| 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 | 35.8 | Very low | 42.8 | Very low | 234 Ų | 234 | 143.4 Ų | 143.4 | 100% | 1.153 | 76% | 0.762 | S | S | * | * | 0 | 129.8 | 0 | -101.5 | 164.8 | 163 | 0 | 0 | 108 | |||||
| 2 | T | 37.3 | Very low | 43.7 | Very low | 133 Ų | 133 | 139.4 Ų | 139.4 | 82% | 0.816 | 75% | 0.75 | S | S | * | * | trans | 65.2 | 120.5 | 163.9 | 30.7 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 3 | T | 39.7 | Very low | 44.6 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 67% | 0.669 | 73% | 0.729 | S | S | * | * | cis | 113.6 | 116.3 | 23.8 | -77.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 4 | I | 45.3 | Very low | 45.1 | Very low | 146 Ų | 146 | 132.6 Ų | 132.6 | 75% | 0.749 | 72% | 0.716 | S | S | * | * | trans | 69 | 149.4 | 145 | -63.4 | 173.1 | 0 | 0 | 0 | 116.8 | ||||
| 5 | S | 37 | Very low | 45.6 | Very low | 94 Ų | 94 | 133.5 Ų | 133.5 | 66% | 0.657 | 71% | 0.714 | S | S | * | * | cis | 179.7 | 172.6 | -23.1 | -83.1 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 6 | Q | 38 | Very low | 46.2 | Very low | 174 Ų | 174 | 136.2 Ų | 136.2 | 81% | 0.813 | 71% | 0.711 | S | S | * | * | trans | 97.5 | 103.3 | 154.1 | -53.8 | -178.4 | -14.4 | 0 | 0 | 116 | ||||
| 7 | F | 42.7 | Very low | 46.9 | Very low | 158 Ų | 158 | 139.2 Ų | 139.2 | 69% | 0.693 | 71% | 0.711 | S | S | * | * | 65.1 | 89.6 | 88.5 | -132.1 | -90.3 | 0 | 0 | 0 | 111.2 | N9 D10 | F7-N9 HydrophobicContact CD1-CB 4.41Å; F7-N9 HydrophobicContact CE1-CB 4.2Å; F7-D10 WeakPolarHBondContact CD1-OD2 2.97Å | |||
| 8 | V | 45.4 | Very low | 47.5 | Very low | 145 Ų | 145 | 138.2 Ų | 138.2 | 88% | 0.879 | 70% | 0.702 | S | S | * | * | trans | -127.3 | 66.5 | 157.5 | -177.4 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 9 | N | 46.3 | Very low | 47.9 | Very low | 123 Ų | 123 | 139.2 Ų | 139.2 | 66% | 0.658 | 70% | 0.701 | S | S | * | * | trans | -113.9 | 49 | 166.8 | -164.8 | 19.1 | 0 | 0 | 0 | 108 | F7 | F7-N9 HydrophobicContact CD1-CB 4.41Å; F7-N9 HydrophobicContact CE1-CB 4.2Å | ||
| 10 | D | 52.8 | Low | 48.5 | Very low | 106 Ų | 106 | 137.9 Ų | 137.9 | 57% | 0.567 | 69% | 0.693 | S | S | * | * | trans | -136.7 | 63.8 | -169.6 | -78.7 | -62.8 | 0 | 0 | 0 | 111.6 | F7 | F7-D10 WeakPolarHBondContact CD1-OD2 2.97Š| ||
| 11 | Q | 50.6 | Low | 49 | Very low | 155 Ų | 155 | 138.3 Ų | 138.3 | 72% | 0.724 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -163.2 | 48.8 | 155 | -97.6 | -113.7 | -24.7 | 0 | 0 | 115.6 | ||
| 12 | P | 53.1 | Low | 50 | Low | 96 Ų | 96 | 132.7 Ų | 132.7 | 62% | 0.623 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -107.7 | 2.7 | 149.1 | 33.3 | -26.9 | 0 | 0 | 0 | 112.8 | ||
| 13 | V | 55.5 | Low | 51.1 | Low | 79 Ų | 79 | 130 Ų | 130 | 48% | 0.479 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -89.3 | -19.6 | -171.1 | 175.8 | 0 | 0 | 0 | 0 | 113.7 | ||
| 14 | L | 52.5 | Low | 51.8 | Low | 105 Ų | 105 | 128 Ų | 128 | 55% | 0.55 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -73.9 | -32.6 | -178.1 | -132.7 | 144.4 | 0 | 0 | 0 | 112.2 | R16 | L14-R16 VanDerWaalsContact C-N 3.33Å; L14-R16 PolarHBondContact O-N 2.93Å |
| 15 | H | 52.7 | Low | 52.3 | Low | 146 Ų | 146 | 130.9 Ų | 130.9 | 68% | 0.676 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -74.5 | -21.8 | -179.8 | -138.2 | -39.8 | 0 | 0 | 0 | 113.8 | ||
| 16 | R | 55 | Low | 53.3 | Low | 176 Ų | 176 | 135.4 Ų | 135.4 | 66% | 0.664 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78 | -38.1 | -179.9 | -175.1 | 175.7 | 177.2 | 169.7 | 4.6 | 112.4 | L14 F19 E20 | L14-R16 VanDerWaalsContact C-N 3.33Å; L14-R16 PolarHBondContact O-N 2.93Å; R16-F19 PolarHBondContact O-N 2.93Å; R16-E20 IonicContact NE-OE2 3.37Å; R16-E20 PolarHBondContact NE-OE2 3.13Å; R16-E20 PolarHBondContact O-N 3.29Å |
| 17 | R | 57.8 | Low | 54.1 | Low | 188 Ų | 188 | 134.4 Ų | 134.4 | 71% | 0.709 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.9 | -39.4 | -178 | -70.3 | -170.9 | -174.7 | 169 | 2.9 | 112.6 | F19 E20 E21 | R17-F19 VanDerWaalsContact C-N 3.3Å; R17-F19 PolarHBondContact O-N 3.26Å; R17-E20 PolarHBondContact O-N 3.17Å; R17-E21 PolarHBondContact O-N 3.17Å; R17-E21 VanDerWaalsContact O-N 3.16Å |
| 18 | E | 57.6 | Low | 54.6 | Low | 121 Ų | 121 | 132 Ų | 132 | 57% | 0.565 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -68.2 | -31.3 | 177.2 | -63.5 | -162.3 | 130.4 | 0 | 0 | 112.6 | L22 | E18-L22 PolarHBondContact O-N 2.95Å |
| 19 | F | 55 | Low | 54.9 | Low | 156 Ų | 156 | 133.3 Ų | 133.3 | 68% | 0.684 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -73.7 | -37.3 | 178.5 | -148.4 | -92.3 | 0 | 0 | 0 | 112.4 | R16 R17 D23 | R16-F19 PolarHBondContact O-N 2.93Å; R17-F19 VanDerWaalsContact C-N 3.3Å; R17-F19 PolarHBondContact O-N 3.26Å; F19-D23 PolarHBondContact O-N 3.3Å |
| 20 | E | 60.5 | Low | 55.2 | Low | 113 Ų | 113 | 131.4 Ų | 131.4 | 53% | 0.528 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -69.3 | -30.4 | 173.2 | -84.6 | 177.6 | 80.6 | 0 | 0 | 112.7 | R16 R17 S24 | R16-E20 IonicContact NE-OE2 3.37Å; R16-E20 PolarHBondContact NE-OE2 3.13Å; R16-E20 PolarHBondContact O-N 3.29Å; R17-E20 PolarHBondContact O-N 3.17Å; E20-S24 WeakPolarHBondContact O-CB 3.48Å; E20-S24 PolarHBondContact O-N 3.18Å; E20-S24 VanDerWaalsContact O-N 3.07Å; E20-S24 PolarHBondContact O-OG 3.46Å |
| 21 | E | 57.9 | Low | 55.2 | Low | 148 Ų | 148 | 133 Ų | 133 | 69% | 0.692 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -73.6 | -37.3 | 177.4 | -161.3 | 172.5 | 155.7 | 0 | 0 | 112.5 | R17 S24 R25 | R17-E21 PolarHBondContact O-N 3.17Å; R17-E21 VanDerWaalsContact O-N 3.16Å; E21-S24 PolarHBondContact O-N 3Å; E21-R25 PolarHBondContact O-N 2.93Å |
| 22 | L | 58.4 | Low | 55.2 | Low | 115 Ų | 115 | 134.4 Ų | 134.4 | 60% | 0.602 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -69.1 | -36.3 | 174.3 | -106.3 | 126.6 | 0 | 0 | 0 | 113.2 | E18 R26 | E18-L22 PolarHBondContact O-N 2.95Å; L22-R26 PolarHBondContact O-N 3.2Å |
| 23 | D | 58.8 | Low | 55.2 | Low | 76 Ų | 76 | 135.5 Ų | 135.5 | 41% | 0.406 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -68.5 | -40.8 | 173.2 | -166.8 | 67.6 | 0 | 0 | 0 | 111.4 | F19 R25 R26 R27 | F19-D23 PolarHBondContact O-N 3.3Å; D23-R25 VanDerWaalsContact C-N 3.33Å; D23-R25 PolarHBondContact O-N 3.2Å; D23-R26 PolarHBondContact O-N 2.78Å; D23-R27 WeakPolarHBondContact O-CB 3.03Å; D23-R27 PolarHBondContact O-N 2.91Å; D23-R27 IonicContact OD2-CZ 3.71Å; D23-R27 IonicContact OD2-NE 3.66Å; D23-R27 IonicContact OD2-NH2 2.87Å; D23-R27 PolarHBondContact OD2-NH2 3.46Å |
| 24 | S | 54.5 | Low | 55.1 | Low | 68 Ų | 68 | 137.1 Ų | 137.1 | 48% | 0.476 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -62.2 | -38.8 | 176.5 | -63 | 0 | 0 | 0 | 0 | 112.1 | E20 E21 R27 C28 | E20-S24 WeakPolarHBondContact O-CB 3.48Å; E20-S24 PolarHBondContact O-N 3.18Å; E20-S24 VanDerWaalsContact O-N 3.07Å; E20-S24 PolarHBondContact O-OG 3.46Å; E21-S24 PolarHBondContact O-N 3Å; S24-R27 PolarHBondContact O-N 3.34Å; S24-C28 PolarHBondContact O-N 3.48Å; S24-C28 VanDerWaalsContact O-N 3.07Å; S24-C28 PolarHBondContact O-SG 3.25Å; S24-C28 VanDerWaalsContact O-SG 3.41Å |
| 25 | R | 57.3 | Low | 54.7 | Low | 206 Ų | 206 | 139.8 Ų | 139.8 | 78% | 0.777 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -66.1 | -41.3 | 173.7 | -117 | -163.5 | -175.2 | -147.7 | 4.2 | 113 | E21 D23 R27 Q29 | E21-R25 PolarHBondContact O-N 2.93Å; D23-R25 VanDerWaalsContact C-N 3.33Å; D23-R25 PolarHBondContact O-N 3.2Å; R25-R27 VanDerWaalsContact C-N 3.34Å; R25-Q29 PolarHBondContact O-N 2.94Å |
| 26 | R | 56.8 | Low | 54.4 | Low | 189 Ų | 189 | 139.4 Ų | 139.4 | 71% | 0.713 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -63.8 | -40.5 | 174.6 | -80.7 | -168.4 | -154.6 | -114.1 | 3 | 111.8 | L22 D23 Q29 S30 | L22-R26 PolarHBondContact O-N 3.2Å; D23-R26 PolarHBondContact O-N 2.78Å; R26-Q29 PolarHBondContact O-N 3.31Å; R26-S30 PolarHBondContact O-N 3.19Å; R26-S30 VanDerWaalsContact O-N 3.15Å |
