| 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 | 41.5 | Very low | 53.1 | Low | 240 Ų | 240 | 160.3 Ų | 160.3 | 100% | 1.182 | 77% | 0.77 | S | S | * | * | 0 | 91.2 | 0 | -126.2 | 150.2 | 82.5 | 0 | 0 | 107.5 | |||||
| 2 | Y | 44.3 | Very low | 53.1 | Low | 241 Ų | 241 | 160 Ų | 160 | 95% | 0.945 | 76% | 0.757 | S | S | * | * | trans | -82.3 | 119.1 | 178.2 | -85.8 | -88.2 | 0 | 0 | 0 | 108.6 | ||||
| 3 | K | 49.6 | Very low | 53.3 | Low | 193 Ų | 193 | 156.8 Ų | 156.8 | 84% | 0.839 | 75% | 0.747 | S | S | * | * | trans | -83.6 | 114 | 167 | -82.1 | 172.5 | 171.8 | 175.9 | 0 | 107.1 | ||||
| 4 | M | 58.1 | Low | 54 | Low | 166 Ų | 166 | 151.4 Ų | 151.4 | 82% | 0.818 | 74% | 0.735 | S | S | * | * | trans | -81.6 | 117.8 | 165.2 | -94.6 | -73.5 | -166.9 | 0 | 0 | 107.3 | Y6 | M4-Y6 WeakPolarHBondContact O-CD2 3.37Å; M4-Y6 PolarHBondContact O-N 3.18Å | ||
| 5 | D | 56.2 | Low | 54.1 | Low | 137 Ų | 137 | 146.3 Ų | 146.3 | 73% | 0.733 | 72% | 0.719 | S | S | * | * | trans | -73.1 | 111.8 | 175.4 | -70.5 | -45.8 | 0 | 0 | 0 | 109.5 | S7 | D5-S7 PolarHBondContact O-N 3.31Š| ||
| 6 | Y | 54.7 | Low | 54.9 | Low | 184 Ų | 184 | 144.7 Ų | 144.7 | 72% | 0.722 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | 25.2 | -176 | -96.8 | -93.5 | 0 | 0 | 0 | 114.3 | M4 Y8 L9 | M4-Y6 WeakPolarHBondContact O-CD2 3.37Å; M4-Y6 PolarHBondContact O-N 3.18Å; Y6-Y8 VanDerWaalsContact C-N 3.32Å; Y6-Y8 PolarHBondContact O-N 3.33Å; Y6-L9 HydrophobicContact CD1-CD1 3.73Å; Y6-L9 HydrophobicContact CE1-CD1 3.74Å |
| 7 | S | 58.8 | Low | 55.2 | Low | 93 Ų | 93 | 139.1 Ų | 139.1 | 65% | 0.65 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -74.7 | -18.4 | -175.3 | 52 | 0 | 0 | 0 | 0 | 114 | D5 | D5-S7 PolarHBondContact O-N 3.31Å |
| 8 | Y | 54.4 | Low | 55.3 | Low | 192 Ų | 192 | 134.6 Ų | 134.6 | 75% | 0.753 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -77.4 | -24.6 | -178.6 | -163.8 | -102.5 | 0 | 0 | 0 | 113.8 | Y6 | Y6-Y8 VanDerWaalsContact C-N 3.32Å; Y6-Y8 PolarHBondContact O-N 3.33Å |
| 9 | L | 55.3 | Low | 55.7 | Low | 110 Ų | 110 | 135.2 Ų | 135.2 | 58% | 0.576 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -75.2 | -27.6 | 179.7 | -94.5 | 163.3 | 0 | 0 | 0 | 113.2 | Y6 D13 | Y6-L9 HydrophobicContact CD1-CD1 3.73Å; Y6-L9 HydrophobicContact CE1-CD1 3.74Å; L9-D13 PolarHBondContact O-N 3.15Å |
| 10 | N | 53.8 | Low | 55.8 | Low | 119 Ų | 119 | 135.2 Ų | 135.2 | 64% | 0.636 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -73.4 | -28.9 | -178 | -93.9 | -0.9 | 0 | 0 | 0 | 114.1 | S14 | N10-S14 WeakPolarHBondContact O-CB 3.43Å; N10-S14 PolarHBondContact O-N 3.3Å; N10-S14 VanDerWaalsContact O-N 3.13Å; N10-S14 PolarHBondContact O-OG 3.06Å; N10-S14 VanDerWaalsContact O-OG 3.07Å |
| 11 | S | 57.9 | Low | 55.7 | Low | 88 Ų | 88 | 131.9 Ų | 131.9 | 62% | 0.615 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -75.6 | -30.2 | -179.5 | -168.9 | 0 | 0 | 0 | 0 | 112.4 | C15 | S11-C15 WeakPolarHBondContact O-CB 3.36Å; S11-C15 PolarHBondContact O-N 3.3Å |
| 12 | Y | 52.4 | Low | 56.3 | Low | 157 Ų | 157 | 125.4 Ų | 125.4 | 62% | 0.616 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -77.5 | -39.7 | 178.7 | -140.9 | -90.2 | 0 | 0 | 0 | 111.1 | C15 M16 | Y12-C15 PolarHBondContact O-N 3.49Å; Y12-M16 HydrophobicContact CD1-CG 4.39Å; Y12-M16 HydrophobicContact CD1-SD 4.25Å; Y12-M16 HydrophobicContact CE1-SD 4.26Å; Y12-M16 PolarHBondContact O-N 3.15Å |
| 13 | D | 56.4 | Low | 56.6 | Low | 118 Ų | 118 | 117.7 Ų | 117.7 | 63% | 0.631 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -64.7 | -41.3 | 176 | -151.8 | -98.8 | 0 | 0 | 0 | 111.6 | L9 C15 M16 A17 | L9-D13 PolarHBondContact O-N 3.15Å; D13-C15 PolarHBondContact O-N 3.2Å; D13-M16 PolarHBondContact O-N 3.13Å; D13-A17 WeakPolarHBondContact O-CB 3.43Å; D13-A17 PolarHBondContact O-N 2.94Å |
| 14 | S | 62.5 | Low | 56.6 | Low | 82 Ų | 82 | 116.9 Ų | 116.9 | 57% | 0.573 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67 | -34.3 | 175.6 | -67.9 | 0 | 0 | 0 | 0 | 113.6 | N10 A18 | N10-S14 WeakPolarHBondContact O-CB 3.43Å; N10-S14 PolarHBondContact O-N 3.3Å; N10-S14 VanDerWaalsContact O-N 3.13Å; N10-S14 PolarHBondContact O-OG 3.06Å; N10-S14 VanDerWaalsContact O-OG 3.07Å; S14-A18 WeakPolarHBondContact O-CB 3.43Å; S14-A18 PolarHBondContact O-N 3.36Å; S14-A18 VanDerWaalsContact O-N 3.09Å |
| 15 | C | 56.1 | Low | 56.1 | Low | 74 Ų | 74 | 113.1 Ų | 113.1 | 50% | 0.5 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -70.2 | -42.7 | 176.2 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | S11 Y12 D13 A18 M19 | S11-C15 WeakPolarHBondContact O-CB 3.36Å; S11-C15 PolarHBondContact O-N 3.3Å; Y12-C15 PolarHBondContact O-N 3.49Å; D13-C15 PolarHBondContact O-N 3.2Å; C15-A18 PolarHBondContact O-N 3.24Å; C15-M19 PolarHBondContact O-N 3.25Å |
| 16 | M | 67.1 | Low | 55.9 | Low | 121 Ų | 121 | 114.2 Ų | 114.2 | 60% | 0.596 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -68.5 | -39.4 | 175.3 | -70.6 | -165.4 | 95.9 | 0 | 0 | 111.9 | Y12 D13 A18 M19 E20 | Y12-M16 HydrophobicContact CD1-CG 4.39Å; Y12-M16 HydrophobicContact CD1-SD 4.25Å; Y12-M16 HydrophobicContact CE1-SD 4.26Å; Y12-M16 PolarHBondContact O-N 3.15Å; D13-M16 PolarHBondContact O-N 3.13Å; M16-A18 VanDerWaalsContact C-N 3.34Å; M16-A18 PolarHBondContact O-N 2.96Å; M16-M19 PolarHBondContact O-N 3.25Å; M16-E20 PolarHBondContact O-N 3.4Å |
| 17 | A | 59.6 | Low | 55.4 | Low | 50 Ų | 50 | 113.5 Ų | 113.5 | 41% | 0.413 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -63.7 | -36.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | D13 A21 | D13-A17 WeakPolarHBondContact O-CB 3.43Å; D13-A17 PolarHBondContact O-N 2.94Å; A17-A21 WeakPolarHBondContact O-CB 3.25Å; A17-A21 PolarHBondContact O-N 3.14Å |
| 18 | A | 56.2 | Low | 54.9 | Low | 58 Ų | 58 | 114.9 Ų | 114.9 | 48% | 0.479 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -70.3 | -34.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | S14 C15 M16 S22 | S14-A18 WeakPolarHBondContact O-CB 3.43Å; S14-A18 PolarHBondContact O-N 3.36Å; S14-A18 VanDerWaalsContact O-N 3.09Å; C15-A18 PolarHBondContact O-N 3.24Å; M16-A18 VanDerWaalsContact C-N 3.34Å; M16-A18 PolarHBondContact O-N 2.96Å; A18-S22 PolarHBondContact O-N 3.44Å; A18-S22 PolarHBondContact O-OG 3.22Å |
| 19 | M | 63.7 | Low | 54.3 | Low | 146 Ų | 146 | 111.5 Ų | 111.5 | 72% | 0.719 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -70.4 | -38 | 173.6 | -82.9 | -170.1 | 175.3 | 0 | 0 | 112.3 | C15 M16 | C15-M19 PolarHBondContact O-N 3.25Å; M16-M19 PolarHBondContact O-N 3.25Å |
| 20 | E | 56.4 | Low | 53.5 | Low | 134 Ų | 134 | 111.1 Ų | 111.1 | 63% | 0.626 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -71.3 | -36.9 | 175.2 | -85.3 | -174.1 | 146.8 | 0 | 0 | 113 | M16 S22 A23 Y24 | M16-E20 PolarHBondContact O-N 3.4Å; E20-S22 PolarHBondContact O-N 2.9Å; E20-A23 PolarHBondContact O-N 2.96Å; E20-A23 VanDerWaalsContact O-N 3.13Å; E20-Y24 PolarHBondContact O-N 3.26Å |
| 21 | A | 54.5 | Low | 53.6 | Low | 67 Ų | 67 | 110.8 Ų | 110.8 | 55% | 0.554 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -63 | -30.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A17 A23 | A17-A21 WeakPolarHBondContact O-CB 3.25Å; A17-A21 PolarHBondContact O-N 3.14Å; A21-A23 VanDerWaalsContact C-N 3.34Å |
| 22 | S | 53.3 | Low | 52.8 | Low | 103 Ų | 103 | 115.8 Ų | 115.8 | 72% | 0.72 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -76.8 | -20.8 | 177.6 | -55.2 | 0 | 0 | 0 | 0 | 113 | A18 E20 | A18-S22 PolarHBondContact O-N 3.44Å; A18-S22 PolarHBondContact O-OG 3.22Å; E20-S22 PolarHBondContact O-N 2.9Å |
| 23 | A | 52.3 | Low | 52.8 | Low | 79 Ų | 79 | 112.9 Ų | 112.9 | 65% | 0.653 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -89.2 | -15.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | E20 A21 | E20-A23 PolarHBondContact O-N 2.96Å; E20-A23 VanDerWaalsContact O-N 3.13Å; A21-A23 VanDerWaalsContact C-N 3.34Å |
| 24 | Y | 47.8 | Very low | 52 | Low | 176 Ų | 176 | 111.6 Ų | 111.6 | 69% | 0.69 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -108.3 | -5.6 | -176.8 | -86.4 | -81.8 | 0 | 0 | 0 | 115.3 | E20 D26 | E20-Y24 PolarHBondContact O-N 3.26Å; Y24-D26 PolarHBondContact O-N 2.91Å |
| 25 | A | 49.3 | Very low | 51.6 | Low | 88 Ų | 88 | 112.7 Ų | 112.7 | 73% | 0.727 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -5.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 26 | D | 50.7 | Low | 50.6 | Low | 159 Ų | 159 | 118.6 Ų | 118.6 | 85% | 0.85 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.8 | 20.9 | -174.7 | -117.7 | -35.7 | 0 | 0 | 0 | 115.1 | Y24 | Y24-D26 PolarHBondContact O-N 2.91Š|
| 27 | F | 44.8 | Very low | 49.2 | Very low | 170 Ų | 170 | 121.5 Ų | 121.5 | 75% | 0.746 | 72% | 0.721 | S | S | * | * | trans | -141.6 | 64.8 | 169.9 | -145.9 | -92.9 | 0 | 0 | 0 | 112.5 | ||||
| 28 | S | 48.6 | Very low | 48.3 | Very low | 122 Ų | 122 | 129.5 Ų | 129.5 | 85% | 0.853 | 74% | 0.742 | S | S | * | * | trans | -142.7 | 73 | 164.7 | -87 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 29 | S | 41.9 | Very low | 47.4 | Very low | 120 Ų | 120 | 133.5 Ų | 133.5 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -162.8 | 68.1 | 149.1 | -170.2 | 0 | 0 | 0 | 0 | 112 | ||
| 30 | C | 38.8 | Very low | 47.3 | Very low | 102 Ų | 102 | 130.9 Ų | 130.9 | 69% | 0.689 | 75% | 0.749 | S | S | * | * | trans | -157.9 | 51.6 | 155.3 | 69 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 31 | S | 55.6 | Low | 46.8 | Very low | 112 Ų | 112 | 132 Ų | 132 | 78% | 0.783 | 76% | 0.757 | S | S | * | * | trans | -93.3 | 103 | 157.1 | 53.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 32 | Q | 40.1 | Very low | 45.9 | Very low | 193 Ų | 193 | 139.9 Ų | 139.9 | 90% | 0.902 | 77% | 0.773 | S | S | * | * | trans | -159.4 | 103.5 | 147 | -110.8 | 173.9 | 102.4 | 0 | 0 | 109.5 | ||||
| 33 | A | 52.8 | Low | 45.3 | Very low | 97 Ų | 97 | 140 Ų | 140 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | trans | -74.8 | 122.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 34 | S | 39.8 | Very low | 44.6 | Very low | 91 Ų | 91 | 139.8 Ų | 139.8 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | trans | -171.8 | 122.5 | 148 | -80.3 | 0 | 0 | 0 | 0 | 110 | F36 | S34-F36 WeakPolarHBondContact O-CD2 3.43Š| ||
| 35 | S | 54.1 | Low | 45.1 | Very low | 104 Ų | 104 | 136.3 Ų | 136.3 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -20.9 | 130.7 | 155.6 | 48.3 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 36 | F | 34.3 | Very low | 44.4 | Very low | 199 Ų | 199 | 141.7 Ų | 141.7 | 87% | 0.873 | 79% | 0.785 | S | S | * | * | trans | -132.5 | 106.9 | 155.1 | -80.5 | -77.4 | 0 | 0 | 0 | 111.6 | S34 | S34-F36 WeakPolarHBondContact O-CD2 3.43Š| ||
| 37 | Q | 39.2 | Very low | 44.4 | Very low | 182 Ų | 182 | 139.3 Ų | 139.3 | 85% | 0.85 | 78% | 0.781 | S | S | * | * | trans | -62.4 | 144.4 | 158.6 | -74.9 | 167.1 | -73.1 | 0 | 0 | 110.1 | ||||
| 38 | Y | 40.4 | Very low | 44.3 | Very low | 218 Ų | 218 | 138.7 Ų | 138.7 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | trans | 8.2 | 134.4 | 155.2 | -78.9 | -96.4 | 0 | 0 | 0 | 118.9 | ||||
| 39 | N | 36.1 | Very low | 44.2 | Very low | 141 Ų | 141 | 138.6 Ų | 138.6 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | 172.5 | -174.9 | 84.4 | -135.4 | 5.7 | 0 | 0 | 0 | 110.9 | |||||
| 40 | P | 63.1 | Low | 43.8 | Very low | 91 Ų | 91 | 136.5 Ų | 136.5 | 59% | 0.591 | 78% | 0.78 | S | S | * | * | -129.4 | -179 | -114.9 | 43 | -22.9 | 0 | 0 | 0 | 116.4 | |||||
| 41 | I | 45.2 | Very low | 43.9 | Very low | 157 Ų | 157 | 137.9 Ų | 137.9 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | trans | 71.1 | 109.1 | 159.2 | -48.7 | -179.7 | 0 | 0 | 0 | 118.2 | ||||
| 42 | R | 35.6 | Very low | 43.9 | Very low | 233 Ų | 233 | 138.9 Ų | 138.9 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | -164.4 | 127.3 | 115.7 | -139.2 | 164.5 | -176.3 | -97.3 | 3.4 | 113.7 | |||||
| 43 | S | 39.9 | Very low | 44.3 | Very low | 106 Ų | 106 | 135.4 Ų | 135.4 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | trans | -33.1 | 144.6 | 169.4 | 31.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 44 | G | 38.3 | Very low | 43.6 | Very low | 74 Ų | 74 | 139.5 Ų | 139.5 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | trans | 139.3 | 144 | 140.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 45 | P | 58.1 | Low | 43.7 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 67% | 0.669 | 80% | 0.797 | S | S | * | * | trans | -105.6 | 160.5 | -135.7 | 37.7 | -29.6 | 0 | 0 | 0 | 112.9 | ||||
