| 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 | 42.2 | Very low | 50.2 | Low | 241 Ų | 241 | 143.5 Ų | 143.5 | 100% | 1.187 | 80% | 0.802 | S | S | * | * | 0 | 110.4 | 0 | -61.4 | -170.5 | 177.5 | 0 | 0 | 106.9 | |||||
| 2 | S | 40.2 | Very low | 50.7 | Low | 119 Ų | 119 | 140.6 Ų | 140.6 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -139.6 | 109.4 | 178 | -54.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 3 | L | 47.7 | Very low | 51.3 | Low | 179 Ų | 179 | 143.1 Ų | 143.1 | 94% | 0.937 | 79% | 0.787 | S | S | * | * | trans | -89.7 | 109.5 | 178.5 | -67.1 | 168.4 | 0 | 0 | 0 | 108.3 | N5 | L3-N5 PolarHBondContact O-N 3.36Š| ||
| 4 | T | 52.6 | Low | 52.4 | Low | 125 Ų | 125 | 139.7 Ų | 139.7 | 77% | 0.767 | 77% | 0.768 | S | S | * | * | trans | -78 | 111.4 | 171.3 | 52.6 | 0 | 0 | 0 | 0 | 109.1 | T6 | T4-T6 PolarHBondContact O-N 2.91Š| ||
| 5 | N | 42.7 | Very low | 53.5 | Low | 166 Ų | 166 | 138.2 Ų | 138.2 | 89% | 0.888 | 76% | 0.757 | S | S | * | * | trans | -75.7 | 106.1 | -179 | -151.2 | -23.6 | 0 | 0 | 0 | 109.6 | L3 K7 | L3-N5 PolarHBondContact O-N 3.36Å; N5-K7 PolarHBondContact O-N 3.18Å | ||
| 6 | T | 48.1 | Very low | 53.6 | Low | 120 Ų | 120 | 136.4 Ų | 136.4 | 74% | 0.736 | 75% | 0.745 | S | S | * | * | trans | -86.1 | 96.5 | 177.7 | 54.1 | 0 | 0 | 0 | 0 | 110.6 | T4 T8 | T4-T6 PolarHBondContact O-N 2.91Å; T6-T8 PolarHBondContact O-N 3.35Å | ||
| 7 | K | 51.7 | Low | 54.1 | Low | 201 Ų | 201 | 138.2 Ų | 138.2 | 87% | 0.874 | 75% | 0.754 | S | S | * | * | trans | 15.8 | 90.6 | 146.4 | -165.6 | 158.5 | -177.1 | 166.1 | 0 | 116.1 | N5 | N5-K7 PolarHBondContact O-N 3.18Š| ||
| 8 | T | 60.7 | Low | 54.4 | Low | 142 Ų | 142 | 138.4 Ų | 138.4 | 87% | 0.871 | 75% | 0.753 | S | S | * | * | trans | -86.6 | 121.9 | 149.9 | 60.4 | 0 | 0 | 0 | 0 | 107.3 | T6 | T6-T8 PolarHBondContact O-N 3.35Š| ||
| 9 | G | 56.5 | Low | 54.5 | Low | 59 Ų | 59 | 136.9 Ų | 136.9 | 61% | 0.608 | 75% | 0.751 | S | S | * | * | trans | -167.4 | 52.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 10 | F | 44.5 | Very low | 54.3 | Low | 176 Ų | 176 | 137.6 Ų | 137.6 | 77% | 0.772 | 75% | 0.754 | S | S | * | * | trans | -93 | 100.5 | 153 | -154.6 | -94.3 | 0 | 0 | 0 | 104.7 | I15 | F10-I15 HydrophobicContact CE1-CD1 4.21Å; F10-I15 HydrophobicContact CE1-CG1 4.12Å | ||
| 11 | S | 65.9 | Low | 54.1 | Low | 50 Ų | 50 | 136.7 Ų | 136.7 | 35% | 0.35 | 75% | 0.753 | S | S | . | * | trans | -90.7 | 141.8 | -175.9 | -174.7 | 0 | 0 | 0 | 0 | 108.5 | K13 D14 | S11-K13 PolarHBondContact O-N 3.32Å; S11-D14 PolarHBondContact N-OD2 3.49Å; S11-D14 VanDerWaalsContact O-CB 3.3Å; S11-D14 WeakPolarHBondContact O-CB 3.4Å; S11-D14 VanDerWaalsContact O-CG 3.31Å; S11-D14 PolarHBondContact O-N 3.1Å; S11-D14 VanDerWaalsContact O-OD2 3.12Å | ||
| 12 | V | 55.5 | Low | 54.2 | Low | 109 Ų | 109 | 131.8 Ų | 131.8 | 66% | 0.661 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -57.6 | -20.3 | 177.7 | 176.7 | 0 | 0 | 0 | 0 | 112.2 | D14 I15 | V12-D14 PolarHBondContact O-N 3.46Å; V12-I15 PolarHBondContact O-N 3.22Å |
| 13 | K | 58.3 | Low | 54.6 | Low | 173 Ų | 173 | 132.9 Ų | 132.9 | 75% | 0.752 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -62.4 | -27.5 | 172.4 | -55.9 | 176.9 | -177.2 | -172.2 | 0 | 112.8 | S11 I15 L16 | S11-K13 PolarHBondContact O-N 3.32Å; K13-I15 PolarHBondContact O-N 3.49Å; K13-L16 VanDerWaalsContact O-O 3.11Å |
| 14 | D | 67.4 | Low | 54.9 | Low | 96 Ų | 96 | 133.1 Ų | 133.1 | 51% | 0.513 | 72% | 0.724 | S | S | . | * | G | 310 helix | trans | -76.5 | -10.4 | 178.9 | -50.1 | -38.5 | 0 | 0 | 0 | 112.6 | S11 V12 | S11-D14 PolarHBondContact N-OD2 3.49Å; S11-D14 VanDerWaalsContact O-CB 3.3Å; S11-D14 WeakPolarHBondContact O-CB 3.4Å; S11-D14 VanDerWaalsContact O-CG 3.31Å; S11-D14 PolarHBondContact O-N 3.1Å; S11-D14 VanDerWaalsContact O-OD2 3.12Å; V12-D14 PolarHBondContact O-N 3.46Å |
| 15 | I | 68.6 | Low | 54.4 | Low | 117 Ų | 117 | 136 Ų | 136 | 60% | 0.6 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -24.7 | -179.4 | -63.8 | 172 | 0 | 0 | 0 | 111.6 | F10 V12 K13 | F10-I15 HydrophobicContact CE1-CD1 4.21Å; F10-I15 HydrophobicContact CE1-CG1 4.12Å; V12-I15 PolarHBondContact O-N 3.22Å; K13-I15 PolarHBondContact O-N 3.49Å |
| 16 | L | 54.7 | Low | 54.3 | Low | 109 Ų | 109 | 131.6 Ų | 131.6 | 57% | 0.571 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -107.9 | 97.4 | 178.2 | -65.9 | 171.4 | 0 | 0 | 0 | 106.7 | K13 L18 | K13-L16 VanDerWaalsContact O-O 3.11Å; L16-L18 HydrophobicContact CB-CD1 4.41Å; L16-L18 HydrophobicContact CB-CG 4.4Å; L16-L18 PolarHBondContact O-N 3.43Å |
| 17 | D | 62.6 | Low | 54 | Low | 168 Ų | 168 | 131.5 Ų | 131.5 | 90% | 0.898 | 73% | 0.727 | S | S | * | * | trans | -60.5 | 77.7 | 169.7 | -90.6 | -21.1 | 0 | 0 | 0 | 109.5 | ||||
| 18 | L | 59.7 | Low | 53.3 | Low | 141 Ų | 141 | 129.5 Ų | 129.5 | 74% | 0.738 | 72% | 0.724 | S | S | * | * | trans | -89.3 | 125.3 | 168.1 | -71.8 | 164.7 | 0 | 0 | 0 | 106.6 | L16 D20 | L16-L18 HydrophobicContact CB-CD1 4.41Å; L16-L18 HydrophobicContact CB-CG 4.4Å; L16-L18 PolarHBondContact O-N 3.43Å; L18-D20 PolarHBondContact O-N 3.28Å | ||
| 19 | P | 55.4 | Low | 52.1 | Low | 111 Ų | 111 | 128.9 Ų | 128.9 | 72% | 0.721 | 72% | 0.72 | S | S | * | * | trans | -62 | 125 | 172.7 | 25.3 | -31.6 | 0 | 0 | 0 | 109.1 | T21 | P19-T21 PolarHBondContact O-N 2.82Š| ||
| 20 | D | 50.8 | Low | 51 | Low | 150 Ų | 150 | 129.3 Ų | 129.3 | 80% | 0.802 | 73% | 0.725 | S | S | * | * | trans | -60.1 | 104.9 | 172.2 | -101.5 | -36.4 | 0 | 0 | 0 | 108.8 | L18 N22 | L18-D20 PolarHBondContact O-N 3.28Å; D20-N22 VanDerWaalsContact C-N 3.29Å; D20-N22 PolarHBondContact O-N 3.47Å; D20-N22 VanDerWaalsContact O-N 3.14Å | ||
| 21 | T | 51.6 | Low | 51.4 | Low | 119 Ų | 119 | 126.6 Ų | 126.6 | 73% | 0.73 | 73% | 0.725 | S | S | * | * | trans | -81.1 | 82 | 165.4 | 56.3 | 0 | 0 | 0 | 0 | 107.9 | P19 | P19-T21 PolarHBondContact O-N 2.82Š| ||
| 22 | N | 42.8 | Very low | 50.2 | Low | 137 Ų | 137 | 132.8 Ų | 132.8 | 73% | 0.733 | 75% | 0.749 | S | S | * | * | trans | -107.9 | 78.2 | 163.3 | -77.8 | -50.5 | 0 | 0 | 0 | 108 | D20 | D20-N22 VanDerWaalsContact C-N 3.29Å; D20-N22 PolarHBondContact O-N 3.47Å; D20-N22 VanDerWaalsContact O-N 3.14Å | ||
| 23 | D | 49.5 | Very low | 49.5 | Very low | 143 Ų | 143 | 136.4 Ų | 136.4 | 77% | 0.765 | 76% | 0.758 | S | S | * | * | trans | -93.4 | 118.4 | 158 | -61.2 | -60.6 | 0 | 0 | 0 | 106.8 | ||||
| 24 | E | 53.2 | Low | 48.4 | Very low | 183 Ų | 183 | 135.7 Ų | 135.7 | 86% | 0.855 | 76% | 0.763 | S | S | * | * | trans | -163.6 | 127.6 | 137.4 | -100.6 | -59.5 | 100.6 | 0 | 0 | 108.6 | ||||
| 25 | E | 42.7 | Very low | 46.9 | Very low | 185 Ų | 185 | 138.5 Ų | 138.5 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -72.8 | 176.7 | -176.3 | -61.6 | -155.9 | 141 | 0 | 0 | 113.1 | ||||
| 26 | G | 40.2 | Very low | 45.2 | Very low | 74 Ų | 74 | 141.9 Ų | 141.9 | 76% | 0.763 | 79% | 0.791 | S | S | * | * | trans | 107.1 | 75.3 | 133.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | I28 | G26-I28 PolarHBondContact O-N 3Š| ||
| 27 | S | 42 | Very low | 44 | Very low | 118 Ų | 118 | 140 Ų | 140 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | -54.7 | 119.5 | 148.4 | 161.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 28 | I | 36.5 | Very low | 42.6 | Very low | 160 Ų | 160 | 137.2 Ų | 137.2 | 82% | 0.821 | 79% | 0.791 | S | S | * | * | trans | -169.7 | 145.2 | 139 | -102.6 | 151.3 | 0 | 0 | 0 | 112 | G26 | G26-I28 PolarHBondContact O-N 3Š| ||
| 29 | T | 35.8 | Very low | 41.3 | Very low | 128 Ų | 128 | 138.6 Ų | 138.6 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | trans | -63.9 | 154.1 | -172.9 | 50.9 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 30 | G | 33.3 | Very low | 40 | Very low | 69 Ų | 69 | 138.9 Ų | 138.9 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | -67.2 | -160.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 31 | P | 53.5 | Low | 39 | Very low | 119 Ų | 119 | 136.7 Ų | 136.7 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | cis | -142 | -175.8 | 13.4 | 43.1 | -23 | 0 | 0 | 0 | 116.2 | ||||
| 32 | E | 39.9 | Very low | 38.2 | Very low | 180 Ų | 180 | 139.4 Ų | 139.4 | 84% | 0.841 | 79% | 0.788 | S | S | * | * | trans | 61.1 | 129.4 | 156.9 | -45.3 | -143.3 | 137.7 | 0 | 0 | 121.2 | ||||
| 33 | E | 41.8 | Very low | 37.6 | Very low | 184 Ų | 184 | 140.5 Ų | 140.5 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | 162.5 | 146 | 117.9 | -83.8 | -178 | -173.1 | 0 | 0 | 111.5 | |||||
| 34 | D | 34.1 | Very low | 36.6 | Very low | 159 Ų | 159 | 140.7 Ų | 140.7 | 85% | 0.85 | 80% | 0.801 | S | S | * | * | trans | -71 | 169.6 | -172.3 | -42.6 | -68.2 | 0 | 0 | 0 | 112.8 | ||||
| 35 | N | 35.5 | Very low | 35.6 | Very low | 155 Ų | 155 | 135.1 Ų | 135.1 | 83% | 0.829 | 79% | 0.792 | S | S | * | * | trans | 145.6 | 140.7 | 134.6 | -159.8 | 14.8 | 0 | 0 | 0 | 115.1 | ||||
| 36 | E | 34.3 | Very low | 35 | Very low | 187 Ų | 187 | 133 Ų | 133 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | -51 | 161.9 | -179.6 | -106.9 | 168.7 | 97.4 | 0 | 0 | 117.7 | ||||
| 37 | G | 29.4 | Very low | 34.6 | Very low | 69 Ų | 69 | 136 Ų | 136 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 125.5 | 103.2 | 135.7 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 38 | S | 32.7 | Very low | 34.3 | Very low | 110 Ų | 110 | 136.4 Ų | 136.4 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | 27.9 | 133.9 | 135.7 | -55.4 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 39 | E | 31.6 | Very low | 34.3 | Very low | 171 Ų | 171 | 137 Ų | 137 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | trans | 53.5 | 126.5 | 137.1 | -60.2 | -175.4 | 103.4 | 0 | 0 | 121.1 | ||||
| 40 | T | 28.5 | Very low | 34.2 | Very low | 116 Ų | 116 | 135.9 Ų | 135.9 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | 160 | 120.7 | 105.5 | 41.7 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 41 | T | 31.1 | Very low | 34.8 | Very low | 105 Ų | 105 | 137.7 Ų | 137.7 | 64% | 0.644 | 78% | 0.782 | S | S | * | * | 88.8 | 139 | 125.5 | 72.3 | 0 | 0 | 0 | 0 | 123.8 | |||||
| 42 | K | 33.8 | Very low | 34 | Very low | 175 Ų | 175 | 139.3 Ų | 139.3 | 76% | 0.761 | 78% | 0.784 | S | S | * | * | trans | 76 | 120.6 | 150.5 | -24 | -175.1 | -174 | 163.5 | 0 | 116.5 | ||||
| 43 | N | 30.9 | Very low | 34 | Very low | 160 Ų | 160 | 139 Ų | 139 | 86% | 0.856 | 78% | 0.782 | S | S | * | * | -151.9 | 135.5 | 61.2 | -78.1 | -30.6 | 0 | 0 | 0 | 114.3 | |||||
| 44 | T | 28.9 | Very low | 34.1 | Very low | 148 Ų | 148 | 137.2 Ų | 137.2 | 91% | 0.908 | 78% | 0.779 | S | S | * | * | trans | -88 | 149.6 | 167.4 | 39.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 45 | G | 30.9 | Very low | 34.3 | Very low | 66 Ų | 66 | 135.9 Ų | 135.9 | 68% | 0.68 | 78% | 0.776 | S | S | * | * | trans | 141.2 | 88.5 | 155.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 46 | V | 31.1 | Very low | 34.7 | Very low | 140 Ų | 140 | 136.9 Ų | 136.9 | 85% | 0.848 | 78% | 0.776 | S | S | * | * | 78.8 | 123.3 | 97.2 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 47 | L | 31.1 | Very low | 35.4 | Very low | 136 Ų | 136 | 135 Ų | 135 | 71% | 0.712 | 77% | 0.772 | S | S | * | * | -168 | 136.9 | 50.9 | -173.8 | 69.4 | 0 | 0 | 0 | 109.9 | |||||
| 48 | V | 35.5 | Very low | 35.7 | Very low | 127 Ų | 127 | 138.3 Ų | 138.3 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | -75.7 | 131.7 | 163.2 | 167.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 49 | Q | 36.6 | Very low | 36.6 | Very low | 173 Ų | 173 | 138.4 Ų | 138.4 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | trans | -156.2 | 120.1 | 150 | -105.5 | 171.9 | 68.2 | 0 | 0 | 110.2 | ||||
| 50 | S | 34.3 | Very low | 37.3 | Very low | 104 Ų | 104 | 137.1 Ų | 137.1 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -111.3 | 170.8 | 157.3 | 43 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 51 | P | 45 | Very low | 38.2 | Very low | 107 Ų | 107 | 140.5 Ų | 140.5 | 70% | 0.695 | 77% | 0.772 | S | S | * | * | cis | -138.9 | 180 | 9.8 | 40.4 | -20.4 | 0 | 0 | 0 | 115.3 | ||||
| 52 | L | 36.9 | Very low | 38.9 | Very low | 153 Ų | 153 | 141.4 Ų | 141.4 | 80% | 0.801 | 77% | 0.773 | S | S | * | * | trans | 57.9 | 110.5 | 151.4 | -108 | 98.3 | 0 | 0 | 0 | 119.6 | ||||
| 53 | E | 40.8 | Very low | 39.9 | Very low | 173 Ų | 173 | 139.2 Ų | 139.2 | 81% | 0.808 | 78% | 0.777 | S | S | * | * | 161.4 | 152.7 | 118.9 | -85.3 | 179.3 | 178.7 | 0 | 0 | 110.1 | |||||
| 54 | N | 43.6 | Very low | 40.7 | Very low | 147 Ų | 147 | 141 Ų | 141 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | 80.3 | 79.7 | 176.7 | -69.4 | 12.4 | 0 | 0 | 0 | 119.4 | ||||