| 27 | R | 54.8 | Low | 53.7 | Low | 154 Ų | 154 | 136.2 Ų | 136.2 | 58% | 0.581 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -66.7 | -42.8 | -178.2 | -159.1 | -179.6 | -64 | -121.8 | 1.1 | 111.6 | D23 S24 R25 Q29 S30 H31 | D23-R27 WeakPolarHBondContact O-CB 3.03Å; D23-R27 PolarHBondContact O-N 2.91Å; D23-R27 IonicContact OD2-CZ 3.71Å; D23-R27 IonicContact OD2-NE 3.66Å; D23-R27 IonicContact OD2-NH2 2.87Å; D23-R27 PolarHBondContact OD2-NH2 3.46Å; S24-R27 PolarHBondContact O-N 3.34Å; R25-R27 VanDerWaalsContact C-N 3.34Å; R27-Q29 VanDerWaalsContact C-N 3.31Å; R27-Q29 PolarHBondContact O-N 3.47Å; R27-S30 PolarHBondContact O-N 3.02Å; R27-S30 PolarHBondContact O-OG 2.97Å; R27-H31 PolarHBondContact O-CD2 3.44Å |
| 28 | C | 53.3 | Low | 53 | Low | 107 Ų | 107 | 137.7 Ų | 137.7 | 72% | 0.723 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -64.4 | -31.1 | 175.1 | -71.3 | 0 | 0 | 0 | 0 | 113.6 | S24 | S24-C28 PolarHBondContact O-N 3.48Å; S24-C28 VanDerWaalsContact O-N 3.07Å; S24-C28 PolarHBondContact O-SG 3.25Å; S24-C28 VanDerWaalsContact O-SG 3.41Å |
| 29 | Q | 52.6 | Low | 52.2 | Low | 172 Ų | 172 | 141.4 Ų | 141.4 | 80% | 0.804 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -81.6 | -21.7 | 179.7 | -137.6 | 168.5 | 47.8 | 0 | 0 | 113.2 | R25 R26 R27 | R25-Q29 PolarHBondContact O-N 2.94Å; R26-Q29 PolarHBondContact O-N 3.31Å; R27-Q29 VanDerWaalsContact C-N 3.31Å; R27-Q29 PolarHBondContact O-N 3.47Å |
| 30 | S | 52 | Low | 51.6 | Low | 83 Ų | 83 | 138.9 Ų | 138.9 | 58% | 0.58 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -81.2 | -11.3 | 178.9 | 76.9 | 0 | 0 | 0 | 0 | 114.7 | R26 R27 H32 | R26-S30 PolarHBondContact O-N 3.19Å; R26-S30 VanDerWaalsContact O-N 3.15Å; R27-S30 PolarHBondContact O-N 3.02Å; R27-S30 PolarHBondContact O-OG 2.97Å; S30-H32 PolarHBondContact O-N 3.32Å |
| 31 | H | 53.4 | Low | 50.8 | Low | 141 Ų | 141 | 141.6 Ų | 141.6 | 65% | 0.653 | 71% | 0.71 | S | S | * | * | trans | -96.6 | 73.9 | 179.9 | -81.2 | -77.1 | 0 | 0 | 0 | 112 | R27 | R27-H31 PolarHBondContact O-CD2 3.44Š| ||
| 32 | H | 49.3 | Very low | 49.9 | Very low | 184 Ų | 184 | 143.8 Ų | 143.8 | 85% | 0.852 | 72% | 0.72 | S | S | * | * | trans | -120.5 | 124.2 | 150.6 | -90.9 | 9.2 | 0 | 0 | 0 | 109.8 | S30 | S30-H32 PolarHBondContact O-N 3.32Š| ||
| 33 | P | 54.6 | Low | 49.1 | Very low | 118 Ų | 118 | 144.3 Ų | 144.3 | 77% | 0.766 | 72% | 0.724 | S | S | * | * | trans | -78.9 | 163.6 | -171.2 | 31.5 | -33.9 | 0 | 0 | 0 | 113.3 | ||||
| 34 | P | 52.2 | Low | 48 | Very low | 113 Ų | 113 | 146.9 Ų | 146.9 | 73% | 0.734 | 74% | 0.738 | S | S | * | * | trans | -85.2 | 139.2 | -168 | 34.6 | -31.2 | 0 | 0 | 0 | 110.6 | ||||
| 35 | N | 43.9 | Very low | 47.8 | Very low | 161 Ų | 161 | 148.8 Ų | 148.8 | 86% | 0.861 | 75% | 0.748 | S | S | * | * | trans | -164.9 | 94.8 | 156.1 | -89.8 | -35.1 | 0 | 0 | 0 | 109.4 | ||||
| 36 | T | 46.6 | Very low | 47.4 | Very low | 139 Ų | 139 | 149.3 Ų | 149.3 | 85% | 0.853 | 75% | 0.75 | S | S | * | * | trans | -134.1 | 107.8 | 156.5 | -36.1 | 0 | 0 | 0 | 0 | 107.2 | R38 | T36-R38 PolarHBondContact O-N 2.99Š| ||
| 37 | P | 41.1 | Very low | 46.9 | Very low | 109 Ų | 109 | 146.7 Ų | 146.7 | 71% | 0.708 | 76% | 0.755 | S | S | * | * | trans | -67.5 | 117.4 | 171 | -11.7 | 26.7 | 0 | 0 | 0 | 108.3 | Q39 | P37-Q39 PolarHBondContact O-N 3.19Š| ||
| 38 | R | 41.7 | Very low | 46.5 | Very low | 219 Ų | 219 | 150.9 Ų | 150.9 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | -13.3 | 96.3 | 143.9 | -171.8 | 178.6 | -178.4 | 154.3 | 0.8 | 112.7 | T36 T40 | T36-R38 PolarHBondContact O-N 2.99Å; R38-T40 VanDerWaalsContact C-N 3.32Å; R38-T40 PolarHBondContact O-N 3.41Å | ||
| 39 | Q | 41.5 | Very low | 46.5 | Very low | 198 Ų | 198 | 150.8 Ų | 150.8 | 93% | 0.925 | 77% | 0.769 | S | S | * | * | trans | -83.8 | 84.5 | 163.9 | -80.3 | -172 | -12.4 | 0 | 0 | 108.7 | P37 | P37-Q39 PolarHBondContact O-N 3.19Š| ||
| 40 | T | 41.4 | Very low | 46.2 | Very low | 103 Ų | 103 | 149 Ų | 149 | 63% | 0.632 | 77% | 0.772 | S | S | * | * | trans | -77.3 | 125.5 | 154.1 | 14.6 | 0 | 0 | 0 | 0 | 108.5 | R38 | R38-T40 VanDerWaalsContact C-N 3.32Å; R38-T40 PolarHBondContact O-N 3.41Å | ||
| 41 | F | 44.1 | Very low | 45.8 | Very low | 170 Ų | 170 | 148.2 Ų | 148.2 | 75% | 0.746 | 78% | 0.777 | S | S | * | * | trans | 52.9 | 96.9 | 141.3 | -155.3 | -96.5 | 0 | 0 | 0 | 117.5 | D43 | F41-D43 WeakPolarHBondContact CE1-OD2 3.49Å; F41-D43 WeakPolarHBondContact CZ-OD2 3.26Å | ||
| 42 | Q | 40.1 | Very low | 45.7 | Very low | 195 Ų | 195 | 147.5 Ų | 147.5 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | -135.3 | 99.1 | 152.4 | -106.7 | -178.4 | 24.7 | 0 | 0 | 109.3 | ||||
| 43 | D | 41.9 | Very low | 45.7 | Very low | 125 Ų | 125 | 149.8 Ų | 149.8 | 67% | 0.668 | 79% | 0.786 | S | S | * | * | trans | -65.6 | 119.1 | 152.1 | -75.1 | -51.7 | 0 | 0 | 0 | 108.8 | F41 | F41-D43 WeakPolarHBondContact CE1-OD2 3.49Å; F41-D43 WeakPolarHBondContact CZ-OD2 3.26Å | ||
| 44 | D | 34.3 | Very low | 45 | Very low | 131 Ų | 131 | 156.1 Ų | 156.1 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | -153.2 | 109.6 | 145 | -156.8 | -39.9 | 0 | 0 | 0 | 110.5 | R46 | D44-R46 PolarHBondContact OD1-N 3.21Š| ||
| 45 | P | 51.5 | Low | 44.6 | Very low | 108 Ų | 108 | 159.3 Ų | 159.3 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | trans | -100 | 77.6 | 174.2 | 36.5 | -27.4 | 0 | 0 | 0 | 110.5 | ||||
| 46 | R | 47.6 | Very low | 45 | Very low | 216 Ų | 216 | 154.7 Ų | 154.7 | 82% | 0.815 | 79% | 0.791 | S | S | * | * | trans | -170.3 | 116 | 159.5 | -91 | 129.6 | -170.5 | 177.4 | 5.7 | 105 | D44 | D44-R46 PolarHBondContact OD1-N 3.21Š| ||
| 47 | V | 46 | Very low | 45.4 | Very low | 135 Ų | 135 | 154 Ų | 154 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | -169.4 | 114.9 | 83.1 | 165.8 | 0 | 0 | 0 | 0 | 106.6 | |||||
| 48 | R | 46.5 | Very low | 46 | Very low | 241 Ų | 241 | 155.4 Ų | 155.4 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -106.3 | 119.8 | 165.8 | -170.1 | -170.1 | -88.7 | -179.4 | -5.4 | 107.2 | ||||
| 49 | P | 54.1 | Low | 46.3 | Very low | 105 Ų | 105 | 148.3 Ų | 148.3 | 68% | 0.682 | 79% | 0.792 | S | S | * | * | trans | -75.2 | 147.2 | 174.2 | 28.4 | -30.5 | 0 | 0 | 0 | 111 | ||||
| 50 | P | 47 | Very low | 46.9 | Very low | 134 Ų | 134 | 145.5 Ų | 145.5 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | trans | -82.1 | 129.1 | 177.9 | 32.8 | -29.4 | 0 | 0 | 0 | 110.1 | ||||
| 51 | G | 42.8 | Very low | 47.1 | Very low | 67 Ų | 67 | 145.9 Ų | 145.9 | 69% | 0.691 | 79% | 0.788 | S | S | * | * | trans | -136.3 | 151.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 52 | P | 50.8 | Low | 47.4 | Very low | 126 Ų | 126 | 140.1 Ų | 140.1 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -83.7 | 141.5 | -132.5 | 28 | -31.2 | 0 | 0 | 0 | 115.1 | W54 | P52-W54 PolarHBondContact O-N 3.38Š| ||
| 53 | R | 49.6 | Very low | 47.9 | Very low | 232 Ų | 232 | 136.5 Ų | 136.5 | 88% | 0.875 | 77% | 0.768 | S | S | * | * | trans | -60.7 | 113.6 | 171.3 | -172.3 | 180 | -154.5 | 156 | 4 | 109.5 | Q55 | R53-Q55 PolarHBondContact O-N 3Å; R53-Q55 VanDerWaalsContact O-N 3.13Å | ||
| 54 | W | 40.2 | Very low | 47.8 | Very low | 251 Ų | 251 | 141.3 Ų | 141.3 | 95% | 0.951 | 78% | 0.777 | S | S | * | * | trans | -55 | 116.3 | 170.7 | -71.8 | 99.4 | 0 | 0 | 0 | 109.9 | P52 | P52-W54 PolarHBondContact O-N 3.38Š| ||
| 55 | Q | 44.9 | Very low | 48.5 | Very low | 180 Ų | 180 | 144 Ų | 144 | 84% | 0.841 | 78% | 0.777 | S | S | * | * | trans | -99.2 | 122.3 | 169.1 | -64.5 | -163.5 | 70.1 | 0 | 0 | 107.5 | R53 | R53-Q55 PolarHBondContact O-N 3Å; R53-Q55 VanDerWaalsContact O-N 3.13Å | ||
| 56 | G | 50.7 | Low | 47.8 | Very low | 64 Ų | 64 | 144.1 Ų | 144.1 | 66% | 0.66 | 78% | 0.781 | S | S | * | * | trans | -68.8 | 176.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 57 | P | 56.6 | Low | 47.5 | Very low | 125 Ų | 125 | 145.4 Ų | 145.4 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -60.9 | 152.3 | -179.9 | -16.4 | 29.4 | 0 | 0 | 0 | 112.1 | G59 | P57-G59 PolarHBondContact O-N 2.76Š| ||
| 58 | P | 53.8 | Low | 47.7 | Very low | 139 Ų | 139 | 145 Ų | 145 | 90% | 0.903 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -76.3 | 115.3 | -175 | 31.2 | -30.7 | 0 | 0 | 0 | 110.1 | ||
| 59 | G | 46.2 | Very low | 47.1 | Very low | 69 Ų | 69 | 139.7 Ų | 139.7 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | -170 | 128.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | P57 | P57-G59 PolarHBondContact O-N 2.76Š| ||
