5 | -35 | 180 | -147.6 | 29.2 | 0 | 0 | 0 | 112.2 | F96 N101 T102 | F96-D98 VanDerWaalsContact C-N 3.3Å; F96-D98 PolarHBondContact O-N 3.31Å; D98-N101 PolarHBondContact O-N 3.17Å; D98-T102 WeakPolarHBondContact O-CB 3.23Å; D98-T102 VanDerWaalsContact O-CG2 3.24Å; D98-T102 WeakPolarHBondContact O-CG2 3.31Å; D98-T102 PolarHBondContact O-N 3.35Å; D98-T102 PolarHBondContact O-OG1 3.5Å |
| 99 | L | 71.2 | Confident | 55.7 | Low | 99 Ų | 99 | 120.1 Ų | 120.1 | 52% | 0.518 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -67.6 | -37.2 | 175.9 | -172.6 | 61.7 | 0 | 0 | 0 | 113 | F96 T102 | F96-L99 HydrophobicContact CD1-CD2 4.38Å; F96-L99 PolarHBondContact O-N 3.16Å; L99-T102 PolarHBondContact O-OG1 2.95Å |
| 100 | F | 60.8 | Low | 54.9 | Low | 144 Ų | 144 | 122.4 Ų | 122.4 | 63% | 0.632 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -81.1 | -27.1 | 176.4 | -91.6 | -87.3 | 0 | 0 | 0 | 113.2 | F96 L97 K104 | F96-F100 PolarHBondContact O-N 3.33Å; L97-F100 PolarHBondContact O-N 2.96Å; F100-K104 VanDerWaalsContact O-CG 3.31Å; F100-K104 WeakPolarHBondContact O-CG 3.4Å; F100-K104 PolarHBondContact O-N 3.2Å |
| 101 | N | 63.2 | Low | 54.1 | Low | 97 Ų | 97 | 125.7 Ų | 125.7 | 52% | 0.519 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -72.5 | -37.6 | 174.3 | -73.1 | -27.8 | 0 | 0 | 0 | 112.4 | L97 D98 V103 K104 Q105 | L97-N101 VanDerWaalsContact O-CB 3.26Å; L97-N101 WeakPolarHBondContact O-CB 3.4Å; L97-N101 PolarHBondContact O-N 2.93Å; L97-N101 PolarHBondContact O-ND2 3.18Å; D98-N101 PolarHBondContact O-N 3.17Å; N101-V103 PolarHBondContact O-N 2.87Å; N101-K104 PolarHBondContact O-N 2.99Å; N101-Q105 PolarHBondContact O-N 2.88Å |
| 102 | T | 57.1 | Low | 54 | Low | 74 Ų | 74 | 128 Ų | 128 | 45% | 0.454 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65.4 | -36.4 | 176.7 | 48.2 | 0 | 0 | 0 | 0 | 112.7 | D98 L99 K104 Q105 | D98-T102 WeakPolarHBondContact O-CB 3.23Å; D98-T102 VanDerWaalsContact O-CG2 3.24Å; D98-T102 WeakPolarHBondContact O-CG2 3.31Å; D98-T102 PolarHBondContact O-N 3.35Å; D98-T102 PolarHBondContact O-OG1 3.5Å; L99-T102 PolarHBondContact O-OG1 2.95Å; T102-K104 VanDerWaalsContact C-N 3.31Å; T102-K104 PolarHBondContact O-N 3.5Å; T102-Q105 PolarHBondContact O-N 3.46Å |
| 103 | V | 55.8 | Low | 53.6 | Low | 109 Ų | 109 | 132.3 Ų | 132.3 | 66% | 0.661 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -70.1 | -25.5 | 174.1 | 170.3 | 0 | 0 | 0 | 0 | 112.8 | N101 | N101-V103 PolarHBondContact O-N 2.87Å |
| 104 | K | 50.7 | Low | 52.7 | Low | 172 Ų | 172 | 135.9 Ų | 135.9 | 75% | 0.748 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -80.2 | -22.1 | 176.9 | -72.6 | -89.4 | -178.5 | 171.7 | 0 | 113.2 | F100 N101 T102 | F100-K104 VanDerWaalsContact O-CG 3.31Å; F100-K104 WeakPolarHBondContact O-CG 3.4Å; F100-K104 PolarHBondContact O-N 3.2Å; N101-K104 PolarHBondContact O-N 2.99Å; T102-K104 VanDerWaalsContact C-N 3.31Å; T102-K104 PolarHBondContact O-N 3.5Å |
| 105 | Q | 49.5 | Very low | 51.7 | Low | 166 Ų | 166 | 134.2 Ų | 134.2 | 78% | 0.776 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -86.3 | -21.8 | -180 | -102.7 | -159 | 31.9 | 0 | 0 | 114.9 | N101 T102 K107 P108 | N101-Q105 PolarHBondContact O-N 2.88Å; T102-Q105 PolarHBondContact O-N 3.46Å; Q105-K107 PolarHBondContact O-N 3.23Å; Q105-P108 WeakPolarHBondContact O-CD 3.28Å |
| 106 | E | 44.8 | Very low | 50.4 | Low | 181 Ų | 181 | 132.6 Ų | 132.6 | 85% | 0.846 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -75 | 11.2 | 180 | -86.5 | -122.4 | 135.3 | 0 | 0 | 114.7 | ||
| 107 | K | 50.3 | Low | 49.2 | Very low | 158 Ų | 158 | 134 Ų | 134 | 69% | 0.687 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -140.7 | 53.7 | -175.8 | -131.4 | 178.5 | -175.2 | 168.6 | 0 | 116.9 | Q105 Y111 | Q105-K107 PolarHBondContact O-N 3.23Å; K107-Y111 PolarHBondContact O-OH 3.22Å; K107-Y111 VanDerWaalsContact O-OH 3.14Å |
| 108 | P | 46.5 | Very low | 48.1 | Very low | 74 Ų | 74 | 137.7 Ų | 137.7 | 48% | 0.481 | 71% | 0.712 | S | S | . | * | S | Bend | trans | -122.8 | -4.3 | 148.9 | 35.9 | -27.8 | 0 | 0 | 0 | 115.9 | Q105 | Q105-P108 WeakPolarHBondContact O-CD 3.28Š|
| 109 | D | 43.8 | Very low | 46.6 | Very low | 142 Ų | 142 | 138.7 Ų | 138.7 | 76% | 0.759 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -102.3 | -0.9 | -169.7 | -64.4 | -33.8 | 0 | 0 | 0 | 116 | Y111 | D109-Y111 PolarHBondContact O-N 3.21Š|
| 110 | F | 39.8 | Very low | 44.7 | Very low | 199 Ų | 199 | 137.8 Ų | 137.8 | 87% | 0.873 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -0.2 | -176.4 | -146.6 | -96.2 | 0 | 0 | 0 | 115.1 | ||
| 111 | Y | 39.8 | Very low | 43.3 | Very low | 163 Ų | 163 | 135 Ų | 135 | 64% | 0.639 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | 2.7 | -179.5 | -9.8 | -83.1 | 0 | 0 | 0 | 114.9 | K107 D109 | K107-Y111 PolarHBondContact O-OH 3.22Å; K107-Y111 VanDerWaalsContact O-OH 3.14Å; D109-Y111 PolarHBondContact O-N 3.21Å |
| 112 | N | 43.6 | Very low | 42.1 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | -123.5 | 50.3 | -171.5 | -153.7 | -8.4 | 0 | 0 | 0 | 113.6 | ||||
| 113 | L | 42.5 | Very low | 41.1 | Very low | 176 Ų | 176 | 143.7 Ų | 143.7 | 92% | 0.921 | 79% | 0.791 | S | S | * | * | trans | -124.2 | 26.9 | 170.3 | -156 | 66.8 | 0 | 0 | 0 | 113 | ||||
| 114 | Q | 38.6 | Very low | 40 | Very low | 192 Ų | 192 | 145.2 Ų | 145.2 | 90% | 0.897 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -122.9 | 33.2 | 175.6 | -162.8 | 106.6 | 70 | 0 | 0 | 111.9 | ||
| 115 | S | 37.1 | Very low | 39.3 | Very low | 105 Ų | 105 | 144.2 Ų | 144.2 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -161.3 | 62.7 | 172.5 | -159.8 | 0 | 0 | 0 | 0 | 113.5 | ||
| 116 | A | 33.4 | Very low | 38.6 | Very low | 103 Ų | 103 | 144 Ų | 144 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -158.4 | 62.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 117 | V | 36.5 | Very low | 38 | Very low | 133 Ų | 133 | 142.7 Ų | 142.7 | 81% | 0.806 | 79% | 0.785 | S | S | * | * | trans | -86.7 | 134.9 | 150.2 | 166 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 118 | L | 40.3 | Very low | 37.1 | Very low | 162 Ų | 162 | 140 Ų | 140 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | trans | 111.9 | 127.3 | 169.8 | -55.5 | -177 | 0 | 0 | 0 | 115.6 | ||||
| 119 | S | 32.9 | Very low | 36.5 | Very low | 133 Ų | 133 | 139.6 Ų | 139.6 | 93% | 0.93 | 79% | 0.79 | S | S | * | * | trans | 86.8 | 109.8 | 176.7 | -137.8 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 120 | G | 31.7 | Very low | 35.8 | Very low | 80 Ų | 80 | 139.6 Ų | 139.6 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | cis | 118.5 | 121.3 | 30.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 121 | G | 31.5 | Very low | 35.3 | Very low | 85 Ų | 85 | 139.8 Ų | 139.8 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | trans | 129.7 | 141.5 | 166 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 122 | M | 38.7 | Very low | 34.9 | Very low | 193 Ų | 193 | 137.1 Ų | 137.1 | 95% | 0.951 | 80% | 0.802 | S | S | * | * | trans | -106.6 | 168.5 | -165.6 | -56.1 | 177.1 | 137.4 | 0 | 0 | 111.8 | ||||
| 123 | M | 34.5 | Very low | 34.3 | Very low | 161 Ų | 161 | 138.7 Ų | 138.7 | 79% | 0.793 | 80% | 0.803 | S | S | * | * | trans | 103.9 | 106.6 | 142.9 | -154.4 | 162.7 | 178.3 | 0 | 0 | 120.4 | ||||
| 124 | Q | 33.5 | Very low | 33.8 | Very low | 140 Ų | 140 | 139.8 Ų | 139.8 | 65% | 0.654 | 80% | 0.803 | S | S | * | * | 92.3 | 138.7 | 119.4 | -163.4 | 173.3 | 40 | 0 | 0 | 124.7 | |||||
| 125 | Q | 35.1 | Very low | 33.4 | Very low | 151 Ų | 151 | 136.9 Ų | 136.9 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | trans | 82.1 | 106.9 | 153.3 | -104.2 | 157.5 | -3.3 | 0 | 0 | 118.5 | ||||
| 126 | Q | 34.8 | Very low | 33 | Very low | 161 Ų | 161 | 136 Ų | 136 | 75% | 0.752 | 80% | 0.801 | S | S | * | * | 78.3 | 126.1 | 65 | -170.7 | 176 | 19.8 | 0 | 0 | 114.2 | |||||
| 127 | L | 32.9 | Very low | 33 | Very low | 154 Ų | 154 | 135.7 Ų | 135.7 | 81% | 0.806 | 80% | 0.799 | S | S | * | * | trans | 161.3 | 94.7 | 138.5 | -83.3 | 159.4 | 0 | 0 | 0 | 108.5 | ||||
| 128 | S | 32.3 | Very low | 33.4 | Very low | 101 Ų | 101 | 135.7 Ų | 135.7 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | 81.4 | 111.8 | 87.4 | 69.1 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 129 | A | 32.2 | Very low | 33.2 | Very low | 67 Ų | 67 | 136.7 Ų | 136.7 | 55% | 0.554 | 80% | 0.802 | S | S | * | * | trans | -80.7 | 148.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y131 | A129-Y131 HydrophobicContact CB-CE1 3.88Š| ||
| 130 | V | 29.5 | Very low | 33.3 | Very low | 141 Ų | 141 | 140.6 Ų | 140.6 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | trans | -129.6 | 124.9 | 166.1 | 174.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 131 | Y | 28.8 | Very low | 33.3 | Very low | 204 Ų | 204 | 140.7 Ų | 140.7 | 80% | 0.8 | 80% | 0.803 | S | S | * | * | trans | -100.9 | 136.1 | 175.2 | -10.6 | -91 | 0 | 0 | 0 | 107.7 | A129 | A129-Y131 HydrophobicContact CB-CE1 3.88Š| ||
| 132 | A | 31.5 | Very low | 33.4 | Very low | 106 Ų | 106 | 141.3 Ų | 141.3 | 88% | 0.876 | 80% | 0.8 | S | S | * | * | trans | -121.2 | 119.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 133 | K | 32.4 | Very low | 33.3 | Very low | 164 Ų | 164 | 142.5 Ų | 142.5 | 71% | 0.713 | 80% | 0.8 | S | S | * | * | trans | -99.3 | 142.7 | 176.6 | -144.3 | -154.9 | 179.4 | -137.2 | 0 | 107.7 | D135 | K133-D135 IonicContact NZ-OD1 2.84Å; K133-D135 PolarHBondContact NZ-OD1 3.06Å; K133-D135 IonicContact NZ-OD2 3.18Å; K133-D135 PolarHBondContact NZ-OD2 2.97Å | ||