| 55 | V | 38.9 | Very low | 41.7 | Very low | 132 Ų | 132 | 141.7 Ų | 141.7 | 80% | 0.8 | 77% | 0.765 | S | S | * | * | trans | -141.4 | 84.8 | 132.1 | -168.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 56 | Q | 43.2 | Very low | 42.6 | Very low | 176 Ų | 176 | 145.3 Ų | 145.3 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -79.2 | 131.2 | 159.6 | -95 | 170.4 | -15.5 | 0 | 0 | 109.1 | ||||
| 57 | N | 48.4 | Very low | 44 | Very low | 147 Ų | 147 | 141.5 Ų | 141.5 | 79% | 0.786 | 75% | 0.748 | S | S | * | * | trans | 66.9 | 87 | 154.7 | -60 | -25.3 | 0 | 0 | 0 | 118.1 | ||||
| 58 | L | 36.3 | Very low | 45.2 | Very low | 139 Ų | 139 | 139.1 Ų | 139.1 | 73% | 0.728 | 74% | 0.743 | S | S | * | * | trans | -121.3 | 127.8 | 148.2 | -84.2 | 157.3 | 0 | 0 | 0 | 108.3 | I60 | L58-I60 PolarHBondContact O-N 3.38Š| ||
| 59 | P | 50.5 | Low | 46.4 | Very low | 111 Ų | 111 | 140.1 Ų | 140.1 | 72% | 0.721 | 74% | 0.744 | S | S | * | * | trans | -71.2 | 103.6 | 171.9 | 28.5 | -28.5 | 0 | 0 | 0 | 107.5 | K61 | P59-K61 VanDerWaalsContact C-N 3.27Å; P59-K61 PolarHBondContact O-N 3.01Å | ||
| 60 | I | 46.2 | Very low | 48 | Very low | 145 Ų | 145 | 134.7 Ų | 134.7 | 74% | 0.744 | 72% | 0.72 | S | S | * | * | trans | -64.4 | 94.3 | 170.3 | -62.3 | 170.9 | 0 | 0 | 0 | 106.7 | L58 N62 | L58-I60 PolarHBondContact O-N 3.38Å; I60-N62 PolarHBondContact O-N 3.13Å; I60-N62 VanDerWaalsContact O-N 3.12Å | ||
| 61 | K | 48.8 | Very low | 49.9 | Very low | 187 Ų | 187 | 134.6 Ų | 134.6 | 81% | 0.813 | 72% | 0.717 | S | S | * | * | trans | -65.8 | 103.5 | 164.5 | -69 | -179.5 | 179.6 | -176.1 | 0 | 106.5 | P59 P63 | P59-K61 VanDerWaalsContact C-N 3.27Å; P59-K61 PolarHBondContact O-N 3.01Å; K61-P63 WeakPolarHBondContact O-CD 3.32Å | ||
| 62 | N | 45.1 | Very low | 50.4 | Low | 123 Ų | 123 | 136.3 Ų | 136.3 | 66% | 0.658 | 71% | 0.711 | S | S | * | * | trans | -72.7 | 109.1 | 164 | -78.3 | -8.2 | 0 | 0 | 0 | 107.5 | I60 F64 | I60-N62 PolarHBondContact O-N 3.13Å; I60-N62 VanDerWaalsContact O-N 3.12Å; N62-F64 PolarHBondContact O-N 3.49Å | ||
| 63 | P | 55.2 | Low | 52.2 | Low | 130 Ų | 130 | 131.1 Ų | 131.1 | 84% | 0.844 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | 14.8 | -176.9 | 34 | -33.8 | 0 | 0 | 0 | 112.6 | K61 | K61-P63 WeakPolarHBondContact O-CD 3.32Š|
| 64 | F | 46.4 | Very low | 53.6 | Low | 197 Ų | 197 | 131.5 Ų | 131.5 | 86% | 0.864 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.7 | 6 | -173.6 | -143.1 | -94 | 0 | 0 | 0 | 113.8 | N62 | N62-F64 PolarHBondContact O-N 3.49Š|
| 65 | Y | 50.8 | Low | 55 | Low | 163 Ų | 163 | 132 Ų | 132 | 64% | 0.639 | 67% | 0.67 | S | S | * | * | trans | -134.3 | 53.4 | 179.3 | -129.5 | -91.8 | 0 | 0 | 0 | 111.6 | S67 | Y65-S67 WeakPolarHBondContact CD1-OG 3.43Å; Y65-S67 VanDerWaalsContact CE1-OG 3.3Å; Y65-S67 WeakPolarHBondContact CE1-OG 3.32Å; Y65-S67 PolarHBondContact O-N 3.18Å | ||
| 66 | D | 50.2 | Low | 56.6 | Low | 142 Ų | 142 | 129.4 Ų | 129.4 | 76% | 0.759 | 65% | 0.652 | S | S | * | * | trans | -78.2 | 111.3 | 158.5 | -165.2 | 4.9 | 0 | 0 | 0 | 108.1 | S68 | D66-S68 PolarHBondContact O-N 3.5Š| ||
| 67 | S | 59.3 | Low | 57.7 | Low | 60 Ų | 60 | 124.2 Ų | 124.2 | 42% | 0.42 | 64% | 0.639 | S | S | . | * | trans | -105.6 | 51.9 | -154.3 | -132.2 | 0 | 0 | 0 | 0 | 113.2 | Y65 | Y65-S67 WeakPolarHBondContact CD1-OG 3.43Å; Y65-S67 VanDerWaalsContact CE1-OG 3.3Å; Y65-S67 WeakPolarHBondContact CE1-OG 3.32Å; Y65-S67 PolarHBondContact O-N 3.18Å | ||
| 68 | S | 57.5 | Low | 58.5 | Low | 86 Ų | 86 | 121.6 Ų | 121.6 | 60% | 0.601 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -131.9 | -22.6 | 168.3 | 52.9 | 0 | 0 | 0 | 0 | 115.3 | D66 | D66-S68 PolarHBondContact O-N 3.5Š|
| 69 | D | 60.4 | Low | 59.5 | Low | 148 Ų | 148 | 118.1 Ų | 118.1 | 79% | 0.791 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -109.8 | 3.1 | -176.7 | -70.9 | -47.2 | 0 | 0 | 0 | 114.7 | P71 | D69-P71 WeakPolarHBondContact O-CD 3.45Š|
| 70 | N | 71.1 | Confident | 59.8 | Low | 58 Ų | 58 | 118 Ų | 118 | 31% | 0.31 | 61% | 0.606 | S | S | . | * | trans | -69.9 | 120.5 | 176.8 | -175.6 | -7.4 | 0 | 0 | 0 | 110.2 | Y72 T73 R74 | N70-Y72 PolarHBondContact O-N 3.15Å; N70-Y72 VanDerWaalsContact OD1-CB 3.24Å; N70-Y72 WeakPolarHBondContact OD1-CB 3.28Å; N70-Y72 PolarHBondContact OD1-N 3.16Å; N70-T73 PolarHBondContact O-N 3.31Å; N70-R74 PolarHBondContact O-N 3.09Å; N70-R74 VanDerWaalsContact O-N 3.13Å | ||
| 71 | P | 72.9 | Confident | 59.8 | Low | 103 Ų | 103 | 115.6 Ų | 115.6 | 67% | 0.669 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -56.4 | -26 | 177.2 | 23.2 | -34.8 | 0 | 0 | 0 | 112.7 | D69 W75 | D69-P71 WeakPolarHBondContact O-CD 3.45Å; P71-W75 WeakPolarHBondContact O-CB 3.46Å; P71-W75 PolarHBondContact O-N 3.12Å |
| 72 | Y | 56.6 | Low | 60.2 | Low | 143 Ų | 143 | 112.9 Ų | 112.9 | 56% | 0.561 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.2 | -43.3 | 176.3 | -152.7 | -97.6 | 0 | 0 | 0 | 112.5 | N70 R74 W75 L76 | N70-Y72 PolarHBondContact O-N 3.15Å; N70-Y72 VanDerWaalsContact OD1-CB 3.24Å; N70-Y72 WeakPolarHBondContact OD1-CB 3.28Å; N70-Y72 PolarHBondContact OD1-N 3.16Å; Y72-R74 VanDerWaalsContact C-N 3.32Å; Y72-R74 PolarHBondContact O-N 3.34Å; Y72-W75 PolarHBondContact O-N 3.44Å; Y72-L76 HydrophobicContact CD1-CD1 3.71Å; Y72-L76 HydrophobicContact CD1-CG 4.22Å; Y72-L76 HydrophobicContact CE1-CD1 3.74Å; Y72-L76 HydrophobicContact CE1-CG 4.21Å; Y72-L76 WeakPolarHBondContact O-CG 3.47Å; Y72-L76 PolarHBondContact O-N 2.93Å |
| 73 | T | 73.1 | Confident | 60.4 | Low | 43 Ų | 43 | 114.2 Ų | 114.2 | 26% | 0.264 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -64.4 | -40.2 | 175.5 | -47.3 | 0 | 0 | 0 | 0 | 110.6 | N70 W75 L76 A77 | N70-T73 PolarHBondContact O-N 3.31Å; T73-W75 VanDerWaalsContact C-N 3.33Å; T73-W75 PolarHBondContact O-N 2.96Å; T73-L76 PolarHBondContact O-N 3.4Å; T73-A77 WeakPolarHBondContact O-CB 3.23Å; T73-A77 PolarHBondContact O-N 3.38Å |
| 74 | R | 71.1 | Confident | 60 | Low | 181 Ų | 181 | 116.9 Ų | 116.9 | 68% | 0.683 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -61.6 | -41 | 174.4 | -135.8 | -178.7 | 86.6 | 120.9 | 9 | 112.1 | N70 Y72 T78 | N70-R74 PolarHBondContact O-N 3.09Å; N70-R74 VanDerWaalsContact O-N 3.13Å; Y72-R74 VanDerWaalsContact C-N 3.32Å; Y72-R74 PolarHBondContact O-N 3.34Å; R74-T78 PolarHBondContact O-N 3.04Å; R74-T78 PolarHBondContact O-OG1 2.9Å |
| 75 | W | 74.2 | Confident | 60.1 | Low | 157 Ų | 157 | 113.4 Ų | 113.4 | 60% | 0.595 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.7 | -45.6 | 177.2 | -172.7 | 83.5 | 0 | 0 | 0 | 112.1 | P71 Y72 T73 T78 T79 | P71-W75 WeakPolarHBondContact O-CB 3.46Å; P71-W75 PolarHBondContact O-N 3.12Å; Y72-W75 PolarHBondContact O-N 3.44Å; T73-W75 VanDerWaalsContact C-N 3.33Å; T73-W75 PolarHBondContact O-N 2.96Å; W75-T78 WeakPolarHBondContact O-CB 3.3Å; W75-T78 PolarHBondContact O-N 3.34Å; W75-T79 PolarHBondContact O-N 3.49Å |
| 76 | L | 71.7 | Confident | 59.7 | Low | 79 Ų | 79 | 113.1 Ų | 113.1 | 41% | 0.414 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.6 | -44.5 | 177.5 | -70.5 | 173.4 | 0 | 0 | 0 | 112.3 | Y72 T73 T78 T79 D80 | Y72-L76 HydrophobicContact CD1-CD1 3.71Å; Y72-L76 HydrophobicContact CD1-CG 4.22Å; Y72-L76 HydrophobicContact CE1-CD1 3.74Å; Y72-L76 HydrophobicContact CE1-CG 4.21Å; Y72-L76 WeakPolarHBondContact O-CG 3.47Å; Y72-L76 PolarHBondContact O-N 2.93Å; T73-L76 PolarHBondContact O-N 3.4Å; L76-T78 PolarHBondContact O-N 2.99Å; L76-T79 PolarHBondContact O-N 3.07Å; L76-T79 PolarHBondContact O-OG1 3.34Å; L76-D80 PolarHBondContact O-N 3.02Å |
| 77 | A | 65.3 | Low | 59.3 | Low | 66 Ų | 66 | 116.1 Ų | 116.1 | 55% | 0.545 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -60.7 | -32.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | T73 T79 | T73-A77 WeakPolarHBondContact O-CB 3.23Å; T73-A77 PolarHBondContact O-N 3.38Å; A77-T79 PolarHBondContact O-N 2.91Å |
| 78 | T | 65.3 | Low | 58.1 | Low | 92 Ų | 92 | 116.8 Ų | 116.8 | 56% | 0.564 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -69.2 | -24.4 | 176.7 | -45.9 | 0 | 0 | 0 | 0 | 112 | R74 W75 L76 | R74-T78 PolarHBondContact O-N 3.04Å; R74-T78 PolarHBondContact O-OG1 2.9Å; W75-T78 WeakPolarHBondContact O-CB 3.3Å; W75-T78 PolarHBondContact O-N 3.34Å; L76-T78 PolarHBondContact O-N 2.99Å |
| 79 | T | 58.7 | Low | 57.1 | Low | 66 Ų | 66 | 121.3 Ų | 121.3 | 41% | 0.405 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -85.9 | -26.3 | 179.5 | 60.3 | 0 | 0 | 0 | 0 | 113.8 | W75 L76 A77 S81 I82 | W75-T79 PolarHBondContact O-N 3.49Å; L76-T79 PolarHBondContact O-N 3.07Å; L76-T79 PolarHBondContact O-OG1 3.34Å; A77-T79 PolarHBondContact O-N 2.91Å; T79-S81 VanDerWaalsContact C-N 3.3Å; T79-S81 PolarHBondContact O-N 2.97Å; T79-I82 PolarHBondContact O-N 2.9Å |
| 80 | D | 55.4 | Low | 55.8 | Low | 108 Ų | 108 | 120 Ų | 120 | 58% | 0.578 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -68.6 | -29.9 | 178.4 | -141 | -88.8 | 0 | 0 | 0 | 112.1 | L76 I82 | L76-D80 PolarHBondContact O-N 3.02Å; D80-I82 VanDerWaalsContact C-N 3.26Å; D80-I82 PolarHBondContact O-N 3.39Å |
| 81 | S | 47.9 | Very low | 54.1 | Low | 96 Ų | 96 | 121.7 Ų | 121.7 | 67% | 0.671 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -72.7 | -11.3 | 176.6 | -172.6 | 0 | 0 | 0 | 0 | 114.4 | T79 Q83 | T79-S81 VanDerWaalsContact C-N 3.3Å; T79-S81 PolarHBondContact O-N 2.97Å; S81-Q83 VanDerWaalsContact C-N 3.32Å; S81-Q83 PolarHBondContact O-N 3.33Å |
| 82 | I | 55.8 | Low | 52.3 | Low | 130 Ų | 130 | 122.3 Ų | 122.3 | 67% | 0.667 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -79.1 | -13.6 | -177.4 | -58.3 | -74.6 | 0 | 0 | 0 | 112.2 | T79 D80 | T79-I82 PolarHBondContact O-N 2.9Å; D80-I82 VanDerWaalsContact C-N 3.26Å; D80-I82 PolarHBondContact O-N 3.39Å |
| 83 | Q | 49.2 | Very low | 51.5 | Low | 151 Ų | 151 | 121 Ų | 121 | 71% | 0.706 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -89.8 | 3.8 | -172.5 | -71.7 | -67.7 | -61 | 0 | 0 | 116.2 | S81 | S81-Q83 VanDerWaalsContact C-N 3.32Å; S81-Q83 PolarHBondContact O-N 3.33Å |
| 84 | Y | 47.8 | Very low | 49.9 | Very low | 186 Ų | 186 | 128.1 Ų | 128.1 | 73% | 0.729 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -135.4 | 39.1 | -175.3 | -43.9 | -76.9 | 0 | 0 | 0 | 116 | ||
| 85 | S | 47.6 | Very low | 48.3 | Very low | 123 Ų | 123 | 126.9 Ų | 126.9 | 86% | 0.86 | 72% | 0.723 | S | S | * | * | trans | -125.5 | 69.6 | 165.2 | -92.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 86 | L | 42.3 | Very low | 46.6 | Very low | 158 Ų | 158 | 125.3 Ų | 125.3 | 83% | 0.827 | 74% | 0.736 | S | S | * | * | trans | -137.9 | 69.1 | 166.5 | -171.2 | 70.5 | 0 | 0 | 0 | 109.3 | ||||
| 87 | H | 41.8 | Very low | 45.5 | Very low | 205 Ų | 205 | 126.4 Ų | 126.4 | 95% | 0.949 | 76% | 0.756 | S | S | * | * | trans | -159.3 | 124.8 | 155.8 | -88.9 | -69.7 | 0 | 0 | 0 | 109 | ||||
| 88 | G | 33.9 | Very low | 44.1 | Very low | 73 Ų | 73 | 132.9 Ų | 132.9 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | trans | 126 | 56.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 89 | L | 37.2 | Very low | 42.7 | Very low | 181 Ų | 181 | 133.3 Ų | 133.3 | 95% | 0.948 | 78% | 0.779 | S | S | * | * | trans | -119.3 | 89.9 | 149.3 | -68.8 | 177.8 | 0 | 0 | 0 | 107.5 | ||||
| 90 | S | 34 | Very low | 42.5 | Very low | 120 Ų | 120 | 135.3 Ų | 135.3 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | trans | -75.4 | 118.3 | 167.4 | -177.6 | 0 | 0 | 0 | 0 | 107.9 | S92 | S90-S92 PolarHBondContact O-N 2.9Š| ||
| 91 | A | 35.3 | Very low | 41.5 | Very low | 94 Ų | 94 | 139 Ų | 139 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | trans | -76.2 | 112.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 92 | S | 34.5 | Very low | 41.6 | Very low | 116 Ų | 116 | 139.6 Ų | 139.6 | 81% | 0.811 | 81% | 0.808 | S | S | * | * | trans | -92.2 | 108 | 160.9 | 58.7 | 0 | 0 | 0 | 0 | 108.6 | S90 | S90-S92 PolarHBondContact O-N 2.9Š| ||
| 93 | S | 38.9 | Very low | 40.8 | Very low | 116 Ų | 116 | 139.2 Ų | 139.2 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | trans | -65.9 | 123.2 | 164.4 | -64.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 94 | Q | 40.8 | Very low | 40.8 | Very low | 193 Ų | 193 | 136.6 Ų | 136.6 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -133.1 | 116.8 | 149.5 | -78.6 | -151.3 | -28.7 | 0 | 0 | 109.7 | ||||
| 95 | D | 37.3 | Very low | 41 | Very low | 155 Ų | 155 | 135.4 Ų | 135.4 | 83% | 0.829 | 83% | 0.828 | S | S | * | * | trans | -55.4 | 135.6 | 160.4 | -105.8 | -43.7 | 0 | 0 | 0 | 110.8 | ||||
