| 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 | R | 76.6 | Confident | 87.4 | Confident | 291 Ų | 291 | 127.3 Ų | 127.3 | 100% | 1.098 | 60% | 0.597 | S | S | * | * | 0 | 131 | 0 | -71.7 | -178.9 | 177.5 | 174.8 | -1.6 | 106.4 | |||||
| 2 | P | 73.3 | Confident | 87.7 | Confident | 64 Ų | 64 | 127.8 Ų | 127.8 | 42% | 0.416 | 60% | 0.596 | S | S | . | * | trans | -58.6 | 153.6 | 174.6 | 26.7 | -33.1 | 0 | 0 | 0 | 110 | D6 E7 | P2-D6 HydrophobicContact CB-CB 4.41Å; P2-E7 HydrophobicContact CG-CG 4.4Å; P2-E7 WeakPolarHBondContact CG-OE1 3.42Å | ||
| 3 | Q | 86.7 | Confident | 87.9 | Confident | 129 Ų | 129 | 125.9 Ų | 125.9 | 60% | 0.603 | 59% | 0.587 | S | S | * | * | trans | -71.3 | 149.8 | 177.3 | -64.6 | -158.9 | -14.2 | 0 | 0 | 109.7 | L5 D6 E7 | Q3-L5 PolarHBondContact O-N 3.35Å; Q3-D6 WeakPolarHBondContact CB-OD2 3.47Å; Q3-D6 PolarHBondContact N-OD2 3.05Å; Q3-D6 WeakPolarHBondContact O-CB 3.38Å; Q3-D6 PolarHBondContact O-N 3.43Å; Q3-E7 PolarHBondContact O-N 3.06Å | ||
| 4 | P | 87.8 | Confident | 87.5 | Confident | 107 Ų | 107 | 121.4 Ų | 121.4 | 70% | 0.695 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -54.2 | -29.9 | 179 | -27 | 34.5 | 0 | 0 | 0 | 113.9 | L8 | P4-L8 PolarHBondContact O-N 2.91Å |
| 5 | L | 91.6 | Very high | 86.7 | Confident | 125 Ų | 125 | 117.3 Ų | 117.3 | 65% | 0.654 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -71.7 | -32.3 | 176.8 | -66.6 | 175.6 | 0 | 0 | 0 | 113 | Q3 E7 L8 K9 | Q3-L5 PolarHBondContact O-N 3.35Å; L5-E7 VanDerWaalsContact C-N 3.31Å; L5-L8 PolarHBondContact O-N 3.3Å; L5-K9 WeakPolarHBondContact O-CB 3.48Å; L5-K9 PolarHBondContact O-N 3.12Å |
| 6 | D | 89.4 | Confident | 85.9 | Confident | 76 Ų | 76 | 114 Ų | 114 | 41% | 0.406 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.4 | -35.1 | 178.3 | -59.3 | -38.4 | 0 | 0 | 0 | 111 | P2 Q3 R10 | P2-D6 HydrophobicContact CB-CB 4.41Å; Q3-D6 WeakPolarHBondContact CB-OD2 3.47Å; Q3-D6 PolarHBondContact N-OD2 3.05Å; Q3-D6 WeakPolarHBondContact O-CB 3.38Å; Q3-D6 PolarHBondContact O-N 3.43Å; D6-R10 WeakPolarHBondContact O-CG 3.47Å; D6-R10 PolarHBondContact O-N 3.38Å; D6-R10 VanDerWaalsContact O-N 3.16Å |
| 7 | E | 91.1 | Very high | 84.7 | Confident | 107 Ų | 107 | 116.1 Ų | 116.1 | 50% | 0.5 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.3 | -45.2 | 173.2 | -78.9 | 171.6 | -166.6 | 0 | 0 | 111.7 | P2 Q3 L5 R10 F11 | P2-E7 HydrophobicContact CG-CG 4.4Å; P2-E7 WeakPolarHBondContact CG-OE1 3.42Å; Q3-E7 PolarHBondContact O-N 3.06Å; L5-E7 VanDerWaalsContact C-N 3.31Å; E7-R10 PolarHBondContact O-N 2.94Å; E7-F11 PolarHBondContact O-N 3.16Å; E7-F11 VanDerWaalsContact O-N 3.12Å |