| 134 | Q | 30.7 | Very low | 33.4 | Very low | 199 Ų | 199 | 140.6 Ų | 140.6 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -145.9 | 125.3 | 155.8 | -118.7 | -178.9 | 0.8 | 0 | 0 | 110.8 | ||||
| 135 | D | 30.7 | Very low | 33.6 | Very low | 132 Ų | 132 | 137.8 Ų | 137.8 | 71% | 0.706 | 80% | 0.802 | S | S | * | * | trans | -88.7 | 154.3 | 178 | -71 | -58.5 | 0 | 0 | 0 | 110.8 | K133 | K133-D135 IonicContact NZ-OD1 2.84Å; K133-D135 PolarHBondContact NZ-OD1 3.06Å; K133-D135 IonicContact NZ-OD2 3.18Å; K133-D135 PolarHBondContact NZ-OD2 2.97Å | ||
| 136 | G | 29.7 | Very low | 34 | Very low | 86 Ų | 86 | 136.8 Ų | 136.8 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | 171 | 104.6 | 163.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 137 | A | 33.5 | Very low | 34.8 | Very low | 97 Ų | 97 | 136.9 Ų | 136.9 | 80% | 0.802 | 81% | 0.812 | S | S | * | * | trans | -112 | 161.9 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 138 | P | 44.6 | Very low | 35.2 | Very low | 132 Ų | 132 | 137.9 Ų | 137.9 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | -149.4 | 171.7 | 82.2 | 35.3 | -14.1 | 0 | 0 | 0 | 116.5 | |||||
| 139 | E | 36.3 | Very low | 35.6 | Very low | 184 Ų | 184 | 140 Ų | 140 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -69.2 | 156.6 | -172.3 | -56.1 | -163.3 | 130 | 0 | 0 | 117.5 | ||||
| 140 | K | 34.2 | Very low | 36 | Very low | 214 Ų | 214 | 145.8 Ų | 145.8 | 93% | 0.93 | 82% | 0.824 | S | S | * | * | trans | -160.6 | 126.1 | 136.7 | -106.5 | 174.8 | -171.7 | -177.4 | 0 | 110.2 | ||||
| 141 | G | 32.5 | Very low | 37.2 | Very low | 82 Ų | 82 | 144 Ų | 144 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | trans | -78.7 | 158.5 | -170 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 142 | A | 33.8 | Very low | 37.9 | Very low | 98 Ų | 98 | 141.5 Ų | 141.5 | 81% | 0.81 | 82% | 0.819 | S | S | * | * | trans | -167.4 | 128.1 | 141.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | C144 | A142-C144 PolarHBondContact O-N 2.99Š| ||
| 143 | F | 36.3 | Very low | 38.6 | Very low | 219 Ų | 219 | 148.1 Ų | 148.1 | 96% | 0.961 | 82% | 0.821 | S | S | * | * | trans | -52.5 | 123.6 | 167.9 | -89.8 | -104.6 | 0 | 0 | 0 | 109.9 | ||||
| 144 | C | 35.8 | Very low | 39.1 | Very low | 121 Ų | 121 | 144.7 Ų | 144.7 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -146.6 | 106.5 | 158 | -149.6 | 0 | 0 | 0 | 0 | 107.8 | A142 | A142-C144 PolarHBondContact O-N 2.99Š| ||
| 145 | A | 38.8 | Very low | 39.6 | Very low | 80 Ų | 80 | 142.4 Ų | 142.4 | 66% | 0.661 | 81% | 0.812 | S | S | * | * | trans | -58.2 | 136.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | I147 | A145-I147 PolarHBondContact O-N 3.14Š| ||
| 146 | P | 42.8 | Very low | 40.1 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | trans | -73.1 | 95.6 | 176.8 | -0.4 | 15 | 0 | 0 | 0 | 109 | ||||
| 147 | I | 52.3 | Low | 41.3 | Very low | 164 Ų | 164 | 143.3 Ų | 143.3 | 84% | 0.841 | 80% | 0.803 | S | S | * | * | trans | -87.3 | 99.9 | 153 | -59.2 | 174.7 | 0 | 0 | 0 | 105.2 | A145 | A145-I147 PolarHBondContact O-N 3.14Š| ||
| 148 | K | 40.2 | Very low | 42 | Very low | 175 Ų | 175 | 146.7 Ų | 146.7 | 76% | 0.761 | 81% | 0.805 | S | S | * | * | trans | -161 | 142.9 | 167.1 | -94.2 | -166.4 | 167.5 | 176.9 | 0 | 107.5 | ||||
| 149 | Q | 42 | Very low | 42.5 | Very low | 146 Ų | 146 | 146.8 Ų | 146.8 | 68% | 0.682 | 81% | 0.808 | S | S | * | * | cis | 178.1 | 113.9 | -4 | 164.9 | 170.9 | 3.2 | 0 | 0 | 99.5 | S151 | Q149-S151 PolarHBondContact O-N 2.96Š| ||
| 150 | E | 38.8 | Very low | 43.2 | Very low | 187 Ų | 187 | 141.7 Ų | 141.7 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -58.2 | 129 | 178.9 | 53.4 | -147.5 | 113.8 | 0 | 0 | 109.3 | D152 | E150-D152 PolarHBondContact O-N 3.4Š| ||
| 151 | S | 56.5 | Low | 44.4 | Very low | 104 Ų | 104 | 135 Ų | 135 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -68.4 | 103.1 | -177.1 | -60.6 | 0 | 0 | 0 | 0 | 108.8 | Q149 W153 | Q149-S151 PolarHBondContact O-N 2.96Å; S151-W153 PolarHBondContact O-N 2.58Å | ||
| 152 | D | 42.9 | Very low | 45.7 | Very low | 152 Ų | 152 | 137.1 Ų | 137.1 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | trans | -62.6 | 115.2 | 165.4 | -159.3 | 17.6 | 0 | 0 | 0 | 107.6 | E150 S154 | E150-D152 PolarHBondContact O-N 3.4Å; D152-S154 PolarHBondContact O-N 3.07Å | ||
| 153 | W | 45.3 | Very low | 47.1 | Very low | 244 Ų | 244 | 136.7 Ų | 136.7 | 92% | 0.924 | 75% | 0.754 | S | S | * | * | trans | -75.7 | 82 | 177.7 | -71.8 | 87.5 | 0 | 0 | 0 | 108.3 | S151 D155 | S151-W153 PolarHBondContact O-N 2.58Å; W153-D155 PolarHBondContact O-N 3.34Å | ||
| 154 | S | 42.6 | Very low | 48.4 | Very low | 92 Ų | 92 | 129.7 Ų | 129.7 | 64% | 0.643 | 73% | 0.732 | S | S | * | * | trans | -79.5 | 112.3 | 170.3 | -168.6 | 0 | 0 | 0 | 0 | 109.3 | D152 S156 | D152-S154 PolarHBondContact O-N 3.07Å; S154-S156 PolarHBondContact O-N 3.01Å; S154-S156 VanDerWaalsContact O-N 3.08Å; S154-S156 PolarHBondContact OG-OG 3.34Å | ||
| 155 | D | 42.7 | Very low | 50.1 | Low | 151 Ų | 151 | 128.7 Ų | 128.7 | 81% | 0.807 | 72% | 0.715 | S | S | * | * | trans | -71.6 | 88.2 | 169.3 | -174.6 | 30.3 | 0 | 0 | 0 | 109.2 | W153 | W153-D155 PolarHBondContact O-N 3.34Š| ||
| 156 | S | 41.4 | Very low | 51.7 | Low | 88 Ų | 88 | 130 Ų | 130 | 62% | 0.615 | 71% | 0.71 | S | S | * | * | trans | -138.2 | 103.7 | 173.8 | -57.9 | 0 | 0 | 0 | 0 | 108.9 | S154 M158 | S154-S156 PolarHBondContact O-N 3.01Å; S154-S156 VanDerWaalsContact O-N 3.08Å; S154-S156 PolarHBondContact OG-OG 3.34Å; S156-M158 PolarHBondContact O-N 3.14Å | ||
| 157 | D | 53.5 | Low | 52.7 | Low | 149 Ų | 149 | 129.7 Ų | 129.7 | 80% | 0.797 | 70% | 0.697 | S | S | * | * | trans | -43.9 | 98.5 | 168.2 | -73.2 | -60.7 | 0 | 0 | 0 | 111 | ||||
| 158 | M | 49 | Very low | 53.3 | Low | 169 Ų | 169 | 126.2 Ų | 126.2 | 83% | 0.833 | 68% | 0.684 | S | S | * | * | trans | -139 | 109.5 | 160.9 | -79 | -70.1 | 104.5 | 0 | 0 | 106.9 | S156 S160 | S156-M158 PolarHBondContact O-N 3.14Å; M158-S160 PolarHBondContact O-N 3.4Å | ||
| 159 | S | 54.4 | Low | 54.6 | Low | 133 Ų | 133 | 122.5 Ų | 122.5 | 93% | 0.93 | 68% | 0.679 | S | S | * | * | trans | -31.5 | 97.1 | -179.4 | -66.1 | 0 | 0 | 0 | 0 | 113.7 | S161 | S159-S161 PolarHBondContact O-N 3.4Š| ||
| 160 | S | 50.6 | Low | 55.6 | Low | 77 Ų | 77 | 119.2 Ų | 119.2 | 54% | 0.538 | 68% | 0.677 | S | S | . | * | trans | -88.3 | 104.9 | 162.4 | 52.9 | 0 | 0 | 0 | 0 | 106.8 | M158 L162 Q165 | M158-S160 PolarHBondContact O-N 3.4Å; S160-L162 PolarHBondContact O-N 2.88Å; S160-L162 VanDerWaalsContact O-N 3.12Å; S160-Q165 PolarHBondContact OG-NE2 3.01Å | ||
| 161 | S | 59.8 | Low | 56.6 | Low | 74 Ų | 74 | 117.6 Ų | 117.6 | 52% | 0.517 | 67% | 0.669 | S | S | . | * | trans | -62 | 119.6 | 177.7 | 65.5 | 0 | 0 | 0 | 0 | 108.1 | S159 P163 S164 | S159-S161 PolarHBondContact O-N 3.4Å; S161-P163 WeakPolarHBondContact O-CD 3.3Å; S161-S164 PolarHBondContact O-N 3.48Å | ||
| 162 | L | 59.9 | Low | 56.6 | Low | 127 Ų | 127 | 117.4 Ų | 117.4 | 67% | 0.665 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -40.1 | -37.9 | 175.4 | -89.6 | 154.1 | 0 | 0 | 0 | 114.1 | S160 S164 Q165 I166 | S160-L162 PolarHBondContact O-N 2.88Å; S160-L162 VanDerWaalsContact O-N 3.12Å; L162-S164 VanDerWaalsContact C-N 3.33Å; L162-S164 PolarHBondContact O-N 3Å; L162-Q165 PolarHBondContact O-N 2.87Å; L162-I166 WeakPolarHBondContact O-CD1 3.34Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 3.39Å; L162-I166 VanDerWaalsContact O-N 3.07Å |
| 163 | P | 64.2 | Low | 56.7 | Low | 89 Ų | 89 | 114.4 Ų | 114.4 | 58% | 0.578 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -58.9 | -38.2 | 175.9 | -27 | 36.9 | 0 | 0 | 0 | 114.4 | S161 I166 E167 | S161-P163 WeakPolarHBondContact O-CD 3.3Å; P163-I166 PolarHBondContact O-N 3.28Å; P163-E167 WeakPolarHBondContact O-CB 3.44Å; P163-E167 PolarHBondContact O-N 3.08Å |
| 164 | S | 62.8 | Low | 56.9 | Low | 71 Ų | 71 | 108.3 Ų | 108.3 | 50% | 0.497 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -71.4 | -34.1 | -178.6 | -175.3 | 0 | 0 | 0 | 0 | 112.4 | S161 L162 T168 | S161-S164 PolarHBondContact O-N 3.48Å; L162-S164 VanDerWaalsContact C-N 3.33Å; L162-S164 PolarHBondContact O-N 3Å; S164-T168 PolarHBondContact O-N 3.47Å; S164-T168 VanDerWaalsContact O-N 3.16Å; S164-T168 PolarHBondContact O-OG1 3.21Å |
| 165 | Q | 72.2 | Confident | 57.1 | Low | 100 Ų | 100 | 108.8 Ų | 108.8 | 47% | 0.467 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -71 | -37 | 173.6 | -69.3 | -169 | 23.2 | 0 | 0 | 112.3 | S160 L162 E167 T168 C169 | S160-Q165 PolarHBondContact OG-NE2 3.01Å; L162-Q165 PolarHBondContact O-N 2.87Å; Q165-E167 VanDerWaalsContact C-N 3.33Å; Q165-T168 WeakPolarHBondContact CA-OG1 3.43Å; Q165-T168 PolarHBondContact O-N 3.47Å; Q165-T168 PolarHBondContact O-OG1 3.06Å; Q165-C169 WeakPolarHBondContact O-CB 3.42Å; Q165-C169 PolarHBondContact O-N 2.96Å; Q165-C169 PolarHBondContact O-SG 3.45Å |