| 96 | S | 38.9 | Very low | 41.3 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 87% | 0.867 | 83% | 0.825 | S | S | * | * | trans | -177.5 | 115 | 134.1 | -84.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 97 | A | 48.1 | Very low | 41.6 | Very low | 101 Ų | 101 | 135.6 Ų | 135.6 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -74.7 | 127.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 98 | K | 35.5 | Very low | 42.4 | Very low | 202 Ų | 202 | 130.7 Ų | 130.7 | 88% | 0.878 | 81% | 0.81 | S | S | * | * | trans | -166.7 | 117.8 | 143.4 | -159.3 | 73.8 | -175.5 | -177.7 | 0 | 111.6 | ||||
| 99 | S | 36.7 | Very low | 43.1 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | trans | -115.4 | 168.7 | 147.1 | -145.6 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 100 | P | 52.7 | Low | 43.8 | Very low | 108 Ų | 108 | 132.7 Ų | 132.7 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | cis | -137.2 | 169.8 | 6 | 40 | -21.7 | 0 | 0 | 0 | 114.8 | ||||
| 101 | E | 35.4 | Very low | 44.7 | Very low | 184 Ų | 184 | 134.1 Ų | 134.1 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | -176.4 | 152.4 | 124.4 | -108.6 | -149.2 | 108.9 | 0 | 0 | 113.4 | |||||
| 102 | P | 49.3 | Very low | 45.7 | Very low | 110 Ų | 110 | 139 Ų | 139 | 71% | 0.714 | 81% | 0.806 | S | S | * | * | trans | -97.2 | 141 | -178.3 | 37.1 | -27.3 | 0 | 0 | 0 | 111.8 | ||||
| 103 | S | 40.4 | Very low | 46.3 | Very low | 121 Ų | 121 | 141.8 Ų | 141.8 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -138.4 | 126.3 | 158.8 | -166.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 104 | A | 48.8 | Very low | 46.5 | Very low | 96 Ų | 96 | 142.1 Ų | 142.1 | 79% | 0.793 | 80% | 0.803 | S | S | * | * | trans | -64.1 | 140.9 | 162 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 105 | D | 52.7 | Low | 46.6 | Very low | 162 Ų | 162 | 137.4 Ų | 137.4 | 87% | 0.866 | 79% | 0.792 | S | S | * | * | trans | -152.6 | 131.1 | 148 | -169.1 | 53 | 0 | 0 | 0 | 108.3 | ||||
| 106 | E | 51.9 | Low | 47 | Very low | 171 Ų | 171 | 135.2 Ų | 135.2 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | trans | -106.5 | 125.3 | -174.7 | -163.4 | -154.2 | 140.2 | 0 | 0 | 107.7 | ||||
| 107 | S | 48.9 | Very low | 47.3 | Very low | 113 Ų | 113 | 137.7 Ų | 137.7 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -165.4 | 129.8 | 150.3 | -158.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 108 | P | 59.1 | Low | 46.9 | Very low | 103 Ų | 103 | 135.8 Ų | 135.8 | 67% | 0.669 | 78% | 0.782 | S | S | * | * | trans | -103.7 | 123.6 | 174.5 | 34.9 | -23.8 | 0 | 0 | 0 | 111.1 | ||||
| 109 | D | 48.4 | Very low | 47.3 | Very low | 147 Ų | 147 | 131.1 Ų | 131.1 | 79% | 0.786 | 78% | 0.775 | S | S | * | * | trans | -175 | 121.6 | 148.5 | -148.1 | -104.9 | 0 | 0 | 0 | 111 | ||||
| 110 | N | 52.9 | Low | 48 | Very low | 149 Ų | 149 | 134.2 Ų | 134.2 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | trans | -174.2 | 106.1 | 138.3 | -129.8 | -39.4 | 0 | 0 | 0 | 111.2 | ||||
| 111 | D | 51.2 | Low | 48.1 | Very low | 149 Ų | 149 | 133 Ų | 133 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | trans | -72.5 | 122.4 | 157.6 | -75.2 | -65.1 | 0 | 0 | 0 | 110 | ||||
| 112 | K | 56.3 | Low | 49.2 | Very low | 197 Ų | 197 | 127.2 Ų | 127.2 | 86% | 0.857 | 77% | 0.768 | S | S | * | * | trans | -155.3 | 117.2 | 150.6 | -156 | 158.3 | 179.6 | 174 | 0 | 113.3 | ||||
| 113 | E | 47.7 | Very low | 49.9 | Very low | 174 Ų | 174 | 131.2 Ų | 131.2 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | -62.7 | 165.3 | 168.8 | -70.3 | -139.9 | 119.3 | 0 | 0 | 114.2 | ||||
| 114 | T | 44.3 | Very low | 51.4 | Low | 123 Ų | 123 | 134.3 Ų | 134.3 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | trans | 88.1 | 133.2 | 140.4 | -171.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 115 | S | 41.9 | Very low | 53.1 | Low | 94 Ų | 94 | 139.5 Ų | 139.5 | 66% | 0.657 | 77% | 0.771 | S | S | * | * | trans | 100.2 | 90.9 | 150.2 | -63.1 | 0 | 0 | 0 | 0 | 119 | ||||
| 116 | S | 45.8 | Very low | 54.6 | Low | 110 Ų | 110 | 141.1 Ų | 141.1 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | 34.2 | 124.4 | 117 | 61.1 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 117 | N | 44.6 | Very low | 56.5 | Low | 176 Ų | 176 | 143.7 Ų | 143.7 | 94% | 0.941 | 77% | 0.773 | S | S | * | * | 116.1 | 132.4 | 129.8 | -151.9 | 41.6 | 0 | 0 | 0 | 116.1 | |||||
| 118 | G | 40.5 | Very low | 58.5 | Low | 60 Ų | 60 | 148.1 Ų | 148.1 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | trans | 121.2 | 86.1 | 157.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 119 | S | 43.4 | Very low | 60.2 | Low | 104 Ų | 104 | 149.5 Ų | 149.5 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | 162 | 108.7 | 118 | 50.9 | 0 | 0 | 0 | 0 | 111.2 | S121 | S119-S121 PolarHBondContact O-N 3.45Š| |||
| 120 | D | 52.8 | Low | 62.4 | Low | 167 Ų | 167 | 150 Ų | 150 | 89% | 0.893 | 78% | 0.78 | S | S | * | * | trans | -51.8 | 105.6 | 158.9 | -178.9 | 41 | 0 | 0 | 0 | 108.8 | ||||
| 121 | S | 54.2 | Low | 64.6 | Low | 82 Ų | 82 | 146.2 Ų | 146.2 | 57% | 0.573 | 76% | 0.757 | S | S | * | * | trans | -125.6 | 121.9 | 171.4 | 51.4 | 0 | 0 | 0 | 0 | 107.4 | S119 K123 | S119-S121 PolarHBondContact O-N 3.45Å; S121-K123 PolarHBondContact O-N 3.34Å | ||
| 122 | G | 57.6 | Low | 66.8 | Low | 64 Ų | 64 | 141.9 Ų | 141.9 | 66% | 0.66 | 74% | 0.738 | S | S | * | * | trans | -33.9 | 129.1 | -169.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | K124 | G122-K124 VanDerWaalsContact C-N 3.28Å; G122-K124 PolarHBondContact O-N 3.41Å | ||
| 123 | K | 64.1 | Low | 68.8 | Low | 194 Ų | 194 | 140.8 Ų | 140.8 | 84% | 0.843 | 73% | 0.733 | S | S | * | * | trans | -43.8 | 81.1 | -173.9 | -67.2 | 157.3 | -179.3 | 168.9 | 0 | 112.8 | S121 R125 | S121-K123 PolarHBondContact O-N 3.34Å; K123-R125 PolarHBondContact O-N 3.04Å | ||
| 124 | K | 73.4 | Confident | 71.2 | Confident | 185 Ų | 185 | 135.8 Ų | 135.8 | 80% | 0.804 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 120.4 | 173.2 | -79.1 | 169.6 | 179.2 | 169.1 | 0 | 107.5 | G122 K126 | G122-K124 VanDerWaalsContact C-N 3.28Å; G122-K124 PolarHBondContact O-N 3.41Å; K124-K126 PolarHBondContact O-N 3.33Å |
| 125 | R | 82.9 | Confident | 73.8 | Confident | 205 Ų | 205 | 131.7 Ų | 131.7 | 77% | 0.774 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 124.8 | 177.6 | 176.5 | 173.4 | 153.9 | 169.6 | -9.7 | 109.5 | K123 R127 | K123-R125 PolarHBondContact O-N 3.04Å; R125-R127 PolarHBondContact O-N 3.35Å |
| 126 | K | 84.9 | Confident | 76.5 | Confident | 196 Ų | 196 | 128.8 Ų | 128.8 | 85% | 0.852 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 124.3 | 178.9 | -127.3 | 97 | 171.2 | -177.8 | 0 | 109.1 | K124 R128 | K124-K126 PolarHBondContact O-N 3.33Å; K126-R128 PolarHBondContact O-N 3.03Å |
| 127 | R | 90.8 | Very high | 79 | Confident | 226 Ų | 226 | 129.4 Ų | 129.4 | 85% | 0.853 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 135.4 | 174.5 | -170.4 | 170.6 | 69.8 | -158 | 2.1 | 108.8 | R125 | R125-R127 PolarHBondContact O-N 3.35Š|
| 128 | R | 92.5 | Very high | 81.6 | Confident | 206 Ų | 206 | 123.7 Ų | 123.7 | 78% | 0.777 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 134 | 175.7 | -68.9 | -177.8 | 179.2 | 170.6 | -0.4 | 109.1 | K126 | K126-R128 PolarHBondContact O-N 3.03Š|
| 129 | V | 93.4 | Very high | 84.3 | Confident | 131 Ų | 131 | 120.9 Ų | 120.9 | 79% | 0.794 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 133 | 174.3 | -179 | 0 | 0 | 0 | 0 | 108.2 | ||
| 130 | L | 96 | Very high | 87 | Confident | 158 Ų | 158 | 119.4 Ų | 119.4 | 83% | 0.827 | 58% | 0.579 | S | S | * | * | P | Polyproline II helix | trans | -96 | 150.6 | 175.3 | -63.8 | 172.2 | 0 | 0 | 0 | 109.7 | ||
| 131 | F | 98 | Very high | 89.1 | Confident | 69 Ų | 69 | 116.2 Ų | 116.2 | 30% | 0.303 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -74.4 | 148.8 | 171.8 | -58.7 | -41.9 | 0 | 0 | 0 | 110.7 | Q135 L139 L163 Q167 W171 | F131-Q135 HydrophobicContact CB-CB 4.2Å; F131-L139 HydrophobicContact CD2-CD1 4.35Å; F131-L163 HydrophobicContact CD1-CD1 3.97Å; F131-L163 HydrophobicContact CD1-CD2 3.8Å; F131-L163 HydrophobicContact CE1-CD1 3.92Å; F131-L163 HydrophobicContact CE1-CD2 3.73Å; F131-L163 HydrophobicContact CG-CD1 4.37Å; F131-L163 HydrophobicContact CZ-CD1 4.25Å; F131-Q167 HydrophobicContact CE1-CB 4.41Å; F131-Q167 HydrophobicContact CE1-CG 4.43Å; F131-Q167 HydrophobicContact CZ-CB 4.06Å; F131-Q167 HydrophobicContact CZ-CG 4.32Å; F131-W171 AromaticContact CD2-CD1 3.75Å; F131-W171 HydrophobicContact CE2-CB 4.28Å; F131-W171 AromaticContact CE2-CD1 3.66Å; F131-W171 HydrophobicContact CE2-CG 4.32Å |
| 132 | S | 98.4 | Very high | 91.2 | Very high | 58 Ų | 58 | 116 Ų | 116 | 41% | 0.406 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -67.1 | 164.6 | 175 | 81 | 0 | 0 | 0 | 0 | 111.3 | A134 Q135 T136 | S132-A134 VanDerWaalsContact C-N 3.33Å; S132-A134 PolarHBondContact O-N 3.13Å; S132-Q135 PolarHBondContact O-N 3.18Å; S132-Q135 VanDerWaalsContact OG-CG 3.32Å; S132-Q135 WeakPolarHBondContact OG-CG 3.48Å; S132-Q135 PolarHBondContact OG-N 3.36Å; S132-T136 PolarHBondContact O-N 3.45Å; S132-T136 PolarHBondContact O-OG1 3.29Å |
| 133 | K | 98.2 | Very high | 93.2 | Very high | 174 Ų | 174 | 113.3 Ų | 113.3 | 76% | 0.757 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.2 | -41.6 | 177.3 | -171.6 | 62.9 | 173.5 | 176.8 | 0 | 111.8 | T136 Y137 | K133-T136 PolarHBondContact O-N 3.47Å; K133-Y137 WeakPolarHBondContact O-CB 3.47Å; K133-Y137 PolarHBondContact O-N 3Å |
| 134 | A | 98.1 | Very high | 94.8 | Very high | 70 Ų | 70 | 112.8 Ų | 112.8 | 58% | 0.579 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.5 | -43.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | S132 T136 Y137 E138 | S132-A134 VanDerWaalsContact C-N 3.33Å; S132-A134 PolarHBondContact O-N 3.13Å; A134-T136 PolarHBondContact O-N 3.25Å; A134-Y137 PolarHBondContact O-N 3.15Å; A134-E138 PolarHBondContact O-N 3.43Å; A134-E138 VanDerWaalsContact O-N 3.1Å |
| 135 | Q | 98.6 | Very high | 96 | Very high | 37 Ų | 37 | 109.6 Ų | 109.6 | 17% | 0.173 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -61 | -46.6 | 175.4 | -73.7 | 173.5 | -30 | 0 | 0 | 111.4 | F131 S132 Y137 E138 L139 I161 | F131-Q135 HydrophobicContact CB-CB 4.2Å; S132-Q135 PolarHBondContact O-N 3.18Å; S132-Q135 VanDerWaalsContact OG-CG 3.32Å; S132-Q135 WeakPolarHBondContact OG-CG 3.48Å; S132-Q135 PolarHBondContact OG-N 3.36Å; Q135-Y137 VanDerWaalsContact C-N 3.31Å; Q135-Y137 PolarHBondContact O-N 3.09Å; Q135-E138 PolarHBondContact O-N 3.41Å; Q135-L139 WeakPolarHBondContact O-CB 3.48Å; Q135-L139 WeakPolarHBondContact O-CD1 3.49Å; Q135-L139 VanDerWaalsContact O-CG 3.23Å; Q135-L139 WeakPolarHBondContact O-CG 3.28Å; Q135-L139 PolarHBondContact O-N 3.49Å; Q135-L139 VanDerWaalsContact O-N 3.07Å; Q135-I161 HydrophobicContact CG-CB 4.38Å; Q135-I161 PolarHBondContact NE2-O 3.46Å |
| 136 | T | 98.4 | Very high | 96.7 | Very high | 32 Ų | 32 | 103 Ų | 103 | 20% | 0.196 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -63 | -39.9 | 178.7 | -54.7 | 0 | 0 | 0 | 0 | 111.6 | S132 K133 A134 L139 E140 | S132-T136 PolarHBondContact O-N 3.45Å; S132-T136 PolarHBondContact O-OG1 3.29Å; K133-T136 PolarHBondContact O-N 3.47Å; A134-T136 PolarHBondContact O-N 3.25Å; T136-L139 PolarHBondContact O-N 3.32Å; T136-E140 HydrophobicContact CG2-CG 4.39Å; T136-E140 WeakPolarHBondContact O-CB 3.5Å; T136-E140 VanDerWaalsContact O-CG 3.28Å; T136-E140 WeakPolarHBondContact O-CG 3.08Å; T136-E140 PolarHBondContact O-N 3.12Å |
| 137 | Y | 98.4 | Very high | 97.3 | Very high | 124 Ų | 124 | 100 Ų | 100 | 49% | 0.486 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.9 | -48.7 | 177.2 | 171.8 | -97.9 | 0 | 0 | 0 | 112.7 | K133 A134 Q135 L139 E140 R141 | K133-Y137 WeakPolarHBondContact O-CB 3.47Å; K133-Y137 PolarHBondContact O-N 3Å; A134-Y137 PolarHBondContact O-N 3.15Å; Q135-Y137 VanDerWaalsContact C-N 3.31Å; Q135-Y137 PolarHBondContact O-N 3.09Å; Y137-L139 VanDerWaalsContact C-N 3.34Å; Y137-L139 PolarHBondContact O-N 2.9Å; Y137-E140 PolarHBondContact O-N 3.37Å; Y137-R141 WeakPolarHBondContact O-CB 3.24Å; Y137-R141 PolarHBondContact O-N 2.89Å |
| 138 | E | 98.6 | Very high | 97.6 | Very high | 56 Ų | 56 | 96.6 Ų | 96.6 | 26% | 0.262 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -66.2 | -37 | 178.6 | -76.3 | -57.4 | 145.2 | 0 | 0 | 112.1 | A134 Q135 R141 R142 I161 | A134-E138 PolarHBondContact O-N 3.43Å; A134-E138 VanDerWaalsContact O-N 3.1Å; Q135-E138 PolarHBondContact O-N 3.41Å; E138-R141 PolarHBondContact O-N 2.81Å; E138-R141 IonicContact OE1-NH1 3.49Å; E138-R141 PolarHBondContact OE1-NH1 3.21Å; E138-R141 IonicContact OE2-NH1 3.22Å; E138-R141 PolarHBondContact OE2-NH1 3.41Å; E138-R142 WeakPolarHBondContact O-CB 3.36Å; E138-R142 WeakPolarHBondContact O-CG 3.4Å; E138-R142 PolarHBondContact O-N 2.93Å; E138-I161 HydrophobicContact CB-CG2 3.64Å; E138-I161 HydrophobicContact CG-CG2 4.12Å |