| 46 | F | 34.8 | Very low | 43.7 | Very low | 201 Ų | 201 | 142 Ų | 142 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | -178.7 | 143.1 | 120.5 | -85.3 | -63.4 | 0 | 0 | 0 | 109.2 | |||||
| 47 | S | 51.6 | Low | 44 | Very low | 110 Ų | 110 | 137 Ų | 137 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -58.2 | 138.5 | -162 | -49.4 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 48 | N | 42.1 | Very low | 44.1 | Very low | 157 Ų | 157 | 133.4 Ų | 133.4 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -153.8 | 143.8 | 142.7 | -96.2 | -26.5 | 0 | 0 | 0 | 110.7 | ||||
| 49 | P | 46.1 | Very low | 43.9 | Very low | 120 Ų | 120 | 129.3 Ų | 129.3 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 129 | -170.6 | 29.7 | -32.8 | 0 | 0 | 0 | 111.3 | ||
| 50 | G | 35 | Very low | 44.5 | Very low | 76 Ų | 76 | 128.7 Ų | 128.7 | 78% | 0.784 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 131.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 51 | C | 40.7 | Very low | 44 | Very low | 131 Ų | 131 | 133.1 Ų | 133.1 | 89% | 0.885 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 124.4 | 151.9 | -65 | 0 | 0 | 0 | 0 | 108.1 | ||
| 52 | T | 54.6 | Low | 43.8 | Very low | 132 Ų | 132 | 129.2 Ų | 129.2 | 81% | 0.81 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 141.6 | 173.2 | 47.8 | 0 | 0 | 0 | 0 | 110.5 | ||
| 53 | P | 48.6 | Very low | 44 | Very low | 121 Ų | 121 | 122.7 Ų | 122.7 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 137 | 174.2 | 30.7 | -31.9 | 0 | 0 | 0 | 111.2 | S55 | P53-S55 PolarHBondContact O-N 3.47Š|
| 54 | L | 39.2 | Very low | 44.6 | Very low | 182 Ų | 182 | 126 Ų | 126 | 95% | 0.953 | 82% | 0.818 | S | S | * | * | trans | -62.4 | 113 | 174.5 | -127.8 | 75 | 0 | 0 | 0 | 109.8 | ||||
| 55 | S | 41.8 | Very low | 45 | Very low | 107 Ų | 107 | 133.8 Ų | 133.8 | 75% | 0.748 | 82% | 0.824 | S | S | * | * | trans | -84.5 | 142.7 | 165.8 | -173.2 | 0 | 0 | 0 | 0 | 110 | P53 A57 | P53-S55 PolarHBondContact O-N 3.47Å; S55-A57 PolarHBondContact O-N 3.45Å | ||
| 56 | T | 53.8 | Low | 44.2 | Very low | 141 Ų | 141 | 136.7 Ų | 136.7 | 87% | 0.865 | 83% | 0.829 | S | S | * | * | trans | -45.3 | 108.6 | 177 | -44.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 57 | A | 39.7 | Very low | 44.8 | Very low | 93 Ų | 93 | 135.8 Ų | 135.8 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -98.4 | 113.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | S55 | S55-A57 PolarHBondContact O-N 3.45Š| ||
| 58 | S | 42.8 | Very low | 44.3 | Very low | 107 Ų | 107 | 137.8 Ų | 137.8 | 75% | 0.748 | 82% | 0.824 | S | S | * | * | trans | -61 | 135.6 | 165 | -169.9 | 0 | 0 | 0 | 0 | 110.6 | T60 | S58-T60 PolarHBondContact O-N 3.07Š| ||
| 59 | C | 35.7 | Very low | 44.8 | Very low | 133 Ų | 133 | 135.8 Ų | 135.8 | 90% | 0.899 | 82% | 0.819 | S | S | * | * | trans | -79.7 | 94.3 | 179.4 | -54.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 60 | T | 49.1 | Very low | 45.1 | Very low | 127 Ų | 127 | 136.3 Ų | 136.3 | 78% | 0.779 | 82% | 0.821 | S | S | * | * | trans | -98.9 | 122.8 | 162.7 | 45.4 | 0 | 0 | 0 | 0 | 110 | S58 G62 | S58-T60 PolarHBondContact O-N 3.07Å; T60-G62 PolarHBondContact O-N 3.08Å | ||
| 61 | L | 52 | Low | 46.1 | Very low | 185 Ų | 185 | 138.7 Ų | 138.7 | 97% | 0.969 | 82% | 0.822 | S | S | * | * | trans | -53.3 | 112.8 | 171.5 | -98.8 | 131.9 | 0 | 0 | 0 | 110.5 | ||||
| 62 | G | 40.8 | Very low | 46.4 | Very low | 74 Ų | 74 | 142.9 Ų | 142.9 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | trans | -81.6 | 133.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | T60 | T60-G62 PolarHBondContact O-N 3.08Š| ||
| 63 | A | 40.4 | Very low | 46.1 | Very low | 96 Ų | 96 | 141.9 Ų | 141.9 | 79% | 0.793 | 82% | 0.819 | S | S | * | * | trans | -64.5 | 152.5 | -172.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | R65 | A63-R65 PolarHBondContact O-N 3.33Š| ||
| 64 | L | 51.1 | Low | 46.6 | Very low | 176 Ų | 176 | 140.5 Ų | 140.5 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | -18.6 | 116.8 | 153.8 | -96.9 | 158.1 | 0 | 0 | 0 | 114 | ||||
| 65 | R | 47.8 | Very low | 47.7 | Very low | 237 Ų | 237 | 137.7 Ų | 137.7 | 89% | 0.894 | 80% | 0.803 | S | S | * | * | trans | -108.8 | 114.4 | 157.3 | -173.6 | 169.9 | 170 | 177.9 | -3.9 | 108.7 | A63 | A63-R65 PolarHBondContact O-N 3.33Š| ||
| 66 | E | 40.1 | Very low | 48.3 | Very low | 164 Ų | 164 | 137.9 Ų | 137.9 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | trans | -45.9 | 133.2 | 177.1 | -161 | -155.1 | 160.6 | 0 | 0 | 113.7 | ||||
| 67 | H | 47.9 | Very low | 48.1 | Very low | 182 Ų | 182 | 141.2 Ų | 141.2 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -82 | 116.4 | 172.4 | -91.4 | -85.4 | 0 | 0 | 0 | 110.6 | ||||
| 68 | Q | 41.3 | Very low | 49.1 | Very low | 153 Ų | 153 | 145.3 Ų | 145.3 | 72% | 0.715 | 80% | 0.8 | S | S | * | * | trans | -74.1 | 132.3 | 159.3 | -91.6 | -78.7 | -17.1 | 0 | 0 | 110 | T70 | Q68-T70 PolarHBondContact O-N 3.37Š| ||
| 69 | P | 51.4 | Low | 49.5 | Very low | 114 Ų | 114 | 148.4 Ų | 148.4 | 74% | 0.74 | 80% | 0.8 | S | S | * | * | trans | -83 | 115 | 179.9 | 31.1 | -31 | 0 | 0 | 0 | 111.4 | ||||
| 70 | T | 53 | Low | 49.9 | Very low | 131 Ų | 131 | 150.6 Ų | 150.6 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -80 | 135.4 | 166.7 | 53.4 | 0 | 0 | 0 | 0 | 110.2 | Q68 | Q68-T70 PolarHBondContact O-N 3.37Š| ||
| 71 | P | 55.7 | Low | 50.2 | Low | 126 Ų | 126 | 150.4 Ų | 150.4 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -71.9 | 134.3 | -176.3 | 28.5 | -32.6 | 0 | 0 | 0 | 111.9 | ||||
| 72 | Y | 48.3 | Very low | 50 | Low | 220 Ų | 220 | 147.8 Ų | 147.8 | 86% | 0.863 | 79% | 0.786 | S | S | * | * | trans | -33.6 | 124.7 | 170.2 | -122.1 | -112 | 0 | 0 | 0 | 114.3 | ||||
| 73 | S | 47.8 | Very low | 50.8 | Low | 110 Ų | 110 | 149.9 Ų | 149.9 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | -108 | 96.8 | 151.3 | -168.9 | 0 | 0 | 0 | 0 | 107.3 | V75 | S73-V75 PolarHBondContact O-N 3.4Å; S73-V75 VanDerWaalsContact O-N 3.13Å | ||
| 74 | S | 58 | Low | 51.3 | Low | 92 Ų | 92 | 150 Ų | 150 | 64% | 0.643 | 78% | 0.781 | S | S | * | * | trans | -69.3 | 98.3 | 173.2 | 50.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 75 | V | 62.4 | Low | 51.4 | Low | 124 Ų | 124 | 145.3 Ų | 145.3 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | trans | -77.6 | 130.7 | 158.9 | -73.1 | 0 | 0 | 0 | 0 | 108.9 | S73 Y77 | S73-V75 PolarHBondContact O-N 3.4Å; S73-V75 VanDerWaalsContact O-N 3.13Å; V75-Y77 PolarHBondContact O-N 3.17Å; V75-Y77 VanDerWaalsContact O-N 3.15Å | ||
| 76 | P | 55.6 | Low | 51.7 | Low | 110 Ų | 110 | 141.1 Ų | 141.1 | 71% | 0.714 | 77% | 0.77 | S | S | * | * | trans | -73.1 | 110.3 | -172.8 | 28.6 | -32.3 | 0 | 0 | 0 | 110.1 | K78 | P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 HydrophobicContact CB-CG 4.5Å; P76-K78 PolarHBondContact O-N 2.93Å | ||
| 77 | Y | 49.2 | Very low | 52.1 | Low | 212 Ų | 212 | 140.9 Ų | 140.9 | 83% | 0.831 | 77% | 0.774 | S | S | * | * | trans | -67.7 | 93.5 | 167.6 | -164.3 | -95.9 | 0 | 0 | 0 | 108.5 | V75 | V75-Y77 PolarHBondContact O-N 3.17Å; V75-Y77 VanDerWaalsContact O-N 3.15Å | ||
| 78 | K | 61.3 | Low | 52.5 | Low | 179 Ų | 179 | 139.9 Ų | 139.9 | 78% | 0.778 | 77% | 0.769 | S | S | * | * | trans | -114.1 | 111.4 | 165.2 | -58.5 | -62.6 | -177.6 | -176 | 0 | 107.9 | P76 | P76-K78 VanDerWaalsContact C-N 3.34Å; P76-K78 HydrophobicContact CB-CG 4.5Å; P76-K78 PolarHBondContact O-N 2.93Å | ||
| 79 | F | 49.6 | Very low | 53.2 | Low | 171 Ų | 171 | 142 Ų | 142 | 75% | 0.75 | 78% | 0.776 | S | S | * | * | trans | 75.2 | 88.7 | 136.6 | -148 | -90.2 | 0 | 0 | 0 | 116.9 | ||||
| 80 | F | 45.9 | Very low | 53.5 | Low | 179 Ų | 179 | 147.2 Ų | 147.2 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -155.9 | 85.5 | 134.4 | -83.1 | -68.5 | 0 | 0 | 0 | 109.1 | ||||
| 81 | S | 55.3 | Low | 54 | Low | 124 Ų | 124 | 150.6 Ų | 150.6 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -76.4 | 109.3 | 147.5 | -69.5 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 82 | D | 47.3 | Very low | 55 | Low | 129 Ų | 129 | 151.4 Ų | 151.4 | 69% | 0.69 | 78% | 0.777 | S | S | * | * | trans | -135.2 | 113.2 | 157.7 | -162.2 | -12.7 | 0 | 0 | 0 | 109.4 | S84 | D82-S84 PolarHBondContact O-N 2.97Š| ||
| 83 | P | 57.6 | Low | 56.7 | Low | 118 Ų | 118 | 151.4 Ų | 151.4 | 77% | 0.766 | 78% | 0.776 | S | S | * | * | trans | -86.3 | 80.5 | -178.7 | 34.8 | -33.6 | 0 | 0 | 0 | 110.6 | ||||
| 84 | S | 51.6 | Low | 58.4 | Low | 99 Ų | 99 | 157 Ų | 157 | 69% | 0.692 | 78% | 0.78 | S | S | * | * | trans | -159.5 | 91 | 170.3 | -79.5 | 0 | 0 | 0 | 0 | 114.3 | D82 L86 | D82-S84 PolarHBondContact O-N 2.97Å; S84-L86 PolarHBondContact O-N 2.73Å | ||
| 85 | G | 52.2 | Low | 59.8 | Low | 77 Ų | 77 | 159.4 Ų | 159.4 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | 78.7 | 12.3 | 121.7 | 0 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 86 | L | 54.6 | Low | 61.2 | Low | 149 Ų | 149 | 164 Ų | 164 | 78% | 0.78 | 79% | 0.788 | S | S | * | * | trans | -112.4 | 30.3 | -175.5 | -60.9 | -175.2 | 0 | 0 | 0 | 116.7 | S84 | S84-L86 PolarHBondContact O-N 2.73Š| ||
| 87 | N | 48.9 | Very low | 63 | Low | 159 Ų | 159 | 161 Ų | 161 | 85% | 0.85 | 77% | 0.768 | S | S | * | * | trans | -96.2 | 16.7 | 176.7 | -68.1 | -43 | 0 | 0 | 0 | 114.9 | K89 | N87-K89 VanDerWaalsContact C-N 3.27Å; N87-K89 PolarHBondContact O-N 2.93Å | ||
| 88 | E | 56.1 | Low | 65.2 | Low | 161 Ų | 161 | 156.7 Ų | 156.7 | 75% | 0.752 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | 24.8 | -178.7 | -146.9 | 66.4 | -133.1 | 0 | 0 | 114 | ||
| 89 | K | 55 | Low | 66.9 | Low | 198 Ų | 198 | 151.2 Ų | 151.2 | 86% | 0.861 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | 9.7 | 176.8 | -69.1 | 174 | -179.2 | 171 | 0 | 113.3 | N87 K91 | N87-K89 VanDerWaalsContact C-N 3.27Å; N87-K89 PolarHBondContact O-N 2.93Å; K89-K91 PolarHBondContact O-N 2.78Å; K89-K91 VanDerWaalsContact O-N 3.16Å |
| 90 | R | 59 | Low | 69.2 | Low | 224 Ų | 224 | 146.7 Ų | 146.7 | 85% | 0.845 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -83.7 | 84.7 | 170.2 | -174.1 | 177.9 | -77.7 | 152.5 | -4.3 | 108.9 | Q92 | R90-Q92 PolarHBondContact O-N 3.23Š|
| 91 | K | 63.2 | Low | 71.7 | Confident | 201 Ų | 201 | 142.2 Ų | 142.2 | 87% | 0.874 | 72% | 0.717 | S | S | * | * | trans | 4.2 | 83.9 | 167.1 | -78.6 | 164.8 | 176.6 | 171.7 | 0 | 113.8 | K89 R93 | K89-K91 PolarHBondContact O-N 2.78Å; K89-K91 VanDerWaalsContact O-N 3.16Å; K91-R93 PolarHBondContact O-N 2.84Å | ||
| 92 | Q | 76.3 | Confident | 73.7 | Confident | 143 Ų | 143 | 140.6 Ų | 140.6 | 67% | 0.668 | 71% | 0.706 | S | S | * | * | trans | -61.9 | 113.3 | 175.2 | -175.4 | 62.9 | 8.8 | 0 | 0 | 108.1 | R90 R94 | R90-Q92 PolarHBondContact O-N 3.23Å; Q92-R94 PolarHBondContact O-N 3.15Å | ||
| 93 | R | 83.1 | Confident | 76.1 | Confident | 221 Ų | 221 | 135.9 Ų | 135.9 | 83% | 0.834 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 130.8 | 178.3 | -169 | 175.1 | -178.7 | -134 | 4.1 | 107.9 | K91 I95 | K91-R93 PolarHBondContact O-N 2.84Å; R93-I95 PolarHBondContact O-N 3.23Å |
| 94 | R | 83.4 | Confident | 78.1 | Confident | 228 Ų | 228 | 133 Ų | 133 | 86% | 0.86 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 129.4 | 178 | -68.6 | -173.2 | -170.8 | -161.4 | 3.4 | 109.3 | Q92 R96 | Q92-R94 PolarHBondContact O-N 3.15Å; R94-R96 PolarHBondContact O-N 3.09Å |
| 95 | I | 88.2 | Confident | 80.3 | Confident | 141 Ų | 141 | 135 Ų | 135 | 72% | 0.723 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 133.2 | 178.4 | -56.3 | -59.9 | 0 | 0 | 0 | 108.8 | R93 | R93-I95 PolarHBondContact O-N 3.23Š|
| 96 | R | 92.3 | Very high | 82.5 | Confident | 222 Ų | 222 | 132.9 Ų | 132.9 | 84% | 0.838 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 133.2 | 179.3 | -175.1 | 178.4 | 178.7 | -169.5 | 0 | 109.3 | R94 | R94-R96 PolarHBondContact O-N 3.09Š|
| 97 | T | 92.6 | Very high | 84.6 | Confident | 46 Ų | 46 | 125.8 Ų | 125.8 | 28% | 0.282 | 59% | 0.586 | S | S | . | * | P | Polyproline II helix | trans | -71.4 | 130.1 | 170.9 | -47.2 | 0 | 0 | 0 | 0 | 110 | F99 L131 R135 | T97-F99 HydrophobicContact CG2-CD1 4.35Å; T97-F99 HydrophobicContact CG2-CE1 3.95Å; T97-F99 HydrophobicContact CG2-CZ 4.41Å; T97-L131 HydrophobicContact CG2-CD2 4.07Å; T97-R135 VanDerWaalsContact OG1-CD 3.23Å; T97-R135 WeakPolarHBondContact OG1-CD 3.41Å |