| 166 | I | 71.9 | Confident | 56.9 | Low | 108 Ų | 108 | 108.7 Ų | 108.7 | 55% | 0.554 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -66 | -39.6 | 176.3 | -65.8 | 161.8 | 0 | 0 | 0 | 110.2 | L162 P163 C169 A170 | L162-I166 WeakPolarHBondContact O-CD1 3.34Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 3.39Å; L162-I166 VanDerWaalsContact O-N 3.07Å; P163-I166 PolarHBondContact O-N 3.28Å; I166-C169 PolarHBondContact O-N 2.95Å; I166-A170 VanDerWaalsContact O-CB 3.28Å; I166-A170 WeakPolarHBondContact O-CB 3.15Å; I166-A170 PolarHBondContact O-N 2.93Å |
| 167 | E | 63.2 | Low | 57.1 | Low | 124 Ų | 124 | 109.6 Ų | 109.6 | 58% | 0.579 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67.2 | -38.6 | 177.8 | -162.6 | 162.2 | -157.4 | 0 | 0 | 112.2 | P163 Q165 A170 Q171 | P163-E167 WeakPolarHBondContact O-CB 3.44Å; P163-E167 PolarHBondContact O-N 3.08Å; Q165-E167 VanDerWaalsContact C-N 3.33Å; E167-A170 PolarHBondContact O-N 3.47Å; E167-Q171 WeakPolarHBondContact O-CG 3.47Å; E167-Q171 PolarHBondContact O-N 2.86Å |
| 168 | T | 66 | Low | 56.9 | Low | 91 Ų | 91 | 109.9 Ų | 109.9 | 56% | 0.558 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -69.3 | -36.6 | 173.4 | 18.8 | 0 | 0 | 0 | 0 | 112.9 | S164 Q165 T172 | S164-T168 PolarHBondContact O-N 3.47Å; S164-T168 VanDerWaalsContact O-N 3.16Å; S164-T168 PolarHBondContact O-OG1 3.21Å; Q165-T168 WeakPolarHBondContact CA-OG1 3.43Å; Q165-T168 PolarHBondContact O-N 3.47Å; Q165-T168 PolarHBondContact O-OG1 3.06Å; T168-T172 PolarHBondContact O-N 3.41Å; T168-T172 VanDerWaalsContact O-N 3.16Å; T168-T172 PolarHBondContact O-OG1 3.28Å |
| 169 | C | 66.2 | Low | 56.5 | Low | 97 Ų | 97 | 104.1 Ų | 104.1 | 66% | 0.655 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -67.6 | -38.7 | 172.7 | -77 | 0 | 0 | 0 | 0 | 112.3 | Q165 I166 T172 | Q165-C169 WeakPolarHBondContact O-CB 3.42Å; Q165-C169 PolarHBondContact O-N 2.96Å; Q165-C169 PolarHBondContact O-SG 3.45Å; I166-C169 PolarHBondContact O-N 2.95Å; C169-T172 WeakPolarHBondContact O-CB 3.14Å; C169-T172 PolarHBondContact O-N 3.35Å |
| 170 | A | 64.3 | Low | 55.9 | Low | 77 Ų | 77 | 105.7 Ų | 105.7 | 64% | 0.636 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -69.2 | -33.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I166 E167 T172 | I166-A170 VanDerWaalsContact O-CB 3.28Å; I166-A170 WeakPolarHBondContact O-CB 3.15Å; I166-A170 PolarHBondContact O-N 2.93Å; E167-A170 PolarHBondContact O-N 3.47Å; A170-T172 VanDerWaalsContact C-N 3.29Å |
| 171 | Q | 58.9 | Low | 55.3 | Low | 152 Ų | 152 | 107.9 Ų | 107.9 | 71% | 0.71 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -77.3 | -13.7 | 173.2 | -68.4 | -154.8 | 24.4 | 0 | 0 | 113.8 | E167 S173 | E167-Q171 WeakPolarHBondContact O-CG 3.47Å; E167-Q171 PolarHBondContact O-N 2.86Å; Q171-S173 PolarHBondContact O-N 3.25Å |
| 172 | T | 56.5 | Low | 54.9 | Low | 101 Ų | 101 | 109.3 Ų | 109.3 | 62% | 0.62 | 65% | 0.652 | S | S | * | * | trans | -77.2 | 60.8 | 167.5 | -50.7 | 0 | 0 | 0 | 0 | 109.6 | T168 C169 A170 V174 | T168-T172 PolarHBondContact O-N 3.41Å; T168-T172 VanDerWaalsContact O-N 3.16Å; T168-T172 PolarHBondContact O-OG1 3.28Å; C169-T172 WeakPolarHBondContact O-CB 3.14Å; C169-T172 PolarHBondContact O-N 3.35Å; A170-T172 VanDerWaalsContact C-N 3.29Å; T172-V174 PolarHBondContact O-N 3.15Å; T172-V174 VanDerWaalsContact O-N 3.11Å | ||
| 173 | S | 45.3 | Very low | 54.8 | Low | 89 Ų | 89 | 108.6 Ų | 108.6 | 62% | 0.622 | 66% | 0.655 | S | S | * | * | trans | -68.2 | 106.3 | 165.6 | 64.4 | 0 | 0 | 0 | 0 | 108 | Q171 S175 | Q171-S173 PolarHBondContact O-N 3.25Å; S173-S175 PolarHBondContact O-N 2.97Å | ||
| 174 | V | 50.1 | Low | 54 | Low | 116 Ų | 116 | 110.3 Ų | 110.3 | 70% | 0.703 | 67% | 0.666 | S | S | * | * | trans | -67.9 | 80.3 | 160.9 | -73.3 | 0 | 0 | 0 | 0 | 107.6 | T172 L176 | T172-V174 PolarHBondContact O-N 3.15Å; T172-V174 VanDerWaalsContact O-N 3.11Å; V174-L176 PolarHBondContact O-N 2.93Å | ||
| 175 | S | 45.4 | Very low | 52.9 | Low | 102 Ų | 102 | 113.4 Ų | 113.4 | 71% | 0.713 | 68% | 0.682 | S | S | * | * | trans | -56.8 | 96 | 157.4 | -68.9 | 0 | 0 | 0 | 0 | 106 | S173 P177 | S173-S175 PolarHBondContact O-N 2.97Å; S175-P177 WeakPolarHBondContact O-CD 3.07Å | ||
| 176 | L | 39.8 | Very low | 51.3 | Low | 148 Ų | 148 | 114.7 Ų | 114.7 | 78% | 0.775 | 70% | 0.697 | S | S | * | * | trans | -65.9 | 111.2 | 167.5 | -79 | 114.8 | 0 | 0 | 0 | 106.4 | V174 T178 | V174-L176 PolarHBondContact O-N 2.93Å; L176-T178 PolarHBondContact O-N 2.97Å | ||
| 177 | P | 44.6 | Very low | 50.3 | Low | 108 Ų | 108 | 115.1 Ų | 115.1 | 70% | 0.701 | 71% | 0.707 | S | S | * | * | trans | -62.3 | 110.9 | 160.5 | 26.5 | -31.2 | 0 | 0 | 0 | 107 | S175 G179 | S175-P177 WeakPolarHBondContact O-CD 3.07Å; P177-G179 PolarHBondContact O-N 3.25Å | ||
| 178 | T | 50.3 | Low | 49.3 | Very low | 155 Ų | 155 | 117.1 Ų | 117.1 | 95% | 0.951 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -54 | 84.7 | 146.4 | 29.4 | 0 | 0 | 0 | 0 | 107.6 | L176 | L176-T178 PolarHBondContact O-N 2.97Š|
| 179 | G | 40.7 | Very low | 48.3 | Very low | 48 Ų | 48 | 118.7 Ų | 118.7 | 50% | 0.495 | 73% | 0.728 | S | S | . | * | S | Bend | trans | 169 | 89.9 | -171.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | P177 | P177-G179 PolarHBondContact O-N 3.25Š|
| 180 | Q | 41.5 | Very low | 47.9 | Very low | 166 Ų | 166 | 119.4 Ų | 119.4 | 78% | 0.776 | 73% | 0.729 | S | S | * | * | trans | -42.6 | 122.2 | 172.6 | 179.1 | -175.7 | -23.3 | 0 | 0 | 112.9 | T182 | Q180-T182 PolarHBondContact O-N 3.1Š| ||
| 181 | P | 38 | Very low | 46.6 | Very low | 123 Ų | 123 | 121.4 Ų | 121.4 | 80% | 0.799 | 74% | 0.738 | S | S | * | * | trans | -85 | 107.2 | 162.4 | 31.5 | -25.9 | 0 | 0 | 0 | 108.2 | ||||
| 182 | T | 52.2 | Low | 46 | Very low | 104 Ų | 104 | 118.9 Ų | 118.9 | 64% | 0.638 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 134.3 | 161.6 | 41 | 0 | 0 | 0 | 0 | 109.6 | Q180 | Q180-T182 PolarHBondContact O-N 3.1Š|
| 183 | P | 55.9 | Low | 45.4 | Very low | 112 Ų | 112 | 123.7 Ų | 123.7 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 152.2 | 168.8 | 29.3 | -32.7 | 0 | 0 | 0 | 111.1 | ||
| 184 | P | 48.9 | Very low | 45.3 | Very low | 124 Ų | 124 | 125.3 Ų | 125.3 | 81% | 0.805 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 135.2 | -177.9 | 27.5 | -33.1 | 0 | 0 | 0 | 112.2 | ||
| 185 | T | 39.9 | Very low | 44.9 | Very low | 137 Ų | 137 | 124.5 Ų | 124.5 | 84% | 0.84 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 129.3 | 173.2 | -63 | 0 | 0 | 0 | 0 | 112.3 | ||
| 186 | T | 38.8 | Very low | 45.1 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -114.9 | 143.4 | 158.9 | -68.7 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 187 | P | 50.3 | Low | 45.6 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | -79.1 | 158.6 | -147.1 | 31.6 | -33.7 | 0 | 0 | 0 | 114.8 | ||||
| 188 | E | 42.7 | Very low | 46 | Very low | 166 Ų | 166 | 134 Ų | 134 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | trans | -51.7 | 165 | -176 | -63.5 | -176.4 | 122.5 | 0 | 0 | 115.9 | ||||
| 189 | P | 45.1 | Very low | 45.9 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | -129 | 130.4 | 100.6 | 35.5 | -27.2 | 0 | 0 | 0 | 114.5 | |||||
| 190 | V | 56.2 | Low | 46 | Very low | 112 Ų | 112 | 136.4 Ų | 136.4 | 68% | 0.679 | 79% | 0.791 | S | S | * | * | trans | 3.4 | 115.6 | 153.6 | -63.5 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 191 | S | 37.2 | Very low | 46.5 | Very low | 120 Ų | 120 | 141.2 Ų | 141.2 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -168.5 | 110.3 | 130.2 | -94.6 | 0 | 0 | 0 | 0 | 111.5 | K193 | S191-K193 PolarHBondContact O-N 3.48Š| ||
| 192 | A | 47.2 | Very low | 46.8 | Very low | 98 Ų | 98 | 143.1 Ų | 143.1 | 81% | 0.81 | 80% | 0.801 | S | S | * | * | trans | -57.9 | 128.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 193 | K | 43.3 | Very low | 46.8 | Very low | 202 Ų | 202 | 148.9 Ų | 148.9 | 88% | 0.878 | 82% | 0.817 | S | S | * | * | trans | -161.8 | 118.7 | 140.7 | -99.6 | 154.5 | -164.9 | -175.6 | 0 | 109.1 | S191 | S191-K193 PolarHBondContact O-N 3.48Š| ||
| 194 | S | 44 | Very low | 46.4 | Very low | 123 Ų | 123 | 145.6 Ų | 145.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -41 | 125.7 | -176.9 | 51.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 195 | S | 40.9 | Very low | 46.6 | Very low | 99 Ų | 99 | 149.9 Ų | 149.9 | 69% | 0.692 | 81% | 0.809 | S | S | * | * | trans | -121.7 | 117 | 165.3 | -157 | 0 | 0 | 0 | 0 | 108.3 | R197 | S195-R197 VanDerWaalsContact C-N 3.33Å; S195-R197 PolarHBondContact O-N 3.36Å | ||
| 196 | P | 50.7 | Low | 47.5 | Very low | 131 Ų | 131 | 151.2 Ų | 151.2 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | -80.8 | 84.8 | 178.1 | 31.5 | -29.6 | 0 | 0 | 0 | 109.2 | K198 | P196-K198 PolarHBondContact O-N 2.98Š| ||
| 197 | R | 50.1 | Low | 48.8 | Very low | 233 Ų | 233 | 150.7 Ų | 150.7 | 88% | 0.879 | 81% | 0.805 | S | S | * | * | trans | -81.4 | 90.6 | 159.6 | -83.3 | -165.9 | -84.4 | -167.5 | -5.8 | 109 | S195 | S195-R197 VanDerWaalsContact C-N 3.33Å; S195-R197 PolarHBondContact O-N 3.36Å | ||
| 198 | K | 53 | Low | 49.9 | Very low | 194 Ų | 194 | 149.2 Ų | 149.2 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -175.9 | 105.8 | 152.4 | -114.6 | -176 | 178.5 | -177.3 | 0 | 110.4 | P196 | P196-K198 PolarHBondContact O-N 2.98Š| ||