| 8 | L | 91.6 | Very high | 83.5 | Confident | 97 Ų | 97 | 117.2 Ų | 117.2 | 51% | 0.508 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -66.1 | -41.2 | -179.9 | -165.9 | 65.8 | 0 | 0 | 0 | 111.8 | P4 L5 F11 F12 | P4-L8 PolarHBondContact O-N 2.91Å; L5-L8 PolarHBondContact O-N 3.3Å; L8-F11 WeakPolarHBondContact O-CB 3.22Å; L8-F11 PolarHBondContact O-N 2.96Å; L8-F12 HydrophobicContact CD1-CE2 3.92Å; L8-F12 HydrophobicContact CD2-CE2 4.46Å; L8-F12 HydrophobicContact CG-CD2 4.25Å; L8-F12 HydrophobicContact CG-CE2 3.85Å; L8-F12 VanDerWaalsContact O-CD2 3.22Å; L8-F12 WeakPolarHBondContact O-CD2 3.34Å; L8-F12 PolarHBondContact O-N 3.41Å |
| 9 | K | 91.9 | Very high | 82.1 | Confident | 130 Ų | 130 | 114.1 Ų | 114.1 | 57% | 0.565 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -59.9 | -46.7 | 175.8 | -176.5 | -179.9 | 168.6 | -174.7 | 0 | 111.8 | L5 F11 F12 E13 | L5-K9 WeakPolarHBondContact O-CB 3.48Å; L5-K9 PolarHBondContact O-N 3.12Å; K9-F11 VanDerWaalsContact C-N 3.3Å; K9-F11 PolarHBondContact O-N 3.33Å; K9-F12 PolarHBondContact O-N 3.16Å; K9-E13 WeakPolarHBondContact CE-OE1 3.34Å; K9-E13 IonicContact NZ-OE1 2.8Å; K9-E13 PolarHBondContact O-N 3.4Å |
| 10 | R | 90.8 | Very high | 80.7 | Confident | 129 Ų | 129 | 112.2 Ų | 112.2 | 49% | 0.487 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.9 | -36.3 | 177.9 | -74.8 | -175.2 | -56.6 | -144 | 4.3 | 113.1 | D6 E7 E13 A14 | D6-R10 WeakPolarHBondContact O-CG 3.47Å; D6-R10 PolarHBondContact O-N 3.38Å; D6-R10 VanDerWaalsContact O-N 3.16Å; E7-R10 PolarHBondContact O-N 2.94Å; R10-E13 PolarHBondContact O-N 3.47Å; R10-A14 WeakPolarHBondContact O-CB 2.95Å; R10-A14 PolarHBondContact O-N 3.39Å |
| 11 | F | 91.1 | Very high | 79.3 | Confident | 145 Ų | 145 | 109.3 Ų | 109.3 | 64% | 0.636 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -61.4 | -45.7 | 177.5 | -180 | -92.1 | 0 | 0 | 0 | 111.6 | E7 L8 K9 A15 | E7-F11 PolarHBondContact O-N 3.16Å; E7-F11 VanDerWaalsContact O-N 3.12Å; L8-F11 WeakPolarHBondContact O-CB 3.22Å; L8-F11 PolarHBondContact O-N 2.96Å; K9-F11 VanDerWaalsContact C-N 3.3Å; K9-F11 PolarHBondContact O-N 3.33Å; F11-A15 PolarHBondContact O-N 3.28Å; F11-A15 VanDerWaalsContact O-N 3.16Å |
| 12 | F | 90.5 | Very high | 78 | Confident | 133 Ų | 133 | 103 Ų | 103 | 58% | 0.583 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -70.9 | -36.7 | 178 | -72.9 | -67.5 | 0 | 0 | 0 | 113.1 | L8 K9 A15 A16 | L8-F12 HydrophobicContact CD1-CE2 3.92Å; L8-F12 HydrophobicContact CD2-CE2 4.46Å; L8-F12 HydrophobicContact CG-CD2 4.25Å; L8-F12 HydrophobicContact CG-CE2 3.85Å; L8-F12 VanDerWaalsContact O-CD2 3.22Å; L8-F12 WeakPolarHBondContact O-CD2 3.34Å; L8-F12 PolarHBondContact O-N 3.41Å; K9-F12 PolarHBondContact O-N 3.16Å; F12-A15 PolarHBondContact O-N 3.14Å; F12-A16 PolarHBondContact O-N 3.36Å; F12-A16 VanDerWaalsContact O-N 3.12Å |