| 139 | L | 98.7 | Very high | 97.9 | Very high | 0 Ų | 0 | 88.1 Ų | 88.1 | 0% | 0 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.9 | -46.7 | 172.8 | -72.7 | 164.7 | 0 | 0 | 0 | 111.5 | F131 Q135 T136 Y137 R142 F143 L157 I161 L163 V168 W171 F172 | F131-L139 HydrophobicContact CD2-CD1 4.35Å; Q135-L139 WeakPolarHBondContact O-CB 3.48Å; Q135-L139 WeakPolarHBondContact O-CD1 3.49Å; Q135-L139 VanDerWaalsContact O-CG 3.23Å; Q135-L139 WeakPolarHBondContact O-CG 3.28Å; Q135-L139 PolarHBondContact O-N 3.49Å; Q135-L139 VanDerWaalsContact O-N 3.07Å; T136-L139 PolarHBondContact O-N 3.32Å; Y137-L139 VanDerWaalsContact C-N 3.34Å; Y137-L139 PolarHBondContact O-N 2.9Å; L139-R142 PolarHBondContact O-N 3.06Å; L139-F143 VanDerWaalsContact O-CB 3.3Å; L139-F143 WeakPolarHBondContact O-CB 3.45Å; L139-F143 PolarHBondContact O-N 3.19Å; L139-L157 HydrophobicContact CD2-CD2 4.17Å; L139-I161 HydrophobicContact CD1-CD1 4.23Å; L139-I161 HydrophobicContact CD2-CD1 3.64Å; L139-I161 HydrophobicContact CG-CD1 3.7Å; L139-L163 HydrophobicContact CD1-CD1 4.18Å; L139-V168 HydrophobicContact CD2-CG1 4.31Å; L139-V168 HydrophobicContact CD2-CG2 4.45Å; L139-W171 HydrophobicContact CB-CD2 3.88Å; L139-W171 HydrophobicContact CB-CE3 3.86Å; L139-W171 HydrophobicContact CB-CH2 3.67Å; L139-W171 HydrophobicContact CB-CZ2 3.67Å; L139-W171 HydrophobicContact CB-CZ3 3.77Å; L139-W171 HydrophobicContact CD1-CB 4.48Å; L139-W171 HydrophobicContact CD1-CD2 3.85Å; L139-W171 HydrophobicContact CD1-CG 3.8Å; L139-W171 HydrophobicContact CD2-CD2 4.19Å; L139-W171 HydrophobicContact CD2-CE3 4.1Å; L139-W171 HydrophobicContact CD2-CG 4.45Å; L139-W171 HydrophobicContact CG-CD2 4.2Å; L139-W171 HydrophobicContact CG-CE3 4.38Å; L139-F172 HydrophobicContact CD2-CD2 4.45Å; L139-F172 HydrophobicContact CD2-CE2 3.96Å |
| 140 | E | 98.4 | Very high | 98.1 | Very high | 74 Ų | 74 | 84.4 Ų | 84.4 | 35% | 0.346 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -66.6 | -39.8 | 177.1 | -72.4 | 175.2 | 173.9 | 0 | 0 | 112.4 | T136 Y137 F143 R144 W171 | T136-E140 HydrophobicContact CG2-CG 4.39Å; T136-E140 WeakPolarHBondContact O-CB 3.5Å; T136-E140 VanDerWaalsContact O-CG 3.28Å; T136-E140 WeakPolarHBondContact O-CG 3.08Å; T136-E140 PolarHBondContact O-N 3.12Å; Y137-E140 PolarHBondContact O-N 3.37Å; E140-F143 PolarHBondContact O-N 2.96Å; E140-R144 WeakPolarHBondContact O-CG 3.25Å; E140-R144 PolarHBondContact O-N 3.08Å; E140-W171 HydrophobicContact CB-CH2 4.48Å; E140-W171 HydrophobicContact CG-CH2 3.8Å; E140-W171 HydrophobicContact CG-CZ2 3.79Å |
| 141 | R | 98.5 | Very high | 98.2 | Very high | 99 Ų | 99 | 79.3 Ų | 79.3 | 37% | 0.374 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.5 | -48.2 | 175.5 | -179 | -176.3 | 175.3 | -146.9 | 2.9 | 111.2 | Y137 E138 | Y137-R141 WeakPolarHBondContact O-CB 3.24Å; Y137-R141 PolarHBondContact O-N 2.89Å; E138-R141 PolarHBondContact O-N 2.81Å; E138-R141 IonicContact OE1-NH1 3.49Å; E138-R141 PolarHBondContact OE1-NH1 3.21Å; E138-R141 IonicContact OE2-NH1 3.22Å; E138-R141 PolarHBondContact OE2-NH1 3.41Å |
| 142 | R | 98.3 | Very high | 98.3 | Very high | 77 Ų | 77 | 80.3 Ų | 80.3 | 29% | 0.291 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 174.6 | -77.2 | -67.7 | 98.4 | -157.2 | 8.6 | 111.9 | E138 L139 R144 Q145 Q146 L157 F172 | E138-R142 WeakPolarHBondContact O-CB 3.36Å; E138-R142 WeakPolarHBondContact O-CG 3.4Å; E138-R142 PolarHBondContact O-N 2.93Å; L139-R142 PolarHBondContact O-N 3.06Å; R142-R144 VanDerWaalsContact C-N 3.3Å; R142-R144 PolarHBondContact O-N 2.88Å; R142-Q145 VanDerWaalsContact CZ-CD 3.49Å; R142-Q145 WeakPolarHBondContact O-CB 3.37Å; R142-Q145 PolarHBondContact O-N 3.03Å; R142-Q146 PolarHBondContact O-N 2.65Å; R142-L157 HydrophobicContact CB-CD2 4.07Å; R142-L157 HydrophobicContact CG-CD1 3.74Å; R142-L157 HydrophobicContact CG-CD2 3.87Å; R142-L157 HydrophobicContact CG-CG 4.42Å; R142-F172 HydrophobicContact CB-CZ 4.25Å |
| 143 | F | 98.4 | Very high | 98.2 | Very high | 9 Ų | 9 | 81 Ų | 81 | 4% | 0.039 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.2 | -38.3 | -178.8 | -173.4 | -92.6 | 0 | 0 | 0 | 113.3 | L139 E140 Q145 Q146 R147 W171 F172 H175 R176 M179 | L139-F143 VanDerWaalsContact O-CB 3.3Å; L139-F143 WeakPolarHBondContact O-CB 3.45Å; L139-F143 PolarHBondContact O-N 3.19Å; E140-F143 PolarHBondContact O-N 2.96Å; F143-Q145 PolarHBondContact O-N 3.35Å; F143-Q146 CarbonylContact O-C 3.39Å; F143-Q146 PolarHBondContact O-N 2.72Å; F143-R147 HydrophobicContact CE1-CG 3.97Å; F143-R147 HydrophobicContact CE2-CB 4.05Å; F143-R147 HydrophobicContact CE2-CG 4.18Å; F143-R147 HydrophobicContact CZ-CB 4.03Å; F143-R147 HydrophobicContact CZ-CG 3.73Å; F143-W171 HydrophobicContact CB-CH2 4.34Å; F143-W171 HydrophobicContact CB-CZ3 4.06Å; F143-W171 HydrophobicContact CD2-CZ3 4.35Å; F143-W171 HydrophobicContact CG-CZ3 4.39Å; F143-F172 HydrophobicContact CB-CE1 4.29Å; F143-F172 HydrophobicContact CB-CZ 4.4Å; F143-F172 AromaticContact CD2-CD1 3.77Å; F143-F172 HydrophobicContact CD2-CD1 3.77Å; F143-F172 AromaticContact CD2-CE1 3.76Å; F143-F172 HydrophobicContact CD2-CE1 3.76Å; F143-F172 HydrophobicContact CE2-CD1 4.33Å; F143-H175 AromaticContact CD1-CD2 3.35Å; F143-H175 WeakPolarHBondContact CD1-CD2 3.49Å; F143-H175 AromaticContact CD1-NE2 3.33Å; F143-H175 VanDerWaalsContact CD1-NE2 3.33Å; F143-H175 WeakPolarHBondContact CD1-NE2 3.47Å; F143-H175 HydrophobicContact CD2-CB 4.48Å; F143-H175 AromaticContact CD2-CD2 3.84Å; F143-H175 AromaticContact CE1-CD2 3.15Å; F143-H175 WeakPolarHBondContact CE1-CD2 3.47Å; F143-H175 AromaticContact CE1-NE2 3.4Å; F143-H175 WeakPolarHBondContact CE1-NE2 3.4Å; F143-H175 HydrophobicContact CE2-CB 4.37Å; F143-H175 AromaticContact CE2-CD2 3.67Å; F143-H175 AromaticContact CG-CD2 3.7Å; F143-H175 AromaticContact CG-NE2 3.96Å; F143-H175 AromaticContact CZ-CD2 3.33Å; F143-H175 WeakPolarHBondContact CZ-CD2 3.36Å; F143-R176 HydrophobicContact CE2-CG 3.76Å; F143-R176 HydrophobicContact CZ-CG 4Å; F143-M179 HydrophobicContact CE1-SD 4.16Å |
| 144 | R | 97.9 | Very high | 98.3 | Very high | 182 Ų | 182 | 75.5 Ų | 75.5 | 69% | 0.687 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.7 | -32.4 | 175.2 | -77.9 | -173.2 | -72.4 | 154.3 | -6.2 | 112.6 | E140 R142 | E140-R144 WeakPolarHBondContact O-CG 3.25Å; E140-R144 PolarHBondContact O-N 3.08Å; R142-R144 VanDerWaalsContact C-N 3.3Å; R142-R144 PolarHBondContact O-N 2.88Å |
| 145 | Q | 97.9 | Very high | 98.3 | Very high | 118 Ų | 118 | 77.7 Ų | 77.7 | 55% | 0.551 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -83.5 | -40.3 | 179.2 | -60 | -177.8 | 25.8 | 0 | 0 | 111.2 | R142 F143 | R142-Q145 VanDerWaalsContact CZ-CD 3.49Å; R142-Q145 WeakPolarHBondContact O-CB 3.37Å; R142-Q145 PolarHBondContact O-N 3.03Å; F143-Q145 PolarHBondContact O-N 3.35Å |
| 146 | Q | 97.9 | Very high | 98.3 | Very high | 67 Ų | 67 | 81.9 Ų | 81.9 | 31% | 0.313 | 37% | 0.374 | S | S | . | . | trans | -147.6 | 115.3 | -175.1 | -174.6 | 172 | -27.4 | 0 | 0 | 110.6 | R142 F143 Y148 L149 E153 F172 | R142-Q146 PolarHBondContact O-N 2.65Å; F143-Q146 CarbonylContact O-C 3.39Å; F143-Q146 PolarHBondContact O-N 2.72Å; Q146-Y148 VanDerWaalsContact C-N 3.29Å; Q146-Y148 WeakPolarHBondContact CG-O 3.21Å; Q146-Y148 PolarHBondContact NE2-O 3.37Å; Q146-Y148 PolarHBondContact O-N 3.43Å; Q146-L149 HydrophobicContact CB-CD2 4.32Å; Q146-L149 HydrophobicContact CG-CD2 4.13Å; Q146-E153 VanDerWaalsContact NE2-CD 3.26Å; Q146-E153 PolarHBondContact NE2-OE1 3.46Å; Q146-E153 PolarHBondContact NE2-OE2 3.2Å; Q146-E153 PolarHBondContact OE1-OE1 3.45Å; Q146-F172 WeakPolarHBondContact O-CE1 3.4Å | ||
| 147 | R | 97.5 | Very high | 98.3 | Very high | 133 Ų | 133 | 80.6 Ų | 80.6 | 50% | 0.502 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -76 | -16 | -176.3 | -68.4 | -176 | 162.4 | 96.4 | -1.6 | 113.9 | F143 R176 | F143-R147 HydrophobicContact CE1-CG 3.97Å; F143-R147 HydrophobicContact CE2-CB 4.05Å; F143-R147 HydrophobicContact CE2-CG 4.18Å; F143-R147 HydrophobicContact CZ-CB 4.03Å; F143-R147 HydrophobicContact CZ-CG 3.73Å; R147-R176 WeakPolarHBondContact O-CD 3.33Å |
| 148 | Y | 98.2 | Very high | 98.3 | Very high | 154 Ų | 154 | 74.9 Ų | 74.9 | 60% | 0.604 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -137.5 | 118.8 | -176.4 | -61.5 | -102.5 | 0 | 0 | 0 | 109.2 | Q146 | Q146-Y148 VanDerWaalsContact C-N 3.29Å; Q146-Y148 WeakPolarHBondContact CG-O 3.21Å; Q146-Y148 PolarHBondContact NE2-O 3.37Å; Q146-Y148 PolarHBondContact O-N 3.43Å |
| 149 | L | 98.1 | Very high | 98.3 | Very high | 29 Ų | 29 | 76.7 Ų | 76.7 | 15% | 0.152 | 36% | 0.363 | C | S | . | . | trans | -99.2 | 137.3 | 177.7 | -61.9 | 179.6 | 0 | 0 | 0 | 110.8 | Q146 E153 R154 L157 V168 F172 | Q146-L149 HydrophobicContact CB-CD2 4.32Å; Q146-L149 HydrophobicContact CG-CD2 4.13Å; L149-E153 HydrophobicContact CB-CB 4.27Å; L149-E153 HydrophobicContact CD2-CB 4.21Å; L149-R154 HydrophobicContact CB-CG 3.5Å; L149-R154 HydrophobicContact CD1-CG 3.97Å; L149-R154 HydrophobicContact CG-CG 4.4Å; L149-L157 HydrophobicContact CD1-CD2 3.79Å; L149-V168 HydrophobicContact CD1-CG1 4.16Å; L149-F172 HydrophobicContact CD1-CD1 4.31Å; L149-F172 HydrophobicContact CD1-CD2 4.21Å; L149-F172 HydrophobicContact CD1-CE1 3.72Å; L149-F172 HydrophobicContact CD1-CE2 3.61Å; L149-F172 HydrophobicContact CD1-CZ 3.33Å; L149-F172 HydrophobicContact CD2-CE1 4.31Å; L149-F172 HydrophobicContact CD2-CZ 4.44Å; L149-F172 HydrophobicContact CG-CD1 4.11Å; L149-F172 HydrophobicContact CG-CE1 3.59Å; L149-F172 HydrophobicContact CG-CE2 4.4Å; L149-F172 HydrophobicContact CG-CZ 3.77Å | ||
| 150 | S | 98.3 | Very high | 98.3 | Very high | 53 Ų | 53 | 82.3 Ų | 82.3 | 37% | 0.371 | 39% | 0.392 | S | S | . | . | trans | -66.9 | 172.3 | 166.2 | 68.3 | 0 | 0 | 0 | 0 | 111.3 | E153 R154 | S150-E153 VanDerWaalsContact CB-OE2 3.26Å; S150-E153 WeakPolarHBondContact CB-OE2 3.35Å; S150-E153 PolarHBondContact N-OE2 3.36Å; S150-E153 VanDerWaalsContact OG-CG 3.24Å; S150-E153 WeakPolarHBondContact OG-CG 3.15Å; S150-E153 PolarHBondContact OG-OE2 3.12Å; S150-R154 WeakPolarHBondContact O-CG 3.33Å; S150-R154 PolarHBondContact O-N 3.34Å; S150-R154 PolarHBondContact O-NE 3.33Å | ||
| 151 | A | 98.2 | Very high | 98.2 | Very high | 51 Ų | 51 | 79.5 Ų | 79.5 | 42% | 0.421 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.2 | -54.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | E153 R154 E155 | A151-E153 VanDerWaalsContact C-N 3.33Å; A151-E153 PolarHBondContact O-N 3.03Å; A151-R154 PolarHBondContact O-N 3.45Å; A151-R154 VanDerWaalsContact O-N 3.15Å; A151-E155 PolarHBondContact O-N 2.83Å; A151-E155 VanDerWaalsContact O-N 3.13Å |
| 152 | P | 98.3 | Very high | 98.2 | Very high | 89 Ų | 89 | 85.5 Ų | 85.5 | 58% | 0.578 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -64.3 | -35.9 | -177.5 | 24.3 | -35 | 0 | 0 | 0 | 112.9 | R154 E155 H156 | P152-R154 VanDerWaalsContact C-N 3.32Å; P152-R154 PolarHBondContact O-N 2.9Å; P152-E155 PolarHBondContact O-N 3.42Å; P152-H156 PolarHBondContact O-N 3.28Å |
| 153 | E | 98.4 | Very high | 98.2 | Very high | 73 Ų | 73 | 82.8 Ų | 82.8 | 34% | 0.341 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.4 | -36.5 | 176.9 | -67.8 | 165.7 | 144 | 0 | 0 | 112.1 | Q146 L149 S150 A151 L157 | Q146-E153 VanDerWaalsContact NE2-CD 3.26Å; Q146-E153 PolarHBondContact NE2-OE1 3.46Å; Q146-E153 PolarHBondContact NE2-OE2 3.2Å; Q146-E153 PolarHBondContact OE1-OE1 3.45Å; L149-E153 HydrophobicContact CB-CB 4.27Å; L149-E153 HydrophobicContact CD2-CB 4.21Å; S150-E153 VanDerWaalsContact CB-OE2 3.26Å; S150-E153 WeakPolarHBondContact CB-OE2 3.35Å; S150-E153 PolarHBondContact N-OE2 3.36Å; S150-E153 VanDerWaalsContact OG-CG 3.24Å; S150-E153 WeakPolarHBondContact OG-CG 3.15Å; S150-E153 PolarHBondContact OG-OE2 3.12Å; A151-E153 VanDerWaalsContact C-N 3.33Å; A151-E153 PolarHBondContact O-N 3.03Å; E153-L157 WeakPolarHBondContact O-CB 3.39Å; E153-L157 PolarHBondContact O-N 2.88Å |
| 154 | R | 98.6 | Very high | 98.2 | Very high | 58 Ų | 58 | 85.6 Ų | 85.6 | 22% | 0.219 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -66.5 | -39.9 | 174.8 | -76 | -175 | -72.7 | 132.9 | -3.1 | 111.6 | L149 S150 A151 P152 A158 V168 | L149-R154 HydrophobicContact CB-CG 3.5Å; L149-R154 HydrophobicContact CD1-CG 3.97Å; L149-R154 HydrophobicContact CG-CG 4.4Å; S150-R154 WeakPolarHBondContact O-CG 3.33Å; S150-R154 PolarHBondContact O-N 3.34Å; S150-R154 PolarHBondContact O-NE 3.33Å; A151-R154 PolarHBondContact O-N 3.45Å; A151-R154 VanDerWaalsContact O-N 3.15Å; P152-R154 VanDerWaalsContact C-N 3.32Å; P152-R154 PolarHBondContact O-N 2.9Å; R154-A158 WeakPolarHBondContact O-CB 3.18Å; R154-A158 PolarHBondContact O-N 2.94Å; R154-V168 HydrophobicContact CG-CG1 4.14Å |