| 199 | M | 46.3 | Very low | 51.9 | Low | 191 Ų | 191 | 146 Ų | 146 | 94% | 0.941 | 78% | 0.781 | S | S | * | * | trans | -156.7 | 93.9 | 143.2 | -72.9 | -51 | -101.6 | 0 | 0 | 103.9 | ||||
| 200 | G | 44 | Very low | 54 | Low | 63 Ų | 63 | 148.5 Ų | 148.5 | 65% | 0.649 | 78% | 0.775 | S | S | * | * | 90.5 | 94.7 | 84 | 0 | 0 | 0 | 0 | 0 | 107.8 | E202 | G200-E202 PolarHBondContact O-N 3.15Š| |||
| 201 | R | 50.8 | Low | 55.6 | Low | 266 Ų | 266 | 150.8 Ų | 150.8 | 100% | 1.004 | 78% | 0.776 | S | S | * | * | trans | -60.5 | 87.3 | 157.5 | -84.9 | -174.4 | 173.4 | -156.2 | 0.2 | 106.4 | ||||
| 202 | E | 45.3 | Very low | 58.3 | Low | 164 Ų | 164 | 147 Ų | 147 | 77% | 0.766 | 75% | 0.75 | S | S | * | * | trans | -118 | 116.3 | 164.2 | -147.6 | -174 | 177.2 | 0 | 0 | 107.5 | G200 G204 | G200-E202 PolarHBondContact O-N 3.15Å; E202-G204 PolarHBondContact O-N 3.12Å | ||
| 203 | K | 52.3 | Low | 60.6 | Low | 224 Ų | 224 | 146.5 Ų | 146.5 | 97% | 0.974 | 74% | 0.736 | S | S | * | * | trans | -68 | 65.6 | 172.6 | -171.5 | 167.6 | 177.4 | 176.4 | 0 | 108.1 | ||||
| 204 | G | 47.7 | Very low | 63 | Low | 43 Ų | 43 | 141.9 Ų | 141.9 | 44% | 0.443 | 72% | 0.718 | S | S | . | * | trans | -107.8 | 125.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | E202 K206 | E202-G204 PolarHBondContact O-N 3.12Å; G204-K206 PolarHBondContact O-N 3.48Å | ||
| 205 | K | 53.7 | Low | 65.5 | Low | 215 Ų | 215 | 139.3 Ų | 139.3 | 94% | 0.935 | 69% | 0.69 | S | S | * | * | trans | -60.2 | 80.1 | 168.2 | -66.7 | 168.9 | 177.3 | 176.9 | 0 | 108.5 | S207 | K205-S207 VanDerWaalsContact C-N 3.32Å; K205-S207 PolarHBondContact O-N 3.24Å | ||
| 206 | K | 59 | Low | 68.2 | Low | 165 Ų | 165 | 141.9 Ų | 141.9 | 72% | 0.717 | 68% | 0.684 | S | S | * | * | trans | -72.3 | 96.9 | 168 | -60.7 | 177.6 | -173.9 | -177.5 | 0 | 104.7 | G204 V208 | G204-K206 PolarHBondContact O-N 3.48Å; K206-V208 VanDerWaalsContact C-N 3.27Å; K206-V208 PolarHBondContact O-N 2.85Å | ||
| 207 | S | 64.8 | Low | 70.4 | Confident | 116 Ų | 116 | 141.1 Ų | 141.1 | 81% | 0.811 | 67% | 0.669 | S | S | * | * | trans | -54.4 | 100.7 | 165.8 | 44.1 | 0 | 0 | 0 | 0 | 106.5 | K205 D209 | K205-S207 VanDerWaalsContact C-N 3.32Å; K205-S207 PolarHBondContact O-N 3.24Å; S207-D209 PolarHBondContact O-N 3.49Å; S207-D209 VanDerWaalsContact O-N 3.15Å | ||
| 208 | V | 73.4 | Confident | 72.6 | Confident | 84 Ų | 84 | 136 Ų | 136 | 51% | 0.509 | 65% | 0.65 | S | S | . | * | trans | -66.8 | 118.9 | 176.7 | 177.4 | 0 | 0 | 0 | 0 | 105.9 | K206 R210 Y215 | K206-V208 VanDerWaalsContact C-N 3.27Å; K206-V208 PolarHBondContact O-N 2.85Å; V208-R210 PolarHBondContact O-N 3.43Å; V208-Y215 HydrophobicContact CB-CD2 4.43Å; V208-Y215 HydrophobicContact CG1-CD2 3.58Å; V208-Y215 HydrophobicContact CG1-CG 4.11Å | ||
| 209 | D | 85.6 | Confident | 74.8 | Confident | 98 Ų | 98 | 132.2 Ų | 132.2 | 52% | 0.524 | 63% | 0.63 | S | S | . | * | trans | -56.8 | 115.8 | 174 | 171.4 | 19.7 | 0 | 0 | 0 | 109.1 | S207 F211 S212 Y215 | S207-D209 PolarHBondContact O-N 3.49Å; S207-D209 VanDerWaalsContact O-N 3.15Å; D209-F211 PolarHBondContact O-N 2.87Å; D209-F211 PolarHBondContact OD1-N 2.86Å; D209-S212 VanDerWaalsContact O-CB 3.27Å; D209-S212 WeakPolarHBondContact O-CB 3.37Å; D209-S212 PolarHBondContact O-N 3.39Å; D209-S212 VanDerWaalsContact O-N 3.15Å; D209-S212 PolarHBondContact OD2-N 3.3Å; D209-Y215 WeakPolarHBondContact O-CB 3.24Å | ||
| 210 | R | 87.7 | Confident | 77.2 | Confident | 177 Ų | 177 | 127.4 Ų | 127.4 | 67% | 0.668 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -22.8 | -175.3 | -172.1 | 173.9 | -179.5 | 174.8 | -0.8 | 112.3 | V208 Y215 | V208-R210 PolarHBondContact O-N 3.43Å; R210-Y215 HydrophobicContact CG-CD1 4.39Å; R210-Y215 HydrophobicContact CG-CE1 3.85Å; R210-Y215 WeakPolarHBondContact O-CD1 3.2Å |
| 211 | F | 89.8 | Confident | 79.8 | Confident | 161 Ų | 161 | 131.6 Ų | 131.6 | 71% | 0.706 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -7 | -178.7 | -57.8 | -74.3 | 0 | 0 | 0 | 113.4 | D209 V213 R216 | D209-F211 PolarHBondContact O-N 2.87Å; D209-F211 PolarHBondContact OD1-N 2.86Å; F211-V213 PolarHBondContact O-N 3.23Å; F211-R216 PolarHBondContact O-NE 2.98Å; F211-R216 PolarHBondContact O-NH2 2.88Å; F211-R216 VanDerWaalsContact O-NH2 3.08Å |
| 212 | S | 95.4 | Very high | 82.1 | Confident | 40 Ų | 40 | 122.6 Ų | 122.6 | 28% | 0.28 | 57% | 0.574 | S | S | . | * | trans | -54.4 | 137.5 | 174.3 | 175.5 | 0 | 0 | 0 | 0 | 111.2 | D209 E214 Y215 R216 | D209-S212 VanDerWaalsContact O-CB 3.27Å; D209-S212 WeakPolarHBondContact O-CB 3.37Å; D209-S212 PolarHBondContact O-N 3.39Å; D209-S212 VanDerWaalsContact O-N 3.15Å; D209-S212 PolarHBondContact OD2-N 3.3Å; S212-E214 PolarHBondContact O-N 3.05Å; S212-E214 PolarHBondContact OG-N 3.41Å; S212-Y215 PolarHBondContact O-N 2.97Å; S212-Y215 VanDerWaalsContact O-N 3.15Å; S212-R216 PolarHBondContact O-N 2.95Å; S212-R216 VanDerWaalsContact O-N 3.09Å | ||
| 213 | V | 94.2 | Very high | 84.6 | Confident | 88 Ų | 88 | 117.8 Ų | 117.8 | 53% | 0.533 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -57.2 | -37.4 | 177.1 | 176.6 | 0 | 0 | 0 | 0 | 110.6 | F211 R216 Q217 | F211-V213 PolarHBondContact O-N 3.23Å; V213-R216 PolarHBondContact O-N 3.44Å; V213-Q217 WeakPolarHBondContact O-CG 3.44Å; V213-Q217 PolarHBondContact O-N 3.04Å |
| 214 | E | 95 | Very high | 86.8 | Confident | 104 Ų | 104 | 111.4 Ų | 111.4 | 49% | 0.486 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.9 | -43.6 | 178 | -167.1 | -167 | 177.5 | 0 | 0 | 112 | S212 R216 Q217 R218 | S212-E214 PolarHBondContact O-N 3.05Å; S212-E214 PolarHBondContact OG-N 3.41Å; E214-R216 PolarHBondContact O-N 3.28Å; E214-Q217 PolarHBondContact O-N 3.4Å; E214-R218 WeakPolarHBondContact O-CG 3.23Å; E214-R218 PolarHBondContact O-N 3.16Å; E214-R218 IonicContact OE1-CZ 3.28Å; E214-R218 IonicContact OE1-NE 2.6Å; E214-R218 PolarHBondContact OE1-NE 3.24Å; E214-R218 IonicContact OE1-NH2 3.18Å; E214-R218 PolarHBondContact OE1-NH2 3.24Å |
| 215 | Y | 96.1 | Very high | 89.3 | Confident | 69 Ų | 69 | 111.9 Ų | 111.9 | 27% | 0.271 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 176.7 | 176.4 | -95.7 | 0 | 0 | 0 | 111 | V208 D209 R210 S212 Q217 R218 R219 | V208-Y215 HydrophobicContact CB-CD2 4.43Å; V208-Y215 HydrophobicContact CG1-CD2 3.58Å; V208-Y215 HydrophobicContact CG1-CG 4.11Å; D209-Y215 WeakPolarHBondContact O-CB 3.24Å; R210-Y215 HydrophobicContact CG-CD1 4.39Å; R210-Y215 HydrophobicContact CG-CE1 3.85Å; R210-Y215 WeakPolarHBondContact O-CD1 3.2Å; S212-Y215 PolarHBondContact O-N 2.97Å; S212-Y215 VanDerWaalsContact O-N 3.15Å; Y215-Q217 PolarHBondContact O-N 3.48Å; Y215-R218 PolarHBondContact O-N 2.91Å; Y215-R219 HydrophobicContact CD1-CG 4.02Å; Y215-R219 HydrophobicContact CD2-CG 4.43Å; Y215-R219 HydrophobicContact CE1-CG 3.56Å; Y215-R219 HydrophobicContact CE2-CG 4.03Å; Y215-R219 HydrophobicContact CG-CG 4.45Å; Y215-R219 WeakPolarHBondContact O-CG 3.48Å; Y215-R219 PolarHBondContact O-N 3.02Å |
| 216 | R | 96.4 | Very high | 91.4 | Very high | 154 Ų | 154 | 104.8 Ų | 104.8 | 58% | 0.581 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -57.8 | -46.9 | 176.6 | -80.6 | -173.9 | -83 | 175 | -7.6 | 112.3 | F211 S212 V213 E214 R218 R219 E220 | F211-R216 PolarHBondContact O-NE 2.98Å; F211-R216 PolarHBondContact O-NH2 2.88Å; F211-R216 VanDerWaalsContact O-NH2 3.08Å; S212-R216 PolarHBondContact O-N 2.95Å; S212-R216 VanDerWaalsContact O-N 3.09Å; V213-R216 PolarHBondContact O-N 3.44Å; E214-R216 PolarHBondContact O-N 3.28Å; R216-R218 PolarHBondContact O-N 2.75Å; R216-R219 PolarHBondContact O-N 3.32Å; R216-E220 PolarHBondContact O-N 2.88Å |
| 217 | Q | 97.2 | Very high | 93.3 | Very high | 114 Ų | 114 | 103.5 Ų | 103.5 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.7 | -40.2 | 177.2 | -71.4 | 179.5 | 19 | 0 | 0 | 112.7 | V213 E214 Y215 E220 R221 | V213-Q217 WeakPolarHBondContact O-CG 3.44Å; V213-Q217 PolarHBondContact O-N 3.04Å; E214-Q217 PolarHBondContact O-N 3.4Å; Y215-Q217 PolarHBondContact O-N 3.48Å; Q217-E220 PolarHBondContact O-N 3.42Å; Q217-R221 WeakPolarHBondContact O-CG 3.4Å; Q217-R221 PolarHBondContact O-N 3.33Å |
| 218 | R | 97.4 | Very high | 94.9 | Very high | 125 Ų | 125 | 105.7 Ų | 105.7 | 47% | 0.472 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 175.6 | -73.6 | 175.9 | -175.7 | -165.2 | 0.6 | 111.5 | E214 Y215 R216 N222 | E214-R218 WeakPolarHBondContact O-CG 3.23Å; E214-R218 PolarHBondContact O-N 3.16Å; E214-R218 IonicContact OE1-CZ 3.28Å; E214-R218 IonicContact OE1-NE 2.6Å; E214-R218 PolarHBondContact OE1-NE 3.24Å; E214-R218 IonicContact OE1-NH2 3.18Å; E214-R218 PolarHBondContact OE1-NH2 3.24Å; Y215-R218 PolarHBondContact O-N 2.91Å; R216-R218 PolarHBondContact O-N 2.75Å; R218-N222 WeakPolarHBondContact O-CB 3.5Å; R218-N222 PolarHBondContact O-N 3.23Å |
| 219 | R | 98.1 | Very high | 96.2 | Very high | 115 Ų | 115 | 105.6 Ų | 105.6 | 43% | 0.434 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65 | -42.2 | 176.6 | -69.9 | -60.3 | -62.5 | 170.2 | -0.8 | 111.8 | Y215 R216 N222 N223 | Y215-R219 HydrophobicContact CD1-CG 4.02Å; Y215-R219 HydrophobicContact CD2-CG 4.43Å; Y215-R219 HydrophobicContact CE1-CG 3.56Å; Y215-R219 HydrophobicContact CE2-CG 4.03Å; Y215-R219 HydrophobicContact CG-CG 4.45Å; Y215-R219 WeakPolarHBondContact O-CG 3.48Å; Y215-R219 PolarHBondContact O-N 3.02Å; R216-R219 PolarHBondContact O-N 3.32Å; R219-N222 PolarHBondContact O-N 2.94Å; R219-N223 WeakPolarHBondContact O-CB 3.44Å; R219-N223 PolarHBondContact O-N 2.92Å; R219-N223 PolarHBondContact O-ND2 3.43Å |