| 60 | D | 55.4 | Low | 46.1 | Very low | 139 Ų | 139 | 138.3 Ų | 138.3 | 74% | 0.743 | 79% | 0.79 | S | S | * | * | trans | -47.6 | 143.3 | -166.6 | -74.2 | -53.4 | 0 | 0 | 0 | 116.6 | G62 | D60-G62 PolarHBondContact O-N 3.23Š| ||
| 61 | P | 45 | Very low | 45.7 | Very low | 112 Ų | 112 | 138.9 Ų | 138.9 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 31.1 | -176.6 | 33.6 | -35.2 | 0 | 0 | 0 | 114.3 | ||
| 62 | G | 51.1 | Low | 45.8 | Very low | 49 Ų | 49 | 141.9 Ų | 141.9 | 51% | 0.505 | 79% | 0.793 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.4 | -10.5 | -169.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | D60 | D60-G62 PolarHBondContact O-N 3.23Š|
| 63 | T | 49 | Very low | 44.9 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 73% | 0.73 | 78% | 0.782 | S | S | * | * | trans | -123.1 | 10.2 | -155.9 | 44.5 | 0 | 0 | 0 | 0 | 117 | W65 | T63-W65 VanDerWaalsContact C-N 3.26Å; T63-W65 PolarHBondContact O-N 2.78Å | ||
| 64 | W | 40.8 | Very low | 44.1 | Very low | 225 Ų | 225 | 134.6 Ų | 134.6 | 85% | 0.852 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -78.7 | -3.8 | -175.4 | -64 | 83.6 | 0 | 0 | 0 | 114.9 | ||
| 65 | W | 48.3 | Very low | 43.9 | Very low | 187 Ų | 187 | 134.2 Ų | 134.2 | 71% | 0.708 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -131.3 | 94.1 | 178.8 | 42.6 | 81.1 | 0 | 0 | 0 | 110.4 | T63 | T63-W65 VanDerWaalsContact C-N 3.26Å; T63-W65 PolarHBondContact O-N 2.78Å |
| 66 | S | 38.4 | Very low | 43.9 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | 159.9 | 110.8 | 135.2 | -72.8 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 67 | R | 40.8 | Very low | 43.2 | Very low | 243 Ų | 243 | 138.7 Ų | 138.7 | 92% | 0.917 | 79% | 0.785 | S | S | * | * | trans | 57.2 | 149 | 140.9 | -77.9 | -171.2 | 179.2 | -177.4 | 1.3 | 123 | ||||
| 68 | P | 49.1 | Very low | 42.4 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -81.8 | 138.6 | -177.8 | 34.9 | -32.6 | 0 | 0 | 0 | 111.5 | ||||
| 69 | S | 35.2 | Very low | 41.5 | Very low | 129 Ų | 129 | 138.5 Ų | 138.5 | 90% | 0.902 | 78% | 0.781 | S | S | * | * | trans | -120.8 | 141.2 | -179.7 | -151.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 70 | G | 31.7 | Very low | 41 | Very low | 75 Ų | 75 | 139.3 Ų | 139.3 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | -79.1 | 177.2 | -165.3 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 71 | D | 39.7 | Very low | 40.3 | Very low | 147 Ų | 147 | 138.8 Ų | 138.8 | 79% | 0.786 | 78% | 0.779 | S | S | * | * | trans | -52.2 | 156.9 | 177.4 | -147 | -6.7 | 0 | 0 | 0 | 114.2 | G73 | D71-G73 PolarHBondContact OD1-N 3.23Š| ||
| 72 | P | 44.8 | Very low | 40.2 | Very low | 129 Ų | 129 | 139 Ų | 139 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | -147.8 | 126.3 | 90.2 | 34.8 | -15.2 | 0 | 0 | 0 | 116.3 | |||||
| 73 | G | 32.8 | Very low | 39.8 | Very low | 56 Ų | 56 | 147.1 Ų | 147.1 | 58% | 0.577 | 80% | 0.795 | S | S | * | * | 87 | 95.9 | 107.8 | 0 | 0 | 0 | 0 | 0 | 120.6 | D71 | D71-G73 PolarHBondContact OD1-N 3.23Š| |||
| 74 | T | 31.7 | Very low | 39 | Very low | 149 Ų | 149 | 145.8 Ų | 145.8 | 91% | 0.914 | 80% | 0.797 | S | S | * | * | -159.6 | 115.5 | 120.3 | 48.7 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 75 | R | 35.5 | Very low | 39 | Very low | 244 Ų | 244 | 145.8 Ų | 145.8 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | trans | -83.6 | 178.6 | 170.1 | -116.1 | -178.9 | -176.1 | 160.2 | 1.5 | 110.1 | ||||
| 76 | P | 46.1 | Very low | 38.5 | Very low | 104 Ų | 104 | 145 Ų | 145 | 68% | 0.675 | 81% | 0.805 | S | S | * | * | cis | -138.8 | 157.7 | -11.2 | 35.1 | -15.9 | 0 | 0 | 0 | 115.4 | ||||
| 77 | R | 34.7 | Very low | 38.6 | Very low | 234 Ų | 234 | 150.3 Ų | 150.3 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | trans | -169.4 | 118.2 | 134.9 | -121.3 | 179 | 176.9 | 152.2 | -0.5 | 112.4 | ||||
| 78 | P | 39.7 | Very low | 38.7 | Very low | 118 Ų | 118 | 144.4 Ų | 144.4 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | trans | -90.7 | 116.8 | 160.1 | 30.9 | -21.8 | 0 | 0 | 0 | 108.7 | A80 | P78-A80 PolarHBondContact O-N 2.76Å; P78-A80 VanDerWaalsContact O-N 3.17Å | ||
| 79 | T | 34.9 | Very low | 38.2 | Very low | 141 Ų | 141 | 143.5 Ų | 143.5 | 87% | 0.865 | 80% | 0.798 | S | S | * | * | trans | -81 | 94.1 | 169.5 | -58.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 80 | A | 35.3 | Very low | 38 | Very low | 87 Ų | 87 | 141.1 Ų | 141.1 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | trans | -101.3 | 130.6 | 164 | 0 | 0 | 0 | 0 | 0 | 110 | P78 | P78-A80 PolarHBondContact O-N 2.76Å; P78-A80 VanDerWaalsContact O-N 3.17Å | ||
| 81 | D | 42.5 | Very low | 38.7 | Very low | 128 Ų | 128 | 144.5 Ų | 144.5 | 68% | 0.684 | 79% | 0.794 | S | S | * | * | trans | 74.6 | 144.8 | 160.3 | -119.3 | -13.4 | 0 | 0 | 0 | 118.4 | R83 | D81-R83 PolarHBondContact OD1-N 3.38Š| ||
| 82 | P | 42.3 | Very low | 38.9 | Very low | 116 Ų | 116 | 142.7 Ų | 142.7 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | -141.8 | 144.5 | 62.9 | 35.5 | -15.6 | 0 | 0 | 0 | 116.6 | A84 | P82-A84 PolarHBondContact O-N 3.32Š| |||
| 83 | R | 42.8 | Very low | 38.6 | Very low | 219 Ų | 219 | 147.9 Ų | 147.9 | 83% | 0.826 | 79% | 0.793 | S | S | * | * | trans | -28.5 | 115.2 | 141.5 | -80.5 | 176.9 | 164.4 | 133.9 | -5.7 | 113.3 | D81 | D81-R83 PolarHBondContact OD1-N 3.38Š| ||
| 84 | A | 32.8 | Very low | 38.5 | Very low | 92 Ų | 92 | 149.9 Ų | 149.9 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | trans | -136.9 | 85 | 148.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | P82 | P82-A84 PolarHBondContact O-N 3.32Š| ||
| 85 | R | 40 | Very low | 39 | Very low | 225 Ų | 225 | 153.9 Ų | 153.9 | 85% | 0.849 | 80% | 0.802 | S | S | * | * | 42.9 | 104.5 | 103.1 | -73.4 | -156.3 | -162.8 | -101.8 | 5.5 | 113.4 | |||||
| 86 | L | 37 | Very low | 38.9 | Very low | 170 Ų | 170 | 151.6 Ų | 151.6 | 89% | 0.89 | 80% | 0.802 | S | S | * | * | 164 | 123.1 | 110.4 | -84.9 | 152 | 0 | 0 | 0 | 110.6 | |||||
| 87 | R | 41.5 | Very low | 38.5 | Very low | 224 Ų | 224 | 157.5 Ų | 157.5 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | -82 | 146.2 | 169.1 | -157.3 | -173.5 | 170.2 | -173 | -4.3 | 108.4 | ||||
| 88 | P | 42.6 | Very low | 39 | Very low | 118 Ų | 118 | 151.7 Ų | 151.7 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | -143 | 131.4 | 110.4 | 33.1 | -16.3 | 0 | 0 | 0 | 111.9 | |||||
| 89 | S | 38.2 | Very low | 39.2 | Very low | 109 Ų | 109 | 151 Ų | 151 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | 73.6 | 111.5 | 103.1 | -164.9 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 90 | G | 31.8 | Very low | 39.1 | Very low | 78 Ų | 78 | 147.8 Ų | 147.8 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 173.2 | 69 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 91 | D | 46.4 | Very low | 39.3 | Very low | 147 Ų | 147 | 150.5 Ų | 150.5 | 79% | 0.786 | 81% | 0.805 | S | S | * | * | trans | -74.5 | 155.9 | 163.7 | -122.2 | -43 | 0 | 0 | 0 | 109.1 | ||||
| 92 | P | 44.5 | Very low | 39.5 | Very low | 109 Ų | 109 | 151 Ų | 151 | 71% | 0.708 | 82% | 0.815 | S | S | * | * | -152.7 | 151.4 | 66.4 | 36.7 | -15.1 | 0 | 0 | 0 | 118.3 | |||||
| 93 | R | 37.2 | Very low | 39.5 | Very low | 237 Ų | 237 | 154.1 Ų | 154.1 | 89% | 0.894 | 82% | 0.822 | S | S | * | * | trans | 68.4 | 120.7 | 156.7 | -67.4 | 173.6 | 178.7 | 167.5 | -0.4 | 116.2 | ||||
| 94 | A | 31.7 | Very low | 39.3 | Very low | 98 Ų | 98 | 147.6 Ų | 147.6 | 81% | 0.81 | 82% | 0.815 | S | S | * | * | -154.2 | 86.5 | 57.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 95 | R | 41.6 | Very low | 39.7 | Very low | 234 Ų | 234 | 153.7 Ų | 153.7 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | trans | 9.7 | 107.1 | 131.7 | -158.2 | 179.6 | -156.1 | 175 | 5.2 | 116.9 | ||||
| 96 | Q | 33.8 | Very low | 39.3 | Very low | 196 Ų | 196 | 154.4 Ų | 154.4 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | trans | -142.1 | 83.3 | 146.6 | -77.9 | -148.9 | -0.2 | 0 | 0 | 113 | ||||
| 97 | R | 37.4 | Very low | 39.6 | Very low | 228 Ų | 228 | 151.1 Ų | 151.1 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -170.3 | 158.5 | 137.6 | -113.2 | -164.8 | 162.2 | 128.3 | -4.8 | 106.3 | ||||