| 98 | T | 95.3 | Very high | 86.9 | Confident | 122 Ų | 122 | 122.4 Ų | 122.4 | 75% | 0.748 | 57% | 0.565 | S | S | * | * | trans | -105.4 | 126.4 | 169.8 | 52 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 99 | F | 97.3 | Very high | 88.9 | Confident | 64 Ų | 64 | 119.8 Ų | 119.8 | 28% | 0.281 | 55% | 0.548 | S | S | . | . | trans | -88 | 138.7 | 179.8 | -55 | -68.9 | 0 | 0 | 0 | 110.5 | T97 L104 L131 W139 | T97-F99 HydrophobicContact CG2-CD1 4.35Å; T97-F99 HydrophobicContact CG2-CE1 3.95Å; T97-F99 HydrophobicContact CG2-CZ 4.41Å; F99-L104 HydrophobicContact CB-CD1 4.49Å; F99-L104 HydrophobicContact CB-CD2 3.72Å; F99-L104 HydrophobicContact CB-CG 3.86Å; F99-L104 HydrophobicContact CD2-CD2 4.23Å; F99-L104 HydrophobicContact CG-CD2 4.18Å; F99-L131 HydrophobicContact CD1-CD1 3.6Å; F99-L131 HydrophobicContact CD1-CD2 4.41Å; F99-L131 HydrophobicContact CE1-CD1 3.53Å; F99-L131 HydrophobicContact CE1-CD2 4.34Å; F99-W139 AromaticContact CD2-CD1 3.82Å; F99-W139 AromaticContact CE2-CD1 3.55Å; F99-W139 HydrophobicContact CE2-CG 4.48Å; F99-W139 HydrophobicContact CZ-CB 4.35Å; F99-W139 AromaticContact CZ-CD1 3.96Å | ||
| 100 | T | 98.3 | Very high | 91 | Very high | 76 Ų | 76 | 110.5 Ų | 110.5 | 47% | 0.466 | 51% | 0.508 | S | S | . | . | trans | -74.8 | 162.5 | 171.2 | 76.3 | 0 | 0 | 0 | 0 | 110.5 | S102 Q103 L104 | T100-S102 VanDerWaalsContact C-N 3.29Å; T100-S102 PolarHBondContact O-N 2.8Å; T100-Q103 PolarHBondContact O-N 2.86Å; T100-Q103 VanDerWaalsContact OG1-CG 3.27Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.41Å; T100-Q103 PolarHBondContact OG1-N 3.37Å; T100-L104 WeakPolarHBondContact O-CG 3.35Å; T100-L104 PolarHBondContact O-N 2.93Å; T100-L104 VanDerWaalsContact O-N 3.08Å | ||
| 101 | S | 97.8 | Very high | 92.8 | Very high | 84 Ų | 84 | 100.4 Ų | 100.4 | 59% | 0.587 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -59 | -40.5 | 177.8 | -178 | 0 | 0 | 0 | 0 | 112.3 | Q103 L104 K105 | S101-Q103 PolarHBondContact O-N 3.03Å; S101-L104 PolarHBondContact O-N 3.16Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.27Å |
| 102 | S | 97.8 | Very high | 94.5 | Very high | 91 Ų | 91 | 94.9 Ų | 94.9 | 64% | 0.636 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62 | -44.6 | 177.6 | -169.5 | 0 | 0 | 0 | 0 | 112.1 | T100 L104 K105 E106 | T100-S102 VanDerWaalsContact C-N 3.29Å; T100-S102 PolarHBondContact O-N 2.8Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.02Å; S102-K105 PolarHBondContact O-N 3.19Å; S102-E106 PolarHBondContact O-N 3.41Å |
| 103 | Q | 98.1 | Very high | 95.5 | Very high | 29 Ų | 29 | 94.3 Ų | 94.3 | 14% | 0.136 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 177.7 | -65 | 172.9 | -31.2 | 0 | 0 | 111.6 | T100 S101 E106 L107 I129 | T100-Q103 PolarHBondContact O-N 2.86Å; T100-Q103 VanDerWaalsContact OG1-CG 3.27Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.41Å; T100-Q103 PolarHBondContact OG1-N 3.37Å; S101-Q103 PolarHBondContact O-N 3.03Å; Q103-E106 PolarHBondContact O-N 3.15Å; Q103-L107 WeakPolarHBondContact O-CB 3.25Å; Q103-L107 WeakPolarHBondContact O-CD1 3.44Å; Q103-L107 VanDerWaalsContact O-CG 3.24Å; Q103-L107 WeakPolarHBondContact O-CG 3.46Å; Q103-L107 PolarHBondContact O-N 3.07Å; Q103-I129 HydrophobicContact CB-CB 4.41Å; Q103-I129 HydrophobicContact CG-CB 4.08Å; Q103-I129 PolarHBondContact NE2-O 2.82Å |
| 104 | L | 98.3 | Very high | 96.2 | Very high | 57 Ų | 57 | 86.5 Ų | 86.5 | 30% | 0.298 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.4 | -40.7 | 177.5 | -68.8 | 175.4 | 0 | 0 | 0 | 112.1 | F99 T100 S101 S102 E106 L107 E108 W139 | F99-L104 HydrophobicContact CB-CD1 4.49Å; F99-L104 HydrophobicContact CB-CD2 3.72Å; F99-L104 HydrophobicContact CB-CG 3.86Å; F99-L104 HydrophobicContact CD2-CD2 4.23Å; F99-L104 HydrophobicContact CG-CD2 4.18Å; T100-L104 WeakPolarHBondContact O-CG 3.35Å; T100-L104 PolarHBondContact O-N 2.93Å; T100-L104 VanDerWaalsContact O-N 3.08Å; S101-L104 PolarHBondContact O-N 3.16Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.02Å; L104-E106 PolarHBondContact O-N 3.02Å; L104-L107 PolarHBondContact O-N 3.48Å; L104-E108 WeakPolarHBondContact O-CB 3.47Å; L104-E108 VanDerWaalsContact O-CG 3.31Å; L104-E108 WeakPolarHBondContact O-CG 3.22Å; L104-E108 PolarHBondContact O-N 3.45Å; L104-W139 HydrophobicContact CD2-CZ2 4.37Å; L104-W139 VanDerWaalsContact CD2-NE1 3.32Å |
| 105 | K | 98.3 | Very high | 96.9 | Very high | 142 Ų | 142 | 78.9 Ų | 78.9 | 62% | 0.617 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -59.3 | -45.6 | 177.3 | -73.2 | 176.4 | -178.4 | -176.8 | 0 | 112 | S101 S102 E108 R109 | S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.27Å; S102-K105 PolarHBondContact O-N 3.19Å; K105-E108 PolarHBondContact O-N 3.05Å; K105-R109 WeakPolarHBondContact O-CB 3.27Å; K105-R109 PolarHBondContact O-N 3.4Å |
| 106 | E | 98.1 | Very high | 97.3 | Very high | 33 Ų | 33 | 79.8 Ų | 79.8 | 15% | 0.154 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -67.3 | -40.9 | 179.6 | -169.1 | 63.5 | -153.7 | 0 | 0 | 111.8 | S102 Q103 L104 E108 R109 V110 L125 K128 I129 | S102-E106 PolarHBondContact O-N 3.41Å; Q103-E106 PolarHBondContact O-N 3.15Å; L104-E106 PolarHBondContact O-N 3.02Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E106-E108 PolarHBondContact O-N 3.12Å; E106-R109 WeakPolarHBondContact O-CB 3.34Å; E106-R109 PolarHBondContact O-N 2.79Å; E106-R109 IonicContact OE1-CZ 3.31Å; E106-R109 VanDerWaalsContact OE1-CZ 3.25Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 PolarHBondContact OE1-NE 2.92Å; E106-R109 IonicContact OE1-NH2 2.93Å; E106-R109 PolarHBondContact OE1-NH2 3.04Å; E106-R109 IonicContact OE2-NE 3.49Å; E106-V110 PolarHBondContact O-N 3.14Å; E106-L125 HydrophobicContact CG-CD2 3.78Å; E106-K128 HydrophobicContact CG-CD 4.13Å; E106-K128 WeakPolarHBondContact OE1-CE 3.27Å; E106-K128 IonicContact OE1-NZ 3.37Å; E106-K128 PolarHBondContact OE1-NZ 2.81Å; E106-K128 IonicContact OE2-NZ 2.63Å; E106-K128 PolarHBondContact OE2-NZ 2.94Å; E106-I129 HydrophobicContact CB-CG2 3.8Å; E106-I129 HydrophobicContact CG-CG2 3.76Å |
| 107 | L | 98.4 | Very high | 97.6 | Very high | 0 Ų | 0 | 69.5 Ų | 69.5 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.3 | -41 | 174.9 | -72 | 166.4 | 0 | 0 | 0 | 112 | Q103 L104 F111 I129 V136 W139 F140 | Q103-L107 WeakPolarHBondContact O-CB 3.25Å; Q103-L107 WeakPolarHBondContact O-CD1 3.44Å; Q103-L107 VanDerWaalsContact O-CG 3.24Å; Q103-L107 WeakPolarHBondContact O-CG 3.46Å; Q103-L107 PolarHBondContact O-N 3.07Å; L104-L107 PolarHBondContact O-N 3.48Å; L107-F111 WeakPolarHBondContact O-CB 3.38Å; L107-F111 PolarHBondContact O-N 3.39Å; L107-I129 HydrophobicContact CD1-CD1 4.08Å; L107-I129 HydrophobicContact CD2-CD1 3.69Å; L107-I129 HydrophobicContact CG-CD1 3.74Å; L107-V136 HydrophobicContact CD2-CG1 3.96Å; L107-V136 HydrophobicContact CD2-CG2 4.43Å; L107-W139 HydrophobicContact CB-CD2 4.11Å; L107-W139 HydrophobicContact CB-CE3 3.99Å; L107-W139 HydrophobicContact CB-CH2 3.68Å; L107-W139 HydrophobicContact CB-CZ2 3.78Å; L107-W139 HydrophobicContact CB-CZ3 3.79Å; L107-W139 HydrophobicContact CD1-CD2 3.88Å; L107-W139 HydrophobicContact CD1-CE3 4.45Å; L107-W139 HydrophobicContact CD1-CG 3.92Å; L107-W139 HydrophobicContact CD1-CZ2 4.49Å; L107-W139 HydrophobicContact CD2-CD2 4.42Å; L107-W139 HydrophobicContact CD2-CE3 4.23Å; L107-W139 HydrophobicContact CG-CD2 4.37Å; L107-W139 HydrophobicContact CG-CE3 4.46Å; L107-F140 HydrophobicContact CD2-CD2 4.49Å; L107-F140 HydrophobicContact CD2-CE2 3.87Å |
| 108 | E | 98.3 | Very high | 97.9 | Very high | 87 Ų | 87 | 71.8 Ų | 71.8 | 41% | 0.407 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -70.6 | -35.6 | 176.9 | -73.5 | -177.8 | 165.1 | 0 | 0 | 112.3 | L104 K105 E106 F111 A112 W139 R143 | L104-E108 WeakPolarHBondContact O-CB 3.47Å; L104-E108 VanDerWaalsContact O-CG 3.31Å; L104-E108 WeakPolarHBondContact O-CG 3.22Å; L104-E108 PolarHBondContact O-N 3.45Å; K105-E108 PolarHBondContact O-N 3.05Å; E106-E108 VanDerWaalsContact C-N 3.34Å; E106-E108 PolarHBondContact O-N 3.12Å; E108-F111 PolarHBondContact O-N 3.34Å; E108-A112 PolarHBondContact O-N 3.41Å; E108-W139 HydrophobicContact CG-CH2 3.85Å; E108-W139 HydrophobicContact CG-CZ2 3.97Å; E108-R143 IonicContact OE1-NH1 3.57Å |
| 109 | R | 98.2 | Very high | 98 | Very high | 106 Ų | 106 | 68.7 Ų | 68.7 | 40% | 0.4 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -56.5 | -52 | 173.2 | -173.5 | -168 | 67.2 | 74.3 | -0.7 | 110.9 | K105 E106 F111 A112 E113 | K105-R109 WeakPolarHBondContact O-CB 3.27Å; K105-R109 PolarHBondContact O-N 3.4Å; E106-R109 WeakPolarHBondContact O-CB 3.34Å; E106-R109 PolarHBondContact O-N 2.79Å; E106-R109 IonicContact OE1-CZ 3.31Å; E106-R109 VanDerWaalsContact OE1-CZ 3.25Å; E106-R109 IonicContact OE1-NE 2.78Å; E106-R109 PolarHBondContact OE1-NE 2.92Å; E106-R109 IonicContact OE1-NH2 2.93Å; E106-R109 PolarHBondContact OE1-NH2 3.04Å; E106-R109 IonicContact OE2-NE 3.49Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 3.1Å; R109-A112 WeakPolarHBondContact O-CB 3.38Å; R109-A112 PolarHBondContact O-N 3.44Å; R109-E113 IonicContact CZ-OE1 2.75Å; R109-E113 IonicContact NH1-OE1 3.69Å; R109-E113 PolarHBondContact NH1-OE1 3.49Å; R109-E113 IonicContact NH1-OE2 2.92Å; R109-E113 PolarHBondContact NH1-OE2 2.63Å; R109-E113 PolarHBondContact O-N 3.24Å |
| 110 | V | 97.9 | Very high | 98 | Very high | 3 Ų | 3 | 73.6 Ų | 73.6 | 2% | 0.018 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -69.4 | -32.6 | 178.8 | 176.5 | 0 | 0 | 0 | 0 | 111.9 | E106 A112 E113 T114 P117 T121 L125 F140 | E106-V110 PolarHBondContact O-N 3.14Å; V110-A112 PolarHBondContact O-N 3.36Å; V110-E113 WeakPolarHBondContact O-CB 3.46Å; V110-E113 PolarHBondContact O-N 3.49Å; V110-E113 VanDerWaalsContact O-N 3.09Å; V110-T114 HydrophobicContact CG1-CG2 4.4Å; V110-T114 PolarHBondContact O-N 2.72Å; V110-P117 HydrophobicContact CG1-CB 4.42Å; V110-T121 HydrophobicContact CG1-CG2 4.22Å; V110-L125 HydrophobicContact CB-CD1 3.88Å; V110-L125 HydrophobicContact CG1-CD1 3.87Å; V110-L125 HydrophobicContact CG2-CD1 3.84Å; V110-L125 HydrophobicContact CG2-CD2 3.75Å; V110-L125 HydrophobicContact CG2-CG 4.14Å; V110-F140 HydrophobicContact CB-CZ 4.27Å; V110-F140 HydrophobicContact CG1-CZ 4.09Å |
| 111 | F | 98.3 | Very high | 98 | Very high | 13 Ų | 13 | 72.4 Ų | 72.4 | 6% | 0.057 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61.3 | -34.6 | 174.2 | -171.7 | -95.6 | 0 | 0 | 0 | 112.5 | L107 E108 R109 E113 T114 H115 W139 F140 R143 R144 F147 | L107-F111 WeakPolarHBondContact O-CB 3.38Å; L107-F111 PolarHBondContact O-N 3.39Å; E108-F111 PolarHBondContact O-N 3.34Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 3.1Å; F111-E113 VanDerWaalsContact C-N 3.3Å; F111-T114 CarbonylContact O-C 3.45Å; F111-H115 AromaticContact CD1-CD2 3.57Å; F111-H115 AromaticContact CD1-NE2 3.92Å; F111-H115 AromaticContact CD2-CD2 3.89Å; F111-H115 AromaticContact CE1-CD2 3.16Å; F111-H115 WeakPolarHBondContact CE1-CD2 3.5Å; F111-H115 AromaticContact CE1-NE2 3.37Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.46Å; F111-H115 HydrophobicContact CE2-CB 4.09Å; F111-H115 AromaticContact CE2-CD2 3.51Å; F111-H115 AromaticContact CG-CD2 3.92Å; F111-H115 HydrophobicContact CZ-CB 4.35Å; F111-H115 AromaticContact CZ-CD2 3.13Å; F111-H115 WeakPolarHBondContact CZ-CD2 3.43Å; F111-H115 AromaticContact CZ-CG 3.89Å; F111-H115 AromaticContact CZ-NE2 3.71Å; F111-H115 PolarHBondContact O-CD2 2.92Å; F111-W139 HydrophobicContact CB-CH2 4.5Å; F111-W139 HydrophobicContact CB-CZ3 4.33Å; F111-W139 HydrophobicContact CD2-CZ3 4.46Å; F111-F140 HydrophobicContact CB-CE1 4Å; F111-F140 AromaticContact CD2-CD1 3.82Å; F111-F140 HydrophobicContact CD2-CD1 3.82Å; F111-F140 AromaticContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CG-CE1 4.41Å; F111-R143 HydrophobicContact CD1-CG 4.05Å; F111-R143 HydrophobicContact CD2-CB 4.25Å; F111-R143 HydrophobicContact CD2-CG 3.56Å; F111-R143 HydrophobicContact CE1-CG 3.92Å; F111-R143 HydrophobicContact CE2-CB 4.03Å; F111-R143 HydrophobicContact CE2-CG 3.42Å; F111-R143 VanDerWaalsContact CE2-CG 3.42Å; F111-R143 HydrophobicContact CG-CG 3.88Å; F111-R143 HydrophobicContact CZ-CG 3.61Å; F111-R144 HydrophobicContact CE2-CG 3.86Å; F111-R144 HydrophobicContact CZ-CG 4.43Å; F111-F147 HydrophobicContact CE1-CD2 4.42Å; F111-F147 HydrophobicContact CZ-CB 4.34Å |
| 112 | A | 97.9 | Very high | 98.1 | Very high | 85 Ų | 85 | 70.6 Ų | 70.6 | 70% | 0.702 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -67.9 | -29.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | E108 R109 V110 | E108-A112 PolarHBondContact O-N 3.41Å; R109-A112 WeakPolarHBondContact O-CB 3.38Å; R109-A112 PolarHBondContact O-N 3.44Å; V110-A112 PolarHBondContact O-N 3.36Å |