| 220 | E | 97.9 | Very high | 96.8 | Very high | 91 Ų | 91 | 108.7 Ų | 108.7 | 43% | 0.425 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 177.7 | -171.9 | 52.5 | -138.8 | 0 | 0 | 111.5 | R216 Q217 N222 N223 I224 R227 | R216-E220 PolarHBondContact O-N 2.88Å; Q217-E220 PolarHBondContact O-N 3.42Å; E220-N222 VanDerWaalsContact C-N 3.3Å; E220-N222 PolarHBondContact O-N 2.98Å; E220-N223 PolarHBondContact O-N 2.9Å; E220-I224 HydrophobicContact CG-CD1 4.21Å; E220-I224 WeakPolarHBondContact O-CG1 3.42Å; E220-I224 PolarHBondContact O-N 3Å; E220-R227 IonicContact OE1-NH2 3.91Å; E220-R227 PolarHBondContact OE1-NH2 3.45Å |
| 221 | R | 98.7 | Very high | 97.3 | Very high | 151 Ų | 151 | 104.2 Ų | 104.2 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -58.2 | -42.3 | 174 | -75.7 | -174.1 | -78.2 | 116.7 | -11.6 | 112.4 | Q217 I224 A225 | Q217-R221 WeakPolarHBondContact O-CG 3.4Å; Q217-R221 PolarHBondContact O-N 3.33Å; R221-I224 PolarHBondContact O-N 3.01Å; R221-A225 WeakPolarHBondContact O-CB 3.42Å; R221-A225 PolarHBondContact O-N 3.29Å |
| 222 | N | 98.6 | Very high | 97.7 | Very high | 76 Ų | 76 | 103.8 Ų | 103.8 | 41% | 0.406 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -42.7 | 177.1 | -177.6 | -109 | 0 | 0 | 0 | 111.9 | R218 R219 E220 I224 A225 V226 | R218-N222 WeakPolarHBondContact O-CB 3.5Å; R218-N222 PolarHBondContact O-N 3.23Å; R219-N222 PolarHBondContact O-N 2.94Å; E220-N222 VanDerWaalsContact C-N 3.3Å; E220-N222 PolarHBondContact O-N 2.98Å; N222-I224 VanDerWaalsContact C-N 3.3Å; N222-I224 PolarHBondContact O-N 2.87Å; N222-A225 PolarHBondContact O-N 3.28Å; N222-A225 VanDerWaalsContact O-N 3.15Å; N222-V226 VanDerWaalsContact O-CG2 3.3Å; N222-V226 WeakPolarHBondContact O-CG2 3.4Å; N222-V226 PolarHBondContact O-N 3.07Å |
| 223 | N | 98.7 | Very high | 97.9 | Very high | 63 Ų | 63 | 104.4 Ų | 104.4 | 34% | 0.337 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.9 | -41.3 | 176.1 | -70.2 | -19.8 | 0 | 0 | 0 | 111.6 | R219 E220 V226 R227 | R219-N223 WeakPolarHBondContact O-CB 3.44Å; R219-N223 PolarHBondContact O-N 2.92Å; R219-N223 PolarHBondContact O-ND2 3.43Å; E220-N223 PolarHBondContact O-N 2.9Å; N223-V226 PolarHBondContact O-N 3.2Å; N223-R227 WeakPolarHBondContact O-CG 3.41Å; N223-R227 PolarHBondContact O-N 2.91Å |
| 224 | I | 98.6 | Very high | 98.1 | Very high | 90 Ų | 90 | 105.8 Ų | 105.8 | 46% | 0.462 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.9 | -47 | 173.8 | -65.2 | 165.4 | 0 | 0 | 0 | 110.6 | E220 R221 N222 V226 R227 K228 | E220-I224 HydrophobicContact CG-CD1 4.21Å; E220-I224 WeakPolarHBondContact O-CG1 3.42Å; E220-I224 PolarHBondContact O-N 3Å; R221-I224 PolarHBondContact O-N 3.01Å; N222-I224 VanDerWaalsContact C-N 3.3Å; N222-I224 PolarHBondContact O-N 2.87Å; I224-V226 VanDerWaalsContact C-N 3.33Å; I224-V226 PolarHBondContact O-N 3.03Å; I224-R227 PolarHBondContact O-N 2.81Å; I224-K228 WeakPolarHBondContact O-CB 3.07Å; I224-K228 PolarHBondContact O-N 3.48Å |
| 225 | A | 98.7 | Very high | 98.3 | Very high | 53 Ų | 53 | 108 Ų | 108 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.5 | -40.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | R221 N222 K228 S229 | R221-A225 WeakPolarHBondContact O-CB 3.42Å; R221-A225 PolarHBondContact O-N 3.29Å; N222-A225 PolarHBondContact O-N 3.28Å; N222-A225 VanDerWaalsContact O-N 3.15Å; A225-K228 PolarHBondContact O-N 2.96Å; A225-S229 VanDerWaalsContact O-CB 3.32Å; A225-S229 WeakPolarHBondContact O-CB 3.26Å; A225-S229 PolarHBondContact O-N 3.49Å |
| 226 | V | 98.9 | Very high | 98.4 | Very high | 67 Ų | 67 | 113.6 Ų | 113.6 | 41% | 0.406 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.4 | -47 | 176.2 | 170.3 | 0 | 0 | 0 | 0 | 110.6 | N222 N223 I224 K228 S229 R230 | N222-V226 VanDerWaalsContact O-CG2 3.3Å; N222-V226 WeakPolarHBondContact O-CG2 3.4Å; N222-V226 PolarHBondContact O-N 3.07Å; N223-V226 PolarHBondContact O-N 3.2Å; I224-V226 VanDerWaalsContact C-N 3.33Å; I224-V226 PolarHBondContact O-N 3.03Å; V226-K228 PolarHBondContact O-N 3.33Å; V226-S229 PolarHBondContact O-N 2.92Å; V226-R230 HydrophobicContact CG1-CG 4.5Å; V226-R230 WeakPolarHBondContact O-CG 3.34Å; V226-R230 PolarHBondContact O-N 2.93Å |
| 227 | R | 98.8 | Very high | 98.5 | Very high | 138 Ų | 138 | 110.5 Ų | 110.5 | 52% | 0.521 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -56.1 | -51.3 | 174.8 | -76.9 | -175.6 | -81.8 | -159.2 | -0.6 | 111 | E220 N223 I224 S229 R230 D231 | E220-R227 IonicContact OE1-NH2 3.91Å; E220-R227 PolarHBondContact OE1-NH2 3.45Å; N223-R227 WeakPolarHBondContact O-CG 3.41Å; N223-R227 PolarHBondContact O-N 2.91Å; I224-R227 PolarHBondContact O-N 2.81Å; R227-S229 VanDerWaalsContact C-N 3.33Å; R227-S229 PolarHBondContact O-N 3.17Å; R227-R230 PolarHBondContact O-N 3.33Å; R227-R230 VanDerWaalsContact O-N 3.17Å; R227-D231 PolarHBondContact O-N 2.85Å |
| 228 | K | 98.8 | Very high | 98.6 | Very high | 162 Ų | 162 | 110.4 Ų | 110.4 | 70% | 0.704 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.4 | -41.6 | 177.5 | -172.6 | 175.7 | -177 | 176.6 | 0 | 112.8 | I224 A225 V226 K232 | I224-K228 WeakPolarHBondContact O-CB 3.07Å; I224-K228 PolarHBondContact O-N 3.48Å; A225-K228 PolarHBondContact O-N 2.96Å; V226-K228 PolarHBondContact O-N 3.33Å; K228-K232 WeakPolarHBondContact O-CB 3.43Å; K228-K232 PolarHBondContact O-N 2.96Å |
| 229 | S | 98.8 | Very high | 98.7 | Very high | 81 Ų | 81 | 109.9 Ų | 109.9 | 57% | 0.566 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -45 | 177.3 | -174.2 | 0 | 0 | 0 | 0 | 111.5 | A225 V226 R227 K232 A233 | A225-S229 VanDerWaalsContact O-CB 3.32Å; A225-S229 WeakPolarHBondContact O-CB 3.26Å; A225-S229 PolarHBondContact O-N 3.49Å; V226-S229 PolarHBondContact O-N 2.92Å; R227-S229 VanDerWaalsContact C-N 3.33Å; R227-S229 PolarHBondContact O-N 3.17Å; S229-K232 PolarHBondContact O-N 2.96Å; S229-A233 PolarHBondContact O-N 2.94Å |
| 230 | R | 98.9 | Very high | 98.7 | Very high | 164 Ų | 164 | 110 Ų | 110 | 62% | 0.619 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.9 | -44.7 | 176.4 | -70.9 | 178.6 | 73.4 | -179.6 | 3.3 | 111.8 | V226 R227 K232 A233 K234 | V226-R230 HydrophobicContact CG1-CG 4.5Å; V226-R230 WeakPolarHBondContact O-CG 3.34Å; V226-R230 PolarHBondContact O-N 2.93Å; R227-R230 PolarHBondContact O-N 3.33Å; R227-R230 VanDerWaalsContact O-N 3.17Å; R230-K232 VanDerWaalsContact C-N 3.33Å; R230-K232 PolarHBondContact O-N 3.18Å; R230-A233 PolarHBondContact O-N 3.25Å; R230-K234 WeakPolarHBondContact O-CG 3.48Å; R230-K234 PolarHBondContact O-N 2.96Å |
| 231 | D | 98.8 | Very high | 98.7 | Very high | 83 Ų | 83 | 111.1 Ų | 111.1 | 44% | 0.444 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.5 | -36.4 | 179.5 | -65.1 | -23.9 | 0 | 0 | 0 | 111.7 | R227 K234 R235 | R227-D231 PolarHBondContact O-N 2.85Å; D231-K234 PolarHBondContact O-N 3.01Å; D231-R235 WeakPolarHBondContact O-CB 3.38Å; D231-R235 PolarHBondContact O-N 3.46Å |
| 232 | K | 98.8 | Very high | 98.7 | Very high | 152 Ų | 152 | 108.6 Ų | 108.6 | 66% | 0.661 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.1 | -43.6 | 172.2 | -172.8 | 178.4 | -179 | -177.2 | 0 | 111.5 | K228 S229 R230 R235 R236 | K228-K232 WeakPolarHBondContact O-CB 3.43Å; K228-K232 PolarHBondContact O-N 2.96Å; S229-K232 PolarHBondContact O-N 2.96Å; R230-K232 VanDerWaalsContact C-N 3.33Å; R230-K232 PolarHBondContact O-N 3.18Å; K232-R235 PolarHBondContact O-N 2.98Å; K232-R236 WeakPolarHBondContact O-CB 3.29Å; K232-R236 PolarHBondContact O-N 3.21Å |
| 233 | A | 98.8 | Very high | 98.8 | Very high | 52 Ų | 52 | 109.8 Ų | 109.8 | 43% | 0.43 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.3 | -44.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | S229 R230 R235 R236 N237 | S229-A233 PolarHBondContact O-N 2.94Å; R230-A233 PolarHBondContact O-N 3.25Å; A233-R235 PolarHBondContact O-N 2.96Å; A233-R236 PolarHBondContact O-N 3.05Å; A233-N237 PolarHBondContact O-N 3.07Å |
| 234 | K | 98.8 | Very high | 98.8 | Very high | 118 Ų | 118 | 113 Ų | 113 | 51% | 0.513 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59 | -46.2 | 174.1 | -73 | 177.5 | 179.4 | 179.9 | 0 | 111.8 | R230 D231 N237 L238 | R230-K234 WeakPolarHBondContact O-CG 3.48Å; R230-K234 PolarHBondContact O-N 2.96Å; D231-K234 PolarHBondContact O-N 3.01Å; K234-N237 PolarHBondContact O-N 2.96Å; K234-L238 WeakPolarHBondContact O-CG 3.42Å; K234-L238 PolarHBondContact O-N 3.44Å |
| 235 | R | 98.7 | Very high | 98.8 | Very high | 149 Ų | 149 | 113.1 Ų | 113.1 | 56% | 0.562 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.4 | -46.5 | 177.3 | -172.4 | -178.3 | -62.5 | 127.8 | 4.8 | 111.5 | D231 K232 A233 N237 L238 E239 | D231-R235 WeakPolarHBondContact O-CB 3.38Å; D231-R235 PolarHBondContact O-N 3.46Å; K232-R235 PolarHBondContact O-N 2.98Å; A233-R235 PolarHBondContact O-N 2.96Å; R235-N237 VanDerWaalsContact C-N 3.28Å; R235-N237 PolarHBondContact O-N 3.28Å; R235-L238 PolarHBondContact O-N 3.43Å; R235-L238 VanDerWaalsContact O-N 3.16Å; R235-E239 WeakPolarHBondContact CD-OE1 3.34Å; R235-E239 HydrophobicContact CG-CG 4.27Å; R235-E239 VanDerWaalsContact CG-OE1 3.28Å; R235-E239 WeakPolarHBondContact CG-OE1 3.38Å; R235-E239 WeakPolarHBondContact O-CB 3.39Å; R235-E239 WeakPolarHBondContact O-CG 3.37Å; R235-E239 PolarHBondContact O-N 3.19Å |