| 98 | P | 44.2 | Very low | 40.1 | Very low | 112 Ų | 112 | 147.7 Ų | 147.7 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | cis | -144 | 174.4 | 28.6 | 36 | -13.2 | 0 | 0 | 0 | 117 | ||||
| 99 | A | 44.1 | Very low | 40.2 | Very low | 103 Ų | 103 | 148.5 Ų | 148.5 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | 51.2 | 124.2 | 144.3 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 100 | G | 33.9 | Very low | 40.6 | Very low | 74 Ų | 74 | 150.4 Ų | 150.4 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -163.8 | 109.2 | 159 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 101 | D | 39.2 | Very low | 41 | Very low | 144 Ų | 144 | 151 Ų | 151 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | trans | -48.9 | 137.9 | 166.1 | -78.7 | -56.3 | 0 | 0 | 0 | 111.9 | M103 | D101-M103 PolarHBondContact O-N 2.84Š| ||
| 102 | P | 47 | Very low | 41.1 | Very low | 138 Ų | 138 | 150.2 Ų | 150.2 | 90% | 0.896 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | 8 | 169.6 | 28.3 | -24.5 | 0 | 0 | 0 | 113.2 | ||
| 103 | M | 41.3 | Very low | 41.3 | Very low | 181 Ų | 181 | 150.3 Ų | 150.3 | 89% | 0.892 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99 | 8.9 | -170.7 | -146.3 | -178.3 | 175.1 | 0 | 0 | 115.5 | D101 | D101-M103 PolarHBondContact O-N 2.84Š|
| 104 | A | 39.3 | Very low | 42 | Very low | 82 Ų | 82 | 144.2 Ų | 144.2 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -128.7 | 43.5 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 105 | R | 40.4 | Very low | 42.7 | Very low | 221 Ų | 221 | 149 Ų | 149 | 83% | 0.834 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -166.2 | 60.5 | 157.2 | -158.4 | 80.3 | -175.7 | -175.1 | 3.1 | 115.1 | ||
| 106 | W | 32.3 | Very low | 43.2 | Very low | 239 Ų | 239 | 142.9 Ų | 142.9 | 91% | 0.905 | 77% | 0.769 | S | S | * | * | trans | -142.8 | 124.6 | 145.1 | -70.7 | 105.5 | 0 | 0 | 0 | 108.8 | ||||
| 107 | P | 43.2 | Very low | 44 | Very low | 101 Ų | 101 | 141.2 Ų | 141.2 | 66% | 0.656 | 76% | 0.761 | S | S | * | * | trans | -68 | 137.9 | 177 | 28.6 | -30.1 | 0 | 0 | 0 | 109 | I109 | P107-I109 PolarHBondContact O-N 2.93Š| ||
| 108 | L | 51.4 | Low | 44.8 | Very low | 152 Ų | 152 | 134.6 Ų | 134.6 | 80% | 0.796 | 75% | 0.746 | S | S | * | * | trans | -21.6 | 93.1 | 153.7 | -177.4 | 74.2 | 0 | 0 | 0 | 112.7 | ||||
| 109 | I | 45.7 | Very low | 45.4 | Very low | 135 Ų | 135 | 134.2 Ų | 134.2 | 69% | 0.692 | 74% | 0.738 | S | S | * | * | trans | -136.9 | 90.2 | 144.2 | -72 | 108.1 | 0 | 0 | 0 | 103.8 | P107 D111 | P107-I109 PolarHBondContact O-N 2.93Å; I109-D111 HydrophobicContact CG2-CB 3.64Å; I109-D111 PolarHBondContact O-N 2.89Å | ||
| 110 | D | 45.8 | Very low | 46.3 | Very low | 150 Ų | 150 | 134 Ų | 134 | 80% | 0.802 | 72% | 0.722 | S | S | * | * | trans | -61.3 | 89.8 | 150.7 | -74.9 | -66.7 | 0 | 0 | 0 | 106.8 | ||||
| 111 | D | 41.2 | Very low | 47.3 | Very low | 90 Ų | 90 | 134.8 Ų | 134.8 | 48% | 0.481 | 72% | 0.715 | S | S | . | * | trans | -110.5 | 114.5 | 161.5 | -169.6 | -79 | 0 | 0 | 0 | 107.9 | I109 T113 | I109-D111 HydrophobicContact CG2-CB 3.64Å; I109-D111 PolarHBondContact O-N 2.89Å; D111-T113 PolarHBondContact O-N 3.21Å; D111-T113 VanDerWaalsContact O-N 3.11Å; D111-T113 WeakPolarHBondContact OD1-CA 3.24Å; D111-T113 WeakPolarHBondContact OD1-CB 3.47Å; D111-T113 PolarHBondContact OD1-N 3.21Å; D111-T113 PolarHBondContact OD1-OG1 3.27Å | ||
| 112 | P | 48.6 | Very low | 48.5 | Very low | 131 Ų | 131 | 134.9 Ų | 134.9 | 85% | 0.851 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | 19 | -176 | 32 | -34.5 | 0 | 0 | 0 | 113.7 | ||
| 113 | T | 48.5 | Very low | 49.4 | Very low | 111 Ų | 111 | 136 Ų | 136 | 68% | 0.681 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.7 | -7.4 | -166.3 | -42.1 | 0 | 0 | 0 | 0 | 115.7 | D111 | D111-T113 PolarHBondContact O-N 3.21Å; D111-T113 VanDerWaalsContact O-N 3.11Å; D111-T113 WeakPolarHBondContact OD1-CA 3.24Å; D111-T113 WeakPolarHBondContact OD1-CB 3.47Å; D111-T113 PolarHBondContact OD1-N 3.21Å; D111-T113 PolarHBondContact OD1-OG1 3.27Å |
| 114 | T | 51.4 | Low | 50.4 | Low | 108 Ų | 108 | 134 Ų | 134 | 66% | 0.663 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -134.7 | 20.8 | -160.6 | -27.8 | 0 | 0 | 0 | 0 | 118.9 | ||
| 115 | R | 45.9 | Very low | 51.7 | Low | 200 Ų | 200 | 132.2 Ų | 132.2 | 76% | 0.755 | 68% | 0.677 | S | S | * | * | trans | -141 | 55.3 | -179.2 | -56.2 | -169.9 | -167.5 | -156.4 | 6.4 | 119.5 | ||||
| 116 | P | 53.2 | Low | 53.3 | Low | 104 Ų | 104 | 125.8 Ų | 125.8 | 68% | 0.675 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -72 | -30 | 161 | -10.9 | 26.5 | 0 | 0 | 0 | 112.7 | ||
| 117 | Q | 49.7 | Very low | 55.1 | Low | 161 Ų | 161 | 118.9 Ų | 118.9 | 75% | 0.752 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -86.8 | -20.1 | -160.5 | -144.8 | -177.2 | 104.8 | 0 | 0 | 115.4 | ||
| 118 | V | 53.6 | Low | 56.3 | Low | 90 Ų | 90 | 121.4 Ų | 121.4 | 55% | 0.545 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -80.5 | -31.1 | -179.4 | -178.7 | 0 | 0 | 0 | 0 | 111.2 | C121 E122 | V118-C121 PolarHBondContact O-N 2.87Å; V118-E122 PolarHBondContact O-N 3.46Å |
| 119 | D | 56.9 | Low | 57.1 | Low | 103 Ų | 103 | 116 Ų | 116 | 55% | 0.551 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65 | -42.3 | 177 | -153 | -88.6 | 0 | 0 | 0 | 110.9 | C121 E122 R123 | D119-C121 PolarHBondContact O-N 3.32Å; D119-E122 PolarHBondContact O-N 2.85Å; D119-R123 WeakPolarHBondContact O-CB 3.31Å; D119-R123 PolarHBondContact O-N 2.98Å |
| 120 | D | 64.2 | Low | 58.4 | Low | 98 Ų | 98 | 115.3 Ų | 115.3 | 52% | 0.524 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.2 | -35.5 | 178 | -75.2 | -40.9 | 0 | 0 | 0 | 113.1 | R123 M124 | D120-R123 PolarHBondContact O-N 3.3Å; D120-M124 WeakPolarHBondContact O-CB 3.21Å; D120-M124 PolarHBondContact O-N 3.44Å |
| 121 | C | 54.1 | Low | 59.5 | Low | 92 Ų | 92 | 112.8 Ų | 112.8 | 62% | 0.622 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.2 | -37.5 | 175.4 | -73.7 | 0 | 0 | 0 | 0 | 112.1 | V118 D119 G125 | V118-C121 PolarHBondContact O-N 2.87Å; D119-C121 PolarHBondContact O-N 3.32Å; C121-G125 PolarHBondContact O-N 3.23Å |
| 122 | E | 64.3 | Low | 60.8 | Low | 146 Ų | 146 | 112.1 Ų | 112.1 | 68% | 0.682 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -73.3 | -36.6 | 176.1 | -153.7 | -179.6 | 130.8 | 0 | 0 | 111.5 | V118 D119 G125 T126 | V118-E122 PolarHBondContact O-N 3.46Å; D119-E122 PolarHBondContact O-N 2.85Å; E122-G125 PolarHBondContact O-N 2.91Å; E122-T126 PolarHBondContact O-N 3.27Å; E122-T126 PolarHBondContact O-OG1 2.82Å |
| 123 | R | 65.3 | Low | 61.6 | Low | 162 Ų | 162 | 113.2 Ų | 113.2 | 61% | 0.611 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -72.8 | -38.8 | 177.8 | -159 | 171.8 | -164.7 | -177.2 | 5.3 | 112.5 | D119 D120 T126 L127 | D119-R123 WeakPolarHBondContact O-CB 3.31Å; D119-R123 PolarHBondContact O-N 2.98Å; D120-R123 PolarHBondContact O-N 3.3Å; R123-T126 PolarHBondContact O-N 2.86Å; R123-L127 WeakPolarHBondContact O-CG 3.46Å; R123-L127 PolarHBondContact O-N 2.76Å |
| 124 | M | 63.1 | Low | 62.4 | Low | 138 Ų | 138 | 112 Ų | 112 | 68% | 0.68 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.7 | -35.9 | 172.1 | -172.7 | 157.6 | 148.4 | 0 | 0 | 111.1 | D120 L127 F128 | D120-M124 WeakPolarHBondContact O-CB 3.21Å; D120-M124 PolarHBondContact O-N 3.44Å; M124-L127 PolarHBondContact O-N 2.85Å; M124-F128 WeakPolarHBondContact O-CB 3.31Å; M124-F128 PolarHBondContact O-N 3.44Å |
| 125 | G | 67.3 | Low | 63 | Low | 45 Ų | 45 | 110 Ų | 110 | 46% | 0.464 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.9 | -39 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | C121 E122 F128 G129 | C121-G125 PolarHBondContact O-N 3.23Å; E122-G125 PolarHBondContact O-N 2.91Å; G125-F128 PolarHBondContact O-N 3.43Å; G125-G129 PolarHBondContact O-N 3.39Å |
| 126 | T | 73.4 | Confident | 63.7 | Low | 85 Ų | 85 | 108.3 Ų | 108.3 | 52% | 0.521 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -68.6 | -39.6 | 175.1 | -57.3 | 0 | 0 | 0 | 0 | 112 | E122 R123 G129 Q130 | E122-T126 PolarHBondContact O-N 3.27Å; E122-T126 PolarHBondContact O-OG1 2.82Å; R123-T126 PolarHBondContact O-N 2.86Å; T126-G129 CarbonylContact O-C 3.6Å; T126-G129 WeakPolarHBondContact O-CA 3.25Å; T126-G129 PolarHBondContact O-N 2.75Å; T126-Q130 PolarHBondContact O-N 2.92Å |