| 155 | E | 98.6 | Very high | 98.2 | Very high | 117 Ų | 117 | 79.4 Ų | 79.4 | 55% | 0.547 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -62.7 | -46.7 | 176.6 | -70.1 | -179 | 178.1 | 0 | 0 | 111.3 | A151 P152 L157 A158 S159 P165 | A151-E155 PolarHBondContact O-N 2.83Å; A151-E155 VanDerWaalsContact O-N 3.13Å; P152-E155 PolarHBondContact O-N 3.42Å; E155-L157 PolarHBondContact O-N 3.48Å; E155-A158 WeakPolarHBondContact O-CB 3.42Å; E155-A158 PolarHBondContact O-N 3.38Å; E155-S159 PolarHBondContact O-N 3.49Å; E155-S159 PolarHBondContact O-OG 3.13Å; E155-P165 HydrophobicContact CG-CB 4.48Å; E155-P165 HydrophobicContact CG-CG 4.12Å |
| 156 | H | 98.5 | Very high | 98.3 | Very high | 124 Ų | 124 | 77.4 Ų | 77.4 | 57% | 0.574 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -59.8 | -48.8 | 176.9 | -177.8 | 66.5 | 0 | 0 | 0 | 112.2 | P152 A158 S159 L160 | P152-H156 PolarHBondContact O-N 3.28Å; H156-A158 PolarHBondContact O-N 3.25Å; H156-S159 PolarHBondContact O-N 3.27Å; H156-L160 WeakPolarHBondContact O-CG 3.46Å; H156-L160 PolarHBondContact O-N 2.98Å; H156-L160 VanDerWaalsContact O-N 3.15Å |
| 157 | L | 98.5 | Very high | 98.3 | Very high | 6 Ų | 6 | 77.7 Ų | 77.7 | 3% | 0.031 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.8 | -43.1 | 178.9 | -178.3 | 56.4 | 0 | 0 | 0 | 112 | L139 R142 L149 E153 E155 S159 L160 I161 V168 F172 | L139-L157 HydrophobicContact CD2-CD2 4.17Å; R142-L157 HydrophobicContact CB-CD2 4.07Å; R142-L157 HydrophobicContact CG-CD1 3.74Å; R142-L157 HydrophobicContact CG-CD2 3.87Å; R142-L157 HydrophobicContact CG-CG 4.42Å; L149-L157 HydrophobicContact CD1-CD2 3.79Å; E153-L157 WeakPolarHBondContact O-CB 3.39Å; E153-L157 PolarHBondContact O-N 2.88Å; E155-L157 PolarHBondContact O-N 3.48Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.39Å; L157-L160 PolarHBondContact O-N 2.91Å; L157-I161 HydrophobicContact CD1-CD1 4.31Å; L157-I161 HydrophobicContact CD1-CG2 4.18Å; L157-I161 HydrophobicContact CG-CD1 4.16Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 3.49Å; L157-I161 VanDerWaalsContact O-N 3.13Å; L157-V168 HydrophobicContact CD2-CG1 3.96Å; L157-F172 HydrophobicContact CD2-CE2 3.99Å; L157-F172 HydrophobicContact CD2-CZ 4.28Å |
| 158 | A | 98.6 | Very high | 98.3 | Very high | 3 Ų | 3 | 71.3 Ų | 71.3 | 3% | 0.025 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -55.9 | -45.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | R154 E155 H156 L160 I161 R162 L163 P165 V168 | R154-A158 WeakPolarHBondContact O-CB 3.18Å; R154-A158 PolarHBondContact O-N 2.94Å; E155-A158 WeakPolarHBondContact O-CB 3.42Å; E155-A158 PolarHBondContact O-N 3.38Å; H156-A158 PolarHBondContact O-N 3.25Å; A158-L160 PolarHBondContact O-N 3.02Å; A158-I161 PolarHBondContact O-N 3.45Å; A158-R162 WeakPolarHBondContact O-CA 3.48Å; A158-R162 PolarHBondContact O-N 3.21Å; A158-L163 CarbonylContact C-O 3.44Å; A158-L163 VanDerWaalsContact CB-O 3.28Å; A158-L163 WeakPolarHBondContact CB-O 3.31Å; A158-L163 PolarHBondContact O-N 3.21Å; A158-L163 VanDerWaalsContact O-O 3.12Å; A158-P165 HydrophobicContact CB-CB 4.49Å; A158-P165 HydrophobicContact CB-CG 4.01Å; A158-V168 HydrophobicContact CB-CG2 4.02Å |
| 159 | S | 98.4 | Very high | 98.4 | Very high | 95 Ų | 95 | 68.8 Ų | 68.8 | 66% | 0.664 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -61.2 | -43 | 175.8 | -63 | 0 | 0 | 0 | 0 | 112.6 | E155 H156 L157 | E155-S159 PolarHBondContact O-N 3.49Å; E155-S159 PolarHBondContact O-OG 3.13Å; H156-S159 PolarHBondContact O-N 3.27Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.39Å |
| 160 | L | 97.9 | Very high | 98.4 | Very high | 117 Ų | 117 | 71.1 Ų | 71.1 | 61% | 0.613 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.5 | -42.8 | -179.7 | -70.6 | 175.2 | 0 | 0 | 0 | 113.2 | H156 L157 A158 | H156-L160 WeakPolarHBondContact O-CG 3.46Å; H156-L160 PolarHBondContact O-N 2.98Å; H156-L160 VanDerWaalsContact O-N 3.15Å; L157-L160 PolarHBondContact O-N 2.91Å; A158-L160 PolarHBondContact O-N 3.02Å |
| 161 | I | 98.1 | Very high | 98.4 | Very high | 16 Ų | 16 | 70.1 Ų | 70.1 | 8% | 0.082 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -100.3 | 8.3 | -174.6 | 70.4 | -175 | 0 | 0 | 0 | 113.4 | Q135 E138 L139 L157 A158 L163 V168 | Q135-I161 HydrophobicContact CG-CB 4.38Å; Q135-I161 PolarHBondContact NE2-O 3.46Å; E138-I161 HydrophobicContact CB-CG2 3.64Å; E138-I161 HydrophobicContact CG-CG2 4.12Å; L139-I161 HydrophobicContact CD1-CD1 4.23Å; L139-I161 HydrophobicContact CD2-CD1 3.64Å; L139-I161 HydrophobicContact CG-CD1 3.7Å; L157-I161 HydrophobicContact CD1-CD1 4.31Å; L157-I161 HydrophobicContact CD1-CG2 4.18Å; L157-I161 HydrophobicContact CG-CD1 4.16Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 3.49Å; L157-I161 VanDerWaalsContact O-N 3.13Å; A158-I161 PolarHBondContact O-N 3.45Å; I161-L163 VanDerWaalsContact C-N 3.31Å; I161-L163 HydrophobicContact CD1-CB 4.42Å; I161-L163 HydrophobicContact CD1-CD1 3.69Å; I161-L163 HydrophobicContact CD1-CG 4.18Å; I161-L163 HydrophobicContact CG1-CB 4.04Å; I161-L163 HydrophobicContact CG1-CD1 3.99Å; I161-L163 HydrophobicContact CG1-CG 3.89Å; I161-L163 PolarHBondContact O-N 3.17Å; I161-V168 HydrophobicContact CD1-CG2 4.38Å |
| 162 | R | 98.4 | Very high | 98.4 | Very high | 224 Ų | 224 | 68 Ų | 68 | 85% | 0.845 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.4 | 45 | -179.4 | -50.3 | -176.8 | 78.9 | -171.8 | 5.7 | 112.6 | A158 | A158-R162 WeakPolarHBondContact O-CA 3.48Å; A158-R162 PolarHBondContact O-N 3.21Å |
| 163 | L | 98 | Very high | 98.4 | Very high | 21 Ų | 21 | 69 Ų | 69 | 11% | 0.11 | 34% | 0.338 | C | S | . | . | trans | -114.9 | 169.4 | 171.4 | -67.5 | -176.5 | 0 | 0 | 0 | 109.8 | F131 L139 A158 I161 Q167 V168 | F131-L163 HydrophobicContact CD1-CD1 3.97Å; F131-L163 HydrophobicContact CD1-CD2 3.8Å; F131-L163 HydrophobicContact CE1-CD1 3.92Å; F131-L163 HydrophobicContact CE1-CD2 3.73Å; F131-L163 HydrophobicContact CG-CD1 4.37Å; F131-L163 HydrophobicContact CZ-CD1 4.25Å; L139-L163 HydrophobicContact CD1-CD1 4.18Å; A158-L163 CarbonylContact C-O 3.44Å; A158-L163 VanDerWaalsContact CB-O 3.28Å; A158-L163 WeakPolarHBondContact CB-O 3.31Å; A158-L163 PolarHBondContact O-N 3.21Å; A158-L163 VanDerWaalsContact O-O 3.12Å; I161-L163 VanDerWaalsContact C-N 3.31Å; I161-L163 HydrophobicContact CD1-CB 4.42Å; I161-L163 HydrophobicContact CD1-CD1 3.69Å; I161-L163 HydrophobicContact CD1-CG 4.18Å; I161-L163 HydrophobicContact CG1-CB 4.04Å; I161-L163 HydrophobicContact CG1-CD1 3.99Å; I161-L163 HydrophobicContact CG1-CG 3.89Å; I161-L163 PolarHBondContact O-N 3.17Å; L163-Q167 HydrophobicContact CB-CB 4.39Å; L163-V168 HydrophobicContact CB-CG2 4.33Å | ||
| 164 | T | 98.5 | Very high | 98.4 | Very high | 68 Ų | 68 | 70.3 Ų | 70.3 | 42% | 0.417 | 35% | 0.348 | S | S | . | . | trans | -84.4 | 150 | 171.5 | 59.8 | 0 | 0 | 0 | 0 | 111.1 | T166 Q167 V168 | T164-T166 PolarHBondContact O-N 2.66Å; T164-T166 VanDerWaalsContact O-N 3.08Å; T164-Q167 WeakPolarHBondContact O-CB 3.17Å; T164-Q167 PolarHBondContact O-N 3.42Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.33Å; T164-Q167 VanDerWaalsContact OG1-CD 3.25Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.26Å; T164-Q167 PolarHBondContact OG1-N 3.04Å; T164-Q167 PolarHBondContact OG1-OE1 3.01Å; T164-V168 PolarHBondContact O-N 3.18Å | ||
| 165 | P | 98.4 | Very high | 98.4 | Very high | 51 Ų | 51 | 69.1 Ų | 69.1 | 33% | 0.331 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -55.2 | -30.2 | 175.2 | -25.9 | 34.2 | 0 | 0 | 0 | 113.1 | E155 A158 K169 | E155-P165 HydrophobicContact CG-CB 4.48Å; E155-P165 HydrophobicContact CG-CG 4.12Å; A158-P165 HydrophobicContact CB-CB 4.49Å; A158-P165 HydrophobicContact CB-CG 4.01Å; P165-K169 WeakPolarHBondContact O-CB 3.42Å; P165-K169 PolarHBondContact O-N 3.25Å |
| 166 | T | 98.4 | Very high | 98.3 | Very high | 77 Ų | 77 | 67.5 Ų | 67.5 | 47% | 0.472 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -70.2 | -42.4 | 174.7 | -61.5 | 0 | 0 | 0 | 0 | 112.5 | T164 V168 K169 I170 | T164-T166 PolarHBondContact O-N 2.66Å; T164-T166 VanDerWaalsContact O-N 3.08Å; T166-V168 VanDerWaalsContact C-N 3.32Å; T166-V168 PolarHBondContact O-N 3.18Å; T166-K169 WeakPolarHBondContact O-CB 3.14Å; T166-K169 PolarHBondContact O-N 3.34Å; T166-I170 HydrophobicContact CG2-CD1 3.98Å; T166-I170 WeakPolarHBondContact O-CG1 3.45Å; T166-I170 PolarHBondContact O-N 2.93Å |
| 167 | Q | 98.3 | Very high | 98.3 | Very high | 72 Ų | 72 | 67.3 Ų | 67.3 | 34% | 0.336 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 174.2 | -77.7 | 164.9 | -38.9 | 0 | 0 | 111.3 | F131 L163 T164 I170 W171 | F131-Q167 HydrophobicContact CE1-CB 4.41Å; F131-Q167 HydrophobicContact CE1-CG 4.43Å; F131-Q167 HydrophobicContact CZ-CB 4.06Å; F131-Q167 HydrophobicContact CZ-CG 4.32Å; L163-Q167 HydrophobicContact CB-CB 4.39Å; T164-Q167 WeakPolarHBondContact O-CB 3.17Å; T164-Q167 PolarHBondContact O-N 3.42Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.33Å; T164-Q167 VanDerWaalsContact OG1-CD 3.25Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.26Å; T164-Q167 PolarHBondContact OG1-N 3.04Å; T164-Q167 PolarHBondContact OG1-OE1 3.01Å; Q167-I170 PolarHBondContact O-N 3.26Å; Q167-W171 WeakPolarHBondContact O-CB 3.3Å; Q167-W171 PolarHBondContact O-N 3.21Å |
| 168 | V | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 73.3 Ų | 73.3 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.1 | -46.7 | 173.2 | 178.7 | 0 | 0 | 0 | 0 | 110.3 | L139 L149 R154 L157 A158 I161 L163 T164 T166 I170 W171 F172 | L139-V168 HydrophobicContact CD2-CG1 4.31Å; L139-V168 HydrophobicContact CD2-CG2 4.45Å; L149-V168 HydrophobicContact CD1-CG1 4.16Å; R154-V168 HydrophobicContact CG-CG1 4.14Å; L157-V168 HydrophobicContact CD2-CG1 3.96Å; A158-V168 HydrophobicContact CB-CG2 4.02Å; I161-V168 HydrophobicContact CD1-CG2 4.38Å; L163-V168 HydrophobicContact CB-CG2 4.33Å; T164-V168 PolarHBondContact O-N 3.18Å; T166-V168 VanDerWaalsContact C-N 3.32Å; T166-V168 PolarHBondContact O-N 3.18Å; V168-I170 PolarHBondContact O-N 3.26Å; V168-W171 PolarHBondContact O-N 3.48Å; V168-F172 HydrophobicContact CG1-CD2 3.81Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 VanDerWaalsContact O-CD2 3.31Å; V168-F172 WeakPolarHBondContact O-CD2 3.44Å; V168-F172 PolarHBondContact O-N 2.99Å |
| 169 | K | 98.4 | Very high | 97.9 | Very high | 100 Ų | 100 | 77.5 Ų | 77.5 | 44% | 0.435 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -54.7 | -50.7 | 176.1 | -171.5 | -176.1 | 79 | 176.3 | 0 | 112.2 | P165 T166 F172 Q173 | P165-K169 WeakPolarHBondContact O-CB 3.42Å; P165-K169 PolarHBondContact O-N 3.25Å; T166-K169 WeakPolarHBondContact O-CB 3.14Å; T166-K169 PolarHBondContact O-N 3.34Å; K169-F172 PolarHBondContact O-N 2.97Å; K169-Q173 WeakPolarHBondContact O-CB 3.43Å; K169-Q173 PolarHBondContact O-N 3.4Å |
| 170 | I | 98.4 | Very high | 97.7 | Very high | 78 Ų | 78 | 79.7 Ų | 79.7 | 40% | 0.4 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.6 | -43.5 | -179.1 | -68.9 | 168.1 | 0 | 0 | 0 | 110.3 | T166 Q167 V168 F172 Q173 N174 | T166-I170 HydrophobicContact CG2-CD1 3.98Å; T166-I170 WeakPolarHBondContact O-CG1 3.45Å; T166-I170 PolarHBondContact O-N 2.93Å; Q167-I170 PolarHBondContact O-N 3.26Å; V168-I170 PolarHBondContact O-N 3.26Å; I170-F172 PolarHBondContact O-N 3.22Å; I170-Q173 PolarHBondContact O-N 3.29Å; I170-N174 WeakPolarHBondContact O-CB 3.34Å; I170-N174 VanDerWaalsContact O-CG 3.3Å; I170-N174 PolarHBondContact O-N 3.49Å; I170-N174 PolarHBondContact O-ND2 2.88Å |