| 236 | R | 98.7 | Very high | 98.8 | Very high | 188 Ų | 188 | 114.5 Ų | 114.5 | 71% | 0.709 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -57.5 | -41.3 | 176.5 | -174 | -174.8 | -179.3 | -167.3 | 0.3 | 112 | K232 A233 E239 M240 | K232-R236 WeakPolarHBondContact O-CB 3.29Å; K232-R236 PolarHBondContact O-N 3.21Å; A233-R236 PolarHBondContact O-N 3.05Å; R236-E239 PolarHBondContact O-N 3.41Å; R236-M240 WeakPolarHBondContact O-CB 3.28Å; R236-M240 PolarHBondContact O-N 3.39Å |
| 237 | N | 98.7 | Very high | 98.8 | Very high | 89 Ų | 89 | 115.5 Ų | 115.5 | 48% | 0.476 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.9 | -41.2 | 177.8 | -72.3 | -14.8 | 0 | 0 | 0 | 112.1 | A233 K234 R235 M240 Q241 | A233-N237 PolarHBondContact O-N 3.07Å; K234-N237 PolarHBondContact O-N 2.96Å; R235-N237 VanDerWaalsContact C-N 3.28Å; R235-N237 PolarHBondContact O-N 3.28Å; N237-M240 PolarHBondContact O-N 3.15Å; N237-Q241 WeakPolarHBondContact O-CG 3.48Å; N237-Q241 PolarHBondContact O-N 2.96Å |
| 238 | L | 98.8 | Very high | 98.8 | Very high | 112 Ų | 112 | 111.8 Ų | 111.8 | 59% | 0.586 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.7 | -44.5 | 175.2 | -69.5 | 171 | 0 | 0 | 0 | 111.9 | K234 R235 M240 Q241 Q242 | K234-L238 WeakPolarHBondContact O-CG 3.42Å; K234-L238 PolarHBondContact O-N 3.44Å; R235-L238 PolarHBondContact O-N 3.43Å; R235-L238 VanDerWaalsContact O-N 3.16Å; L238-M240 VanDerWaalsContact C-N 3.28Å; L238-M240 PolarHBondContact O-N 3.39Å; L238-Q241 PolarHBondContact O-N 3.34Å; L238-Q242 WeakPolarHBondContact O-CB 3.41Å; L238-Q242 PolarHBondContact O-N 3.41Å |
| 239 | E | 98.6 | Very high | 98.8 | Very high | 114 Ų | 114 | 107.7 Ų | 107.7 | 53% | 0.533 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59 | -40.3 | 175.3 | -73.8 | 168.2 | -178.9 | 0 | 0 | 111.4 | R235 R236 Q242 K243 | R235-E239 WeakPolarHBondContact CD-OE1 3.34Å; R235-E239 HydrophobicContact CG-CG 4.27Å; R235-E239 VanDerWaalsContact CG-OE1 3.28Å; R235-E239 WeakPolarHBondContact CG-OE1 3.38Å; R235-E239 WeakPolarHBondContact O-CB 3.39Å; R235-E239 WeakPolarHBondContact O-CG 3.37Å; R235-E239 PolarHBondContact O-N 3.19Å; R236-E239 PolarHBondContact O-N 3.41Å; E239-Q242 PolarHBondContact O-N 3.44Å; E239-K243 WeakPolarHBondContact O-CB 3.36Å; E239-K243 PolarHBondContact O-N 3.29Å |
| 240 | M | 98.8 | Very high | 98.7 | Very high | 117 Ų | 117 | 108.9 Ų | 108.9 | 58% | 0.576 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64 | -45.4 | 175.6 | 179.7 | 179.9 | 68.4 | 0 | 0 | 112.2 | R236 N237 L238 K243 M244 | R236-M240 WeakPolarHBondContact O-CB 3.28Å; R236-M240 PolarHBondContact O-N 3.39Å; N237-M240 PolarHBondContact O-N 3.15Å; L238-M240 VanDerWaalsContact C-N 3.28Å; L238-M240 PolarHBondContact O-N 3.39Å; M240-K243 PolarHBondContact O-N 2.93Å; M240-M244 PolarHBondContact O-N 3.49Å |
| 241 | Q | 98.8 | Very high | 98.7 | Very high | 115 Ų | 115 | 105.2 Ų | 105.2 | 54% | 0.537 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -44 | 175.6 | -73.2 | 176.7 | -11.2 | 0 | 0 | 111.5 | N237 L238 K243 M244 I245 | N237-Q241 WeakPolarHBondContact O-CG 3.48Å; N237-Q241 PolarHBondContact O-N 2.96Å; L238-Q241 PolarHBondContact O-N 3.34Å; Q241-K243 VanDerWaalsContact C-N 3.33Å; Q241-K243 PolarHBondContact O-N 3.02Å; Q241-M244 WeakPolarHBondContact O-CB 3.35Å; Q241-M244 PolarHBondContact O-N 2.82Å; Q241-I245 WeakPolarHBondContact O-CG1 3.36Å; Q241-I245 PolarHBondContact O-N 2.83Å; Q241-I245 VanDerWaalsContact O-N 3.15Å |
| 242 | Q | 98.8 | Very high | 98.7 | Very high | 98 Ų | 98 | 106 Ų | 106 | 46% | 0.458 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.5 | -44.6 | 175.4 | 179.9 | 58.7 | 32.3 | 0 | 0 | 111.3 | L238 E239 M244 I245 E246 | L238-Q242 WeakPolarHBondContact O-CB 3.41Å; L238-Q242 PolarHBondContact O-N 3.41Å; E239-Q242 PolarHBondContact O-N 3.44Å; Q242-M244 VanDerWaalsContact C-N 3.32Å; Q242-M244 PolarHBondContact O-N 3.19Å; Q242-I245 PolarHBondContact O-N 3.49Å; Q242-E246 WeakPolarHBondContact CG-OE1 3.36Å; Q242-E246 PolarHBondContact NE2-OE1 2.98Å; Q242-E246 WeakPolarHBondContact O-CG 3.41Å; Q242-E246 PolarHBondContact O-N 3.02Å |
| 243 | K | 98.8 | Very high | 98.7 | Very high | 100 Ų | 100 | 105.4 Ų | 105.4 | 44% | 0.435 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.6 | -36.2 | 178.4 | -172.3 | 57.4 | 177.2 | 172.4 | 0 | 112.6 | E239 M240 Q241 I245 E246 L247 | E239-K243 WeakPolarHBondContact O-CB 3.36Å; E239-K243 PolarHBondContact O-N 3.29Å; M240-K243 PolarHBondContact O-N 2.93Å; Q241-K243 VanDerWaalsContact C-N 3.33Å; Q241-K243 PolarHBondContact O-N 3.02Å; K243-I245 VanDerWaalsContact C-N 3.34Å; K243-E246 IonicContact NZ-OE2 3.05Å; K243-E246 PolarHBondContact O-N 3.37Å; K243-L247 HydrophobicContact CD-CD1 4.44Å; K243-L247 HydrophobicContact CD-CG 4.26Å; K243-L247 HydrophobicContact CG-CD1 4.08Å; K243-L247 HydrophobicContact CG-CG 4.36Å; K243-L247 WeakPolarHBondContact O-CB 3.47Å; K243-L247 VanDerWaalsContact O-CG 3.29Å; K243-L247 WeakPolarHBondContact O-CG 3.41Å; K243-L247 PolarHBondContact O-N 2.88Å |
| 244 | M | 98.8 | Very high | 98.7 | Very high | 132 Ų | 132 | 107.4 Ų | 107.4 | 65% | 0.65 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.5 | -44.8 | 174.2 | -177.2 | -173.3 | -73.8 | 0 | 0 | 111.2 | M240 Q241 Q242 L247 S248 | M240-M244 PolarHBondContact O-N 3.49Å; Q241-M244 WeakPolarHBondContact O-CB 3.35Å; Q241-M244 PolarHBondContact O-N 2.82Å; Q242-M244 VanDerWaalsContact C-N 3.32Å; Q242-M244 PolarHBondContact O-N 3.19Å; M244-L247 PolarHBondContact O-N 3.22Å; M244-S248 WeakPolarHBondContact O-CB 3.26Å; M244-S248 PolarHBondContact O-N 3.46Å |
| 245 | I | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 107.3 Ų | 107.3 | 47% | 0.467 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.2 | -45.4 | 177.2 | -64.7 | 166.2 | 0 | 0 | 0 | 110.7 | Q241 Q242 K243 L247 S248 N249 | Q241-I245 WeakPolarHBondContact O-CG1 3.36Å; Q241-I245 PolarHBondContact O-N 2.83Å; Q241-I245 VanDerWaalsContact O-N 3.15Å; Q242-I245 PolarHBondContact O-N 3.49Å; K243-I245 VanDerWaalsContact C-N 3.34Å; I245-L247 PolarHBondContact O-N 3.26Å; I245-S248 PolarHBondContact O-N 3.44Å; I245-N249 VanDerWaalsContact O-CG 3.26Å; I245-N249 PolarHBondContact O-N 3.26Å; I245-N249 PolarHBondContact O-ND2 2.99Å |
| 246 | E | 98.7 | Very high | 98.7 | Very high | 83 Ų | 83 | 106.5 Ų | 106.5 | 39% | 0.388 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.3 | -47.8 | 177.5 | -74.4 | 170.7 | -167.3 | 0 | 0 | 112.3 | Q242 K243 N249 E250 | Q242-E246 WeakPolarHBondContact CG-OE1 3.36Å; Q242-E246 PolarHBondContact NE2-OE1 2.98Å; Q242-E246 WeakPolarHBondContact O-CG 3.41Å; Q242-E246 PolarHBondContact O-N 3.02Å; K243-E246 IonicContact NZ-OE2 3.05Å; K243-E246 PolarHBondContact O-N 3.37Å; E246-N249 PolarHBondContact O-N 2.92Å; E246-E250 WeakPolarHBondContact O-CB 3.33Å; E246-E250 PolarHBondContact O-N 3.43Å |
| 247 | L | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 100.9 Ų | 100.9 | 46% | 0.461 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.4 | -38.6 | 178.1 | -71 | 173 | 0 | 0 | 0 | 111.8 | K243 M244 I245 E250 N251 | K243-L247 HydrophobicContact CD-CD1 4.44Å; K243-L247 HydrophobicContact CD-CG 4.26Å; K243-L247 HydrophobicContact CG-CD1 4.08Å; K243-L247 HydrophobicContact CG-CG 4.36Å; K243-L247 WeakPolarHBondContact O-CB 3.47Å; K243-L247 VanDerWaalsContact O-CG 3.29Å; K243-L247 WeakPolarHBondContact O-CG 3.41Å; K243-L247 PolarHBondContact O-N 2.88Å; M244-L247 PolarHBondContact O-N 3.22Å; I245-L247 PolarHBondContact O-N 3.26Å; L247-E250 PolarHBondContact O-N 3.43Å; L247-N251 VanDerWaalsContact O-CB 3.26Å; L247-N251 WeakPolarHBondContact O-CB 3.04Å; L247-N251 PolarHBondContact O-N 2.92Å |
| 248 | S | 98.7 | Very high | 98.7 | Very high | 60 Ų | 60 | 101.3 Ų | 101.3 | 42% | 0.42 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.6 | -47.5 | 174.4 | -168.3 | 0 | 0 | 0 | 0 | 111.2 | M244 I245 E250 N251 E252 | M244-S248 WeakPolarHBondContact O-CB 3.26Å; M244-S248 PolarHBondContact O-N 3.46Å; I245-S248 PolarHBondContact O-N 3.44Å; S248-E250 PolarHBondContact O-N 3.08Å; S248-N251 PolarHBondContact O-N 2.91Å; S248-E252 WeakPolarHBondContact O-CG 3.46Å; S248-E252 PolarHBondContact O-N 3.12Å |
| 249 | N | 98.8 | Very high | 98.7 | Very high | 76 Ų | 76 | 100.8 Ų | 100.8 | 41% | 0.406 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.8 | -39.3 | 178.2 | -69.6 | -25.7 | 0 | 0 | 0 | 112.4 | I245 E246 K253 | I245-N249 VanDerWaalsContact O-CG 3.26Å; I245-N249 PolarHBondContact O-N 3.26Å; I245-N249 PolarHBondContact O-ND2 2.99Å; E246-N249 PolarHBondContact O-N 2.92Å; N249-K253 VanDerWaalsContact O-CG 3.3Å; N249-K253 WeakPolarHBondContact O-CG 3.32Å; N249-K253 PolarHBondContact O-N 3.44Å; N249-K253 VanDerWaalsContact O-N 3.16Å |
| 250 | E | 98.7 | Very high | 98.7 | Very high | 106 Ų | 106 | 100 Ų | 100 | 50% | 0.495 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.5 | -42.4 | 175.7 | -173.8 | 169.8 | -166.1 | 0 | 0 | 111.4 | E246 L247 S248 E252 K253 L254 | E246-E250 WeakPolarHBondContact O-CB 3.33Å; E246-E250 PolarHBondContact O-N 3.43Å; L247-E250 PolarHBondContact O-N 3.43Å; S248-E250 PolarHBondContact O-N 3.08Å; E250-E252 PolarHBondContact O-N 2.89Å; E250-K253 WeakPolarHBondContact O-CB 3.3Å; E250-K253 PolarHBondContact O-N 3.14Å; E250-L254 HydrophobicContact CG-CD1 4.46Å; E250-L254 WeakPolarHBondContact O-CG 3.44Å; E250-L254 PolarHBondContact O-N 3.08Å |