| 127 | L | 70.1 | Confident | 63.9 | Low | 94 Ų | 94 | 108.2 Ų | 108.2 | 49% | 0.492 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.7 | -38.3 | 174 | -77.1 | 166.5 | 0 | 0 | 0 | 112 | R123 M124 G129 Q130 L131 | R123-L127 WeakPolarHBondContact O-CG 3.46Å; R123-L127 PolarHBondContact O-N 2.76Å; M124-L127 PolarHBondContact O-N 2.85Å; L127-G129 VanDerWaalsContact C-N 3.25Å; L127-G129 PolarHBondContact O-N 2.88Å; L127-Q130 CarbonylContact O-C 3.58Å; L127-Q130 PolarHBondContact O-N 3.03Å; L127-L131 WeakPolarHBondContact O-CB 2.99Å; L127-L131 PolarHBondContact O-N 2.77Å |
| 128 | F | 69.6 | Low | 64.3 | Low | 154 Ų | 154 | 102.6 Ų | 102.6 | 68% | 0.675 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.1 | -35.1 | 173.1 | -146.1 | -92.8 | 0 | 0 | 0 | 111.1 | M124 G125 N132 | M124-F128 WeakPolarHBondContact O-CB 3.31Å; M124-F128 PolarHBondContact O-N 3.44Å; G125-F128 PolarHBondContact O-N 3.43Å; F128-N132 WeakPolarHBondContact O-CB 3.37Å; F128-N132 PolarHBondContact O-N 3.31Å |
| 129 | G | 66.7 | Low | 64.5 | Low | 39 Ų | 39 | 100.1 Ų | 100.1 | 40% | 0.402 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.3 | -42.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | G125 T126 L127 K133 | G125-G129 PolarHBondContact O-N 3.39Å; T126-G129 CarbonylContact O-C 3.6Å; T126-G129 WeakPolarHBondContact O-CA 3.25Å; T126-G129 PolarHBondContact O-N 2.75Å; L127-G129 VanDerWaalsContact C-N 3.25Å; L127-G129 PolarHBondContact O-N 2.88Å; G129-K133 WeakPolarHBondContact O-CB 3.19Å; G129-K133 PolarHBondContact O-N 3.44Å |
| 130 | Q | 72.6 | Confident | 64.3 | Low | 120 Ų | 120 | 100.5 Ų | 100.5 | 56% | 0.561 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -69.4 | -38 | 174.4 | -90.3 | -176.6 | -54.4 | 0 | 0 | 112.7 | T126 L127 K133 C134 | T126-Q130 PolarHBondContact O-N 2.92Å; L127-Q130 CarbonylContact O-C 3.58Å; L127-Q130 PolarHBondContact O-N 3.03Å; Q130-K133 CarbonylContact O-C 3.59Å; Q130-K133 PolarHBondContact O-N 2.84Å; Q130-C134 WeakPolarHBondContact O-CB 3.31Å; Q130-C134 PolarHBondContact O-N 3.43Å |
| 131 | L | 68.9 | Low | 63.6 | Low | 98 Ų | 98 | 101.9 Ų | 101.9 | 51% | 0.513 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.4 | -48.6 | 171.8 | -100.3 | 142 | 0 | 0 | 0 | 110.5 | L127 K133 C134 L135 | L127-L131 WeakPolarHBondContact O-CB 2.99Å; L127-L131 PolarHBondContact O-N 2.77Å; L131-K133 VanDerWaalsContact C-N 3.28Å; L131-K133 PolarHBondContact O-N 2.93Å; L131-C134 PolarHBondContact O-N 3.03Å; L131-L135 VanDerWaalsContact O-CB 3.3Å; L131-L135 WeakPolarHBondContact O-CB 3.02Å; L131-L135 VanDerWaalsContact O-CD1 3.31Å; L131-L135 WeakPolarHBondContact O-CD1 3.38Å; L131-L135 VanDerWaalsContact O-CG 3.25Å; L131-L135 WeakPolarHBondContact O-CG 3.05Å; L131-L135 PolarHBondContact O-N 2.8Å |
| 132 | N | 68.4 | Low | 63.3 | Low | 75 Ų | 75 | 101.6 Ų | 101.6 | 40% | 0.401 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.9 | -39.2 | 174.8 | -174.1 | -12.8 | 0 | 0 | 0 | 111.4 | F128 R136 | F128-N132 WeakPolarHBondContact O-CB 3.37Å; F128-N132 PolarHBondContact O-N 3.31Å; N132-R136 WeakPolarHBondContact O-CB 3.3Å; N132-R136 WeakPolarHBondContact O-CG 3.33Å; N132-R136 PolarHBondContact O-N 3.49Å; N132-R136 PolarHBondContact OD1-NE 2.89Å |
| 133 | K | 66.6 | Low | 62.8 | Low | 155 Ų | 155 | 102.6 Ų | 102.6 | 67% | 0.674 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -69.5 | -39.4 | 175.8 | -166.9 | 169 | -174.9 | 169.3 | 0 | 112.5 | G129 Q130 L131 S137 | G129-K133 WeakPolarHBondContact O-CB 3.19Å; G129-K133 PolarHBondContact O-N 3.44Å; Q130-K133 CarbonylContact O-C 3.59Å; Q130-K133 PolarHBondContact O-N 2.84Å; L131-K133 VanDerWaalsContact C-N 3.28Å; L131-K133 PolarHBondContact O-N 2.93Å; K133-S137 WeakPolarHBondContact O-CA 3.36Å; K133-S137 WeakPolarHBondContact O-CB 3.47Å; K133-S137 PolarHBondContact O-N 3.46Å |
| 134 | C | 65.8 | Low | 62.1 | Low | 86 Ų | 86 | 98 Ų | 98 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.9 | -45.9 | 172.9 | -96.9 | 0 | 0 | 0 | 0 | 111.2 | Q130 L131 R136 S137 A138 | Q130-C134 WeakPolarHBondContact O-CB 3.31Å; Q130-C134 PolarHBondContact O-N 3.43Å; L131-C134 PolarHBondContact O-N 3.03Å; C134-R136 VanDerWaalsContact C-N 3.33Å; C134-R136 PolarHBondContact O-N 3.24Å; C134-S137 PolarHBondContact O-N 2.87Å; C134-A138 WeakPolarHBondContact O-CB 3.38Å; C134-A138 PolarHBondContact O-N 3.43Å |
| 135 | L | 63.1 | Low | 61.4 | Low | 65 Ų | 65 | 100.5 Ų | 100.5 | 34% | 0.34 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -55.6 | -48.3 | 175 | -78.3 | 155.8 | 0 | 0 | 0 | 110.5 | L131 F140 L161 | L131-L135 VanDerWaalsContact O-CB 3.3Å; L131-L135 WeakPolarHBondContact O-CB 3.02Å; L131-L135 VanDerWaalsContact O-CD1 3.31Å; L131-L135 WeakPolarHBondContact O-CD1 3.38Å; L131-L135 VanDerWaalsContact O-CG 3.25Å; L131-L135 WeakPolarHBondContact O-CG 3.05Å; L131-L135 PolarHBondContact O-N 2.8Å; L135-F140 WeakPolarHBondContact O-CB 3.25Å; L135-F140 PolarHBondContact O-N 3.39Å; L135-L161 HydrophobicContact CD2-CD2 4.35Å |
| 136 | R | 61.2 | Low | 60.9 | Low | 164 Ų | 164 | 101.3 Ų | 101.3 | 62% | 0.619 | 55% | 0.545 | S | S | * | . | I | π-helix | trans | -66 | -41 | 175.1 | -76.7 | 177.6 | 176.1 | -119.1 | -1.4 | 114 | N132 C134 A138 | N132-R136 WeakPolarHBondContact O-CB 3.3Å; N132-R136 WeakPolarHBondContact O-CG 3.33Å; N132-R136 PolarHBondContact O-N 3.49Å; N132-R136 PolarHBondContact OD1-NE 2.89Å; C134-R136 VanDerWaalsContact C-N 3.33Å; C134-R136 PolarHBondContact O-N 3.24Å; R136-A138 VanDerWaalsContact C-N 3.29Å; R136-A138 PolarHBondContact O-N 2.99Å |
| 137 | S | 57.4 | Low | 59.4 | Low | 103 Ų | 103 | 106.2 Ų | 106.2 | 72% | 0.72 | 56% | 0.562 | S | S | * | * | I | π-helix | trans | -70.7 | -24.5 | -177.5 | 178.3 | 0 | 0 | 0 | 0 | 113.2 | K133 C134 | K133-S137 WeakPolarHBondContact O-CA 3.36Å; K133-S137 WeakPolarHBondContact O-CB 3.47Å; K133-S137 PolarHBondContact O-N 3.46Å; C134-S137 PolarHBondContact O-N 2.87Å |
| 138 | A | 58.4 | Low | 58.8 | Low | 43 Ų | 43 | 110 Ų | 110 | 36% | 0.355 | 58% | 0.575 | S | S | . | * | I | π-helix | trans | -107.8 | 2.5 | -168.1 | 0 | 0 | 0 | 0 | 0 | 113 | C134 R136 F157 | C134-A138 WeakPolarHBondContact O-CB 3.38Å; C134-A138 PolarHBondContact O-N 3.43Å; R136-A138 VanDerWaalsContact C-N 3.29Å; R136-A138 PolarHBondContact O-N 2.99Å; A138-F157 HydrophobicContact CB-CD2 4.33Å; A138-F157 HydrophobicContact CB-CE1 3.88Å; A138-F157 HydrophobicContact CB-CE2 3.26Å; A138-F157 HydrophobicContact CB-CZ 2.98Å; A138-F157 VanDerWaalsContact O-CD2 3.25Å; A138-F157 WeakPolarHBondContact O-CD2 3.44Å; A138-F157 VanDerWaalsContact O-CE2 3.31Å; A138-F157 WeakPolarHBondContact O-CE2 3.12Å; A138-F157 WeakPolarHBondContact O-CG 3.39Å |
| 139 | G | 56.8 | Low | 58.2 | Low | 37 Ų | 37 | 109 Ų | 109 | 38% | 0.381 | 58% | 0.581 | S | S | . | * | I | π-helix | trans | 159.9 | -7.3 | 163.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | T141 | G139-T141 VanDerWaalsContact C-N 3.29Å; G139-T141 PolarHBondContact O-N 2.78Å |
| 140 | F | 52.9 | Low | 57.8 | Low | 111 Ų | 111 | 111.2 Ų | 111.2 | 49% | 0.487 | 59% | 0.587 | S | S | . | * | I | π-helix | trans | -77.1 | -0.1 | -170.5 | -108.9 | -89.6 | 0 | 0 | 0 | 117 | L135 Q142 F158 | L135-F140 WeakPolarHBondContact O-CB 3.25Å; L135-F140 PolarHBondContact O-N 3.39Å; F140-Q142 PolarHBondContact O-N 3Å; F140-F158 AromaticContact CE2-CE2 3.63Å; F140-F158 HydrophobicContact CE2-CE2 3.63Å; F140-F158 AromaticContact CE2-CZ 3.41Å; F140-F158 HydrophobicContact CE2-CZ 3.41Å; F140-F158 VanDerWaalsContact CE2-CZ 3.41Å; F140-F158 HydrophobicContact CZ-CE2 4.04Å; F140-F158 AromaticContact CZ-CZ 3.67Å; F140-F158 HydrophobicContact CZ-CZ 3.67Å |
| 141 | T | 49.9 | Very low | 57.5 | Low | 128 Ų | 128 | 108.5 Ų | 108.5 | 79% | 0.785 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 19.8 | 174.5 | -43.5 | 0 | 0 | 0 | 0 | 112 | G139 | G139-T141 VanDerWaalsContact C-N 3.29Å; G139-T141 PolarHBondContact O-N 2.78Å |
| 142 | Q | 47.6 | Very low | 57.3 | Low | 86 Ų | 86 | 107.6 Ų | 107.6 | 40% | 0.402 | 58% | 0.576 | S | S | . | * | trans | -128 | 79 | 161.5 | -148.9 | -104.2 | -34.7 | 0 | 0 | 108.4 | F140 Y144 | F140-Q142 PolarHBondContact O-N 3Å; Q142-Y144 PolarHBondContact O-N 3.35Å | ||