| 113 | E | 97.5 | Very high | 98.1 | Very high | 131 Ų | 131 | 70.6 Ų | 70.6 | 61% | 0.612 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -78.3 | -47.4 | 175 | -68.3 | 168.8 | -167.4 | 0 | 0 | 111.5 | R109 V110 F111 | R109-E113 IonicContact CZ-OE1 2.75Å; R109-E113 IonicContact NH1-OE1 3.69Å; R109-E113 PolarHBondContact NH1-OE1 3.49Å; R109-E113 IonicContact NH1-OE2 2.92Å; R109-E113 PolarHBondContact NH1-OE2 2.63Å; R109-E113 PolarHBondContact O-N 3.24Å; V110-E113 WeakPolarHBondContact O-CB 3.46Å; V110-E113 PolarHBondContact O-N 3.49Å; V110-E113 VanDerWaalsContact O-N 3.09Å; F111-E113 VanDerWaalsContact C-N 3.3Å |
| 114 | T | 97.5 | Very high | 98.1 | Very high | 56 Ų | 56 | 75.9 Ų | 75.9 | 34% | 0.344 | 36% | 0.362 | S | S | . | . | trans | -149.4 | 130.3 | 177 | 178.3 | 0 | 0 | 0 | 0 | 112.1 | V110 F111 Y116 P117 | V110-T114 HydrophobicContact CG1-CG2 4.4Å; V110-T114 PolarHBondContact O-N 2.72Å; F111-T114 CarbonylContact O-C 3.45Å; T114-Y116 PolarHBondContact O-N 2.92Å; T114-Y116 PolarHBondContact OG1-N 2.75Å; T114-Y116 VanDerWaalsContact OG1-N 3.15Å; T114-Y116 PolarHBondContact OG1-O 3.4Å; T114-P117 HydrophobicContact CG2-CB 4.11Å | ||
| 115 | H | 97.8 | Very high | 98.1 | Very high | 69 Ų | 69 | 73.4 Ų | 73.4 | 32% | 0.319 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -72.2 | -19.1 | 173.1 | -60.5 | 142.9 | 0 | 0 | 0 | 112.9 | F111 R144 | F111-H115 AromaticContact CD1-CD2 3.57Å; F111-H115 AromaticContact CD1-NE2 3.92Å; F111-H115 AromaticContact CD2-CD2 3.89Å; F111-H115 AromaticContact CE1-CD2 3.16Å; F111-H115 WeakPolarHBondContact CE1-CD2 3.5Å; F111-H115 AromaticContact CE1-NE2 3.37Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.46Å; F111-H115 HydrophobicContact CE2-CB 4.09Å; F111-H115 AromaticContact CE2-CD2 3.51Å; F111-H115 AromaticContact CG-CD2 3.92Å; F111-H115 HydrophobicContact CZ-CB 4.35Å; F111-H115 AromaticContact CZ-CD2 3.13Å; F111-H115 WeakPolarHBondContact CZ-CD2 3.43Å; F111-H115 AromaticContact CZ-CG 3.89Å; F111-H115 AromaticContact CZ-NE2 3.71Å; F111-H115 PolarHBondContact O-CD2 2.92Å; H115-R144 HydrophobicContact CB-CG 4.45Å; H115-R144 VanDerWaalsContact O-CD 3.27Å; H115-R144 WeakPolarHBondContact O-CD 3.36Å; H115-R144 PolarHBondContact O-NH1 3.37Å |
| 116 | Y | 98.2 | Very high | 98.1 | Very high | 159 Ų | 159 | 67 Ų | 67 | 62% | 0.624 | 32% | 0.323 | S | S | * | . | S | Bend | trans | -127.4 | 72.2 | -176.8 | -64.3 | -89.1 | 0 | 0 | 0 | 110.3 | T114 | T114-Y116 PolarHBondContact O-N 2.92Å; T114-Y116 PolarHBondContact OG1-N 2.75Å; T114-Y116 VanDerWaalsContact OG1-N 3.15Å; T114-Y116 PolarHBondContact OG1-O 3.4Å |
| 117 | P | 97.6 | Very high | 98.1 | Very high | 7 Ų | 7 | 72.2 Ų | 72.2 | 5% | 0.045 | 35% | 0.351 | C | S | . | . | trans | -66.1 | 141.5 | 177.6 | 28.8 | -36.5 | 0 | 0 | 0 | 110.9 | V110 T114 T121 R122 F140 | V110-P117 HydrophobicContact CG1-CB 4.42Å; T114-P117 HydrophobicContact CG2-CB 4.11Å; P117-T121 HydrophobicContact CB-CG2 4.11Å; P117-R122 HydrophobicContact CB-CG 4.04Å; P117-R122 HydrophobicContact CG-CG 3.83Å; P117-R122 PolarHBondContact O-NH1 2.86Å; P117-F140 HydrophobicContact CG-CD1 3.64Å; P117-F140 HydrophobicContact CG-CD2 4.07Å; P117-F140 HydrophobicContact CG-CE1 3.56Å; P117-F140 HydrophobicContact CG-CE2 4.01Å; P117-F140 HydrophobicContact CG-CG 3.91Å; P117-F140 HydrophobicContact CG-CZ 3.77Å | ||
| 118 | D | 98.3 | Very high | 98 | Very high | 94 Ų | 94 | 78 Ų | 78 | 50% | 0.503 | 38% | 0.377 | S | S | . | . | trans | -72.2 | 167 | 177.4 | -169.5 | 22.3 | 0 | 0 | 0 | 112.1 | Y120 T121 R122 | D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 3.43Å; D118-T121 PolarHBondContact O-N 3.25Å; D118-R122 WeakPolarHBondContact O-CG 3.23Å; D118-R122 PolarHBondContact O-N 3.34Å | ||
| 119 | I | 97.9 | Very high | 98 | Very high | 57 Ų | 57 | 74.5 Ų | 74.5 | 29% | 0.292 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -52 | -48 | 179.7 | -174.2 | 61.2 | 0 | 0 | 0 | 111.8 | T121 R122 E123 E133 | I119-T121 PolarHBondContact O-N 3.02Å; I119-R122 VanDerWaalsContact CD1-NH2 3.33Å; I119-R122 PolarHBondContact O-N 3.18Å; I119-R122 VanDerWaalsContact O-N 3.14Å; I119-E123 HydrophobicContact CD1-CG 4.38Å; I119-E123 HydrophobicContact CG1-CG 4.48Å; I119-E123 WeakPolarHBondContact O-CG 3.45Å; I119-E123 PolarHBondContact O-N 3.09Å; I119-E133 HydrophobicContact CD1-CG 4Å; I119-E133 WeakPolarHBondContact CD1-OE1 3.49Å |
| 120 | Y | 98.3 | Very high | 98 | Very high | 167 Ų | 167 | 76.4 Ų | 76.4 | 66% | 0.655 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -63 | -43.7 | -179.2 | -60.1 | -66.8 | 0 | 0 | 0 | 112.3 | D118 R122 E123 E124 | D118-Y120 VanDerWaalsContact C-N 3.31Å; D118-Y120 PolarHBondContact O-N 3.43Å; Y120-R122 VanDerWaalsContact C-N 3.3Å; Y120-R122 PolarHBondContact O-N 3.23Å; Y120-E123 PolarHBondContact O-N 3.13Å; Y120-E124 PolarHBondContact O-N 3.47Å |
| 121 | T | 97.9 | Very high | 97.9 | Very high | 51 Ų | 51 | 77.8 Ų | 77.8 | 31% | 0.313 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.7 | -36.9 | 176.4 | -48.2 | 0 | 0 | 0 | 0 | 111.6 | V110 P117 D118 I119 L125 | V110-T121 HydrophobicContact CG1-CG2 4.22Å; P117-T121 HydrophobicContact CB-CG2 4.11Å; D118-T121 PolarHBondContact O-N 3.25Å; I119-T121 PolarHBondContact O-N 3.02Å; T121-L125 WeakPolarHBondContact O-CB 3.44Å; T121-L125 WeakPolarHBondContact O-CG 3.45Å; T121-L125 PolarHBondContact O-N 3.33Å |
| 122 | R | 98.5 | Very high | 97.9 | Very high | 46 Ų | 46 | 81.2 Ų | 81.2 | 17% | 0.174 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -70.2 | -37.5 | 176.5 | -67.2 | -167.9 | -50.6 | -87.6 | -1 | 112 | P117 D118 I119 Y120 A126 E133 V136 | P117-R122 HydrophobicContact CB-CG 4.04Å; P117-R122 HydrophobicContact CG-CG 3.83Å; P117-R122 PolarHBondContact O-NH1 2.86Å; D118-R122 WeakPolarHBondContact O-CG 3.23Å; D118-R122 PolarHBondContact O-N 3.34Å; I119-R122 VanDerWaalsContact CD1-NH2 3.33Å; I119-R122 PolarHBondContact O-N 3.18Å; I119-R122 VanDerWaalsContact O-N 3.14Å; Y120-R122 VanDerWaalsContact C-N 3.3Å; Y120-R122 PolarHBondContact O-N 3.23Å; R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.13Å; R122-A126 PolarHBondContact O-N 3.46Å; R122-E133 HydrophobicContact CB-CG 4.05Å; R122-E133 IonicContact CZ-OE1 3.86Å; R122-E133 VanDerWaalsContact CZ-OE1 3.31Å; R122-E133 IonicContact NE-OE1 2.72Å; R122-E133 PolarHBondContact NE-OE1 3Å; R122-E133 IonicContact NH2-OE1 3.25Å; R122-E133 PolarHBondContact NH2-OE1 2.88Å; R122-V136 HydrophobicContact CB-CG1 4.24Å; R122-V136 HydrophobicContact CG-CG1 4.22Å |
| 123 | E | 98.5 | Very high | 97.9 | Very high | 91 Ų | 91 | 79.3 Ų | 79.3 | 43% | 0.425 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -65 | -45.9 | 175.6 | -73.1 | 177.5 | 164.5 | 0 | 0 | 111.5 | I119 Y120 L125 A126 L127 E133 | I119-E123 HydrophobicContact CD1-CG 4.38Å; I119-E123 HydrophobicContact CG1-CG 4.48Å; I119-E123 WeakPolarHBondContact O-CG 3.45Å; I119-E123 PolarHBondContact O-N 3.09Å; Y120-E123 PolarHBondContact O-N 3.13Å; E123-L125 VanDerWaalsContact C-N 3.35Å; E123-L125 PolarHBondContact O-N 3.48Å; E123-A126 WeakPolarHBondContact O-CB 3.16Å; E123-A126 PolarHBondContact O-N 3.22Å; E123-L127 WeakPolarHBondContact O-CG 3.39Å; E123-L127 PolarHBondContact O-N 3.34Å; E123-L127 VanDerWaalsContact O-N 3.08Å; E123-E133 HydrophobicContact CG-CB 4.45Å; E123-E133 HydrophobicContact CG-CG 4.05Å |
| 124 | E | 98.1 | Very high | 97.9 | Very high | 139 Ų | 139 | 74.9 Ų | 74.9 | 65% | 0.65 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -59.7 | -45.5 | 175.3 | -173.4 | -174.1 | 174.9 | 0 | 0 | 111.6 | Y120 A126 L127 K128 | Y120-E124 PolarHBondContact O-N 3.47Å; E124-A126 PolarHBondContact O-N 3.42Å; E124-L127 PolarHBondContact O-N 3.38Å; E124-K128 WeakPolarHBondContact O-CB 3.49Å; E124-K128 PolarHBondContact O-N 3.07Å |
| 125 | L | 98 | Very high | 97.9 | Very high | 6 Ų | 6 | 76.6 Ų | 76.6 | 3% | 0.031 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60.6 | -44.5 | 175.2 | -85.6 | 176 | 0 | 0 | 0 | 112.4 | E106 V110 T121 E123 L127 K128 I129 V136 F140 | E106-L125 HydrophobicContact CG-CD2 3.78Å; V110-L125 HydrophobicContact CB-CD1 3.88Å; V110-L125 HydrophobicContact CG1-CD1 3.87Å; V110-L125 HydrophobicContact CG2-CD1 3.84Å; V110-L125 HydrophobicContact CG2-CD2 3.75Å; V110-L125 HydrophobicContact CG2-CG 4.14Å; T121-L125 WeakPolarHBondContact O-CB 3.44Å; T121-L125 WeakPolarHBondContact O-CG 3.45Å; T121-L125 PolarHBondContact O-N 3.33Å; E123-L125 VanDerWaalsContact C-N 3.35Å; E123-L125 PolarHBondContact O-N 3.48Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.39Å; L125-K128 PolarHBondContact O-N 3.46Å; L125-K128 VanDerWaalsContact O-N 3.12Å; L125-I129 VanDerWaalsContact O-CG1 3.22Å; L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.38Å; L125-V136 HydrophobicContact CD1-CG1 4.45Å; L125-F140 HydrophobicContact CD1-CE2 4.15Å; L125-F140 HydrophobicContact CD1-CZ 4.33Å |
| 126 | A | 98.3 | Very high | 97.9 | Very high | 7 Ų | 7 | 73.3 Ų | 73.3 | 6% | 0.058 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -57.8 | -43.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | R122 E123 E124 D130 L131 E133 V136 | R122-A126 VanDerWaalsContact O-CB 3.25Å; R122-A126 WeakPolarHBondContact O-CB 3.13Å; R122-A126 PolarHBondContact O-N 3.46Å; E123-A126 WeakPolarHBondContact O-CB 3.16Å; E123-A126 PolarHBondContact O-N 3.22Å; E124-A126 PolarHBondContact O-N 3.42Å; A126-D130 PolarHBondContact O-N 3.5Å; A126-D130 VanDerWaalsContact O-N 3.17Å; A126-L131 CarbonylContact C-O 3.57Å; A126-L131 WeakPolarHBondContact CB-O 3.47Å; A126-L131 PolarHBondContact O-N 3.27Å; A126-L131 VanDerWaalsContact O-O 3.04Å; A126-E133 HydrophobicContact CB-CB 4.43Å; A126-V136 HydrophobicContact CB-CG2 4.03Å |
| 127 | L | 98.1 | Very high | 97.9 | Very high | 142 Ų | 142 | 69.6 Ų | 69.6 | 74% | 0.743 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -64.7 | -44.5 | 173.5 | -65.2 | 172.3 | 0 | 0 | 0 | 111.9 | E123 E124 L125 I129 | E123-L127 WeakPolarHBondContact O-CG 3.39Å; E123-L127 PolarHBondContact O-N 3.34Å; E123-L127 VanDerWaalsContact O-N 3.08Å; E124-L127 PolarHBondContact O-N 3.38Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.39Å; L127-I129 VanDerWaalsContact C-N 3.3Å; L127-I129 PolarHBondContact O-N 3.03Å |
| 128 | K | 97.2 | Very high | 98 | Very high | 123 Ų | 123 | 72.4 Ų | 72.4 | 54% | 0.535 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.8 | -31.8 | -177.5 | -175 | 173.9 | -178.7 | -178.6 | 0 | 113.8 | E106 E124 L125 | E106-K128 HydrophobicContact CG-CD 4.13Å; E106-K128 WeakPolarHBondContact OE1-CE 3.27Å; E106-K128 IonicContact OE1-NZ 3.37Å; E106-K128 PolarHBondContact OE1-NZ 2.81Å; E106-K128 IonicContact OE2-NZ 2.63Å; E106-K128 PolarHBondContact OE2-NZ 2.94Å; E124-K128 WeakPolarHBondContact O-CB 3.49Å; E124-K128 PolarHBondContact O-N 3.07Å; L125-K128 PolarHBondContact O-N 3.46Å; L125-K128 VanDerWaalsContact O-N 3.12Å |
| 129 | I | 97.4 | Very high | 98 | Very high | 13 Ų | 13 | 69 Ų | 69 | 7% | 0.067 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.4 | 11.1 | -173.3 | 75.7 | -169.1 | 0 | 0 | 0 | 113.4 | Q103 E106 L107 L125 L127 L131 V136 | Q103-I129 HydrophobicContact CB-CB 4.41Å; Q103-I129 HydrophobicContact CG-CB 4.08Å; Q103-I129 PolarHBondContact NE2-O 2.82Å; E106-I129 HydrophobicContact CB-CG2 3.8Å; E106-I129 HydrophobicContact CG-CG2 3.76Å; L107-I129 HydrophobicContact CD1-CD1 4.08Å; L107-I129 HydrophobicContact CD2-CD1 3.69Å; L107-I129 HydrophobicContact CG-CD1 3.74Å; L125-I129 VanDerWaalsContact O-CG1 3.22Å; L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.38Å; L127-I129 VanDerWaalsContact C-N 3.3Å; L127-I129 PolarHBondContact O-N 3.03Å; I129-L131 HydrophobicContact CD1-CD1 3.7Å; I129-L131 HydrophobicContact CD1-CG 4.43Å; I129-L131 HydrophobicContact CG1-CB 4.11Å; I129-L131 HydrophobicContact CG1-CD1 3.72Å; I129-L131 HydrophobicContact CG1-CG 3.91Å; I129-V136 HydrophobicContact CD1-CG2 4.22Å |
| 130 | D | 97.8 | Very high | 98 | Very high | 146 Ų | 146 | 66.4 Ų | 66.4 | 78% | 0.781 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.2 | 49.8 | -179.8 | -62.4 | -48 | 0 | 0 | 0 | 114 | A126 | A126-D130 PolarHBondContact O-N 3.5Å; A126-D130 VanDerWaalsContact O-N 3.17Å |