| 251 | N | 98.6 | Very high | 98.7 | Very high | 86 Ų | 86 | 98.7 Ų | 98.7 | 46% | 0.46 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.6 | -44.6 | 177.5 | -161.1 | -3.8 | 0 | 0 | 0 | 111.6 | L247 S248 K253 L254 H255 | L247-N251 VanDerWaalsContact O-CB 3.26Å; L247-N251 WeakPolarHBondContact O-CB 3.04Å; L247-N251 PolarHBondContact O-N 2.92Å; S248-N251 PolarHBondContact O-N 2.91Å; N251-K253 VanDerWaalsContact C-N 3.3Å; N251-K253 PolarHBondContact O-N 3.04Å; N251-L254 PolarHBondContact O-N 3.4Å; N251-H255 PolarHBondContact O-CD2 3.45Å; N251-H255 VanDerWaalsContact O-CD2 3.22Å; N251-H255 PolarHBondContact O-N 3.03Å; N251-H255 PolarHBondContact OD1-CD2 3.09Å; N251-H255 PolarHBondContact OD1-NE2 3.5Å |
| 252 | E | 98.7 | Very high | 98.7 | Very high | 99 Ų | 99 | 96.7 Ų | 96.7 | 46% | 0.463 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -58.5 | -40.1 | 173.3 | -75.4 | 179.6 | -156 | 0 | 0 | 112.8 | S248 E250 H255 K256 | S248-E252 WeakPolarHBondContact O-CG 3.46Å; S248-E252 PolarHBondContact O-N 3.12Å; E250-E252 PolarHBondContact O-N 2.89Å; E252-H255 PolarHBondContact O-N 3.39Å; E252-K256 WeakPolarHBondContact O-CG 3.46Å; E252-K256 PolarHBondContact O-N 3.15Å |
| 253 | K | 98.8 | Very high | 98.7 | Very high | 140 Ų | 140 | 98.9 Ų | 98.9 | 61% | 0.609 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.3 | -44.6 | 175.7 | -72.7 | 170.2 | -175.5 | 176.8 | 0 | 111.2 | N249 E250 N251 H255 K256 T257 | N249-K253 VanDerWaalsContact O-CG 3.3Å; N249-K253 WeakPolarHBondContact O-CG 3.32Å; N249-K253 PolarHBondContact O-N 3.44Å; N249-K253 VanDerWaalsContact O-N 3.16Å; E250-K253 WeakPolarHBondContact O-CB 3.3Å; E250-K253 PolarHBondContact O-N 3.14Å; N251-K253 VanDerWaalsContact C-N 3.3Å; N251-K253 PolarHBondContact O-N 3.04Å; K253-H255 VanDerWaalsContact C-N 3.34Å; K253-H255 PolarHBondContact O-N 3.45Å; K253-K256 PolarHBondContact O-N 3.28Å; K253-T257 PolarHBondContact O-N 2.91Å; K253-T257 PolarHBondContact O-OG1 3.05Å; K253-T257 VanDerWaalsContact O-OG1 3.1Å |
| 254 | L | 98.8 | Very high | 98.7 | Very high | 95 Ų | 95 | 98.7 Ų | 98.7 | 50% | 0.497 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.2 | -44 | 176.8 | -69.9 | 173.2 | 0 | 0 | 0 | 111.2 | E250 N251 K256 T257 I258 | E250-L254 HydrophobicContact CG-CD1 4.46Å; E250-L254 WeakPolarHBondContact O-CG 3.44Å; E250-L254 PolarHBondContact O-N 3.08Å; N251-L254 PolarHBondContact O-N 3.4Å; L254-K256 VanDerWaalsContact C-N 3.35Å; L254-K256 PolarHBondContact O-N 3.37Å; L254-T257 PolarHBondContact O-N 3.3Å; L254-I258 VanDerWaalsContact O-CG1 3.31Å; L254-I258 WeakPolarHBondContact O-CG1 3.31Å; L254-I258 PolarHBondContact O-N 3.19Å |
| 255 | H | 98.7 | Very high | 98.6 | Very high | 116 Ų | 116 | 97 Ų | 97 | 54% | 0.537 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.4 | -43.7 | 174.7 | -81.3 | -62.4 | 0 | 0 | 0 | 112.5 | N251 E252 K253 T257 I258 E259 | N251-H255 PolarHBondContact O-CD2 3.45Å; N251-H255 VanDerWaalsContact O-CD2 3.22Å; N251-H255 PolarHBondContact O-N 3.03Å; N251-H255 PolarHBondContact OD1-CD2 3.09Å; N251-H255 PolarHBondContact OD1-NE2 3.5Å; E252-H255 PolarHBondContact O-N 3.39Å; K253-H255 VanDerWaalsContact C-N 3.34Å; K253-H255 PolarHBondContact O-N 3.45Å; H255-T257 PolarHBondContact O-N 3.36Å; H255-I258 PolarHBondContact O-N 3.44Å; H255-E259 WeakPolarHBondContact O-CB 3.24Å; H255-E259 PolarHBondContact O-N 3.15Å |
| 256 | K | 98.8 | Very high | 98.6 | Very high | 131 Ų | 131 | 96.6 Ų | 96.6 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.3 | -41.6 | 175.4 | -73.3 | 171.9 | -177.7 | 167.7 | 0 | 112.4 | E252 K253 L254 E259 Q260 | E252-K256 WeakPolarHBondContact O-CG 3.46Å; E252-K256 PolarHBondContact O-N 3.15Å; K253-K256 PolarHBondContact O-N 3.28Å; L254-K256 VanDerWaalsContact C-N 3.35Å; L254-K256 PolarHBondContact O-N 3.37Å; K256-E259 PolarHBondContact O-N 3.22Å; K256-Q260 WeakPolarHBondContact O-CB 3.48Å; K256-Q260 PolarHBondContact O-N 2.98Å |
| 257 | T | 98.6 | Very high | 98.5 | Very high | 71 Ų | 71 | 94.7 Ų | 94.7 | 44% | 0.436 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.5 | -44.8 | 175.9 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | K253 L254 H255 E259 Q260 L261 | K253-T257 PolarHBondContact O-N 2.91Å; K253-T257 PolarHBondContact O-OG1 3.05Å; K253-T257 VanDerWaalsContact O-OG1 3.1Å; L254-T257 PolarHBondContact O-N 3.3Å; H255-T257 PolarHBondContact O-N 3.36Å; T257-E259 PolarHBondContact O-N 2.97Å; T257-Q260 PolarHBondContact O-N 3.49Å; T257-L261 HydrophobicContact CG2-CD1 4.01Å; T257-L261 HydrophobicContact CG2-CG 4.44Å; T257-L261 WeakPolarHBondContact O-CG 3.43Å; T257-L261 PolarHBondContact O-N 2.89Å |
| 258 | I | 98.8 | Very high | 98.4 | Very high | 98 Ų | 98 | 95.1 Ų | 95.1 | 50% | 0.503 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.6 | -46.6 | 176.4 | -70.3 | 166.7 | 0 | 0 | 0 | 110.4 | L254 H255 Q260 L261 T262 | L254-I258 VanDerWaalsContact O-CG1 3.31Å; L254-I258 WeakPolarHBondContact O-CG1 3.31Å; L254-I258 PolarHBondContact O-N 3.19Å; H255-I258 PolarHBondContact O-N 3.44Å; I258-Q260 PolarHBondContact O-N 3.38Å; I258-L261 PolarHBondContact O-N 3.02Å; I258-T262 VanDerWaalsContact O-CB 3.23Å; I258-T262 WeakPolarHBondContact O-CB 3.46Å; I258-T262 PolarHBondContact O-N 3.07Å; I258-T262 PolarHBondContact O-OG1 3.48Å |
| 259 | E | 98.7 | Very high | 98.2 | Very high | 101 Ų | 101 | 101 Ų | 101 | 47% | 0.472 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.6 | -43.2 | 178.2 | -166.5 | -168 | 158.1 | 0 | 0 | 111.6 | H255 K256 T257 T262 R263 | H255-E259 WeakPolarHBondContact O-CB 3.24Å; H255-E259 PolarHBondContact O-N 3.15Å; K256-E259 PolarHBondContact O-N 3.22Å; T257-E259 PolarHBondContact O-N 2.97Å; E259-T262 PolarHBondContact O-N 3.24Å; E259-R263 WeakPolarHBondContact O-CG 3.36Å; E259-R263 PolarHBondContact O-N 3.45Å; E259-R263 IonicContact OE1-CZ 3.5Å; E259-R263 IonicContact OE1-NH1 2.7Å; E259-R263 PolarHBondContact OE1-NH1 3.18Å; E259-R263 IonicContact OE1-NH2 3.81Å |
| 260 | Q | 98.6 | Very high | 98 | Very high | 96 Ų | 96 | 101.3 Ų | 101.3 | 45% | 0.449 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.4 | -54.7 | 175.2 | 178.1 | -177.5 | -12.1 | 0 | 0 | 111.6 | K256 T257 I258 T262 R263 E264 | K256-Q260 WeakPolarHBondContact O-CB 3.48Å; K256-Q260 PolarHBondContact O-N 2.98Å; T257-Q260 PolarHBondContact O-N 3.49Å; I258-Q260 PolarHBondContact O-N 3.38Å; Q260-T262 PolarHBondContact O-N 3.07Å; Q260-R263 WeakPolarHBondContact O-CB 3.07Å; Q260-R263 PolarHBondContact O-N 3.34Å; Q260-R263 VanDerWaalsContact O-N 3.1Å; Q260-E264 WeakPolarHBondContact CG-OE1 3.44Å; Q260-E264 PolarHBondContact NE2-OE1 2.99Å; Q260-E264 PolarHBondContact O-N 3.36Å |
| 261 | L | 98.6 | Very high | 97.8 | Very high | 90 Ų | 90 | 102.1 Ų | 102.1 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.9 | -35.4 | -179.3 | -67.9 | 173.7 | 0 | 0 | 0 | 111.5 | T257 I258 E264 L265 | T257-L261 HydrophobicContact CG2-CD1 4.01Å; T257-L261 HydrophobicContact CG2-CG 4.44Å; T257-L261 WeakPolarHBondContact O-CG 3.43Å; T257-L261 PolarHBondContact O-N 2.89Å; I258-L261 PolarHBondContact O-N 3.02Å; L261-E264 PolarHBondContact O-N 3.28Å; L261-L265 WeakPolarHBondContact O-CB 3.39Å; L261-L265 VanDerWaalsContact O-CG 3.31Å; L261-L265 WeakPolarHBondContact O-CG 3.49Å; L261-L265 PolarHBondContact O-N 3.15Å |
| 262 | T | 98.4 | Very high | 97.6 | Very high | 74 Ų | 74 | 104.8 Ų | 104.8 | 45% | 0.454 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 175.7 | -59.4 | 0 | 0 | 0 | 0 | 111 | I258 E259 Q260 T266 | I258-T262 VanDerWaalsContact O-CB 3.23Å; I258-T262 WeakPolarHBondContact O-CB 3.46Å; I258-T262 PolarHBondContact O-N 3.07Å; I258-T262 PolarHBondContact O-OG1 3.48Å; E259-T262 PolarHBondContact O-N 3.24Å; Q260-T262 PolarHBondContact O-N 3.07Å; T262-T266 WeakPolarHBondContact O-CB 3.39Å; T262-T266 PolarHBondContact O-N 2.83Å; T262-T266 PolarHBondContact O-OG1 3.23Å |
| 263 | R | 98.4 | Very high | 97.2 | Very high | 143 Ų | 143 | 108 Ų | 108 | 54% | 0.54 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | 174 | -76.7 | -171 | -70.4 | -119.1 | -8 | 111.8 | E259 Q260 T266 G267 | E259-R263 WeakPolarHBondContact O-CG 3.36Å; E259-R263 PolarHBondContact O-N 3.45Å; E259-R263 IonicContact OE1-CZ 3.5Å; E259-R263 IonicContact OE1-NH1 2.7Å; E259-R263 PolarHBondContact OE1-NH1 3.18Å; E259-R263 IonicContact OE1-NH2 3.81Å; Q260-R263 WeakPolarHBondContact O-CB 3.07Å; Q260-R263 PolarHBondContact O-N 3.34Å; Q260-R263 VanDerWaalsContact O-N 3.1Å; R263-T266 PolarHBondContact O-N 3.44Å; R263-G267 PolarHBondContact O-N 2.6Å |
| 264 | E | 98.1 | Very high | 96.6 | Very high | 97 Ų | 97 | 108 Ų | 108 | 45% | 0.453 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.3 | -47.6 | 178.1 | -71.4 | 176.5 | -164.5 | 0 | 0 | 111.6 | Q260 L261 T266 G267 L268 | Q260-E264 WeakPolarHBondContact CG-OE1 3.44Å; Q260-E264 PolarHBondContact NE2-OE1 2.99Å; Q260-E264 PolarHBondContact O-N 3.36Å; L261-E264 PolarHBondContact O-N 3.28Å; E264-T266 VanDerWaalsContact C-N 3.34Å; E264-T266 PolarHBondContact O-N 3.02Å; E264-G267 PolarHBondContact O-N 2.86Å; E264-L268 WeakPolarHBondContact O-CG 3.41Å; E264-L268 PolarHBondContact O-N 2.73Å |