| 143 | M | 52.9 | Low | 57.5 | Low | 166 Ų | 166 | 109 Ų | 109 | 82% | 0.818 | 59% | 0.587 | S | S | * | * | trans | -48.4 | 107.7 | 151 | -158.9 | 173 | -168.3 | 0 | 0 | 105.6 | F145 | M143-F145 PolarHBondContact O-N 2.81Š| ||
| 144 | Y | 51.5 | Low | 58 | Low | 66 Ų | 66 | 103.4 Ų | 103.4 | 26% | 0.259 | 56% | 0.564 | S | S | . | * | trans | -61.8 | 92.2 | 170.7 | -119.8 | -104.1 | 0 | 0 | 0 | 106.1 | Q142 G146 K148 V149 D151 I154 | Q142-Y144 PolarHBondContact O-N 3.35Å; Y144-G146 PolarHBondContact O-N 3.41Å; Y144-K148 WeakPolarHBondContact CD1-O 3.2Å; Y144-K148 HydrophobicContact CE1-CB 4.21Å; Y144-K148 WeakPolarHBondContact CE1-O 3.23Å; Y144-V149 VanDerWaalsContact CE1-O 3.31Å; Y144-V149 WeakPolarHBondContact CE1-O 3.35Å; Y144-V149 PolarHBondContact OH-O 3.42Å; Y144-D151 HydrophobicContact CD2-CB 4.46Å; Y144-D151 HydrophobicContact CE2-CB 3.4Å; Y144-D151 WeakPolarHBondContact OH-CA 3.35Å; Y144-D151 WeakPolarHBondContact OH-CB 3.21Å; Y144-D151 PolarHBondContact OH-N 3.11Å; Y144-D151 PolarHBondContact OH-OD1 3.37Å; Y144-I154 HydrophobicContact CD2-CD1 3.91Å; Y144-I154 HydrophobicContact CE2-CD1 4.27Å | ||
| 145 | F | 47.4 | Very low | 58.5 | Low | 191 Ų | 191 | 103.9 Ų | 103.9 | 84% | 0.838 | 56% | 0.56 | S | S | * | * | trans | -55.8 | 126 | 168.9 | -143.6 | -94 | 0 | 0 | 0 | 105.5 | M143 | M143-F145 PolarHBondContact O-N 2.81Š| ||
| 146 | G | 57.8 | Low | 59.4 | Low | 61 Ų | 61 | 106 Ų | 106 | 63% | 0.629 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -47.1 | 155.8 | -161.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | Y144 | Y144-G146 PolarHBondContact O-N 3.41Š|
| 147 | E | 42 | Very low | 60.2 | Low | 188 Ų | 188 | 100.3 Ų | 100.3 | 88% | 0.879 | 55% | 0.551 | S | S | * | * | S | Bend | trans | 94.4 | 9.9 | 165.7 | -53.2 | -163.9 | 156.4 | 0 | 0 | 119.9 | ||
| 148 | K | 56.2 | Low | 61.2 | Low | 173 Ų | 173 | 99.5 Ų | 99.5 | 75% | 0.752 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -128.7 | 141.8 | 160.3 | -62.1 | -73.6 | 163.6 | 172.7 | 0 | 108.9 | Y144 V150 | Y144-K148 WeakPolarHBondContact CD1-O 3.2Å; Y144-K148 HydrophobicContact CE1-CB 4.21Å; Y144-K148 WeakPolarHBondContact CE1-O 3.23Å; K148-V150 PolarHBondContact O-N 3.26Å |
| 149 | V | 58.4 | Low | 62.5 | Low | 133 Ų | 133 | 106 Ų | 106 | 81% | 0.806 | 55% | 0.549 | S | S | * | . | trans | -54.9 | 120.7 | -179.9 | -81.7 | 0 | 0 | 0 | 0 | 110.6 | Y144 | Y144-V149 VanDerWaalsContact CE1-O 3.31Å; Y144-V149 WeakPolarHBondContact CE1-O 3.35Å; Y144-V149 PolarHBondContact OH-O 3.42Å | ||
| 150 | V | 58.2 | Low | 63.8 | Low | 86 Ų | 86 | 107.7 Ų | 107.7 | 52% | 0.521 | 55% | 0.553 | S | S | . | * | trans | -14.6 | 125.8 | 169 | -86.6 | 0 | 0 | 0 | 0 | 115.5 | K148 I155 | K148-V150 PolarHBondContact O-N 3.26Å; V150-I155 HydrophobicContact CB-CD1 4.42Å; V150-I155 HydrophobicContact CG2-CD1 3.99Å | ||
| 151 | D | 65.8 | Low | 65.1 | Low | 63 Ų | 63 | 105 Ų | 105 | 34% | 0.337 | 54% | 0.543 | S | S | . | . | trans | -59.5 | 132.7 | -178.8 | -108.9 | -36.5 | 0 | 0 | 0 | 109 | Y144 V153 I154 I155 | Y144-D151 HydrophobicContact CD2-CB 4.46Å; Y144-D151 HydrophobicContact CE2-CB 3.4Å; Y144-D151 WeakPolarHBondContact OH-CA 3.35Å; Y144-D151 WeakPolarHBondContact OH-CB 3.21Å; Y144-D151 PolarHBondContact OH-N 3.11Å; Y144-D151 PolarHBondContact OH-OD1 3.37Å; D151-V153 PolarHBondContact O-N 3.15Å; D151-I154 HydrophobicContact CB-CD1 4.25Å; D151-I154 HydrophobicContact CB-CG1 4.3Å; D151-I154 PolarHBondContact O-N 3.33Å; D151-I155 PolarHBondContact O-N 3.01Å | ||
| 152 | P | 64.4 | Low | 66.7 | Low | 79 Ų | 79 | 104.9 Ų | 104.9 | 51% | 0.513 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -56.7 | -25.3 | 178.3 | 20.2 | -30.9 | 0 | 0 | 0 | 112.5 | I154 I155 I156 | P152-I154 VanDerWaalsContact C-N 3.34Å; P152-I154 PolarHBondContact O-N 3.39Å; P152-I155 PolarHBondContact O-N 3.36Å; P152-I156 VanDerWaalsContact O-CG1 3.26Å; P152-I156 WeakPolarHBondContact O-CG1 3.34Å; P152-I156 PolarHBondContact O-N 3.31Å |
| 153 | V | 73.9 | Confident | 68.6 | Low | 105 Ų | 105 | 108.5 Ų | 108.5 | 64% | 0.636 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63 | -40.1 | 176.2 | -174.7 | 0 | 0 | 0 | 0 | 111.7 | D151 I156 F157 | D151-V153 PolarHBondContact O-N 3.15Å; V153-I156 PolarHBondContact O-N 2.99Å; V153-F157 VanDerWaalsContact O-CB 3.24Å; V153-F157 WeakPolarHBondContact O-CB 3.36Å; V153-F157 PolarHBondContact O-N 3.26Å |
| 154 | I | 75.5 | Confident | 70 | Confident | 38 Ų | 38 | 106.4 Ų | 106.4 | 20% | 0.195 | 53% | 0.533 | C | S | . | . | H | α-helix | trans | -69.8 | -39.6 | 178.8 | -60.6 | 171.3 | 0 | 0 | 0 | 109.7 | Y144 D151 P152 F157 F158 | Y144-I154 HydrophobicContact CD2-CD1 3.91Å; Y144-I154 HydrophobicContact CE2-CD1 4.27Å; D151-I154 HydrophobicContact CB-CD1 4.25Å; D151-I154 HydrophobicContact CB-CG1 4.3Å; D151-I154 PolarHBondContact O-N 3.33Å; P152-I154 VanDerWaalsContact C-N 3.34Å; P152-I154 PolarHBondContact O-N 3.39Å; I154-F157 PolarHBondContact O-N 2.65Å; I154-F158 HydrophobicContact CG2-CD2 3.54Å; I154-F158 HydrophobicContact CG2-CE2 3.72Å; I154-F158 WeakPolarHBondContact O-CB 3.18Å; I154-F158 WeakPolarHBondContact O-CD2 3.26Å; I154-F158 PolarHBondContact O-N 2.86Å |
| 155 | I | 77.4 | Confident | 71.5 | Confident | 96 Ų | 96 | 108.2 Ų | 108.2 | 49% | 0.492 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 176.5 | -63.1 | 167.6 | 0 | 0 | 0 | 110.8 | V150 D151 P152 W159 | V150-I155 HydrophobicContact CB-CD1 4.42Å; V150-I155 HydrophobicContact CG2-CD1 3.99Å; D151-I155 PolarHBondContact O-N 3.01Å; P152-I155 PolarHBondContact O-N 3.36Å; I155-W159 VanDerWaalsContact O-CB 3.23Å; I155-W159 WeakPolarHBondContact O-CB 3.09Å; I155-W159 PolarHBondContact O-N 3.02Å |
| 156 | I | 81.6 | Confident | 73.3 | Confident | 108 Ų | 108 | 100.9 Ų | 100.9 | 55% | 0.554 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.3 | -43.8 | 177.1 | -66.9 | 165.4 | 0 | 0 | 0 | 110.5 | P152 V153 W159 V160 | P152-I156 VanDerWaalsContact O-CG1 3.26Å; P152-I156 WeakPolarHBondContact O-CG1 3.34Å; P152-I156 PolarHBondContact O-N 3.31Å; V153-I156 PolarHBondContact O-N 2.99Å; I156-W159 PolarHBondContact O-N 2.76Å; I156-V160 WeakPolarHBondContact O-CG2 3.42Å; I156-V160 PolarHBondContact O-N 3.49Å |
| 157 | F | 78.4 | Confident | 74.7 | Confident | 46 Ų | 46 | 102 Ų | 102 | 20% | 0.202 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -62.6 | -48.9 | 178.6 | -177.5 | -104.1 | 0 | 0 | 0 | 112 | A138 V153 I154 W159 V160 L161 | A138-F157 HydrophobicContact CB-CD2 4.33Å; A138-F157 HydrophobicContact CB-CE1 3.88Å; A138-F157 HydrophobicContact CB-CE2 3.26Å; A138-F157 HydrophobicContact CB-CZ 2.98Å; A138-F157 VanDerWaalsContact O-CD2 3.25Å; A138-F157 WeakPolarHBondContact O-CD2 3.44Å; A138-F157 VanDerWaalsContact O-CE2 3.31Å; A138-F157 WeakPolarHBondContact O-CE2 3.12Å; A138-F157 WeakPolarHBondContact O-CG 3.39Å; V153-F157 VanDerWaalsContact O-CB 3.24Å; V153-F157 WeakPolarHBondContact O-CB 3.36Å; V153-F157 PolarHBondContact O-N 3.26Å; I154-F157 PolarHBondContact O-N 2.65Å; F157-W159 VanDerWaalsContact C-N 3.33Å; F157-W159 PolarHBondContact O-N 2.83Å; F157-V160 PolarHBondContact O-N 2.74Å; F157-L161 HydrophobicContact CD1-CD1 4.21Å; F157-L161 HydrophobicContact CD1-CD2 4.36Å; F157-L161 HydrophobicContact CD2-CD1 3.86Å; F157-L161 HydrophobicContact CE1-CD1 3.67Å; F157-L161 HydrophobicContact CE1-CD2 3.42Å; F157-L161 VanDerWaalsContact CE1-CD2 3.42Å; F157-L161 HydrophobicContact CE1-CG 4.13Å; F157-L161 HydrophobicContact CE2-CD1 3.21Å; F157-L161 HydrophobicContact CE2-CD2 4.43Å; F157-L161 HydrophobicContact CE2-CG 4.42Å; F157-L161 HydrophobicContact CG-CD1 4.28Å; F157-L161 HydrophobicContact CZ-CD1 3.07Å; F157-L161 HydrophobicContact CZ-CD2 3.42Å; F157-L161 VanDerWaalsContact CZ-CD2 3.42Å; F157-L161 HydrophobicContact CZ-CG 3.85Å; F157-L161 WeakPolarHBondContact O-CD1 3.14Å; F157-L161 PolarHBondContact O-N 3Å |