| 171 | W | 98.4 | Very high | 97.5 | Very high | 32 Ų | 32 | 81.6 Ų | 81.6 | 12% | 0.121 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 178.2 | -170.9 | 96.7 | 0 | 0 | 0 | 111.5 | F131 L139 E140 F143 Q167 V168 Q173 N174 H175 | F131-W171 AromaticContact CD2-CD1 3.75Å; F131-W171 HydrophobicContact CE2-CB 4.28Å; F131-W171 AromaticContact CE2-CD1 3.66Å; F131-W171 HydrophobicContact CE2-CG 4.32Å; L139-W171 HydrophobicContact CB-CD2 3.88Å; L139-W171 HydrophobicContact CB-CE3 3.86Å; L139-W171 HydrophobicContact CB-CH2 3.67Å; L139-W171 HydrophobicContact CB-CZ2 3.67Å; L139-W171 HydrophobicContact CB-CZ3 3.77Å; L139-W171 HydrophobicContact CD1-CB 4.48Å; L139-W171 HydrophobicContact CD1-CD2 3.85Å; L139-W171 HydrophobicContact CD1-CG 3.8Å; L139-W171 HydrophobicContact CD2-CD2 4.19Å; L139-W171 HydrophobicContact CD2-CE3 4.1Å; L139-W171 HydrophobicContact CD2-CG 4.45Å; L139-W171 HydrophobicContact CG-CD2 4.2Å; L139-W171 HydrophobicContact CG-CE3 4.38Å; E140-W171 HydrophobicContact CB-CH2 4.48Å; E140-W171 HydrophobicContact CG-CH2 3.8Å; E140-W171 HydrophobicContact CG-CZ2 3.79Å; F143-W171 HydrophobicContact CB-CH2 4.34Å; F143-W171 HydrophobicContact CB-CZ3 4.06Å; F143-W171 HydrophobicContact CD2-CZ3 4.35Å; F143-W171 HydrophobicContact CG-CZ3 4.39Å; Q167-W171 WeakPolarHBondContact O-CB 3.3Å; Q167-W171 PolarHBondContact O-N 3.21Å; V168-W171 PolarHBondContact O-N 3.48Å; W171-Q173 VanDerWaalsContact C-N 3.3Å; W171-Q173 PolarHBondContact O-N 3.3Å; W171-N174 PolarHBondContact O-N 3.37Å; W171-H175 HydrophobicContact CE3-CB 4.1Å; W171-H175 HydrophobicContact CH2-CB 4.17Å; W171-H175 AromaticContact CH2-CE1 3.85Å; W171-H175 AromaticContact CH2-CG 3.78Å; W171-H175 AromaticContact CH2-ND1 3.21Å; W171-H175 WeakPolarHBondContact CH2-ND1 3.27Å; W171-H175 AromaticContact CZ2-ND1 3.56Å; W171-H175 HydrophobicContact CZ3-CB 3.88Å; W171-H175 AromaticContact CZ3-CG 3.88Å; W171-H175 AromaticContact CZ3-ND1 3.81Å; W171-H175 VanDerWaalsContact O-CB 3.3Å; W171-H175 WeakPolarHBondContact O-CB 3.29Å; W171-H175 PolarHBondContact O-N 3.16Å |
| 172 | F | 98.6 | Very high | 97.1 | Very high | 6 Ų | 6 | 82.9 Ų | 82.9 | 3% | 0.026 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.4 | -34.8 | 177 | -90 | -106.5 | 0 | 0 | 0 | 112.5 | L139 R142 F143 Q146 L149 L157 V168 K169 I170 R176 | L139-F172 HydrophobicContact CD2-CD2 4.45Å; L139-F172 HydrophobicContact CD2-CE2 3.96Å; R142-F172 HydrophobicContact CB-CZ 4.25Å; F143-F172 HydrophobicContact CB-CE1 4.29Å; F143-F172 HydrophobicContact CB-CZ 4.4Å; F143-F172 AromaticContact CD2-CD1 3.77Å; F143-F172 HydrophobicContact CD2-CD1 3.77Å; F143-F172 AromaticContact CD2-CE1 3.76Å; F143-F172 HydrophobicContact CD2-CE1 3.76Å; F143-F172 HydrophobicContact CE2-CD1 4.33Å; Q146-F172 WeakPolarHBondContact O-CE1 3.4Å; L149-F172 HydrophobicContact CD1-CD1 4.31Å; L149-F172 HydrophobicContact CD1-CD2 4.21Å; L149-F172 HydrophobicContact CD1-CE1 3.72Å; L149-F172 HydrophobicContact CD1-CE2 3.61Å; L149-F172 HydrophobicContact CD1-CZ 3.33Å; L149-F172 HydrophobicContact CD2-CE1 4.31Å; L149-F172 HydrophobicContact CD2-CZ 4.44Å; L149-F172 HydrophobicContact CG-CD1 4.11Å; L149-F172 HydrophobicContact CG-CE1 3.59Å; L149-F172 HydrophobicContact CG-CE2 4.4Å; L149-F172 HydrophobicContact CG-CZ 3.77Å; L157-F172 HydrophobicContact CD2-CE2 3.99Å; L157-F172 HydrophobicContact CD2-CZ 4.28Å; V168-F172 HydrophobicContact CG1-CD2 3.81Å; V168-F172 HydrophobicContact CG1-CE2 3.87Å; V168-F172 VanDerWaalsContact O-CD2 3.31Å; V168-F172 WeakPolarHBondContact O-CD2 3.44Å; V168-F172 PolarHBondContact O-N 2.99Å; K169-F172 PolarHBondContact O-N 2.97Å; I170-F172 PolarHBondContact O-N 3.22Å; F172-R176 WeakPolarHBondContact O-CB 3.49Å; F172-R176 VanDerWaalsContact O-CG 3.29Å; F172-R176 WeakPolarHBondContact O-CG 3.33Å; F172-R176 PolarHBondContact O-N 3.02Å; F172-R176 VanDerWaalsContact O-N 3.12Å; F172-R176 PolarHBondContact O-NE 3.01Å; F172-R176 VanDerWaalsContact O-NE 3.13Å |
| 173 | Q | 98.4 | Very high | 96.4 | Very high | 110 Ų | 110 | 81.2 Ų | 81.2 | 51% | 0.514 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -66.9 | -49.1 | 174.1 | -172.1 | 169.9 | 22.9 | 0 | 0 | 111.6 | K169 I170 W171 H175 R176 Y177 | K169-Q173 WeakPolarHBondContact O-CB 3.43Å; K169-Q173 PolarHBondContact O-N 3.4Å; I170-Q173 PolarHBondContact O-N 3.29Å; W171-Q173 VanDerWaalsContact C-N 3.3Å; W171-Q173 PolarHBondContact O-N 3.3Å; Q173-H175 VanDerWaalsContact C-N 3.32Å; Q173-H175 PolarHBondContact O-N 3.39Å; Q173-R176 PolarHBondContact O-N 3.3Å; Q173-Y177 PolarHBondContact O-N 3.4Å |
| 174 | N | 98.1 | Very high | 95.6 | Very high | 101 Ų | 101 | 83.1 Ų | 83.1 | 54% | 0.54 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 177.7 | -72.4 | -17.2 | 0 | 0 | 0 | 111.7 | I170 W171 Y177 K178 | I170-N174 WeakPolarHBondContact O-CB 3.34Å; I170-N174 VanDerWaalsContact O-CG 3.3Å; I170-N174 PolarHBondContact O-N 3.49Å; I170-N174 PolarHBondContact O-ND2 2.88Å; W171-N174 PolarHBondContact O-N 3.37Å; N174-Y177 PolarHBondContact O-N 3.46Å; N174-K178 WeakPolarHBondContact O-CB 3.46Å; N174-K178 PolarHBondContact O-N 3.37Å |
| 175 | H | 97.9 | Very high | 94.5 | Very high | 34 Ų | 34 | 86.8 Ų | 86.8 | 16% | 0.157 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -64 | -46.4 | 179.3 | -163.4 | 100.5 | 0 | 0 | 0 | 111.5 | F143 W171 Q173 Y177 K178 M179 | F143-H175 AromaticContact CD1-CD2 3.35Å; F143-H175 WeakPolarHBondContact CD1-CD2 3.49Å; F143-H175 AromaticContact CD1-NE2 3.33Å; F143-H175 VanDerWaalsContact CD1-NE2 3.33Å; F143-H175 WeakPolarHBondContact CD1-NE2 3.47Å; F143-H175 HydrophobicContact CD2-CB 4.48Å; F143-H175 AromaticContact CD2-CD2 3.84Å; F143-H175 AromaticContact CE1-CD2 3.15Å; F143-H175 WeakPolarHBondContact CE1-CD2 3.47Å; F143-H175 AromaticContact CE1-NE2 3.4Å; F143-H175 WeakPolarHBondContact CE1-NE2 3.4Å; F143-H175 HydrophobicContact CE2-CB 4.37Å; F143-H175 AromaticContact CE2-CD2 3.67Å; F143-H175 AromaticContact CG-CD2 3.7Å; F143-H175 AromaticContact CG-NE2 3.96Å; F143-H175 AromaticContact CZ-CD2 3.33Å; F143-H175 WeakPolarHBondContact CZ-CD2 3.36Å; W171-H175 HydrophobicContact CE3-CB 4.1Å; W171-H175 HydrophobicContact CH2-CB 4.17Å; W171-H175 AromaticContact CH2-CE1 3.85Å; W171-H175 AromaticContact CH2-CG 3.78Å; W171-H175 AromaticContact CH2-ND1 3.21Å; W171-H175 WeakPolarHBondContact CH2-ND1 3.27Å; W171-H175 AromaticContact CZ2-ND1 3.56Å; W171-H175 HydrophobicContact CZ3-CB 3.88Å; W171-H175 AromaticContact CZ3-CG 3.88Å; W171-H175 AromaticContact CZ3-ND1 3.81Å; W171-H175 VanDerWaalsContact O-CB 3.3Å; W171-H175 WeakPolarHBondContact O-CB 3.29Å; W171-H175 PolarHBondContact O-N 3.16Å; Q173-H175 VanDerWaalsContact C-N 3.32Å; Q173-H175 PolarHBondContact O-N 3.39Å; H175-Y177 VanDerWaalsContact C-N 3.34Å; H175-Y177 PolarHBondContact O-N 3.42Å; H175-K178 PolarHBondContact O-N 3.46Å; H175-M179 PolarHBondContact O-N 3.49Å |
| 176 | R | 97.8 | Very high | 93.1 | Very high | 82 Ų | 82 | 93 Ų | 93 | 31% | 0.309 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 174.1 | -74.1 | 180 | -70.5 | 154.7 | -3.6 | 112 | F143 R147 F172 Q173 M179 K180 | F143-R176 HydrophobicContact CE2-CG 3.76Å; F143-R176 HydrophobicContact CZ-CG 4Å; R147-R176 WeakPolarHBondContact O-CD 3.33Å; F172-R176 WeakPolarHBondContact O-CB 3.49Å; F172-R176 VanDerWaalsContact O-CG 3.29Å; F172-R176 WeakPolarHBondContact O-CG 3.33Å; F172-R176 PolarHBondContact O-N 3.02Å; F172-R176 VanDerWaalsContact O-N 3.12Å; F172-R176 PolarHBondContact O-NE 3.01Å; F172-R176 VanDerWaalsContact O-NE 3.13Å; Q173-R176 PolarHBondContact O-N 3.3Å; R176-M179 PolarHBondContact O-N 3.5Å; R176-K180 WeakPolarHBondContact O-CB 3.5Å; R176-K180 PolarHBondContact O-N 3.14Å |
| 177 | Y | 97.8 | Very high | 91.2 | Very high | 121 Ų | 121 | 92.4 Ų | 92.4 | 48% | 0.475 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.5 | -45 | 178.3 | -173.5 | -97.3 | 0 | 0 | 0 | 111.9 | Q173 N174 H175 M179 K180 R181 | Q173-Y177 PolarHBondContact O-N 3.4Å; N174-Y177 PolarHBondContact O-N 3.46Å; H175-Y177 VanDerWaalsContact C-N 3.34Å; H175-Y177 PolarHBondContact O-N 3.42Å; Y177-M179 VanDerWaalsContact C-N 3.35Å; Y177-M179 PolarHBondContact O-N 3.4Å; Y177-K180 PolarHBondContact O-N 2.9Å; Y177-R181 WeakPolarHBondContact O-CB 3.45Å; Y177-R181 PolarHBondContact O-N 3.47Å; Y177-R181 PolarHBondContact OH-NH1 3.28Å |
| 178 | K | 95.8 | Very high | 89.1 | Confident | 132 Ų | 132 | 95.4 Ų | 95.4 | 57% | 0.574 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -58.5 | -45.8 | 176.1 | -172.3 | 177.6 | 69.4 | 173.3 | 0 | 111.6 | N174 H175 K180 R181 A182 | N174-K178 WeakPolarHBondContact O-CB 3.46Å; N174-K178 PolarHBondContact O-N 3.37Å; H175-K178 PolarHBondContact O-N 3.46Å; K178-K180 PolarHBondContact O-N 3.48Å; K178-R181 PolarHBondContact O-N 3.29Å; K178-A182 WeakPolarHBondContact O-CB 3.17Å; K178-A182 PolarHBondContact O-N 2.68Å |
| 179 | M | 93.2 | Very high | 86.6 | Confident | 91 Ų | 91 | 103.2 Ų | 103.2 | 45% | 0.448 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 179.8 | -148 | -169.5 | 93.3 | 0 | 0 | 111.9 | F143 H175 R176 Y177 R183 | F143-M179 HydrophobicContact CE1-SD 4.16Å; H175-M179 PolarHBondContact O-N 3.49Å; R176-M179 PolarHBondContact O-N 3.5Å; Y177-M179 VanDerWaalsContact C-N 3.35Å; Y177-M179 PolarHBondContact O-N 3.4Å; M179-R183 PolarHBondContact O-N 3.37Å |
| 180 | K | 93.9 | Very high | 84.4 | Confident | 141 Ų | 141 | 104.7 Ų | 104.7 | 61% | 0.613 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.6 | -45.9 | 174.3 | -174.9 | 179.2 | 68.9 | 171 | 0 | 111.4 | R176 Y177 K178 R183 A184 | R176-K180 WeakPolarHBondContact O-CB 3.5Å; R176-K180 PolarHBondContact O-N 3.14Å; Y177-K180 PolarHBondContact O-N 2.9Å; K178-K180 PolarHBondContact O-N 3.48Å; K180-R183 PolarHBondContact O-N 3.31Å; K180-A184 PolarHBondContact O-N 3.29Å |
| 181 | R | 93.6 | Very high | 82 | Confident | 157 Ų | 157 | 105.8 Ų | 105.8 | 59% | 0.592 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.4 | -42.3 | -178.8 | -165.6 | 170.7 | -175.7 | 122.7 | -1.1 | 111.9 | Y177 K178 R183 A184 E185 | Y177-R181 WeakPolarHBondContact O-CB 3.45Å; Y177-R181 PolarHBondContact O-N 3.47Å; Y177-R181 PolarHBondContact OH-NH1 3.28Å; K178-R181 PolarHBondContact O-N 3.29Å; R181-R183 VanDerWaalsContact C-N 3.27Å; R181-R183 PolarHBondContact O-N 3.28Å; R181-A184 PolarHBondContact O-N 3.45Å; R181-E185 PolarHBondContact O-N 3.28Å |
| 182 | A | 90.8 | Very high | 79.8 | Confident | 43 Ų | 43 | 113.3 Ų | 113.3 | 36% | 0.355 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.1 | -33.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | K178 K186 | K178-A182 WeakPolarHBondContact O-CB 3.17Å; K178-A182 PolarHBondContact O-N 2.68Å; A182-K186 WeakPolarHBondContact O-CG 3.34Å; A182-K186 PolarHBondContact O-N 2.72Å; A182-K186 VanDerWaalsContact O-N 3.17Å |
| 183 | R | 82.6 | Confident | 77.5 | Confident | 189 Ų | 189 | 119.2 Ų | 119.2 | 71% | 0.713 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -71.8 | -36.6 | 175.4 | -169.8 | 176.4 | -178.8 | 173.9 | 0.3 | 112.3 | M179 K180 R181 G187 | M179-R183 PolarHBondContact O-N 3.37Å; K180-R183 PolarHBondContact O-N 3.31Å; R181-R183 VanDerWaalsContact C-N 3.27Å; R181-R183 PolarHBondContact O-N 3.28Å; R183-G187 PolarHBondContact O-N 3.1Å |
| 184 | A | 81.5 | Confident | 75.3 | Confident | 60 Ų | 60 | 118 Ų | 118 | 50% | 0.496 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -68.8 | -40.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | K180 R181 G187 M188 | K180-A184 PolarHBondContact O-N 3.29Å; R181-A184 PolarHBondContact O-N 3.45Å; A184-G187 PolarHBondContact O-N 2.83Å; A184-M188 PolarHBondContact O-N 3.34Å |
| 185 | E | 76.3 | Confident | 73.1 | Confident | 145 Ų | 145 | 117.9 Ų | 117.9 | 68% | 0.678 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65.4 | -43.4 | 177.4 | -172.4 | -175.2 | 179.3 | 0 | 0 | 112.1 | R181 G187 M188 | R181-E185 PolarHBondContact O-N 3.28Å; E185-G187 PolarHBondContact O-N 3.39Å; E185-M188 PolarHBondContact O-N 3.44Å |
| 186 | K | 68.1 | Low | 71.3 | Confident | 182 Ų | 182 | 121.7 Ų | 121.7 | 79% | 0.791 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.3 | -21 | 175.1 | -75.1 | -176.1 | 175 | -170 | 0 | 113.9 | A182 M188 | A182-K186 WeakPolarHBondContact O-CG 3.34Å; A182-K186 PolarHBondContact O-N 2.72Å; A182-K186 VanDerWaalsContact O-N 3.17Å; K186-M188 VanDerWaalsContact C-N 3.28Å |
| 187 | G | 59.6 | Low | 69.3 | Low | 65 Ų | 65 | 127.7 Ų | 127.7 | 67% | 0.67 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -5.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114 | R183 A184 E185 | R183-G187 PolarHBondContact O-N 3.1Å; A184-G187 PolarHBondContact O-N 2.83Å; E185-G187 PolarHBondContact O-N 3.39Å |
| 188 | M | 53.2 | Low | 67.4 | Low | 135 Ų | 135 | 133.6 Ų | 133.6 | 67% | 0.665 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | 24.3 | -177 | -72.8 | -175.9 | 145.9 | 0 | 0 | 113 | A184 E185 K186 | A184-M188 PolarHBondContact O-N 3.34Å; E185-M188 PolarHBondContact O-N 3.44Å; K186-M188 VanDerWaalsContact C-N 3.28Å |
| 189 | E | 47.3 | Very low | 65.7 | Low | 163 Ų | 163 | 133.2 Ų | 133.2 | 76% | 0.762 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -96.2 | 15.7 | 175.4 | -141.5 | -87.2 | 140.5 | 0 | 0 | 113 | ||
| 190 | V | 50.6 | Low | 64 | Low | 132 Ų | 132 | 133.2 Ų | 133.2 | 80% | 0.8 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -126 | 13.1 | 174.3 | -173.4 | 0 | 0 | 0 | 0 | 112.4 | ||
| 191 | T | 49.1 | Very low | 62.4 | Low | 101 Ų | 101 | 132.1 Ų | 132.1 | 62% | 0.62 | 70% | 0.696 | S | S | * | * | trans | -137.7 | 98.6 | 167.7 | -42 | 0 | 0 | 0 | 0 | 107.8 | L193 | T191-L193 PolarHBondContact O-N 2.74Š| ||