| 131 | L | 96.9 | Very high | 98 | Very high | 31 Ų | 31 | 62.7 Ų | 62.7 | 16% | 0.162 | 32% | 0.316 | C | S | . | . | trans | -127.7 | 168.1 | 176 | -65.8 | 176.4 | 0 | 0 | 0 | 110.7 | T97 F99 A126 I129 R135 V136 | T97-L131 HydrophobicContact CG2-CD2 4.07Å; F99-L131 HydrophobicContact CD1-CD1 3.6Å; F99-L131 HydrophobicContact CD1-CD2 4.41Å; F99-L131 HydrophobicContact CE1-CD1 3.53Å; F99-L131 HydrophobicContact CE1-CD2 4.34Å; A126-L131 CarbonylContact C-O 3.57Å; A126-L131 WeakPolarHBondContact CB-O 3.47Å; A126-L131 PolarHBondContact O-N 3.27Å; A126-L131 VanDerWaalsContact O-O 3.04Å; I129-L131 HydrophobicContact CD1-CD1 3.7Å; I129-L131 HydrophobicContact CD1-CG 4.43Å; I129-L131 HydrophobicContact CG1-CB 4.11Å; I129-L131 HydrophobicContact CG1-CD1 3.72Å; I129-L131 HydrophobicContact CG1-CG 3.91Å; L131-R135 HydrophobicContact CB-CB 4.38Å; L131-V136 HydrophobicContact CB-CG2 4.47Å | ||
| 132 | T | 97.9 | Very high | 98 | Very high | 85 Ų | 85 | 65 Ų | 65 | 52% | 0.521 | 33% | 0.326 | S | S | . | . | trans | -84.5 | 148.7 | 169.2 | 73.4 | 0 | 0 | 0 | 0 | 110.7 | A134 R135 V136 | T132-A134 PolarHBondContact O-N 3.48Å; T132-A134 VanDerWaalsContact O-N 3.15Å; T132-R135 WeakPolarHBondContact O-CA 3.4Å; T132-R135 WeakPolarHBondContact O-CB 3.5Å; T132-R135 PolarHBondContact O-N 3.17Å; T132-R135 WeakPolarHBondContact OG1-CG 3.4Å; T132-V136 PolarHBondContact O-N 2.98Å | ||
| 133 | E | 98.1 | Very high | 98 | Very high | 45 Ų | 45 | 66.9 Ų | 66.9 | 21% | 0.21 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -49.7 | -42.5 | 175.9 | -176.1 | -79.2 | 160.3 | 0 | 0 | 111 | I119 R122 E123 A126 R135 V136 Q137 | I119-E133 HydrophobicContact CD1-CG 4Å; I119-E133 WeakPolarHBondContact CD1-OE1 3.49Å; R122-E133 HydrophobicContact CB-CG 4.05Å; R122-E133 IonicContact CZ-OE1 3.86Å; R122-E133 VanDerWaalsContact CZ-OE1 3.31Å; R122-E133 IonicContact NE-OE1 2.72Å; R122-E133 PolarHBondContact NE-OE1 3Å; R122-E133 IonicContact NH2-OE1 3.25Å; R122-E133 PolarHBondContact NH2-OE1 2.88Å; E123-E133 HydrophobicContact CG-CB 4.45Å; E123-E133 HydrophobicContact CG-CG 4.05Å; A126-E133 HydrophobicContact CB-CB 4.43Å; E133-R135 VanDerWaalsContact C-N 3.27Å; E133-R135 PolarHBondContact O-N 2.86Å; E133-V136 CarbonylContact O-C 3.43Å; E133-V136 WeakPolarHBondContact O-CA 3.36Å; E133-V136 WeakPolarHBondContact O-CB 3.11Å; E133-V136 PolarHBondContact O-N 3.36Å; E133-Q137 PolarHBondContact O-N 3.07Å |
| 134 | A | 97.6 | Very high | 98 | Very high | 39 Ų | 39 | 64.8 Ų | 64.8 | 32% | 0.322 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.9 | -34.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | T132 V138 | T132-A134 PolarHBondContact O-N 3.48Å; T132-A134 VanDerWaalsContact O-N 3.15Å; A134-V138 VanDerWaalsContact O-CG2 3.25Å; A134-V138 WeakPolarHBondContact O-CG2 3.46Å; A134-V138 PolarHBondContact O-N 3.38Å; A134-V138 VanDerWaalsContact O-N 3.09Å |
| 135 | R | 97.8 | Very high | 98 | Very high | 92 Ų | 92 | 60.4 Ų | 60.4 | 35% | 0.347 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -68.4 | -42.8 | 174.1 | -63.5 | -57.8 | 95.3 | 155.2 | 7.2 | 111 | T97 L131 T132 E133 V138 W139 | T97-R135 VanDerWaalsContact OG1-CD 3.23Å; T97-R135 WeakPolarHBondContact OG1-CD 3.41Å; L131-R135 HydrophobicContact CB-CB 4.38Å; T132-R135 WeakPolarHBondContact O-CA 3.4Å; T132-R135 WeakPolarHBondContact O-CB 3.5Å; T132-R135 PolarHBondContact O-N 3.17Å; T132-R135 WeakPolarHBondContact OG1-CG 3.4Å; E133-R135 VanDerWaalsContact C-N 3.27Å; E133-R135 PolarHBondContact O-N 2.86Å; R135-V138 PolarHBondContact O-N 3.06Å; R135-W139 WeakPolarHBondContact O-CB 3.45Å; R135-W139 PolarHBondContact O-N 3.37Å |
| 136 | V | 98.1 | Very high | 97.9 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.1 | -47.9 | 176.1 | 179.4 | 0 | 0 | 0 | 0 | 109.8 | L107 R122 L125 A126 I129 L131 T132 E133 V138 W139 F140 | L107-V136 HydrophobicContact CD2-CG1 3.96Å; L107-V136 HydrophobicContact CD2-CG2 4.43Å; R122-V136 HydrophobicContact CB-CG1 4.24Å; R122-V136 HydrophobicContact CG-CG1 4.22Å; L125-V136 HydrophobicContact CD1-CG1 4.45Å; A126-V136 HydrophobicContact CB-CG2 4.03Å; I129-V136 HydrophobicContact CD1-CG2 4.22Å; L131-V136 HydrophobicContact CB-CG2 4.47Å; T132-V136 PolarHBondContact O-N 2.98Å; E133-V136 CarbonylContact O-C 3.43Å; E133-V136 WeakPolarHBondContact O-CA 3.36Å; E133-V136 WeakPolarHBondContact O-CB 3.11Å; E133-V136 PolarHBondContact O-N 3.36Å; V136-V138 PolarHBondContact O-N 3.42Å; V136-W139 WeakPolarHBondContact O-CB 3.37Å; V136-W139 PolarHBondContact O-N 3.23Å; V136-W139 VanDerWaalsContact O-N 3.1Å; V136-F140 HydrophobicContact CG1-CD2 3.72Å; V136-F140 HydrophobicContact CG1-CE2 3.74Å; V136-F140 WeakPolarHBondContact O-CD2 3.36Å; V136-F140 PolarHBondContact O-N 3.5Å |
| 137 | Q | 98.3 | Very high | 97.8 | Very high | 80 Ų | 80 | 70.1 Ų | 70.1 | 37% | 0.374 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -56 | -47.2 | 176.8 | -168.1 | -161.5 | -18.4 | 0 | 0 | 112.1 | E133 W139 F140 Q141 | E133-Q137 PolarHBondContact O-N 3.07Å; Q137-W139 VanDerWaalsContact C-N 3.34Å; Q137-F140 PolarHBondContact O-N 3.14Å; Q137-Q141 WeakPolarHBondContact O-CG 3.44Å; Q137-Q141 PolarHBondContact O-N 3.26Å; Q137-Q141 PolarHBondContact O-NE2 3.25Å |
| 138 | V | 98.2 | Very high | 97.7 | Very high | 67 Ų | 67 | 69.9 Ų | 69.9 | 41% | 0.406 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66 | -38 | 177.7 | 171 | 0 | 0 | 0 | 0 | 111.2 | A134 R135 V136 Q141 N142 | A134-V138 VanDerWaalsContact O-CG2 3.25Å; A134-V138 WeakPolarHBondContact O-CG2 3.46Å; A134-V138 PolarHBondContact O-N 3.38Å; A134-V138 VanDerWaalsContact O-N 3.09Å; R135-V138 PolarHBondContact O-N 3.06Å; V136-V138 PolarHBondContact O-N 3.42Å; V138-Q141 PolarHBondContact O-N 3.05Å; V138-N142 WeakPolarHBondContact O-CB 3.31Å; V138-N142 PolarHBondContact O-N 3.33Å; V138-N142 PolarHBondContact O-ND2 3.08Å; V138-N142 VanDerWaalsContact O-ND2 3.14Å |
| 139 | W | 98.1 | Very high | 97.6 | Very high | 23 Ų | 23 | 71.7 Ų | 71.7 | 9% | 0.087 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.5 | -48.8 | 175.7 | -172.7 | 100.7 | 0 | 0 | 0 | 111.4 | F99 L104 L107 E108 F111 R135 V136 Q137 Q141 N142 R143 | F99-W139 AromaticContact CD2-CD1 3.82Å; F99-W139 AromaticContact CE2-CD1 3.55Å; F99-W139 HydrophobicContact CE2-CG 4.48Å; F99-W139 HydrophobicContact CZ-CB 4.35Å; F99-W139 AromaticContact CZ-CD1 3.96Å; L104-W139 HydrophobicContact CD2-CZ2 4.37Å; L104-W139 VanDerWaalsContact CD2-NE1 3.32Å; L107-W139 HydrophobicContact CB-CD2 4.11Å; L107-W139 HydrophobicContact CB-CE3 3.99Å; L107-W139 HydrophobicContact CB-CH2 3.68Å; L107-W139 HydrophobicContact CB-CZ2 3.78Å; L107-W139 HydrophobicContact CB-CZ3 3.79Å; L107-W139 HydrophobicContact CD1-CD2 3.88Å; L107-W139 HydrophobicContact CD1-CE3 4.45Å; L107-W139 HydrophobicContact CD1-CG 3.92Å; L107-W139 HydrophobicContact CD1-CZ2 4.49Å; L107-W139 HydrophobicContact CD2-CD2 4.42Å; L107-W139 HydrophobicContact CD2-CE3 4.23Å; L107-W139 HydrophobicContact CG-CD2 4.37Å; L107-W139 HydrophobicContact CG-CE3 4.46Å; E108-W139 HydrophobicContact CG-CH2 3.85Å; E108-W139 HydrophobicContact CG-CZ2 3.97Å; F111-W139 HydrophobicContact CB-CH2 4.5Å; F111-W139 HydrophobicContact CB-CZ3 4.33Å; F111-W139 HydrophobicContact CD2-CZ3 4.46Å; R135-W139 WeakPolarHBondContact O-CB 3.45Å; R135-W139 PolarHBondContact O-N 3.37Å; V136-W139 WeakPolarHBondContact O-CB 3.37Å; V136-W139 PolarHBondContact O-N 3.23Å; V136-W139 VanDerWaalsContact O-N 3.1Å; Q137-W139 VanDerWaalsContact C-N 3.34Å; W139-Q141 VanDerWaalsContact C-N 3.34Å; W139-Q141 PolarHBondContact O-N 2.98Å; W139-N142 PolarHBondContact O-N 3.5Å; W139-R143 HydrophobicContact CE3-CB 4.03Å; W139-R143 HydrophobicContact CH2-CB 4.11Å; W139-R143 HydrophobicContact CH2-CG 3.8Å; W139-R143 HydrophobicContact CZ2-CG 4.47Å; W139-R143 HydrophobicContact CZ3-CB 3.81Å; W139-R143 HydrophobicContact CZ3-CG 3.84Å; W139-R143 WeakPolarHBondContact O-CB 3.47Å; W139-R143 PolarHBondContact O-N 3.42Å |
| 140 | F | 98.6 | Very high | 97.3 | Very high | 2 Ų | 2 | 77.7 Ų | 77.7 | 1% | 0.009 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63 | -38.1 | 178.9 | -89.2 | -89.5 | 0 | 0 | 0 | 112.4 | L107 V110 F111 P117 L125 V136 Q137 R143 R144 | L107-F140 HydrophobicContact CD2-CD2 4.49Å; L107-F140 HydrophobicContact CD2-CE2 3.87Å; V110-F140 HydrophobicContact CB-CZ 4.27Å; V110-F140 HydrophobicContact CG1-CZ 4.09Å; F111-F140 HydrophobicContact CB-CE1 4Å; F111-F140 AromaticContact CD2-CD1 3.82Å; F111-F140 HydrophobicContact CD2-CD1 3.82Å; F111-F140 AromaticContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CD2-CE1 3.8Å; F111-F140 HydrophobicContact CG-CE1 4.41Å; P117-F140 HydrophobicContact CG-CD1 3.64Å; P117-F140 HydrophobicContact CG-CD2 4.07Å; P117-F140 HydrophobicContact CG-CE1 3.56Å; P117-F140 HydrophobicContact CG-CE2 4.01Å; P117-F140 HydrophobicContact CG-CG 3.91Å; P117-F140 HydrophobicContact CG-CZ 3.77Å; L125-F140 HydrophobicContact CD1-CE2 4.15Å; L125-F140 HydrophobicContact CD1-CZ 4.33Å; V136-F140 HydrophobicContact CG1-CD2 3.72Å; V136-F140 HydrophobicContact CG1-CE2 3.74Å; V136-F140 WeakPolarHBondContact O-CD2 3.36Å; V136-F140 PolarHBondContact O-N 3.5Å; Q137-F140 PolarHBondContact O-N 3.14Å; F140-R143 PolarHBondContact O-N 2.97Å; F140-R144 WeakPolarHBondContact O-CB 3.34Å; F140-R144 WeakPolarHBondContact O-CG 3.47Å; F140-R144 PolarHBondContact O-N 3.33Å |
| 141 | Q | 98.4 | Very high | 96.8 | Very high | 89 Ų | 89 | 75.8 Ų | 75.8 | 42% | 0.416 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.9 | -48.3 | 172.7 | -75.7 | 175 | 70.1 | 0 | 0 | 111.9 | Q137 V138 W139 R143 R144 A145 | Q137-Q141 WeakPolarHBondContact O-CG 3.44Å; Q137-Q141 PolarHBondContact O-N 3.26Å; Q137-Q141 PolarHBondContact O-NE2 3.25Å; V138-Q141 PolarHBondContact O-N 3.05Å; W139-Q141 VanDerWaalsContact C-N 3.34Å; W139-Q141 PolarHBondContact O-N 2.98Å; Q141-R143 VanDerWaalsContact C-N 3.33Å; Q141-R143 PolarHBondContact O-N 3.39Å; Q141-R144 PolarHBondContact O-N 2.95Å; Q141-A145 WeakPolarHBondContact O-CB 3.45Å; Q141-A145 PolarHBondContact O-N 3.07Å |
| 142 | N | 98.1 | Very high | 96.3 | Very high | 100 Ų | 100 | 83.3 Ų | 83.3 | 54% | 0.535 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 178.3 | -73.3 | -34.3 | 0 | 0 | 0 | 112 | V138 W139 A145 K146 | V138-N142 WeakPolarHBondContact O-CB 3.31Å; V138-N142 PolarHBondContact O-N 3.33Å; V138-N142 PolarHBondContact O-ND2 3.08Å; V138-N142 VanDerWaalsContact O-ND2 3.14Å; W139-N142 PolarHBondContact O-N 3.5Å; N142-A145 PolarHBondContact O-N 3.13Å; N142-K146 PolarHBondContact O-N 3.24Å |
| 143 | R | 98.1 | Very high | 95.6 | Very high | 84 Ų | 84 | 82 Ų | 82 | 32% | 0.317 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64 | -47.8 | 177.8 | -174.4 | 67.7 | -167.7 | 178.3 | 5.1 | 111.1 | E108 F111 W139 F140 Q141 A145 K146 F147 | E108-R143 IonicContact OE1-NH1 3.57Å; F111-R143 HydrophobicContact CD1-CG 4.05Å; F111-R143 HydrophobicContact CD2-CB 4.25Å; F111-R143 HydrophobicContact CD2-CG 3.56Å; F111-R143 HydrophobicContact CE1-CG 3.92Å; F111-R143 HydrophobicContact CE2-CB 4.03Å; F111-R143 HydrophobicContact CE2-CG 3.42Å; F111-R143 VanDerWaalsContact CE2-CG 3.42Å; F111-R143 HydrophobicContact CG-CG 3.88Å; F111-R143 HydrophobicContact CZ-CG 3.61Å; W139-R143 HydrophobicContact CE3-CB 4.03Å; W139-R143 HydrophobicContact CH2-CB 4.11Å; W139-R143 HydrophobicContact CH2-CG 3.8Å; W139-R143 HydrophobicContact CZ2-CG 4.47Å; W139-R143 HydrophobicContact CZ3-CB 3.81Å; W139-R143 HydrophobicContact CZ3-CG 3.84Å; W139-R143 WeakPolarHBondContact O-CB 3.47Å; W139-R143 PolarHBondContact O-N 3.42Å; F140-R143 PolarHBondContact O-N 2.97Å; Q141-R143 VanDerWaalsContact C-N 3.33Å; Q141-R143 PolarHBondContact O-N 3.39Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 3.14Å; R143-K146 PolarHBondContact O-N 3.12Å; R143-F147 PolarHBondContact O-N 3.34Å |
| 144 | R | 97.9 | Very high | 94.7 | Very high | 48 Ų | 48 | 82.8 Ų | 82.8 | 18% | 0.181 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.4 | -36.4 | 174.3 | -72.1 | -166 | -63.2 | -92.6 | 4.4 | 113 | F111 H115 F140 Q141 F147 R148 | F111-R144 HydrophobicContact CE2-CG 3.86Å; F111-R144 HydrophobicContact CZ-CG 4.43Å; H115-R144 HydrophobicContact CB-CG 4.45Å; H115-R144 VanDerWaalsContact O-CD 3.27Å; H115-R144 WeakPolarHBondContact O-CD 3.36Å; H115-R144 PolarHBondContact O-NH1 3.37Å; F140-R144 WeakPolarHBondContact O-CB 3.34Å; F140-R144 WeakPolarHBondContact O-CG 3.47Å; F140-R144 PolarHBondContact O-N 3.33Å; Q141-R144 PolarHBondContact O-N 2.95Å; R144-F147 PolarHBondContact O-N 3.39Å; R144-R148 WeakPolarHBondContact O-CG 3.37Å; R144-R148 PolarHBondContact O-N 3.28Å |
| 145 | A | 97.8 | Very high | 93.6 | Very high | 46 Ų | 46 | 87 Ų | 87 | 38% | 0.38 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q141 N142 R143 K149 | Q141-A145 WeakPolarHBondContact O-CB 3.45Å; Q141-A145 PolarHBondContact O-N 3.07Å; N142-A145 PolarHBondContact O-N 3.13Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 3.14Å; A145-K149 PolarHBondContact O-N 2.99Å; A145-K149 VanDerWaalsContact O-N 3.12Å |