| 158 | F | 78.6 | Confident | 76.8 | Confident | 86 Ų | 86 | 97.7 Ų | 97.7 | 38% | 0.377 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.7 | -41.5 | 174.1 | -95 | -84.7 | 0 | 0 | 0 | 111.8 | F140 I154 V160 L161 L162 | F140-F158 AromaticContact CE2-CE2 3.63Å; F140-F158 HydrophobicContact CE2-CE2 3.63Å; F140-F158 AromaticContact CE2-CZ 3.41Å; F140-F158 HydrophobicContact CE2-CZ 3.41Å; F140-F158 VanDerWaalsContact CE2-CZ 3.41Å; F140-F158 HydrophobicContact CZ-CE2 4.04Å; F140-F158 AromaticContact CZ-CZ 3.67Å; F140-F158 HydrophobicContact CZ-CZ 3.67Å; I154-F158 HydrophobicContact CG2-CD2 3.54Å; I154-F158 HydrophobicContact CG2-CE2 3.72Å; I154-F158 WeakPolarHBondContact O-CB 3.18Å; I154-F158 WeakPolarHBondContact O-CD2 3.26Å; I154-F158 PolarHBondContact O-N 2.86Å; F158-V160 PolarHBondContact O-N 2.88Å; F158-L161 PolarHBondContact O-N 2.98Å; F158-L162 WeakPolarHBondContact O-CB 3.34Å; F158-L162 PolarHBondContact O-N 3.39Å |
| 159 | W | 85.4 | Confident | 78.4 | Confident | 178 Ų | 178 | 92.4 Ų | 92.4 | 67% | 0.674 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.5 | -44.4 | 177.7 | -174.6 | 75.1 | 0 | 0 | 0 | 111.8 | I155 I156 F157 W163 | I155-W159 VanDerWaalsContact O-CB 3.23Å; I155-W159 WeakPolarHBondContact O-CB 3.09Å; I155-W159 PolarHBondContact O-N 3.02Å; I156-W159 PolarHBondContact O-N 2.76Å; F157-W159 VanDerWaalsContact C-N 3.33Å; F157-W159 PolarHBondContact O-N 2.83Å; W159-W163 WeakPolarHBondContact O-CB 3.09Å; W159-W163 PolarHBondContact O-N 3.07Å |
| 160 | V | 84.1 | Confident | 79.8 | Confident | 74 Ų | 74 | 92 Ų | 92 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.6 | -40.3 | 175.6 | 175 | 0 | 0 | 0 | 0 | 111.7 | I156 F157 F158 F164 | I156-V160 WeakPolarHBondContact O-CG2 3.42Å; I156-V160 PolarHBondContact O-N 3.49Å; F157-V160 PolarHBondContact O-N 2.74Å; F158-V160 PolarHBondContact O-N 2.88Å; V160-F164 WeakPolarHBondContact O-CB 3.43Å; V160-F164 PolarHBondContact O-N 3.33Å |
| 161 | L | 79.5 | Confident | 81.3 | Confident | 55 Ų | 55 | 89.5 Ų | 89.5 | 29% | 0.288 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.7 | -42.4 | 177.2 | -98.5 | 68 | 0 | 0 | 0 | 112.7 | L135 F157 F158 W163 F164 L165 | L135-L161 HydrophobicContact CD2-CD2 4.35Å; F157-L161 HydrophobicContact CD1-CD1 4.21Å; F157-L161 HydrophobicContact CD1-CD2 4.36Å; F157-L161 HydrophobicContact CD2-CD1 3.86Å; F157-L161 HydrophobicContact CE1-CD1 3.67Å; F157-L161 HydrophobicContact CE1-CD2 3.42Å; F157-L161 VanDerWaalsContact CE1-CD2 3.42Å; F157-L161 HydrophobicContact CE1-CG 4.13Å; F157-L161 HydrophobicContact CE2-CD1 3.21Å; F157-L161 HydrophobicContact CE2-CD2 4.43Å; F157-L161 HydrophobicContact CE2-CG 4.42Å; F157-L161 HydrophobicContact CG-CD1 4.28Å; F157-L161 HydrophobicContact CZ-CD1 3.07Å; F157-L161 HydrophobicContact CZ-CD2 3.42Å; F157-L161 VanDerWaalsContact CZ-CD2 3.42Å; F157-L161 HydrophobicContact CZ-CG 3.85Å; F157-L161 WeakPolarHBondContact O-CD1 3.14Å; F157-L161 PolarHBondContact O-N 3Å; F158-L161 PolarHBondContact O-N 2.98Å; L161-W163 VanDerWaalsContact C-N 3.34Å; L161-F164 PolarHBondContact O-N 3.17Å; L161-L165 WeakPolarHBondContact O-CB 3.19Å; L161-L165 PolarHBondContact O-N 3.22Å |
| 162 | L | 84.1 | Confident | 82.5 | Confident | 125 Ų | 125 | 92.8 Ų | 92.8 | 65% | 0.654 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -68.8 | -36.7 | 178.4 | -139.7 | 74.8 | 0 | 0 | 0 | 110.7 | F158 G166 | F158-L162 WeakPolarHBondContact O-CB 3.34Å; F158-L162 PolarHBondContact O-N 3.39Å; L162-G166 VanDerWaalsContact O-CA 3.26Å; L162-G166 WeakPolarHBondContact O-CA 3.26Å; L162-G166 PolarHBondContact O-N 3.04Å |
| 163 | W | 86.9 | Confident | 83.9 | Confident | 162 Ų | 162 | 93 Ų | 93 | 61% | 0.614 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.5 | -46.1 | 171.2 | 178.5 | -98.7 | 0 | 0 | 0 | 111.6 | W159 L161 G166 I167 | W159-W163 WeakPolarHBondContact O-CB 3.09Å; W159-W163 PolarHBondContact O-N 3.07Å; L161-W163 VanDerWaalsContact C-N 3.34Å; W163-G166 PolarHBondContact O-N 3.42Å; W163-I167 HydrophobicContact CD2-CD1 3.97Å; W163-I167 HydrophobicContact CG-CD1 4.18Å; W163-I167 HydrophobicContact CZ2-CD1 3.7Å; W163-I167 WeakPolarHBondContact O-CB 3.42Å; W163-I167 VanDerWaalsContact O-CG1 3.26Å; W163-I167 WeakPolarHBondContact O-CG1 3.39Å; W163-I167 PolarHBondContact O-N 2.89Å |
| 164 | F | 83.6 | Confident | 84.8 | Confident | 121 Ų | 121 | 89.3 Ų | 89.3 | 53% | 0.531 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66 | -48.6 | 179.4 | 177.5 | -104.3 | 0 | 0 | 0 | 112.3 | V160 L161 G166 I167 Q168 | V160-F164 WeakPolarHBondContact O-CB 3.43Å; V160-F164 PolarHBondContact O-N 3.33Å; L161-F164 PolarHBondContact O-N 3.17Å; F164-G166 VanDerWaalsContact C-N 3.32Å; F164-I167 PolarHBondContact O-N 3.41Å; F164-Q168 WeakPolarHBondContact O-CG 3.38Å; F164-Q168 PolarHBondContact O-N 2.91Å |
| 165 | L | 81.8 | Confident | 85.7 | Confident | 105 Ų | 105 | 91.7 Ų | 91.7 | 55% | 0.55 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.6 | -38.4 | 177.7 | -161.9 | 70.9 | 0 | 0 | 0 | 111 | L161 Q168 A169 | L161-L165 WeakPolarHBondContact O-CB 3.19Å; L161-L165 PolarHBondContact O-N 3.22Å; L165-Q168 PolarHBondContact O-N 3.32Å; L165-A169 WeakPolarHBondContact O-CB 3.43Å; L165-A169 PolarHBondContact O-N 3.41Å |
| 166 | G | 85.6 | Confident | 86.4 | Confident | 36 Ų | 36 | 92 Ų | 92 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.6 | -48.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L162 W163 F164 Q168 A169 L170 | L162-G166 VanDerWaalsContact O-CA 3.26Å; L162-G166 WeakPolarHBondContact O-CA 3.26Å; L162-G166 PolarHBondContact O-N 3.04Å; W163-G166 PolarHBondContact O-N 3.42Å; F164-G166 VanDerWaalsContact C-N 3.32Å; G166-Q168 PolarHBondContact O-N 3.44Å; G166-A169 PolarHBondContact O-N 3.44Å; G166-L170 WeakPolarHBondContact O-CB 3.48Å; G166-L170 PolarHBondContact O-N 3.45Å |
| 167 | I | 86.9 | Confident | 87 | Confident | 85 Ų | 85 | 90.2 Ų | 90.2 | 44% | 0.436 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.8 | -39.2 | 177.1 | -75.4 | 176.5 | 0 | 0 | 0 | 111.7 | W163 F164 L170 G171 | W163-I167 HydrophobicContact CD2-CD1 3.97Å; W163-I167 HydrophobicContact CG-CD1 4.18Å; W163-I167 HydrophobicContact CZ2-CD1 3.7Å; W163-I167 WeakPolarHBondContact O-CB 3.42Å; W163-I167 VanDerWaalsContact O-CG1 3.26Å; W163-I167 WeakPolarHBondContact O-CG1 3.39Å; W163-I167 PolarHBondContact O-N 2.89Å; F164-I167 PolarHBondContact O-N 3.41Å; I167-L170 PolarHBondContact O-N 2.9Å; I167-G171 WeakPolarHBondContact O-CA 3.34Å; I167-G171 PolarHBondContact O-N 2.83Å |
| 168 | Q | 86.5 | Confident | 87.7 | Confident | 98 Ų | 98 | 93.7 Ų | 93.7 | 46% | 0.458 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.8 | -45 | 176.4 | -75.4 | -173.1 | -0.7 | 0 | 0 | 111.8 | F164 L165 G166 L172 | F164-Q168 WeakPolarHBondContact O-CG 3.38Å; F164-Q168 PolarHBondContact O-N 2.91Å; L165-Q168 PolarHBondContact O-N 3.32Å; G166-Q168 PolarHBondContact O-N 3.44Å; Q168-L172 WeakPolarHBondContact O-CB 3.09Å; Q168-L172 PolarHBondContact O-N 2.87Å |
| 169 | A | 89.2 | Confident | 88.5 | Confident | 61 Ų | 61 | 92.7 Ų | 92.7 | 50% | 0.504 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.4 | -43 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L165 G166 L172 V173 | L165-A169 WeakPolarHBondContact O-CB 3.43Å; L165-A169 PolarHBondContact O-N 3.41Å; G166-A169 PolarHBondContact O-N 3.44Å; A169-L172 PolarHBondContact O-N 3.23Å; A169-V173 WeakPolarHBondContact O-CB 3.45Å; A169-V173 WeakPolarHBondContact O-CG1 3.43Å; A169-V173 PolarHBondContact O-N 2.86Å |
| 170 | L | 87.6 | Confident | 88.8 | Confident | 124 Ų | 124 | 87.8 Ų | 87.8 | 65% | 0.649 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -69.2 | -35.4 | -179.7 | -162.4 | 71.9 | 0 | 0 | 0 | 111.6 | G166 I167 V173 G174 | G166-L170 WeakPolarHBondContact O-CB 3.48Å; G166-L170 PolarHBondContact O-N 3.45Å; I167-L170 PolarHBondContact O-N 2.9Å; L170-V173 HydrophobicContact CD1-CG1 4.28Å; L170-V173 WeakPolarHBondContact O-CG1 3.06Å; L170-G174 WeakPolarHBondContact O-CA 3.41Å; L170-G174 PolarHBondContact O-N 3.26Å |
| 171 | G | 90.3 | Very high | 89.3 | Confident | 35 Ų | 35 | 89 Ų | 89 | 36% | 0.361 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.3 | -43.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I167 T175 | I167-G171 WeakPolarHBondContact O-CA 3.34Å; I167-G171 PolarHBondContact O-N 2.83Å; G171-T175 WeakPolarHBondContact O-CB 3.24Å; G171-T175 PolarHBondContact O-N 3.49Å; G171-T175 PolarHBondContact O-OG1 3.25Å |