| 192 | H | 52.1 | Low | 60.9 | Low | 189 Ų | 189 | 130 Ų | 130 | 88% | 0.875 | 70% | 0.702 | S | S | * | * | trans | -48.7 | 85 | 157.1 | -66.2 | -93.8 | 0 | 0 | 0 | 108.3 | ||||
| 193 | L | 50.6 | Low | 59.6 | Low | 130 Ų | 130 | 133.7 Ų | 133.7 | 68% | 0.681 | 72% | 0.72 | S | S | * | * | trans | -62.2 | 126.1 | 166 | -71.7 | 176.3 | 0 | 0 | 0 | 105 | T191 S195 | T191-L193 PolarHBondContact O-N 2.74Å; L193-S195 PolarHBondContact O-N 2.99Å; L193-S195 VanDerWaalsContact O-N 3.1Å | ||
| 194 | P | 51.8 | Low | 58.5 | Low | 86 Ų | 86 | 133 Ų | 133 | 56% | 0.558 | 73% | 0.729 | S | S | * | * | trans | -56.2 | 127.8 | 176.7 | 23.8 | -31.3 | 0 | 0 | 0 | 106.7 | ||||
| 195 | S | 50.8 | Low | 57.5 | Low | 97 Ų | 97 | 135.4 Ų | 135.4 | 68% | 0.678 | 74% | 0.738 | S | S | * | * | trans | -18.8 | 127.8 | 166.1 | 177.7 | 0 | 0 | 0 | 0 | 110.9 | L193 R197 | L193-S195 PolarHBondContact O-N 2.99Å; L193-S195 VanDerWaalsContact O-N 3.1Å; S195-R197 WeakPolarHBondContact O-CA 3.42Å; S195-R197 PolarHBondContact O-N 3.41Å | ||
| 196 | P | 60.7 | Low | 56.3 | Low | 115 Ų | 115 | 139.3 Ų | 139.3 | 75% | 0.747 | 75% | 0.746 | S | S | * | * | trans | -47.3 | 105.2 | -178.8 | -23.3 | 30.3 | 0 | 0 | 0 | 107.9 | R198 | P196-R198 PolarHBondContact O-N 3.38Š| ||
| 197 | R | 55.9 | Low | 55.6 | Low | 208 Ų | 208 | 137.6 Ų | 137.6 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | -59.8 | 111.6 | -173.4 | -65.3 | -174 | -154.4 | -156.4 | 5.4 | 104.4 | S195 V199 | S195-R197 WeakPolarHBondContact O-CA 3.42Å; S195-R197 PolarHBondContact O-N 3.41Å; R197-V199 VanDerWaalsContact C-N 3.32Å; R197-V199 PolarHBondContact O-N 3.19Å | ||
| 198 | R | 58.9 | Low | 55.2 | Low | 244 Ų | 244 | 138 Ų | 138 | 92% | 0.921 | 75% | 0.75 | S | S | * | * | trans | -54.2 | 105.3 | 173 | -71.4 | -177.7 | 170.2 | -173.8 | -3.2 | 105.3 | P196 A200 | P196-R198 PolarHBondContact O-N 3.38Å; R198-A200 PolarHBondContact O-N 3.26Å | ||
| 199 | V | 58.7 | Low | 55.1 | Low | 125 Ų | 125 | 140.6 Ų | 140.6 | 76% | 0.758 | 76% | 0.758 | S | S | * | * | trans | -65.4 | 108.1 | 168.6 | 178.3 | 0 | 0 | 0 | 0 | 103.9 | R197 V201 | R197-V199 VanDerWaalsContact C-N 3.32Å; R197-V199 PolarHBondContact O-N 3.19Å; V199-V201 VanDerWaalsContact C-N 3.32Å; V199-V201 PolarHBondContact O-N 3.23Å | ||
| 200 | A | 57.7 | Low | 55.2 | Low | 90 Ų | 90 | 137.9 Ų | 137.9 | 74% | 0.744 | 75% | 0.754 | S | S | * | * | trans | -63.6 | 102.6 | 170 | 0 | 0 | 0 | 0 | 0 | 106.1 | R198 P202 | R198-A200 PolarHBondContact O-N 3.26Å; A200-P202 VanDerWaalsContact O-CD 3.23Å; A200-P202 WeakPolarHBondContact O-CD 3.24Å | ||
| 201 | V | 61.4 | Low | 55 | Low | 119 Ų | 119 | 137.1 Ų | 137.1 | 72% | 0.721 | 75% | 0.754 | S | S | * | * | trans | -63.7 | 115.2 | 168.5 | 178.5 | 0 | 0 | 0 | 0 | 105.3 | V199 V203 | V199-V201 VanDerWaalsContact C-N 3.32Å; V199-V201 PolarHBondContact O-N 3.23Å; V201-V203 PolarHBondContact O-N 2.91Å | ||
| 202 | P | 60.8 | Low | 55.1 | Low | 111 Ų | 111 | 139.4 Ų | 139.4 | 72% | 0.721 | 76% | 0.757 | S | S | * | * | trans | -62 | 113.5 | 173.6 | 24.1 | -29.4 | 0 | 0 | 0 | 107 | A200 L204 | A200-P202 VanDerWaalsContact O-CD 3.23Å; A200-P202 WeakPolarHBondContact O-CD 3.24Å; P202-L204 PolarHBondContact O-N 3.38Å | ||
| 203 | V | 63.4 | Low | 54.8 | Low | 121 Ų | 121 | 136.4 Ų | 136.4 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | trans | -59.3 | 109.9 | 167.9 | 179.4 | 0 | 0 | 0 | 0 | 105.3 | V201 V205 | V201-V203 PolarHBondContact O-N 2.91Å; V203-V205 HydrophobicContact CB-CG2 4.26Å; V203-V205 HydrophobicContact CG1-CG2 3.65Å; V203-V205 PolarHBondContact O-N 2.95Å | ||
| 204 | L | 59.7 | Low | 54.9 | Low | 175 Ų | 175 | 136.3 Ų | 136.3 | 92% | 0.916 | 75% | 0.752 | S | S | * | * | trans | -66.2 | 82.9 | 167.6 | -77 | 161.6 | 0 | 0 | 0 | 107.1 | P202 | P202-L204 PolarHBondContact O-N 3.38Š| ||
| 205 | V | 61.8 | Low | 54.8 | Low | 110 Ų | 110 | 140 Ų | 140 | 67% | 0.667 | 76% | 0.759 | S | S | * | * | trans | -73.5 | 123.5 | 165.2 | -176.4 | 0 | 0 | 0 | 0 | 106 | V203 D207 | V203-V205 HydrophobicContact CB-CG2 4.26Å; V203-V205 HydrophobicContact CG1-CG2 3.65Å; V203-V205 PolarHBondContact O-N 2.95Å; V205-D207 PolarHBondContact O-N 3.23Å | ||
| 206 | R | 50.7 | Low | 54.9 | Low | 227 Ų | 227 | 139.5 Ų | 139.5 | 86% | 0.857 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.2 | 138.8 | 169.5 | -99.7 | -173.8 | 166.5 | 152 | -3.9 | 109.4 | ||
| 207 | D | 52.4 | Low | 54.5 | Low | 146 Ų | 146 | 142.2 Ų | 142.2 | 78% | 0.781 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.8 | 31.7 | 172.1 | -44.2 | -30.8 | 0 | 0 | 0 | 117.7 | V205 K209 | V205-D207 PolarHBondContact O-N 3.23Å; D207-K209 PolarHBondContact O-N 3.02Å; D207-K209 VanDerWaalsContact O-N 3.16Å |
| 208 | G | 52.4 | Low | 54.2 | Low | 74 Ų | 74 | 137 Ų | 137 | 76% | 0.763 | 75% | 0.751 | S | S | * | * | trans | 67.3 | 29.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 209 | K | 51.5 | Low | 53.9 | Low | 189 Ų | 189 | 130.7 Ų | 130.7 | 82% | 0.822 | 74% | 0.735 | S | S | * | * | trans | -124.7 | 125.7 | 169.3 | -65.4 | -173.9 | -178.7 | -179.1 | 0 | 112 | D207 C211 | D207-K209 PolarHBondContact O-N 3.02Å; D207-K209 VanDerWaalsContact O-N 3.16Å; K209-C211 PolarHBondContact O-N 3.44Å; K209-C211 VanDerWaalsContact O-N 3.16Å | ||
| 210 | P | 48.7 | Very low | 53.4 | Low | 106 Ų | 106 | 128 Ų | 128 | 69% | 0.688 | 73% | 0.726 | S | S | * | * | trans | -68.3 | 111.2 | 176.2 | 25 | -30.3 | 0 | 0 | 0 | 110.4 | H212 | P210-H212 PolarHBondContact O-N 2.64Å; P210-H212 VanDerWaalsContact O-N 3.14Å; P210-H212 PolarHBondContact O-ND1 2.91Å | ||
| 211 | C | 46.2 | Very low | 53 | Low | 117 Ų | 117 | 126.7 Ų | 126.7 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | trans | -67.7 | 108.9 | 174.7 | -173.4 | 0 | 0 | 0 | 0 | 109.4 | K209 | K209-C211 PolarHBondContact O-N 3.44Å; K209-C211 VanDerWaalsContact O-N 3.16Å | ||
| 212 | H | 51.8 | Low | 52.3 | Low | 148 Ų | 148 | 124.5 Ų | 124.5 | 69% | 0.685 | 70% | 0.702 | S | S | * | * | trans | -84.3 | 129.1 | 175.7 | -71.9 | 45.2 | 0 | 0 | 0 | 109.5 | P210 L214 | P210-H212 PolarHBondContact O-N 2.64Å; P210-H212 VanDerWaalsContact O-N 3.14Å; P210-H212 PolarHBondContact O-ND1 2.91Å; H212-L214 PolarHBondContact O-N 2.83Å | ||
| 213 | T | 45.6 | Very low | 51.7 | Low | 127 Ų | 127 | 127.6 Ų | 127.6 | 78% | 0.779 | 71% | 0.705 | S | S | * | * | trans | 13.6 | 95.7 | 160.7 | 59.9 | 0 | 0 | 0 | 0 | 116.1 | K215 | T213-K215 PolarHBondContact O-N 3.01Å; T213-K215 VanDerWaalsContact O-N 3.14Å | ||
| 214 | L | 51.5 | Low | 51.1 | Low | 128 Ų | 128 | 130.6 Ų | 130.6 | 67% | 0.67 | 71% | 0.711 | S | S | * | * | trans | -61.1 | 114.6 | 164.3 | -70.8 | 169 | 0 | 0 | 0 | 108.6 | H212 D218 | H212-L214 PolarHBondContact O-N 2.83Å; L214-D218 HydrophobicContact CD2-CB 4.32Å | ||
| 215 | K | 50.5 | Low | 50.7 | Low | 162 Ų | 162 | 124.9 Ų | 124.9 | 70% | 0.704 | 69% | 0.688 | S | S | * | * | trans | -70.6 | 147.8 | 167.2 | -70.7 | -165.6 | 178.7 | 173.5 | 0 | 108.5 | T213 Q217 D218 | T213-K215 PolarHBondContact O-N 3.01Å; T213-K215 VanDerWaalsContact O-N 3.14Å; K215-Q217 PolarHBondContact O-N 3.01Å; K215-D218 PolarHBondContact O-N 3.48Å; K215-D218 VanDerWaalsContact O-N 3.12Å | ||
| 216 | A | 53.8 | Low | 50.1 | Low | 88 Ų | 88 | 123.2 Ų | 123.2 | 73% | 0.727 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.7 | -9.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 217 | Q | 51.7 | Low | 50 | Low | 172 Ų | 172 | 119.8 Ų | 119.8 | 80% | 0.804 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | -22.4 | 178 | -73.5 | 176 | -14.8 | 0 | 0 | 113.8 | K215 | K215-Q217 PolarHBondContact O-N 3.01Š|
| 218 | D | 48.3 | Very low | 49.8 | Very low | 99 Ų | 99 | 118.9 Ų | 118.9 | 53% | 0.529 | 69% | 0.687 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.3 | -18 | 177.3 | -84.8 | -29.8 | 0 | 0 | 0 | 113.8 | L214 K215 A220 A221 | L214-D218 HydrophobicContact CD2-CB 4.32Å; K215-D218 PolarHBondContact O-N 3.48Å; K215-D218 VanDerWaalsContact O-N 3.12Å; D218-A220 PolarHBondContact O-N 3.13Å; D218-A221 PolarHBondContact O-N 3.04Å |
| 219 | L | 54.2 | Low | 49.6 | Very low | 111 Ų | 111 | 122.3 Ų | 122.3 | 58% | 0.581 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -65.6 | -24.7 | 174.6 | -76.1 | 168.8 | 0 | 0 | 0 | 112.1 | A221 F223 | L219-A221 VanDerWaalsContact C-N 3.34Å; L219-F223 WeakPolarHBondContact O-CD2 3.37Å |
| 220 | A | 47.5 | Very low | 49.6 | Very low | 69 Ų | 69 | 117.7 Ų | 117.7 | 57% | 0.57 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -70 | -30.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | D218 F223 | D218-A220 PolarHBondContact O-N 3.13Å; A220-F223 PolarHBondContact O-N 2.95Å |
| 221 | A | 48.5 | Very low | 49.7 | Very low | 62 Ų | 62 | 115.9 Ų | 115.9 | 51% | 0.512 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -77.2 | -27.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | D218 L219 F223 Q224 | D218-A221 PolarHBondContact O-N 3.04Å; L219-A221 VanDerWaalsContact C-N 3.34Å; A221-F223 VanDerWaalsContact C-N 3.26Å; A221-F223 PolarHBondContact O-N 2.84Å; A221-Q224 PolarHBondContact O-N 3.37Å |
| 222 | T | 47.3 | Very low | 49.8 | Very low | 72 Ų | 72 | 118.8 Ų | 118.8 | 44% | 0.442 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -70 | -22.1 | 174.9 | -49.7 | 0 | 0 | 0 | 0 | 112.8 | Q224 A225 F227 | T222-Q224 PolarHBondContact O-N 2.98Å; T222-A225 PolarHBondContact O-N 2.87Å; T222-F227 HydrophobicContact CG2-CD2 4.26Å |
| 223 | F | 47.4 | Very low | 49.8 | Very low | 177 Ų | 177 | 115.8 Ų | 115.8 | 78% | 0.776 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -18.4 | 173.1 | -80.1 | -79.3 | 0 | 0 | 0 | 113.8 | L219 A220 A221 | L219-F223 WeakPolarHBondContact O-CD2 3.37Å; A220-F223 PolarHBondContact O-N 2.95Å; A221-F223 VanDerWaalsContact C-N 3.26Å; A221-F223 PolarHBondContact O-N 2.84Å |
| 224 | Q | 52.2 | Low | 50.1 | Low | 184 Ų | 184 | 112.9 Ų | 112.9 | 86% | 0.86 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -14.8 | 174.1 | -82 | -176.9 | -3.5 | 0 | 0 | 113.5 | A221 T222 | A221-Q224 PolarHBondContact O-N 3.37Å; T222-Q224 PolarHBondContact O-N 2.98Å |
| 225 | A | 50.8 | Low | 50.4 | Low | 54 Ų | 54 | 113 Ų | 113 | 45% | 0.446 | 65% | 0.65 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -108.2 | 60.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | T222 F227 | T222-A225 PolarHBondContact O-N 2.87Å; A225-F227 VanDerWaalsContact C-N 3.27Å; A225-F227 HydrophobicContact CB-CE2 4.38Å; A225-F227 WeakPolarHBondContact O-CD2 3.34Å; A225-F227 WeakPolarHBondContact O-CE2 2.88Å; A225-F227 WeakPolarHBondContact O-CG 3.3Å; A225-F227 PolarHBondContact O-N 3.37Å |
| 226 | G | 48.4 | Very low | 50.6 | Low | 75 Ų | 75 | 109 Ų | 109 | 77% | 0.773 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 45.5 | 23.8 | 147 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||
| 227 | F | 49.4 | Very low | 50.6 | Low | 155 Ų | 155 | 110.9 Ų | 110.9 | 68% | 0.68 | 64% | 0.637 | S | S | * | * | trans | -95.2 | 120.9 | 174.6 | -64.4 | -68.2 | 0 | 0 | 0 | 110.1 | T222 A225 L229 | T222-F227 HydrophobicContact CG2-CD2 4.26Å; A225-F227 VanDerWaalsContact C-N 3.27Å; A225-F227 HydrophobicContact CB-CE2 4.38Å; A225-F227 WeakPolarHBondContact O-CD2 3.34Å; A225-F227 WeakPolarHBondContact O-CE2 2.88Å; A225-F227 WeakPolarHBondContact O-CG 3.3Å; A225-F227 PolarHBondContact O-N 3.37Å; F227-L229 PolarHBondContact O-N 3.21Å | ||
| 228 | P | 48.4 | Very low | 50.8 | Low | 128 Ų | 128 | 109.9 Ų | 109.9 | 83% | 0.831 | 63% | 0.632 | S | S | * | * | trans | -76.3 | 88.7 | -178.9 | 31.4 | -33.2 | 0 | 0 | 0 | 109.6 | S230 | P228-S230 PolarHBondContact O-N 3.34Š| ||
| 229 | L | 47.1 | Very low | 51.1 | Low | 146 Ų | 146 | 112.4 Ų | 112.4 | 76% | 0.764 | 64% | 0.64 | S | S | * | * | trans | -72.3 | 119.5 | 159.8 | -75.5 | 169.1 | 0 | 0 | 0 | 107.9 | F227 A231 | F227-L229 PolarHBondContact O-N 3.21Å; L229-A231 PolarHBondContact O-N 3.24Å | ||
| 230 | S | 52.9 | Low | 51 | Low | 91 Ų | 91 | 113.6 Ų | 113.6 | 64% | 0.636 | 65% | 0.645 | S | S | * | * | trans | -45 | 123.2 | 179.4 | 179.5 | 0 | 0 | 0 | 0 | 112.2 | P228 Y232 S233 | P228-S230 PolarHBondContact O-N 3.34Å; S230-Y232 PolarHBondContact O-N 3.12Å; S230-S233 PolarHBondContact O-N 3.18Å; S230-S233 PolarHBondContact O-OG 3.29Å | ||
| 231 | A | 49.6 | Very low | 51.4 | Low | 69 Ų | 69 | 116 Ų | 116 | 57% | 0.57 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -7.8 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | L229 S233 | L229-A231 PolarHBondContact O-N 3.24Å; A231-S233 PolarHBondContact O-N 3.49Å |