| 146 | K | 96.9 | Very high | 92.5 | Very high | 146 Ų | 146 | 85.3 Ų | 85.3 | 64% | 0.635 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -63.5 | -44.3 | 174.3 | -74.1 | -176.4 | 177.4 | -175.8 | 0 | 112.2 | N142 R143 R148 K149 Q150 | N142-K146 PolarHBondContact O-N 3.24Å; R143-K146 PolarHBondContact O-N 3.12Å; K146-R148 PolarHBondContact O-N 2.85Å; K146-K149 WeakPolarHBondContact O-CB 3.34Å; K146-K149 PolarHBondContact O-N 3.24Å; K146-K149 VanDerWaalsContact O-N 3.14Å; K146-Q150 PolarHBondContact O-N 3.46Å |
| 147 | F | 96.1 | Very high | 91 | Very high | 71 Ų | 71 | 93.1 Ų | 93.1 | 31% | 0.311 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -56.3 | -52.6 | 178.5 | -176.3 | -94.1 | 0 | 0 | 0 | 111.7 | F111 R143 R144 K149 Q150 E151 | F111-F147 HydrophobicContact CE1-CD2 4.42Å; F111-F147 HydrophobicContact CZ-CB 4.34Å; R143-F147 PolarHBondContact O-N 3.34Å; R144-F147 PolarHBondContact O-N 3.39Å; F147-K149 VanDerWaalsContact C-N 3.27Å; F147-K149 PolarHBondContact O-N 3.09Å; F147-Q150 WeakPolarHBondContact O-CB 3.42Å; F147-Q150 PolarHBondContact O-N 3.41Å; F147-E151 VanDerWaalsContact CE1-CD 3.43Å; F147-E151 HydrophobicContact CE1-CG 4.24Å; F147-E151 WeakPolarHBondContact CE1-OE1 3.41Å; F147-E151 HydrophobicContact CZ-CG 4.48Å; F147-E151 WeakPolarHBondContact CZ-OE1 3.21Å; F147-E151 PolarHBondContact O-N 3.02Å; F147-E151 VanDerWaalsContact O-N 3.14Å |
| 148 | R | 96.3 | Very high | 89.3 | Confident | 138 Ų | 138 | 92.7 Ų | 92.7 | 52% | 0.521 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.9 | -33.4 | 176.3 | -69.3 | -173 | -65.8 | 160.6 | -1.9 | 113.3 | R144 K146 R152 | R144-R148 WeakPolarHBondContact O-CG 3.37Å; R144-R148 PolarHBondContact O-N 3.28Å; K146-R148 PolarHBondContact O-N 2.85Å; R148-R152 WeakPolarHBondContact O-CG 3.5Å; R148-R152 PolarHBondContact O-N 3.43Å |
| 149 | K | 94.6 | Very high | 87.2 | Confident | 160 Ų | 160 | 96.3 Ų | 96.3 | 70% | 0.696 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -68.3 | -38 | 175.8 | -173.5 | 176.7 | 179.9 | 179.8 | 0 | 111.4 | A145 K146 F147 A153 | A145-K149 PolarHBondContact O-N 2.99Å; A145-K149 VanDerWaalsContact O-N 3.12Å; K146-K149 WeakPolarHBondContact O-CB 3.34Å; K146-K149 PolarHBondContact O-N 3.24Å; K146-K149 VanDerWaalsContact O-N 3.14Å; F147-K149 VanDerWaalsContact C-N 3.27Å; F147-K149 PolarHBondContact O-N 3.09Å; K149-A153 PolarHBondContact O-N 3.22Å; K149-A153 VanDerWaalsContact O-N 3.12Å |
| 150 | Q | 91.8 | Very high | 85.3 | Confident | 140 Ų | 140 | 99.2 Ų | 99.2 | 65% | 0.654 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68 | -42.7 | -179.6 | -169.4 | 170.6 | 12.7 | 0 | 0 | 111.8 | K146 F147 R152 A153 A154 | K146-Q150 PolarHBondContact O-N 3.46Å; F147-Q150 WeakPolarHBondContact O-CB 3.42Å; F147-Q150 PolarHBondContact O-N 3.41Å; Q150-R152 PolarHBondContact O-N 3Å; Q150-A153 PolarHBondContact O-N 3.4Å; Q150-A154 PolarHBondContact O-N 3Å |
| 151 | E | 87.4 | Confident | 83.1 | Confident | 106 Ų | 106 | 104.2 Ų | 104.2 | 50% | 0.495 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.6 | -44 | 175.2 | -70.1 | 179.9 | 147.7 | 0 | 0 | 112.2 | F147 A153 A154 N155 | F147-E151 VanDerWaalsContact CE1-CD 3.43Å; F147-E151 HydrophobicContact CE1-CG 4.24Å; F147-E151 WeakPolarHBondContact CE1-OE1 3.41Å; F147-E151 HydrophobicContact CZ-CG 4.48Å; F147-E151 WeakPolarHBondContact CZ-OE1 3.21Å; F147-E151 PolarHBondContact O-N 3.02Å; F147-E151 VanDerWaalsContact O-N 3.14Å; E151-A153 VanDerWaalsContact C-N 3.32Å; E151-A153 PolarHBondContact O-N 3.29Å; E151-A154 PolarHBondContact O-N 3.39Å; E151-N155 PolarHBondContact O-N 3.13Å |
| 152 | R | 85.4 | Confident | 80.7 | Confident | 189 Ų | 189 | 104 Ų | 104 | 71% | 0.713 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.9 | -38.2 | 177.2 | -71 | 175.9 | -177 | -155.2 | -2.2 | 112.7 | R148 Q150 A156 | R148-R152 WeakPolarHBondContact O-CG 3.5Å; R148-R152 PolarHBondContact O-N 3.43Å; Q150-R152 PolarHBondContact O-N 3Å; R152-A156 WeakPolarHBondContact O-CB 3.48Å; R152-A156 PolarHBondContact O-N 3.03Å |
| 153 | A | 83.1 | Confident | 78 | Confident | 56 Ų | 56 | 102.2 Ų | 102.2 | 46% | 0.463 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -70.5 | -33.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K149 Q150 E151 K157 | K149-A153 PolarHBondContact O-N 3.22Å; K149-A153 VanDerWaalsContact O-N 3.12Å; Q150-A153 PolarHBondContact O-N 3.4Å; E151-A153 VanDerWaalsContact C-N 3.32Å; E151-A153 PolarHBondContact O-N 3.29Å; A153-K157 PolarHBondContact O-N 3.21Å |
| 154 | A | 80.6 | Confident | 75.5 | Confident | 63 Ų | 63 | 105.7 Ų | 105.7 | 52% | 0.521 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -66.7 | -46.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q150 E151 A156 K157 A158 | Q150-A154 PolarHBondContact O-N 3Å; E151-A154 PolarHBondContact O-N 3.39Å; A154-A156 PolarHBondContact O-N 3.01Å; A154-K157 PolarHBondContact O-N 3.18Å; A154-A158 PolarHBondContact O-N 3.27Å; A154-A158 VanDerWaalsContact O-N 3.14Å |
| 155 | N | 73.9 | Confident | 73 | Confident | 127 Ų | 127 | 109.3 Ų | 109.3 | 68% | 0.679 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.6 | -36.8 | 176.2 | -103.5 | 36.7 | 0 | 0 | 0 | 113.1 | E151 K157 A158 N159 | E151-N155 PolarHBondContact O-N 3.13Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.27Å; N155-A158 PolarHBondContact O-N 3.12Å; N155-N159 PolarHBondContact O-N 3.47Å; N155-N159 VanDerWaalsContact O-N 3.12Å |
| 156 | A | 75.6 | Confident | 70.4 | Confident | 56 Ų | 56 | 110.3 Ų | 110.3 | 46% | 0.463 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -65.5 | -33.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | R152 A154 S160 | R152-A156 WeakPolarHBondContact O-CB 3.48Å; R152-A156 PolarHBondContact O-N 3.03Å; A154-A156 PolarHBondContact O-N 3.01Å; A156-S160 WeakPolarHBondContact O-CB 3.46Å; A156-S160 PolarHBondContact O-N 3.21Å; A156-S160 PolarHBondContact O-OG 3.19Å |
| 157 | K | 65.8 | Low | 67.8 | Low | 164 Ų | 164 | 109.3 Ų | 109.3 | 71% | 0.713 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -72.3 | -37.7 | 174.4 | -78.8 | -169.7 | 176.5 | -173.9 | 0 | 112.7 | A153 A154 N155 N159 S160 S161 | A153-K157 PolarHBondContact O-N 3.21Å; A154-K157 PolarHBondContact O-N 3.18Å; N155-K157 VanDerWaalsContact C-N 3.31Å; N155-K157 PolarHBondContact O-N 3.27Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 3.44Å; K157-S160 PolarHBondContact O-N 3Å; K157-S161 PolarHBondContact O-OG 3.4Å |
| 158 | A | 61.7 | Low | 65.5 | Low | 71 Ų | 71 | 113.9 Ų | 113.9 | 59% | 0.587 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -63.6 | -38.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | A154 N155 S160 | A154-A158 PolarHBondContact O-N 3.27Å; A154-A158 VanDerWaalsContact O-N 3.14Å; N155-A158 PolarHBondContact O-N 3.12Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 3.33Å |
| 159 | N | 56.1 | Low | 62.8 | Low | 143 Ų | 143 | 112.8 Ų | 112.8 | 77% | 0.765 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -6.2 | 178.6 | -133.4 | 58.6 | 0 | 0 | 0 | 114.6 | N155 K157 | N155-N159 PolarHBondContact O-N 3.47Å; N155-N159 VanDerWaalsContact O-N 3.12Å; K157-N159 VanDerWaalsContact C-N 3.33Å; K157-N159 PolarHBondContact O-N 3.44Å |
| 160 | S | 56.7 | Low | 60.2 | Low | 84 Ų | 84 | 111.3 Ų | 111.3 | 59% | 0.587 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -3.4 | 179.2 | -55.6 | 0 | 0 | 0 | 0 | 113.1 | A156 K157 A158 G162 | A156-S160 WeakPolarHBondContact O-CB 3.46Å; A156-S160 PolarHBondContact O-N 3.21Å; A156-S160 PolarHBondContact O-OG 3.19Å; K157-S160 PolarHBondContact O-N 3Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 3.33Å; S160-G162 PolarHBondContact O-N 3.29Å |
| 161 | S | 52.7 | Low | 57.5 | Low | 108 Ų | 108 | 110.1 Ų | 110.1 | 76% | 0.755 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | 6.5 | 178.2 | -59.4 | 0 | 0 | 0 | 0 | 114.2 | K157 | K157-S161 PolarHBondContact O-OG 3.4Š|
| 162 | G | 48.4 | Very low | 55.1 | Low | 84 Ų | 84 | 111.1 Ų | 111.1 | 87% | 0.866 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | 2.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | S160 | S160-G162 PolarHBondContact O-N 3.29Š|
| 163 | G | 41.3 | Very low | 53 | Low | 62 Ų | 62 | 108 Ų | 108 | 64% | 0.639 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -136.7 | 109.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 164 | N | 45.8 | Very low | 50.6 | Low | 157 Ų | 157 | 109.3 Ų | 109.3 | 84% | 0.84 | 75% | 0.75 | S | S | * | * | trans | -65.7 | 153.2 | -179.7 | -170.3 | 41.7 | 0 | 0 | 0 | 113.2 | ||||
| 165 | T | 44.6 | Very low | 48.6 | Very low | 125 Ų | 125 | 109.8 Ų | 109.8 | 77% | 0.767 | 76% | 0.761 | S | S | * | * | trans | 102.1 | 103.1 | 156.4 | -18.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 166 | G | 43.3 | Very low | 46.9 | Very low | 66 Ų | 66 | 113 Ų | 113 | 68% | 0.68 | 77% | 0.769 | S | S | * | * | 102.8 | 96.6 | 125.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 167 | S | 42.4 | Very low | 45.2 | Very low | 126 Ų | 126 | 120 Ų | 120 | 88% | 0.881 | 79% | 0.789 | S | S | * | * | 170.6 | 129.2 | 116.7 | 44.2 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 168 | N | 47.1 | Very low | 43.6 | Very low | 167 Ų | 167 | 116 Ų | 116 | 89% | 0.893 | 80% | 0.795 | S | S | * | * | trans | 1.5 | 121.7 | 167.5 | -75.1 | 1.4 | 0 | 0 | 0 | 120.8 | ||||
| 169 | S | 41.4 | Very low | 42.3 | Very low | 115 Ų | 115 | 116.2 Ų | 116.2 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -137.4 | 128.1 | 134.4 | 54.3 | 0 | 0 | 0 | 0 | 110.2 | S171 | S169-S171 PolarHBondContact O-N 3.2Š| ||
| 170 | S | 38.3 | Very low | 41.4 | Very low | 128 Ų | 128 | 118 Ų | 118 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | -59 | 121.9 | -177.6 | 47.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 171 | S | 36 | Very low | 40.6 | Very low | 115 Ų | 115 | 119.8 Ų | 119.8 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -115 | 119.2 | 163.1 | 49.1 | 0 | 0 | 0 | 0 | 109.2 | S169 | S169-S171 PolarHBondContact O-N 3.2Š| ||
| 172 | S | 37.8 | Very low | 40 | Very low | 127 Ų | 127 | 125.7 Ų | 125.7 | 89% | 0.888 | 82% | 0.821 | S | S | * | * | trans | -76.3 | 127.2 | 171.1 | 50.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 173 | S | 39.7 | Very low | 39.5 | Very low | 124 Ų | 124 | 127.2 Ų | 127.2 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | -88.3 | 150.4 | -177.9 | 47.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 174 | G | 34 | Very low | 39.4 | Very low | 83 Ų | 83 | 129.5 Ų | 129.5 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | trans | 155.4 | 115.9 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 175 | G | 37.2 | Very low | 39 | Very low | 73 Ų | 73 | 127.4 Ų | 127.4 | 75% | 0.753 | 82% | 0.822 | S | S | * | * | cis | 143.8 | 117.7 | 4.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 176 | K | 39.7 | Very low | 39 | Very low | 195 Ų | 195 | 127.9 Ų | 127.9 | 85% | 0.848 | 82% | 0.82 | S | S | * | * | trans | 115.3 | 121.5 | 148 | -70.6 | 177.7 | 168.6 | 173.8 | 0 | 120 | ||||
| 177 | K | 38.4 | Very low | 39.1 | Very low | 202 Ų | 202 | 132.1 Ų | 132.1 | 88% | 0.878 | 83% | 0.827 | S | S | * | * | trans | 56.9 | 138.5 | 135.1 | -65.4 | -173.4 | 172.6 | -170.7 | 0 | 118.2 | ||||
| 178 | G | 33.4 | Very low | 39.3 | Very low | 81 Ų | 81 | 133.4 Ų | 133.4 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | cis | 156.8 | 156.1 | 8.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 179 | G | 34.2 | Very low | 38.9 | Very low | 75 Ų | 75 | 133.1 Ų | 133.1 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | trans | 117.4 | 91.2 | 162.4 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 180 | E | 36.9 | Very low | 39 | Very low | 180 Ų | 180 | 132.1 Ų | 132.1 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | trans | 30.8 | 121.8 | 130.7 | -52.6 | 179.4 | 119.8 | 0 | 0 | 123.3 | ||||
| 181 | T | 40.2 | Very low | 39.5 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | 65.3 | 135.1 | 137.1 | 64.7 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 182 | R | 39.1 | Very low | 39.8 | Very low | 231 Ų | 231 | 138.2 Ų | 138.2 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | trans | 80.7 | 116 | 143.2 | 83.7 | -171.9 | 171.4 | 173.4 | -1.1 | 122.4 | ||||