| 172 | L | 91 | Very high | 89.9 | Confident | 132 Ų | 132 | 94.1 Ų | 94.1 | 69% | 0.691 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.4 | -50.2 | 174.9 | -103.2 | 162.8 | 0 | 0 | 0 | 112 | Q168 A169 G174 T175 L176 | Q168-L172 WeakPolarHBondContact O-CB 3.09Å; Q168-L172 PolarHBondContact O-N 2.87Å; A169-L172 PolarHBondContact O-N 3.23Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 2.81Å; L172-T175 PolarHBondContact O-N 3.16Å; L172-L176 VanDerWaalsContact O-CB 3.22Å; L172-L176 WeakPolarHBondContact O-CB 3.26Å; L172-L176 PolarHBondContact O-N 2.79Å |
| 173 | V | 93.7 | Very high | 90.2 | Very high | 82 Ų | 82 | 94.3 Ų | 94.3 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.2 | -38.8 | 179.7 | 77.6 | 0 | 0 | 0 | 0 | 111.2 | A169 L170 L176 C177 | A169-V173 WeakPolarHBondContact O-CB 3.45Å; A169-V173 WeakPolarHBondContact O-CG1 3.43Å; A169-V173 PolarHBondContact O-N 2.86Å; L170-V173 HydrophobicContact CD1-CG1 4.28Å; L170-V173 WeakPolarHBondContact O-CG1 3.06Å; V173-L176 PolarHBondContact O-N 3.5Å; V173-C177 VanDerWaalsContact O-CB 3.24Å; V173-C177 WeakPolarHBondContact O-CB 3.48Å; V173-C177 PolarHBondContact O-N 3.07Å |
| 174 | G | 94 | Very high | 89.8 | Confident | 28 Ų | 28 | 94.5 Ų | 94.5 | 29% | 0.289 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.2 | -45.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L170 L172 C177 I178 | L170-G174 WeakPolarHBondContact O-CA 3.41Å; L170-G174 PolarHBondContact O-N 3.26Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 2.81Å; G174-C177 PolarHBondContact O-N 3.46Å; G174-I178 WeakPolarHBondContact O-CG1 3.3Å; G174-I178 PolarHBondContact O-N 3.19Å |
| 175 | T | 93.8 | Very high | 89 | Confident | 88 Ų | 88 | 99.3 Ų | 99.3 | 54% | 0.54 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.3 | -44.6 | 175 | -55.8 | 0 | 0 | 0 | 0 | 110.7 | G171 L172 C177 I178 V179 | G171-T175 WeakPolarHBondContact O-CB 3.24Å; G171-T175 PolarHBondContact O-N 3.49Å; G171-T175 PolarHBondContact O-OG1 3.25Å; L172-T175 PolarHBondContact O-N 3.16Å; T175-C177 VanDerWaalsContact C-N 3.33Å; T175-C177 PolarHBondContact O-N 3.46Å; T175-I178 PolarHBondContact O-N 3.45Å; T175-V179 HydrophobicContact CG2-CG2 4.45Å; T175-V179 WeakPolarHBondContact O-CB 3.28Å; T175-V179 VanDerWaalsContact O-CG2 3.26Å; T175-V179 WeakPolarHBondContact O-CG2 3.18Å; T175-V179 PolarHBondContact O-N 2.94Å |
| 176 | L | 92.3 | Very high | 89.4 | Confident | 103 Ų | 103 | 99.1 Ų | 99.1 | 54% | 0.539 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 175.4 | -177.7 | 66 | 0 | 0 | 0 | 111.2 | L172 V173 V179 I180 | L172-L176 VanDerWaalsContact O-CB 3.22Å; L172-L176 WeakPolarHBondContact O-CB 3.26Å; L172-L176 PolarHBondContact O-N 2.79Å; V173-L176 PolarHBondContact O-N 3.5Å; L176-V179 PolarHBondContact O-N 3.36Å; L176-I180 HydrophobicContact CD1-CD1 4.11Å; L176-I180 HydrophobicContact CD1-CG1 4.44Å; L176-I180 HydrophobicContact CG-CD1 3.81Å; L176-I180 WeakPolarHBondContact O-CD1 3.36Å; L176-I180 WeakPolarHBondContact O-CG1 3.22Å; L176-I180 PolarHBondContact O-N 3.4Å |
| 177 | C | 93.6 | Very high | 89.6 | Confident | 71 Ų | 71 | 102.4 Ų | 102.4 | 48% | 0.48 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -62.9 | -44.2 | 178.6 | -151.9 | 0 | 0 | 0 | 0 | 111.5 | V173 G174 T175 V179 I180 I181 | V173-C177 VanDerWaalsContact O-CB 3.24Å; V173-C177 WeakPolarHBondContact O-CB 3.48Å; V173-C177 PolarHBondContact O-N 3.07Å; G174-C177 PolarHBondContact O-N 3.46Å; T175-C177 VanDerWaalsContact C-N 3.33Å; T175-C177 PolarHBondContact O-N 3.46Å; C177-V179 PolarHBondContact O-N 3.01Å; C177-I180 PolarHBondContact O-N 2.94Å; C177-I181 VanDerWaalsContact O-CG1 3.28Å; C177-I181 WeakPolarHBondContact O-CG1 3.22Å; C177-I181 PolarHBondContact O-N 3.5Å |
| 178 | I | 93.6 | Very high | 89.7 | Confident | 118 Ų | 118 | 103.3 Ų | 103.3 | 61% | 0.605 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.7 | -43.8 | 175.2 | -70.7 | 170.1 | 0 | 0 | 0 | 111.2 | G174 T175 I181 F182 | G174-I178 WeakPolarHBondContact O-CG1 3.3Å; G174-I178 PolarHBondContact O-N 3.19Å; T175-I178 PolarHBondContact O-N 3.45Å; I178-I181 PolarHBondContact O-N 3.3Å; I178-F182 WeakPolarHBondContact O-CB 3.33Å; I178-F182 PolarHBondContact O-N 3.46Å |
| 179 | V | 94.3 | Very high | 89.9 | Confident | 66 Ų | 66 | 103.6 Ų | 103.6 | 40% | 0.4 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.2 | -42.8 | 179.2 | 168.4 | 0 | 0 | 0 | 0 | 111.3 | T175 L176 C177 I181 F182 I183 | T175-V179 HydrophobicContact CG2-CG2 4.45Å; T175-V179 WeakPolarHBondContact O-CB 3.28Å; T175-V179 VanDerWaalsContact O-CG2 3.26Å; T175-V179 WeakPolarHBondContact O-CG2 3.18Å; T175-V179 PolarHBondContact O-N 2.94Å; L176-V179 PolarHBondContact O-N 3.36Å; C177-V179 PolarHBondContact O-N 3.01Å; V179-I181 VanDerWaalsContact C-N 3.35Å; V179-I181 PolarHBondContact O-N 3.2Å; V179-F182 PolarHBondContact O-N 3.37Å; V179-I183 HydrophobicContact CG1-CD1 3.73Å; V179-I183 HydrophobicContact CG1-CG1 4.43Å; V179-I183 VanDerWaalsContact O-CG1 3.3Å; V179-I183 WeakPolarHBondContact O-CG1 3.41Å; V179-I183 PolarHBondContact O-N 3.47Å |
| 180 | I | 92.9 | Very high | 90 | Very high | 74 Ų | 74 | 106.3 Ų | 106.3 | 38% | 0.379 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.3 | -43.9 | 177.7 | -65.7 | 162.6 | 0 | 0 | 0 | 110.3 | L176 C177 F182 I183 Q184 | L176-I180 HydrophobicContact CD1-CD1 4.11Å; L176-I180 HydrophobicContact CD1-CG1 4.44Å; L176-I180 HydrophobicContact CG-CD1 3.81Å; L176-I180 WeakPolarHBondContact O-CD1 3.36Å; L176-I180 WeakPolarHBondContact O-CG1 3.22Å; L176-I180 PolarHBondContact O-N 3.4Å; C177-I180 PolarHBondContact O-N 2.94Å; I180-F182 VanDerWaalsContact C-N 3.35Å; I180-I183 PolarHBondContact O-N 3.44Å; I180-Q184 HydrophobicContact CG2-CG 4.47Å; I180-Q184 WeakPolarHBondContact O-CB 3.31Å; I180-Q184 VanDerWaalsContact O-CG 3.31Å; I180-Q184 WeakPolarHBondContact O-CG 2.99Å; I180-Q184 PolarHBondContact O-N 3.43Å |
| 181 | I | 93.9 | Very high | 90.1 | Very high | 100 Ų | 100 | 105.1 Ų | 105.1 | 51% | 0.513 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.1 | -40.2 | 175.6 | -65.8 | 165.6 | 0 | 0 | 0 | 110.8 | C177 I178 V179 I183 Q184 K185 | C177-I181 VanDerWaalsContact O-CG1 3.28Å; C177-I181 WeakPolarHBondContact O-CG1 3.22Å; C177-I181 PolarHBondContact O-N 3.5Å; I178-I181 PolarHBondContact O-N 3.3Å; V179-I181 VanDerWaalsContact C-N 3.35Å; V179-I181 PolarHBondContact O-N 3.2Å; I181-I183 VanDerWaalsContact C-N 3.33Å; I181-I183 PolarHBondContact O-N 2.91Å; I181-Q184 PolarHBondContact O-N 3.01Å; I181-K185 WeakPolarHBondContact O-CB 3.43Å; I181-K185 PolarHBondContact O-N 3.42Å |
| 182 | F | 93.1 | Very high | 90.1 | Very high | 163 Ų | 163 | 110.1 Ų | 110.1 | 72% | 0.715 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.4 | -34.7 | 179.6 | 178 | -101.1 | 0 | 0 | 0 | 113 | I178 V179 I180 | I178-F182 WeakPolarHBondContact O-CB 3.33Å; I178-F182 PolarHBondContact O-N 3.46Å; V179-F182 PolarHBondContact O-N 3.37Å; I180-F182 VanDerWaalsContact C-N 3.35Å |
| 183 | I | 90.5 | Very high | 90 | Very high | 129 Ų | 129 | 108.5 Ų | 108.5 | 66% | 0.662 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -81.7 | -32.3 | 178.8 | -65.9 | 172.2 | 0 | 0 | 0 | 111.5 | V179 I180 I181 | V179-I183 HydrophobicContact CG1-CD1 3.73Å; V179-I183 HydrophobicContact CG1-CG1 4.43Å; V179-I183 VanDerWaalsContact O-CG1 3.3Å; V179-I183 WeakPolarHBondContact O-CG1 3.41Å; V179-I183 PolarHBondContact O-N 3.47Å; I180-I183 PolarHBondContact O-N 3.44Å; I181-I183 VanDerWaalsContact C-N 3.33Å; I181-I183 PolarHBondContact O-N 2.91Å |
| 184 | Q | 77.3 | Confident | 89.7 | Confident | 165 Ų | 165 | 110.7 Ų | 110.7 | 77% | 0.771 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -89.4 | -10.8 | -179.2 | -66.7 | -175.3 | 19.7 | 0 | 0 | 114.2 | I180 I181 | I180-Q184 HydrophobicContact CG2-CG 4.47Å; I180-Q184 WeakPolarHBondContact O-CB 3.31Å; I180-Q184 VanDerWaalsContact O-CG 3.31Å; I180-Q184 WeakPolarHBondContact O-CG 2.99Å; I180-Q184 PolarHBondContact O-N 3.43Å; I181-Q184 PolarHBondContact O-N 3.01Å |
| 185 | K | 67.7 | Low | 89.4 | Confident | 223 Ų | 223 | 118.2 Ų | 118.2 | 97% | 0.97 | 60% | 0.598 | S | S | * | * | trans | -98.8 | 0 | 177.4 | -179.2 | -178.3 | 171.1 | 61 | 0 | 111 | I181 | I181-K185 WeakPolarHBondContact O-CB 3.43Å; I181-K185 PolarHBondContact O-N 3.42Å |
Retrieved 185 of 185 residues in 310.2 ms
(Link to these results)