| 232 | Y | 49.7 | Very low | 51.5 | Low | 178 Ų | 178 | 120 Ų | 120 | 70% | 0.698 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -70.5 | -29.1 | -178.9 | -158.6 | -99.1 | 0 | 0 | 0 | 113.3 | S230 T236 | S230-Y232 PolarHBondContact O-N 3.12Å; Y232-T236 PolarHBondContact O-OG1 2.81Å; Y232-T236 VanDerWaalsContact O-OG1 3.14Å |
| 233 | S | 51.8 | Low | 51.6 | Low | 84 Ų | 84 | 121.9 Ų | 121.9 | 59% | 0.587 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -75.8 | -31.8 | -179.6 | 63.6 | 0 | 0 | 0 | 0 | 113 | S230 A231 | S230-S233 PolarHBondContact O-N 3.18Å; S230-S233 PolarHBondContact O-OG 3.29Å; A231-S233 PolarHBondContact O-N 3.49Å |
| 234 | A | 52 | Low | 51.6 | Low | 67 Ų | 67 | 117 Ų | 117 | 55% | 0.554 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -69.4 | -36.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T236 L237 H238 | A234-T236 PolarHBondContact O-N 2.74Å; A234-L237 PolarHBondContact O-N 2.93Å; A234-H238 PolarHBondContact O-N 3.45Å |
| 235 | Q | 56.2 | Low | 51.6 | Low | 131 Ų | 131 | 115 Ų | 115 | 61% | 0.612 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -68.5 | -35.7 | -179.7 | -66.6 | 175.2 | -2.7 | 0 | 0 | 112.3 | L237 H238 Q239 | Q235-L237 VanDerWaalsContact C-N 3.32Å; Q235-L237 PolarHBondContact O-N 3.39Å; Q235-H238 PolarHBondContact O-N 3.26Å; Q235-Q239 PolarHBondContact O-N 3.24Å; Q235-Q239 VanDerWaalsContact O-N 3.16Å |
| 236 | T | 54.5 | Low | 51.4 | Low | 77 Ų | 77 | 119.8 Ų | 119.8 | 47% | 0.472 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -66.7 | -34.9 | -178.9 | -49.1 | 0 | 0 | 0 | 0 | 111.7 | Y232 A234 M240 | Y232-T236 PolarHBondContact O-OG1 2.81Å; Y232-T236 VanDerWaalsContact O-OG1 3.14Å; A234-T236 PolarHBondContact O-N 2.74Å; T236-M240 WeakPolarHBondContact O-CG 3.47Å; T236-M240 PolarHBondContact O-N 3.14Å |
| 237 | L | 54.2 | Low | 51.2 | Low | 128 Ų | 128 | 121.1 Ų | 121.1 | 67% | 0.67 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -75.4 | -35 | -179.8 | -151.6 | 130.5 | 0 | 0 | 0 | 112 | A234 Q235 M240 Q241 | A234-L237 PolarHBondContact O-N 2.93Å; Q235-L237 VanDerWaalsContact C-N 3.32Å; Q235-L237 PolarHBondContact O-N 3.39Å; L237-M240 PolarHBondContact O-N 3.36Å; L237-Q241 PolarHBondContact O-N 3.01Å |
| 238 | H | 56.2 | Low | 51 | Low | 151 Ų | 151 | 118.3 Ų | 118.3 | 70% | 0.699 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -69 | -36.2 | 176.5 | -139.3 | -151.8 | 0 | 0 | 0 | 112.1 | A234 Q235 M240 Q241 Y242 | A234-H238 PolarHBondContact O-N 3.45Å; Q235-H238 PolarHBondContact O-N 3.26Å; H238-M240 PolarHBondContact O-N 3.45Å; H238-Q241 PolarHBondContact O-N 2.71Å; H238-Y242 PolarHBondContact O-N 2.79Å |
| 239 | Q | 54.7 | Low | 51 | Low | 152 Ų | 152 | 116.3 Ų | 116.3 | 71% | 0.71 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -68.6 | -32.9 | 177.5 | -170.6 | 157.3 | 55.4 | 0 | 0 | 113.1 | Q235 N243 | Q235-Q239 PolarHBondContact O-N 3.24Å; Q235-Q239 VanDerWaalsContact O-N 3.16Å; Q239-N243 PolarHBondContact O-N 3.03Å |
| 240 | M | 53.1 | Low | 50.9 | Low | 136 Ų | 136 | 115.9 Ų | 115.9 | 67% | 0.67 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -68.6 | -37.7 | 175.8 | -69.7 | -90.8 | 103.8 | 0 | 0 | 112.2 | T236 L237 H238 | T236-M240 WeakPolarHBondContact O-CG 3.47Å; T236-M240 PolarHBondContact O-N 3.14Å; L237-M240 PolarHBondContact O-N 3.36Å; H238-M240 PolarHBondContact O-N 3.45Å |
| 241 | Q | 55.1 | Low | 50.9 | Low | 119 Ų | 119 | 118.4 Ų | 118.4 | 56% | 0.556 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -74.1 | -34.6 | -179.1 | -168.2 | 170.6 | -31.4 | 0 | 0 | 112.6 | L237 H238 | L237-Q241 PolarHBondContact O-N 3.01Å; H238-Q241 PolarHBondContact O-N 2.71Å |
| 242 | Y | 50.7 | Low | 50.7 | Low | 145 Ų | 145 | 119.3 Ų | 119.3 | 57% | 0.569 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -66.1 | -37.8 | 177.3 | -162.7 | -98.8 | 0 | 0 | 0 | 112.2 | H238 A244 Q245 Y246 | H238-Y242 PolarHBondContact O-N 2.79Å; Y242-A244 VanDerWaalsContact C-N 3.34Å; Y242-A244 PolarHBondContact O-N 2.97Å; Y242-Q245 PolarHBondContact O-N 3.14Å; Y242-Y246 HydrophobicContact CD1-CD2 4.28Å; Y242-Y246 AromaticContact CD1-CE2 3.86Å; Y242-Y246 HydrophobicContact CD1-CE2 3.86Å; Y242-Y246 HydrophobicContact CD2-CE2 4.36Å; Y242-Y246 HydrophobicContact CE1-CD2 4.12Å; Y242-Y246 AromaticContact CE1-CE2 3.41Å; Y242-Y246 HydrophobicContact CE1-CE2 3.41Å; Y242-Y246 VanDerWaalsContact CE1-CE2 3.41Å; Y242-Y246 AromaticContact CE2-CE2 3.97Å; Y242-Y246 HydrophobicContact CE2-CE2 3.97Å; Y242-Y246 HydrophobicContact CG-CE2 4.31Å; Y242-Y246 AromaticContact CZ-CE2 3.48Å; Y242-Y246 VanDerWaalsContact CZ-CE2 3.48Å; Y242-Y246 AromaticContact CZ-CZ 3.9Å; Y242-Y246 VanDerWaalsContact O-CD2 3.27Å; Y242-Y246 WeakPolarHBondContact O-CD2 3.23Å; Y242-Y246 PolarHBondContact OH-OH 2.87Å |
| 243 | N | 49.9 | Very low | 50.3 | Low | 113 Ų | 113 | 120 Ų | 120 | 60% | 0.604 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -75.5 | -22 | -176.9 | -147.1 | 31.7 | 0 | 0 | 0 | 113.7 | Q239 Q245 | Q239-N243 PolarHBondContact O-N 3.03Å; N243-Q245 VanDerWaalsContact C-N 3.35Å |
| 244 | A | 47.4 | Very low | 49.8 | Very low | 73 Ų | 73 | 124.3 Ų | 124.3 | 60% | 0.603 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -73.6 | -25.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y242 | Y242-A244 VanDerWaalsContact C-N 3.34Å; Y242-A244 PolarHBondContact O-N 2.97Å |
| 245 | Q | 51.1 | Low | 49.5 | Very low | 142 Ų | 142 | 126.7 Ų | 126.7 | 66% | 0.664 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -85 | -13.6 | -175.2 | -69.3 | -174.9 | -21.8 | 0 | 0 | 114.2 | Y242 N243 | Y242-Q245 PolarHBondContact O-N 3.14Å; N243-Q245 VanDerWaalsContact C-N 3.35Å |
| 246 | Y | 47.3 | Very low | 49 | Very low | 155 Ų | 155 | 125.7 Ų | 125.7 | 61% | 0.608 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -101.8 | -4.9 | 180 | -67.3 | -79.9 | 0 | 0 | 0 | 115 | Y242 | Y242-Y246 HydrophobicContact CD1-CD2 4.28Å; Y242-Y246 AromaticContact CD1-CE2 3.86Å; Y242-Y246 HydrophobicContact CD1-CE2 3.86Å; Y242-Y246 HydrophobicContact CD2-CE2 4.36Å; Y242-Y246 HydrophobicContact CE1-CD2 4.12Å; Y242-Y246 AromaticContact CE1-CE2 3.41Å; Y242-Y246 HydrophobicContact CE1-CE2 3.41Å; Y242-Y246 VanDerWaalsContact CE1-CE2 3.41Å; Y242-Y246 AromaticContact CE2-CE2 3.97Å; Y242-Y246 HydrophobicContact CE2-CE2 3.97Å; Y242-Y246 HydrophobicContact CG-CE2 4.31Å; Y242-Y246 AromaticContact CZ-CE2 3.48Å; Y242-Y246 VanDerWaalsContact CZ-CE2 3.48Å; Y242-Y246 AromaticContact CZ-CZ 3.9Å; Y242-Y246 VanDerWaalsContact O-CD2 3.27Å; Y242-Y246 WeakPolarHBondContact O-CD2 3.23Å; Y242-Y246 PolarHBondContact OH-OH 2.87Å |
| 247 | S | 44.5 | Very low | 48.5 | Very low | 103 Ų | 103 | 126.4 Ų | 126.4 | 72% | 0.72 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -94.4 | 10.1 | -178.7 | -76.5 | 0 | 0 | 0 | 0 | 115 | ||
| 248 | A | 45.4 | Very low | 48.1 | Very low | 96 Ų | 96 | 128.8 Ų | 128.8 | 79% | 0.793 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -93.2 | 10.6 | -172.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 249 | A | 48.3 | Very low | 47.6 | Very low | 87 Ų | 87 | 129 Ų | 129 | 72% | 0.719 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -144.7 | 65.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 250 | T | 44.6 | Very low | 47.2 | Very low | 137 Ų | 137 | 128.8 Ų | 128.8 | 84% | 0.84 | 72% | 0.718 | S | S | * | * | trans | -165.3 | 109.9 | 151.4 | -4 | 0 | 0 | 0 | 0 | 110.2 | P252 | T250-P252 WeakPolarHBondContact O-CD 3.3Š| ||
| 251 | T | 51.6 | Low | 46.9 | Very low | 143 Ų | 143 | 128.7 Ų | 128.7 | 88% | 0.877 | 72% | 0.717 | S | S | * | * | trans | -89.5 | 103.7 | 162.7 | 30.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 252 | P | 46.7 | Very low | 46.6 | Very low | 88 Ų | 88 | 130.2 Ų | 130.2 | 57% | 0.571 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 120.6 | 162.7 | 30.5 | -30 | 0 | 0 | 0 | 109.7 | T250 F254 | T250-P252 WeakPolarHBondContact O-CD 3.3Å; P252-F254 HydrophobicContact CB-CE2 4.17Å; P252-F254 HydrophobicContact CG-CE2 3.86Å; P252-F254 PolarHBondContact O-N 3.14Å |
| 253 | Q | 40 | Very low | 46.5 | Very low | 193 Ų | 193 | 128.9 Ų | 128.9 | 90% | 0.902 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 116.5 | 168.1 | -172.9 | 178.8 | 15.3 | 0 | 0 | 109 | ||
| 254 | F | 41.7 | Very low | 46.2 | Very low | 174 Ų | 174 | 130.3 Ų | 130.3 | 76% | 0.763 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 135.2 | 172.5 | -76.8 | -80.2 | 0 | 0 | 0 | 110.5 | P252 | P252-F254 HydrophobicContact CB-CE2 4.17Å; P252-F254 HydrophobicContact CG-CE2 3.86Å; P252-F254 PolarHBondContact O-N 3.14Å |
| 255 | P | 46.1 | Very low | 45.9 | Very low | 118 Ų | 118 | 135 Ų | 135 | 77% | 0.766 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 140.2 | 172.7 | 30.8 | -30.2 | 0 | 0 | 0 | 110.8 | A257 | P255-A257 PolarHBondContact O-N 3.16Š|
| 256 | S | 46.7 | Very low | 45.3 | Very low | 109 Ų | 109 | 138.3 Ų | 138.3 | 76% | 0.762 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 119.9 | 174.2 | -175.8 | 0 | 0 | 0 | 0 | 111.5 | ||
| 257 | A | 43.9 | Very low | 45.5 | Very low | 93 Ų | 93 | 137.1 Ų | 137.1 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | trans | -109.6 | 111.5 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | P255 H259 | P255-A257 PolarHBondContact O-N 3.16Å; A257-H259 PolarHBondContact O-N 3.48Å | ||
| 258 | H | 44.1 | Very low | 46 | Very low | 178 Ų | 178 | 146.4 Ų | 146.4 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -61.6 | 122.5 | 173.1 | -79 | -99.5 | 0 | 0 | 0 | 110.2 | L260 | H258-L260 PolarHBondContact O-N 3Š| ||
| 259 | H | 46.6 | Very low | 46 | Very low | 154 Ų | 154 | 149 Ų | 149 | 71% | 0.713 | 78% | 0.778 | S | S | * | * | trans | -82 | 100.8 | 173.9 | -168.1 | 94.2 | 0 | 0 | 0 | 109.3 | A257 M261 | A257-H259 PolarHBondContact O-N 3.48Å; H259-M261 WeakPolarHBondContact CD2-CG 3.42Å; H259-M261 WeakPolarHBondContact NE2-CG 3.21Å; H259-M261 PolarHBondContact O-N 3.12Å; H259-M261 VanDerWaalsContact O-N 3.12Å | ||
| 260 | L | 45.5 | Very low | 45.9 | Very low | 148 Ų | 148 | 152.2 Ų | 152.2 | 78% | 0.775 | 78% | 0.781 | S | S | * | * | trans | -75.5 | 91.5 | 167.7 | -161.9 | 96.6 | 0 | 0 | 0 | 108.3 | H258 Q262 | H258-L260 PolarHBondContact O-N 3Å; L260-Q262 HydrophobicContact CD2-CG 4.33Å; L260-Q262 PolarHBondContact O-N 3.01Å; L260-Q262 VanDerWaalsContact O-N 3.09Å | ||
| 261 | M | 47.8 | Very low | 46 | Very low | 134 Ų | 134 | 153.1 Ų | 153.1 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | -68.3 | 102.1 | 165.2 | -82.8 | -127.7 | 96.4 | 0 | 0 | 108.8 | H259 T263 | H259-M261 WeakPolarHBondContact CD2-CG 3.42Å; H259-M261 WeakPolarHBondContact NE2-CG 3.21Å; H259-M261 PolarHBondContact O-N 3.12Å; H259-M261 VanDerWaalsContact O-N 3.12Å; M261-T263 PolarHBondContact O-N 3.16Å | ||
| 262 | Q | 48.6 | Very low | 45.7 | Very low | 151 Ų | 151 | 153.6 Ų | 153.6 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -77.4 | 99.2 | 155.2 | -89.3 | -179.3 | 6.5 | 0 | 0 | 108.3 | L260 Q264 | L260-Q262 HydrophobicContact CD2-CG 4.33Å; L260-Q262 PolarHBondContact O-N 3.01Å; L260-Q262 VanDerWaalsContact O-N 3.09Å; Q262-Q264 PolarHBondContact O-N 2.84Å; Q262-Q264 VanDerWaalsContact O-N 3.12Å | ||
| 263 | T | 47.8 | Very low | 45.6 | Very low | 117 Ų | 117 | 157.8 Ų | 157.8 | 72% | 0.718 | 79% | 0.785 | S | S | * | * | trans | -72 | 94.7 | 166.1 | 44.2 | 0 | 0 | 0 | 0 | 109 | M261 Q265 | M261-T263 PolarHBondContact O-N 3.16Å; T263-Q265 PolarHBondContact O-N 3.39Å; T263-Q265 VanDerWaalsContact O-N 3.09Å | ||
| 264 | Q | 44.1 | Very low | 46 | Very low | 143 Ų | 143 | 155.4 Ų | 155.4 | 67% | 0.668 | 78% | 0.777 | S | S | * | * | trans | -74.5 | 97.5 | 162.9 | -71.3 | -165.1 | 50.9 | 0 | 0 | 108.9 | Q262 | Q262-Q264 PolarHBondContact O-N 2.84Å; Q262-Q264 VanDerWaalsContact O-N 3.12Å | ||
| 265 | Q | 40.8 | Very low | 46.3 | Very low | 172 Ų | 172 | 154.1 Ų | 154.1 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -67.7 | 120.5 | 166.2 | 58.4 | -167.6 | 10.8 | 0 | 0 | 109.6 | T263 | T263-Q265 PolarHBondContact O-N 3.39Å; T263-Q265 VanDerWaalsContact O-N 3.09Å | ||
| 266 | W | 40.2 | Very low | 46.3 | Very low | 211 Ų | 211 | 156.8 Ų | 156.8 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | trans | -102.7 | 111.7 | 166.5 | -68.2 | 88 | 0 | 0 | 0 | 107.3 | ||||
| 267 | T | 49.8 | Very low | 46.2 | Very low | 130 Ų | 130 | 160.8 Ų | 160.8 | 80% | 0.798 | 78% | 0.78 | S | S | * | * | trans | -80 | 137 | 174 | 51.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 268 | W | 55.9 | Low | 46.5 | Very low | 299 Ų | 299 | 167 Ų | 167 | 100% | 1.133 | 78% | 0.782 | S | S | * | * | trans | -77 | 0 | 179.4 | -68.2 | 88.6 | 0 | 0 | 0 | 112.3 |
Retrieved 268 of 268 residues in 687.3 ms
(Link to these results)