| 183 | S | 37.6 | Very low | 40.1 | Very low | 116 Ų | 116 | 137.8 Ų | 137.8 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | 40.1 | 129.6 | 131.4 | -66.4 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 184 | S | 40.3 | Very low | 39.9 | Very low | 110 Ų | 110 | 137.5 Ų | 137.5 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | 65 | 116.8 | 128.1 | -170.4 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 185 | S | 37.3 | Very low | 39.9 | Very low | 114 Ų | 114 | 138.6 Ų | 138.6 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | 169.8 | 154.3 | 113.5 | 47 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 186 | D | 45.1 | Very low | 39.9 | Very low | 135 Ų | 135 | 140.5 Ų | 140.5 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | trans | -72.4 | 173.6 | -172.7 | -57.9 | -93.2 | 0 | 0 | 0 | 115.7 | ||||
| 187 | D | 44.4 | Very low | 40.6 | Very low | 155 Ų | 155 | 136.8 Ų | 136.8 | 83% | 0.829 | 79% | 0.79 | S | S | * | * | trans | 76.6 | 127.6 | 153.2 | -54.2 | -52 | 0 | 0 | 0 | 120.8 | ||||
| 188 | D | 46.1 | Very low | 41 | Very low | 153 Ų | 153 | 133.3 Ų | 133.3 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | 158.5 | 100.6 | 114.4 | -157.7 | -118.9 | 0 | 0 | 0 | 113.2 | |||||
| 189 | E | 40.2 | Very low | 42 | Very low | 161 Ų | 161 | 135.5 Ų | 135.5 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | 16 | 130.9 | 135.1 | -159.1 | 126.5 | 85.5 | 0 | 0 | 122.5 | ||||
| 190 | S | 42.2 | Very low | 42.2 | Very low | 94 Ų | 94 | 138.5 Ų | 138.5 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | trans | 71.2 | 138.8 | 152.7 | 65.5 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 191 | K | 50.2 | Low | 42.2 | Very low | 196 Ų | 196 | 135.1 Ų | 135.1 | 85% | 0.852 | 78% | 0.78 | S | S | * | * | -159.4 | 145.1 | 59.2 | -40 | -165 | 178 | 173.5 | 0 | 112.6 | |||||
| 192 | E | 41.8 | Very low | 42.1 | Very low | 174 Ų | 174 | 135 Ų | 135 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | -51.7 | 143.1 | 165 | 166.2 | -178.4 | 78.3 | 0 | 0 | 114.5 | ||||
| 193 | S | 44.8 | Very low | 42 | Very low | 118 Ų | 118 | 127.8 Ų | 127.8 | 83% | 0.825 | 77% | 0.769 | S | S | * | * | trans | -161.5 | 88.5 | 154 | -74.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 194 | T | 34 | Very low | 42 | Very low | 118 Ų | 118 | 127.9 Ų | 127.9 | 72% | 0.724 | 77% | 0.77 | S | S | * | * | 33.1 | 116.9 | 128.2 | -72.6 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 195 | C | 34.2 | Very low | 42.1 | Very low | 107 Ų | 107 | 130.6 Ų | 130.6 | 72% | 0.723 | 78% | 0.775 | S | S | * | * | trans | 61.3 | 113.5 | 134.8 | -64.2 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 196 | S | 37.2 | Very low | 42.6 | Very low | 113 Ų | 113 | 131.2 Ų | 131.2 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | 50.8 | 164.1 | 115.9 | -56.1 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 197 | P | 55.6 | Low | 42.1 | Very low | 117 Ų | 117 | 128 Ų | 128 | 76% | 0.76 | 77% | 0.774 | S | S | * | * | cis | -130.9 | -178.1 | -17.3 | 28.1 | -4.5 | 0 | 0 | 0 | 113.6 | ||||
| 198 | T | 47.3 | Very low | 41.6 | Very low | 128 Ų | 128 | 126.3 Ų | 126.3 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | -61.9 | 165.4 | 161.7 | 48.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 199 | P | 53.9 | Low | 41.2 | Very low | 127 Ų | 127 | 123 Ų | 123 | 83% | 0.825 | 77% | 0.769 | S | S | * | * | -142.5 | 156 | 107.6 | 35.2 | -19.8 | 0 | 0 | 0 | 116.4 | |||||
| 200 | D | 37.4 | Very low | 41.1 | Very low | 138 Ų | 138 | 123.6 Ų | 123.6 | 74% | 0.738 | 78% | 0.777 | S | S | * | * | trans | -60.1 | 153.5 | 168.5 | -167.8 | -81.5 | 0 | 0 | 0 | 113.5 | ||||
| 201 | S | 37.2 | Very low | 40.7 | Very low | 109 Ų | 109 | 122.4 Ų | 122.4 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | -175.9 | 107.6 | 140.1 | -87.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 202 | T | 38.6 | Very low | 40.1 | Very low | 121 Ų | 121 | 120 Ų | 120 | 74% | 0.742 | 78% | 0.776 | S | S | * | * | 43.3 | 133.1 | 122.9 | -152.5 | 0 | 0 | 0 | 0 | 123 | |||||
| 203 | A | 36.5 | Very low | 40.1 | Very low | 79 Ų | 79 | 119.3 Ų | 119.3 | 65% | 0.653 | 78% | 0.777 | S | S | * | * | trans | 64.2 | 117.8 | 143.7 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 204 | S | 37.7 | Very low | 39.7 | Very low | 119 Ų | 119 | 117 Ų | 117 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | 166.4 | 141 | 99.3 | -72 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 205 | L | 41.5 | Very low | 40.3 | Very low | 166 Ų | 166 | 117.4 Ų | 117.4 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | trans | -60 | 162.5 | 166.7 | -62.8 | 161.5 | 0 | 0 | 0 | 111.2 | ||||
| 206 | P | 49.1 | Very low | 40.9 | Very low | 128 Ų | 128 | 118.2 Ų | 118.2 | 83% | 0.831 | 78% | 0.784 | S | S | * | * | -131 | 143.1 | 103.1 | 35 | -28 | 0 | 0 | 0 | 113.5 | |||||
| 207 | G | 34 | Very low | 41 | Very low | 66 Ų | 66 | 116.7 Ų | 116.7 | 68% | 0.68 | 78% | 0.778 | S | S | * | * | trans | -88.7 | 146.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 208 | S | 34.5 | Very low | 40.2 | Very low | 121 Ų | 121 | 116.1 Ų | 116.1 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | trans | 179.3 | 104.5 | 143.1 | -81.4 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 209 | A | 36.6 | Very low | 39.8 | Very low | 84 Ų | 84 | 117.9 Ų | 117.9 | 69% | 0.694 | 78% | 0.781 | S | S | * | * | 73.9 | 97.4 | 90.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 210 | N | 38.7 | Very low | 39.1 | Very low | 172 Ų | 172 | 117.3 Ų | 117.3 | 92% | 0.92 | 78% | 0.78 | S | S | * | * | 166.3 | 143.1 | 119.6 | -89.4 | -18 | 0 | 0 | 0 | 113 | |||||
| 211 | G | 35 | Very low | 39.6 | Very low | 69 Ų | 69 | 116.2 Ų | 116.2 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | 96 | 82.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 212 | N | 37.5 | Very low | 39.6 | Very low | 145 Ų | 145 | 116.7 Ų | 116.7 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | 47.9 | 114.2 | 84.1 | -157.8 | 53.3 | 0 | 0 | 0 | 112.2 | |||||
| 213 | L | 41.1 | Very low | 40 | Very low | 160 Ų | 160 | 116.8 Ų | 116.8 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | 161.2 | 110.1 | 127.7 | -80 | 161 | 0 | 0 | 0 | 110.8 | |||||
| 214 | G | 36.7 | Very low | 40.2 | Very low | 70 Ų | 70 | 117.5 Ų | 117.5 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | trans | 47.2 | 101 | 136.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | P216 | G214-P216 WeakPolarHBondContact O-CD 3.48Š| ||
| 215 | S | 45.5 | Very low | 40.7 | Very low | 126 Ų | 126 | 117.7 Ų | 117.7 | 88% | 0.881 | 79% | 0.79 | S | S | * | * | trans | -62.7 | 143 | 144.2 | -52.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 216 | P | 47.7 | Very low | 40.6 | Very low | 124 Ų | 124 | 116.6 Ų | 116.6 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -118.2 | 130 | 135.6 | 32.2 | -26.9 | 0 | 0 | 0 | 110.5 | G214 | G214-P216 WeakPolarHBondContact O-CD 3.48Š| ||
| 217 | A | 39.9 | Very low | 40 | Very low | 82 Ų | 82 | 117.6 Ų | 117.6 | 68% | 0.678 | 79% | 0.789 | S | S | * | * | trans | -66.6 | 162.5 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 218 | S | 37.7 | Very low | 39.9 | Very low | 104 Ų | 104 | 119.6 Ų | 119.6 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | trans | 79.9 | 145.6 | 143.7 | 79.6 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 219 | L | 40 | Very low | 39.9 | Very low | 165 Ų | 165 | 116.9 Ų | 116.9 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | cis | -155.9 | 158.5 | 25 | -71.9 | 161.6 | 0 | 0 | 0 | 110.3 | ||||
| 220 | S | 38.3 | Very low | 40.2 | Very low | 115 Ų | 115 | 124.2 Ų | 124.2 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -104.6 | 141.1 | 159.3 | -164.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 221 | P | 47.8 | Very low | 40.1 | Very low | 116 Ų | 116 | 122.5 Ų | 122.5 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | -95.5 | 141.6 | 176 | 34.5 | -28.1 | 0 | 0 | 0 | 111.5 | ||||
| 222 | S | 37.3 | Very low | 40.1 | Very low | 118 Ų | 118 | 127 Ų | 127 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -147.1 | 146.9 | 152.9 | -91.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 223 | P | 46.9 | Very low | 39.9 | Very low | 124 Ų | 124 | 123.6 Ų | 123.6 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -86 | 153.7 | -163.2 | 34.2 | -35.8 | 0 | 0 | 0 | 113.5 | ||
| 224 | A | 41.2 | Very low | 39.7 | Very low | 93 Ų | 93 | 121.3 Ų | 121.3 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 147.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 225 | P | 48.3 | Very low | 39.7 | Very low | 123 Ų | 123 | 123.5 Ų | 123.5 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 140.8 | 160.3 | 31.7 | -28.4 | 0 | 0 | 0 | 111.7 | ||
| 226 | T | 38.9 | Very low | 39.4 | Very low | 143 Ų | 143 | 123 Ų | 123 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 131.8 | 168.6 | 31.8 | 0 | 0 | 0 | 0 | 112.6 | ||
| 227 | N | 35.8 | Very low | 39.4 | Very low | 149 Ų | 149 | 122.7 Ų | 122.7 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | -166.9 | 128 | 133.9 | -154.8 | 10.2 | 0 | 0 | 0 | 110.8 | ||||
| 228 | S | 32.4 | Very low | 39.3 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | 169.9 | 117.8 | 120.8 | -72.1 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 229 | G | 34.7 | Very low | 39.7 | Very low | 65 Ų | 65 | 127.9 Ų | 127.9 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 166.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 230 | Y | 42.4 | Very low | 39.7 | Very low | 237 Ų | 237 | 128.8 Ų | 128.8 | 93% | 0.929 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 152.6 | -164.6 | -58.7 | -93.3 | 0 | 0 | 0 | 114.9 | ||
| 231 | T | 37.9 | Very low | 39.8 | Very low | 136 Ų | 136 | 127.1 Ų | 127.1 | 83% | 0.834 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 133.5 | 170.4 | 51.2 | 0 | 0 | 0 | 0 | 111.9 | ||
| 232 | N | 34.3 | Very low | 39.2 | Very low | 164 Ų | 164 | 130 Ų | 130 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | 163 | 148.4 | 132.1 | -124.8 | -7.6 | 0 | 0 | 0 | 108 | ||||
| 233 | A | 33 | Very low | 39.5 | Very low | 73 Ų | 73 | 133.6 Ų | 133.6 | 60% | 0.603 | 81% | 0.809 | S | S | * | * | cis | -163.1 | 169.1 | 6.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 234 | S | 36.9 | Very low | 39.4 | Very low | 112 Ų | 112 | 132.9 Ų | 132.9 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | 84 | 130 | 149.1 | 63.6 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 235 | S | 36.3 | Very low | 39.6 | Very low | 117 Ų | 117 | 134.6 Ų | 134.6 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | 97.6 | 102 | 156.3 | -34 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 236 | S | 40.9 | Very low | 39 | Very low | 115 Ų | 115 | 134 Ų | 134 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -60.4 | 161.2 | 153.8 | -57.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 237 | P | 47.6 | Very low | 39 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 77% | 0.766 | 81% | 0.81 | S | S | * | * | cis | -145.2 | -172.9 | 32.4 | 34.1 | -9.2 | 0 | 0 | 0 | 116.5 | ||||
| 238 | V | 37.6 | Very low | 39.1 | Very low | 129 Ų | 129 | 138.2 Ų | 138.2 | 78% | 0.782 | 81% | 0.814 | S | S | * | * | trans | 98.3 | 113.5 | 160.3 | -176.4 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 239 | L | 44.6 | Very low | 39.3 | Very low | 166 Ų | 166 | 138.5 Ų | 138.5 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | trans | -68.5 | 131.4 | 169.3 | -68.1 | 168.7 | 0 | 0 | 0 | 110.8 | ||||
| 240 | Q | 40 | Very low | 39.6 | Very low | 184 Ų | 184 | 144 Ų | 144 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | trans | -159.7 | 121.1 | 146.7 | -106.9 | 163 | 30.8 | 0 | 0 | 110 | ||||
| 241 | G | 41.7 | Very low | 39.2 | Very low | 80 Ų | 80 | 135.8 Ų | 135.8 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -72.6 | 142.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 242 | L | 35.3 | Very low | 39.7 | Very low | 177 Ų | 177 | 135.3 Ų | 135.3 | 93% | 0.927 | 82% | 0.816 | S | S | * | * | trans | -115.5 | 138.8 | 171.8 | -71.2 | 174.9 | 0 | 0 | 0 | 111.2 | ||||
| 243 | K | 42.8 | Very low | 39.9 | Very low | 193 Ų | 193 | 133 Ų | 133 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 148.9 | -167.4 | 177.5 | 160.5 | 172.3 | 161.9 | 0 | 110.8 | ||
| 244 | P | 45.4 | Very low | 40.3 | Very low | 109 Ų | 109 | 137 Ų | 137 | 71% | 0.708 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -74 | 161.6 | 170.5 | 29.6 | -33.7 | 0 | 0 | 0 | 112.7 | ||
| 245 | P | 44.2 | Very low | 40.9 | Very low | 128 Ų | 128 | 137.2 Ų | 137.2 | 83% | 0.831 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 145.3 | -156.1 | 28.9 | -34.8 | 0 | 0 | 0 | 114.4 | ||