| 265 | L | 98.3 | Very high | 95.7 | Very high | 97 Ų | 97 | 108.2 Ų | 108.2 | 51% | 0.508 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 176.1 | -73.4 | 177 | 0 | 0 | 0 | 112.5 | L261 L268 R269 | L261-L265 WeakPolarHBondContact O-CB 3.39Å; L261-L265 VanDerWaalsContact O-CG 3.31Å; L261-L265 WeakPolarHBondContact O-CG 3.49Å; L261-L265 PolarHBondContact O-N 3.15Å; L265-L268 PolarHBondContact O-N 2.97Å; L265-R269 WeakPolarHBondContact O-CB 3.13Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.42Å; L265-R269 PolarHBondContact O-N 2.84Å |
| 266 | T | 97.6 | Very high | 94.6 | Very high | 81 Ų | 81 | 107.7 Ų | 107.7 | 50% | 0.497 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 176.8 | -56.8 | 0 | 0 | 0 | 0 | 110.6 | T262 R263 E264 L268 R269 E270 | T262-T266 WeakPolarHBondContact O-CB 3.39Å; T262-T266 PolarHBondContact O-N 2.83Å; T262-T266 PolarHBondContact O-OG1 3.23Å; R263-T266 PolarHBondContact O-N 3.44Å; E264-T266 VanDerWaalsContact C-N 3.34Å; E264-T266 PolarHBondContact O-N 3.02Å; T266-L268 PolarHBondContact O-N 3.41Å; T266-R269 PolarHBondContact O-N 3.16Å; T266-E270 WeakPolarHBondContact O-CB 3.49Å; T266-E270 PolarHBondContact O-N 2.72Å |
| 267 | G | 97.1 | Very high | 92.8 | Very high | 44 Ų | 44 | 107.1 Ų | 107.1 | 45% | 0.454 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.1 | -44.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | R263 E264 E270 F271 | R263-G267 PolarHBondContact O-N 2.6Å; E264-G267 PolarHBondContact O-N 2.86Å; G267-E270 PolarHBondContact O-N 3.36Å; G267-F271 WeakPolarHBondContact O-CB 3.27Å; G267-F271 PolarHBondContact O-N 3.16Å |
| 268 | L | 96.9 | Very high | 90.7 | Very high | 96 Ų | 96 | 107.8 Ų | 107.8 | 50% | 0.503 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.7 | -43.4 | 175.7 | -72.4 | 172.8 | 0 | 0 | 0 | 112.2 | E264 L265 T266 E270 F271 F272 | E264-L268 WeakPolarHBondContact O-CG 3.41Å; E264-L268 PolarHBondContact O-N 2.73Å; L265-L268 PolarHBondContact O-N 2.97Å; T266-L268 PolarHBondContact O-N 3.41Å; L268-E270 VanDerWaalsContact C-N 3.32Å; L268-E270 PolarHBondContact O-N 2.79Å; L268-F271 WeakPolarHBondContact O-CB 3.48Å; L268-F271 PolarHBondContact O-N 2.84Å; L268-F272 VanDerWaalsContact O-CD2 3.27Å; L268-F272 WeakPolarHBondContact O-CD2 3.48Å; L268-F272 PolarHBondContact O-N 2.84Å |
| 269 | R | 95.1 | Very high | 88.6 | Confident | 183 Ų | 183 | 108.9 Ų | 108.9 | 69% | 0.691 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.1 | -44 | 176 | -77.2 | 174.6 | 179.2 | 173.9 | 1 | 111.5 | L265 T266 F272 K273 | L265-R269 WeakPolarHBondContact O-CB 3.13Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.42Å; L265-R269 PolarHBondContact O-N 2.84Å; T266-R269 PolarHBondContact O-N 3.16Å; R269-F272 PolarHBondContact O-N 2.98Å; R269-K273 WeakPolarHBondContact O-CB 3.21Å; R269-K273 PolarHBondContact O-N 2.79Å |
| 270 | E | 94.5 | Very high | 86.5 | Confident | 84 Ų | 84 | 113.8 Ų | 113.8 | 39% | 0.393 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.5 | -40.1 | 178 | -172.5 | 56.3 | -153.1 | 0 | 0 | 111.4 | T266 G267 L268 F272 K273 Q274 | T266-E270 WeakPolarHBondContact O-CB 3.49Å; T266-E270 PolarHBondContact O-N 2.72Å; G267-E270 PolarHBondContact O-N 3.36Å; L268-E270 VanDerWaalsContact C-N 3.32Å; L268-E270 PolarHBondContact O-N 2.79Å; E270-F272 PolarHBondContact O-N 2.81Å; E270-K273 PolarHBondContact O-N 2.82Å; E270-Q274 WeakPolarHBondContact O-CG 3.36Å; E270-Q274 PolarHBondContact O-N 3.11Å; E270-Q274 PolarHBondContact OE1-NE2 3.44Å |
| 271 | F | 94.7 | Very high | 84.2 | Confident | 122 Ų | 122 | 114 Ų | 114 | 54% | 0.535 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -58.5 | -47.5 | 173.2 | 179 | -96.6 | 0 | 0 | 0 | 112.4 | G267 L268 K273 Q274 M275 | G267-F271 WeakPolarHBondContact O-CB 3.27Å; G267-F271 PolarHBondContact O-N 3.16Å; L268-F271 WeakPolarHBondContact O-CB 3.48Å; L268-F271 PolarHBondContact O-N 2.84Å; F271-K273 VanDerWaalsContact C-N 3.3Å; F271-K273 PolarHBondContact O-N 2.98Å; F271-Q274 PolarHBondContact O-N 3.3Å; F271-M275 HydrophobicContact CD1-CG 4.49Å; F271-M275 HydrophobicContact CE1-CG 4.17Å; F271-M275 HydrophobicContact CE1-SD 4.28Å; F271-M275 HydrophobicContact CZ-CG 4.44Å; F271-M275 HydrophobicContact CZ-SD 4.33Å; F271-M275 WeakPolarHBondContact O-CG 2.98Å; F271-M275 PolarHBondContact O-N 2.92Å; F271-M275 VanDerWaalsContact O-N 3.13Å |
| 272 | F | 92.8 | Very high | 82 | Confident | 142 Ų | 142 | 113.2 Ų | 113.2 | 62% | 0.623 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66.3 | -31.1 | 176.4 | -85 | -70.5 | 0 | 0 | 0 | 113.2 | L268 R269 E270 M275 | L268-F272 VanDerWaalsContact O-CD2 3.27Å; L268-F272 WeakPolarHBondContact O-CD2 3.48Å; L268-F272 PolarHBondContact O-N 2.84Å; R269-F272 PolarHBondContact O-N 2.98Å; E270-F272 PolarHBondContact O-N 2.81Å; F272-M275 PolarHBondContact O-N 3.45Å |
| 273 | K | 91.3 | Very high | 79.6 | Confident | 167 Ų | 167 | 115.3 Ų | 115.3 | 73% | 0.726 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -72.3 | -31.8 | 177.2 | -168.5 | -179 | 177.6 | -170.1 | 0 | 112.5 | R269 E270 F271 | R269-K273 WeakPolarHBondContact O-CB 3.21Å; R269-K273 PolarHBondContact O-N 2.79Å; E270-K273 PolarHBondContact O-N 2.82Å; F271-K273 VanDerWaalsContact C-N 3.3Å; F271-K273 PolarHBondContact O-N 2.98Å |
| 274 | Q | 86.3 | Confident | 77.4 | Confident | 139 Ų | 139 | 113.4 Ų | 113.4 | 65% | 0.65 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -81.2 | -18.7 | 176.1 | -68.6 | 178.7 | 24.3 | 0 | 0 | 113.1 | E270 F271 P276 | E270-Q274 WeakPolarHBondContact O-CG 3.36Å; E270-Q274 PolarHBondContact O-N 3.11Å; E270-Q274 PolarHBondContact OE1-NE2 3.44Å; F271-Q274 PolarHBondContact O-N 3.3Å; Q274-P276 WeakPolarHBondContact O-CD 3.28Å |
| 275 | M | 80.2 | Confident | 75.1 | Confident | 101 Ų | 101 | 114.4 Ų | 114.4 | 50% | 0.498 | 67% | 0.672 | S | S | . | * | S | Bend | trans | -66.4 | 125 | 172.8 | -75.8 | -109.9 | -71.5 | 0 | 0 | 110.5 | F271 F272 S277 | F271-M275 HydrophobicContact CD1-CG 4.49Å; F271-M275 HydrophobicContact CE1-CG 4.17Å; F271-M275 HydrophobicContact CE1-SD 4.28Å; F271-M275 HydrophobicContact CZ-CG 4.44Å; F271-M275 HydrophobicContact CZ-SD 4.33Å; F271-M275 WeakPolarHBondContact O-CG 2.98Å; F271-M275 PolarHBondContact O-N 2.92Å; F271-M275 VanDerWaalsContact O-N 3.13Å; F272-M275 PolarHBondContact O-N 3.45Å; M275-S277 PolarHBondContact O-N 3.28Å |
| 276 | P | 74.9 | Confident | 72.9 | Confident | 105 Ų | 105 | 115 Ų | 115 | 68% | 0.682 | 68% | 0.684 | S | S | * | * | trans | -57.9 | 137.1 | 174.3 | -20.1 | 30.6 | 0 | 0 | 0 | 110.4 | Q274 A278 | Q274-P276 WeakPolarHBondContact O-CD 3.28Å; P276-A278 PolarHBondContact O-N 3.05Å | ||
| 277 | S | 60.9 | Low | 70.7 | Confident | 119 Ų | 119 | 120.5 Ų | 120.5 | 83% | 0.832 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | 5.6 | 178.5 | 48.9 | 0 | 0 | 0 | 0 | 115.2 | M275 | M275-S277 PolarHBondContact O-N 3.28Š|
| 278 | A | 54.4 | Low | 68.5 | Low | 84 Ų | 84 | 122.5 Ų | 122.5 | 69% | 0.694 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -3.4 | -164.5 | 0 | 0 | 0 | 0 | 0 | 116 | P276 | P276-A278 PolarHBondContact O-N 3.05Š|
| 279 | S | 55.3 | Low | 66.3 | Low | 122 Ų | 122 | 133.2 Ų | 133.2 | 85% | 0.853 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -113.8 | -3.4 | -176.7 | -58.5 | 0 | 0 | 0 | 0 | 115.9 | ||
| 280 | F | 53.2 | Low | 64.8 | Low | 204 Ų | 204 | 130.8 Ų | 130.8 | 90% | 0.895 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -106.5 | -12.7 | 178.4 | -160.4 | -100.9 | 0 | 0 | 0 | 114.2 | G282 | F280-G282 PolarHBondContact O-N 2.84Å; F280-G282 VanDerWaalsContact O-N 3.16Å |
| 281 | A | 51.9 | Low | 63.3 | Low | 100 Ų | 100 | 133.2 Ų | 133.2 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -85.5 | 29.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 282 | G | 51.6 | Low | 61.5 | Low | 73 Ų | 73 | 133.8 Ų | 133.8 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -134.9 | 42.9 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | F280 | F280-G282 PolarHBondContact O-N 2.84Å; F280-G282 VanDerWaalsContact O-N 3.16Å |
| 283 | S | 49.1 | Very low | 59.7 | Low | 119 Ų | 119 | 133.4 Ų | 133.4 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -156.7 | 28.1 | 166.2 | -169.3 | 0 | 0 | 0 | 0 | 114.5 | ||
| 284 | A | 50.8 | Low | 57.7 | Low | 103 Ų | 103 | 131.3 Ų | 131.3 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | trans | -130.9 | 58.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 285 | S | 49.3 | Very low | 55.8 | Low | 118 Ų | 118 | 130.7 Ų | 130.7 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | trans | -155.1 | 73.9 | 167.2 | 67.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 286 | S | 52.1 | Low | 54.1 | Low | 108 Ų | 108 | 132.9 Ų | 132.9 | 76% | 0.755 | 84% | 0.844 | S | S | * | * | trans | -176.9 | 116.4 | 151.5 | 52.6 | 0 | 0 | 0 | 0 | 103.8 | ||||
| 287 | E | 53.2 | Low | 52.5 | Low | 197 Ų | 197 | 135 Ų | 135 | 92% | 0.921 | 86% | 0.857 | S | S | * | * | 177.7 | 139.9 | 67.8 | -153.8 | 164.4 | 150.8 | 0 | 0 | 106.3 | |||||
| 288 | G | 49 | Very low | 51.8 | Low | 86 Ų | 86 | 136.3 Ų | 136.3 | 89% | 0.887 | 86% | 0.859 | S | S | * | * | trans | 159.3 | 70.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 289 | R | 51.1 | Low | 51.5 | Low | 322 Ų | 322 | 141.1 Ų | 141.1 | 100% | 1.215 | 87% | 0.874 | S | S | * | * | trans | -113.4 | 0 | 165.4 | -161.1 | -175.1 | -166.1 | -157 | 4.3 | 108.6 |
Retrieved 289 of 289 residues in 35.4 ms
(Link to these results)