| 246 | S | 37.4 | Very low | 40.9 | Very low | 110 Ų | 110 | 136 Ų | 136 | 77% | 0.769 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 128.2 | 177.6 | 60.8 | 0 | 0 | 0 | 0 | 112 | ||
| 247 | W | 37.7 | Very low | 40.6 | Very low | 255 Ų | 255 | 137.2 Ų | 137.2 | 97% | 0.966 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 130.8 | 153.7 | -70.8 | -47.8 | 0 | 0 | 0 | 109.5 | S249 | W247-S249 PolarHBondContact O-N 3.47Å; W247-S249 VanDerWaalsContact O-N 3.15Å |
| 248 | S | 37.2 | Very low | 40 | Very low | 126 Ų | 126 | 136.1 Ų | 136.1 | 88% | 0.881 | 82% | 0.823 | S | S | * | * | trans | -61.8 | 109.5 | 173.6 | -51.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 249 | S | 38.4 | Very low | 39.8 | Very low | 114 Ų | 114 | 138.8 Ų | 138.8 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | trans | -115 | 114.8 | 167.1 | -163.1 | 0 | 0 | 0 | 0 | 107.3 | W247 G251 | W247-S249 PolarHBondContact O-N 3.47Å; W247-S249 VanDerWaalsContact O-N 3.15Å; S249-G251 PolarHBondContact O-N 3.34Å | ||
| 250 | L | 39.5 | Very low | 40 | Very low | 182 Ų | 182 | 136.1 Ų | 136.1 | 95% | 0.953 | 82% | 0.819 | S | S | * | * | trans | -68.8 | 105.3 | 170.1 | -69.5 | 165.5 | 0 | 0 | 0 | 107.4 | ||||
| 251 | G | 34 | Very low | 39.8 | Very low | 63 Ų | 63 | 132 Ų | 132 | 65% | 0.649 | 82% | 0.817 | S | S | * | * | trans | -112.7 | 130.3 | 169 | 0 | 0 | 0 | 0 | 0 | 109.5 | S249 | S249-G251 PolarHBondContact O-N 3.34Š| ||
| 252 | P | 49.3 | Very low | 39.8 | Very low | 127 Ų | 127 | 132.5 Ų | 132.5 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -76.9 | 140.2 | 178.2 | 30.8 | -30.7 | 0 | 0 | 0 | 110.7 | ||||
| 253 | S | 38.6 | Very low | 40.2 | Very low | 114 Ų | 114 | 132.7 Ų | 132.7 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -62.2 | 135.8 | 168.8 | 49.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 254 | N | 41.4 | Very low | 40.4 | Very low | 157 Ų | 157 | 130.2 Ų | 130.2 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | trans | -124.1 | 144 | 163.1 | -132.3 | 16.2 | 0 | 0 | 0 | 108.4 | ||||
| 255 | P | 48.9 | Very low | 40.7 | Very low | 118 Ų | 118 | 133.2 Ų | 133.2 | 77% | 0.766 | 82% | 0.815 | S | S | * | * | trans | -132.5 | 134.7 | 131.9 | 33.7 | -21.2 | 0 | 0 | 0 | 112.9 | ||||
| 256 | A | 35.7 | Very low | 40.8 | Very low | 91 Ų | 91 | 134.7 Ų | 134.7 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | 38.5 | 117.9 | 147.5 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 257 | V | 35 | Very low | 41.3 | Very low | 140 Ų | 140 | 137.3 Ų | 137.3 | 85% | 0.848 | 81% | 0.814 | S | S | * | * | -175.9 | 132.9 | 127.4 | 145.1 | 0 | 0 | 0 | 0 | 110 | |||||
| 258 | A | 35.3 | Very low | 41.9 | Very low | 96 Ų | 96 | 133.5 Ų | 133.5 | 79% | 0.793 | 81% | 0.812 | S | S | * | * | trans | 47.2 | 136.4 | 154.9 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 259 | Q | 33.6 | Very low | 42.5 | Very low | 184 Ų | 184 | 135.2 Ų | 135.2 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -63.5 | -177.7 | 165.1 | -64.2 | -170.4 | -15.2 | 0 | 0 | 113.5 | ||||
| 260 | P | 49.2 | Very low | 42.8 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 71% | 0.714 | 80% | 0.804 | S | S | * | * | cis | -134 | 176.5 | -13.1 | 21.3 | 3.9 | 0 | 0 | 0 | 115.3 | ||||
| 261 | A | 35.5 | Very low | 43.2 | Very low | 98 Ų | 98 | 138 Ų | 138 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | 79.6 | 136 | 146.1 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 262 | A | 41.1 | Very low | 43.9 | Very low | 90 Ų | 90 | 143.2 Ų | 143.2 | 74% | 0.744 | 81% | 0.812 | S | S | * | * | trans | 77.7 | 112.1 | 156 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 263 | Q | 43.5 | Very low | 43.7 | Very low | 181 Ų | 181 | 143.2 Ų | 143.2 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | 154 | 93 | 120.8 | -81.4 | 175.9 | 5.1 | 0 | 0 | 111.4 | Q265 | Q263-Q265 PolarHBondContact O-N 3.12Š| |||
| 264 | T | 46.7 | Very low | 44 | Very low | 141 Ų | 141 | 142.5 Ų | 142.5 | 87% | 0.865 | 81% | 0.813 | S | S | * | * | trans | -86 | 34.4 | 171.9 | 17.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 265 | Q | 51.6 | Low | 44.3 | Very low | 173 Ų | 173 | 142.1 Ų | 142.1 | 81% | 0.808 | 81% | 0.811 | S | S | * | * | trans | -138.5 | 61 | -173.6 | -69.2 | -71.3 | -17.6 | 0 | 0 | 111.9 | Q263 | Q263-Q265 PolarHBondContact O-N 3.12Š| ||
| 266 | E | 47.7 | Very low | 44.2 | Very low | 158 Ų | 158 | 142.1 Ų | 142.1 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -152.7 | 26.7 | 165.2 | -131.3 | -166.5 | 172.8 | 0 | 0 | 116.6 | ||||
| 267 | I | 47.6 | Very low | 44.8 | Very low | 165 Ų | 165 | 146.5 Ų | 146.5 | 85% | 0.846 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -97.3 | 10.9 | 176.4 | -35.9 | -178.5 | 0 | 0 | 0 | 112 | ||
| 268 | L | 49.7 | Very low | 45.7 | Very low | 175 Ų | 175 | 146.4 Ų | 146.4 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -116.1 | 19.4 | -177.2 | -122 | 83.5 | 0 | 0 | 0 | 115.1 | ||
| 269 | K | 50.4 | Low | 46.5 | Very low | 162 Ų | 162 | 144 Ų | 144 | 70% | 0.704 | 81% | 0.805 | S | S | * | * | trans | -117.4 | 4.6 | 178.5 | -92.9 | -176.6 | 177.9 | 177 | 0 | 116.3 | W271 | K269-W271 VanDerWaalsContact C-N 3.33Å; K269-W271 PolarHBondContact O-N 3.14Å | ||
| 270 | A | 45.1 | Very low | 47.7 | Very low | 97 Ų | 97 | 141.3 Ų | 141.3 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -86 | 12.3 | -176 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 271 | W | 47 | Very low | 47.9 | Very low | 259 Ų | 259 | 145.5 Ų | 145.5 | 98% | 0.981 | 81% | 0.811 | S | S | * | * | trans | -107.3 | 66.6 | 168.6 | -89.1 | 92.3 | 0 | 0 | 0 | 110.4 | K269 | K269-W271 VanDerWaalsContact C-N 3.33Å; K269-W271 PolarHBondContact O-N 3.14Å | ||
| 272 | Q | 48.4 | Very low | 48.7 | Very low | 172 Ų | 172 | 145.6 Ų | 145.6 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -112.2 | 131.1 | 158.8 | -71.3 | -155 | -8.8 | 0 | 0 | 109.2 | A274 | Q272-A274 PolarHBondContact O-N 2.68Š| ||
| 273 | P | 46.1 | Very low | 49.3 | Very low | 127 Ų | 127 | 144.5 Ų | 144.5 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 118.6 | 172.8 | 27.8 | -29.2 | 0 | 0 | 0 | 108.7 | ||
| 274 | A | 44.9 | Very low | 49.7 | Very low | 98 Ų | 98 | 142.4 Ų | 142.4 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 143 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q272 | Q272-A274 PolarHBondContact O-N 2.68Š|
| 275 | D | 46.4 | Very low | 49.9 | Very low | 150 Ų | 150 | 143.8 Ų | 143.8 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 143.6 | 177.8 | -68.9 | -78.3 | 0 | 0 | 0 | 114.7 | M277 | D275-M277 PolarHBondContact O-N 3.37Š|
| 276 | S | 47.5 | Very low | 49.5 | Very low | 117 Ų | 117 | 141.6 Ų | 141.6 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -51.2 | 101.7 | 172.1 | 39.8 | 0 | 0 | 0 | 0 | 112.8 | T278 | S276-T278 PolarHBondContact O-N 3.48Š| ||
| 277 | M | 48.8 | Very low | 49.6 | Very low | 184 Ų | 184 | 138.9 Ų | 138.9 | 91% | 0.906 | 81% | 0.811 | S | S | * | * | trans | -73.3 | 119.5 | 162.3 | -87.2 | -82.1 | 176.5 | 0 | 0 | 110 | D275 G279 | D275-M277 PolarHBondContact O-N 3.37Å; M277-G279 PolarHBondContact O-N 3.18Å | ||
| 278 | T | 53.5 | Low | 49.4 | Very low | 138 Ų | 138 | 141.1 Ų | 141.1 | 85% | 0.847 | 82% | 0.815 | S | S | * | * | trans | -58.5 | 104.6 | 172.5 | 35.3 | 0 | 0 | 0 | 0 | 112 | S276 | S276-T278 PolarHBondContact O-N 3.48Š| ||
| 279 | G | 51.8 | Low | 49.3 | Very low | 44 Ų | 44 | 141.6 Ų | 141.6 | 45% | 0.454 | 81% | 0.813 | S | S | . | * | trans | -98.4 | 155.4 | 163.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | M277 F281 A282 | M277-G279 PolarHBondContact O-N 3.18Å; G279-F281 PolarHBondContact O-N 3.39Å; G279-A282 PolarHBondContact O-N 3.33Å | ||
| 280 | P | 59.8 | Low | 49.2 | Very low | 128 Ų | 128 | 145.5 Ų | 145.5 | 83% | 0.831 | 82% | 0.823 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | 18.5 | -168.3 | 29.4 | -35.8 | 0 | 0 | 0 | 116.1 | ||
| 281 | F | 51.8 | Low | 49.5 | Very low | 199 Ų | 199 | 150.4 Ų | 150.4 | 87% | 0.873 | 83% | 0.826 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.6 | 15.1 | 179.6 | -72.1 | -79.3 | 0 | 0 | 0 | 114.2 | G279 G283 | G279-F281 PolarHBondContact O-N 3.39Å; F281-G283 VanDerWaalsContact C-N 3.31Å; F281-G283 PolarHBondContact O-N 3.27Å; F281-G283 VanDerWaalsContact O-N 3.07Å |
| 282 | A | 52.8 | Low | 49.8 | Very low | 100 Ų | 100 | 144 Ų | 144 | 83% | 0.826 | 82% | 0.818 | S | S | * | * | trans | -85.3 | 71.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111 | G279 | G279-A282 PolarHBondContact O-N 3.33Š| ||
| 283 | G | 53.2 | Low | 49.4 | Very low | 66 Ų | 66 | 143.5 Ų | 143.5 | 68% | 0.68 | 82% | 0.821 | S | S | * | * | trans | -139.7 | 21.8 | -168.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | F281 | F281-G283 VanDerWaalsContact C-N 3.31Å; F281-G283 PolarHBondContact O-N 3.27Å; F281-G283 VanDerWaalsContact O-N 3.07Å | ||
| 284 | V | 53.3 | Low | 49.8 | Very low | 138 Ų | 138 | 142.5 Ų | 142.5 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -151.7 | 97.2 | 165.8 | -178.3 | 0 | 0 | 0 | 0 | 108.4 | ||
| 285 | L | 51.1 | Low | 49.8 | Very low | 169 Ų | 169 | 142 Ų | 142 | 89% | 0.885 | 81% | 0.81 | S | S | * | * | trans | 169.4 | 75.6 | 147.9 | -89.5 | 170.9 | 0 | 0 | 0 | 108.6 | ||||
| 286 | S | 43 | Very low | 50 | Low | 127 Ų | 127 | 141.9 Ų | 141.9 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -161.2 | 88.9 | 160 | -100.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 287 | S | 48.8 | Very low | 50 | Low | 101 Ų | 101 | 144.6 Ų | 144.6 | 71% | 0.706 | 81% | 0.805 | S | S | * | * | trans | -163.9 | 79.3 | 149.2 | -160 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 288 | F | 43.6 | Very low | 50.8 | Low | 212 Ų | 212 | 141.8 Ų | 141.8 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | trans | -136.5 | 72.5 | 149.4 | -76.7 | -69.6 | 0 | 0 | 0 | 108.4 | R290 | F288-R290 PolarHBondContact O-N 3.38Š| ||
| 289 | H | 47.3 | Very low | 50.6 | Low | 186 Ų | 186 | 142.4 Ų | 142.4 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | trans | -61 | 110.7 | 157.6 | -98.3 | 48.2 | 0 | 0 | 0 | 108.3 | K291 | H289-K291 PolarHBondContact O-N 3.48Š| ||
| 290 | R | 49.4 | Very low | 50.5 | Low | 244 Ų | 244 | 147.8 Ų | 147.8 | 92% | 0.921 | 81% | 0.814 | S | S | * | * | trans | -68.2 | 113.6 | 163.1 | -75.4 | -173.9 | -170.1 | -137.2 | 2.1 | 108.2 | F288 | F288-R290 PolarHBondContact O-N 3.38Š| ||
| 291 | K | 50.7 | Low | 50.4 | Low | 200 Ų | 200 | 155.2 Ų | 155.2 | 87% | 0.87 | 83% | 0.834 | S | S | * | * | trans | -82.5 | 126.2 | 163 | -118.1 | 161.6 | 176.2 | 167.1 | 0 | 108.2 | H289 | H289-K291 PolarHBondContact O-N 3.48Š| ||
| 292 | P | 53.9 | Low | 50.3 | Low | 124 Ų | 124 | 153 Ų | 153 | 81% | 0.805 | 83% | 0.832 | S | S | * | * | trans | -82 | 131.7 | 160.2 | 32.1 | -26.3 | 0 | 0 | 0 | 107.9 | ||||
| 293 | N | 38.8 | Very low | 50.2 | Low | 161 Ų | 161 | 155.8 Ų | 155.8 | 86% | 0.861 | 83% | 0.832 | S | S | * | * | trans | -127.9 | 138.4 | 162.5 | -149.1 | 19.7 | 0 | 0 | 0 | 109 | ||||
| 294 | P | 54.7 | Low | 50 | Low | 107 Ų | 107 | 160.8 Ų | 160.8 | 70% | 0.695 | 84% | 0.84 | S | S | * | * | trans | -97.5 | 152.8 | -164.5 | 38.2 | -30.2 | 0 | 0 | 0 | 112.6 | ||||
| 295 | A | 46.3 | Very low | 49.8 | Very low | 86 Ų | 86 | 162.1 Ų | 162.1 | 71% | 0.711 | 84% | 0.841 | S | S | * | * | trans | 82.7 | 139.9 | 139.6 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 296 | I | 50.9 | Low | 49.7 | Very low | 148 Ų | 148 | 161.7 Ų | 161.7 | 76% | 0.759 | 84% | 0.838 | S | S | * | * | trans | 72.4 | 127.8 | 151.1 | -7.5 | -176.7 | 0 | 0 | 0 | 116.2 | ||||
| 297 | K | 47.5 | Very low | 50.2 | Low | 174 Ų | 174 | 164 Ų | 164 | 76% | 0.757 | 83% | 0.834 | S | S | * | * | cis | -152.8 | 140.4 | 33.8 | -75.6 | 166.5 | -179.9 | 177.7 | 0 | 112.8 | ||||
| 298 | T | 64.1 | Low | 50.3 | Low | 125 Ų | 125 | 168.5 Ų | 168.5 | 77% | 0.767 | 84% | 0.844 | S | S | * | * | trans | -60 | 136.4 | 152 | 49.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 299 | N | 49.6 | Very low | 50.8 | Low | 151 Ų | 151 | 165.2 Ų | 165.2 | 81% | 0.807 | 84% | 0.837 | S | S | * | * | trans | -145.6 | 102.7 | 147 | -86.5 | -58.5 | 0 | 0 | 0 | 108.1 | ||||
| 300 | L | 49.9 | Very low | 51.1 | Low | 157 Ų | 157 | 163.4 Ų | 163.4 | 82% | 0.822 | 84% | 0.835 | S | S | * | * | trans | -70.1 | 129 | 145.1 | -92.2 | 73 | 0 | 0 | 0 | 106.7 | ||||
| 301 | F | 57 | Low | 51.2 | Low | 284 Ų | 284 | 156.1 Ų | 156.1 | 100% | 1.246 | 83% | 0.827 | S | S | * | * | -161.4 | 0 | 127 | -109.5 | -76 | 0 | 0 | 0 | 108.2 |
Retrieved 301 of 301 residues in 108.4 ms
(Link to these results)