| 13 | E | 89.8 | Confident | 77.1 | Confident | 104 Ų | 104 | 108.9 Ų | 108.9 | 49% | 0.486 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.9 | -45.6 | 173.8 | -76.1 | 173.4 | 169.4 | 0 | 0 | 111.5 | K9 R10 A15 A16 E17 | K9-E13 WeakPolarHBondContact CE-OE1 3.34Å; K9-E13 IonicContact NZ-OE1 2.8Å; K9-E13 PolarHBondContact O-N 3.4Å; R10-E13 PolarHBondContact O-N 3.47Å; E13-A15 VanDerWaalsContact C-N 3.3Å; E13-A15 PolarHBondContact O-N 3.02Å; E13-A16 PolarHBondContact O-N 3.5Å; E13-A16 VanDerWaalsContact O-N 3.14Å; E13-E17 WeakPolarHBondContact O-CG 3.48Å; E13-E17 PolarHBondContact O-N 3.42Å |
| 14 | A | 82.4 | Confident | 75.3 | Confident | 63 Ų | 63 | 114.1 Ų | 114.1 | 52% | 0.521 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -61.5 | -37.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | R10 A16 E17 D18 | R10-A14 WeakPolarHBondContact O-CB 2.95Å; R10-A14 PolarHBondContact O-N 3.39Å; A14-A16 VanDerWaalsContact C-N 3.33Å; A14-E17 PolarHBondContact O-N 3.12Å; A14-D18 PolarHBondContact O-N 3.3Å |
| 15 | A | 76.4 | Confident | 73.4 | Confident | 59 Ų | 59 | 115.6 Ų | 115.6 | 49% | 0.488 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -69.8 | -28.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | F11 F12 E13 G19 | F11-A15 PolarHBondContact O-N 3.28Å; F11-A15 VanDerWaalsContact O-N 3.16Å; F12-A15 PolarHBondContact O-N 3.14Å; E13-A15 VanDerWaalsContact C-N 3.3Å; E13-A15 PolarHBondContact O-N 3.02Å; A15-G19 PolarHBondContact O-N 3.22Å |
| 16 | A | 74.1 | Confident | 71.1 | Confident | 65 Ų | 65 | 115.5 Ų | 115.5 | 54% | 0.537 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -73.8 | -35.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | F12 E13 A14 G19 A20 | F12-A16 PolarHBondContact O-N 3.36Å; F12-A16 VanDerWaalsContact O-N 3.12Å; E13-A16 PolarHBondContact O-N 3.5Å; E13-A16 VanDerWaalsContact O-N 3.14Å; A14-A16 VanDerWaalsContact C-N 3.33Å; A16-G19 PolarHBondContact O-N 3.43Å; A16-A20 PolarHBondContact O-N 3.28Å |
| 17 | E | 64.9 | Low | 69.2 | Low | 150 Ų | 150 | 119.1 Ų | 119.1 | 70% | 0.701 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -66.6 | -39.5 | 176.8 | -66.3 | -71.2 | 155.5 | 0 | 0 | 111.9 | E13 A14 G19 A20 G21 | E13-E17 WeakPolarHBondContact O-CG 3.48Å; E13-E17 PolarHBondContact O-N 3.42Å; A14-E17 PolarHBondContact O-N 3.12Å; E17-G19 VanDerWaalsContact C-N 3.32Å; E17-G19 PolarHBondContact O-N 3.31Å; E17-A20 PolarHBondContact O-N 3.45Å; E17-G21 PolarHBondContact O-N 3.45Å |
| 18 | D | 62.5 | Low | 67 | Low | 136 Ų | 136 | 120.2 Ų | 120.2 | 73% | 0.727 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -70.5 | -29.3 | 179.2 | -129.6 | 12.5 | 0 | 0 | 0 | 112.2 | A14 | A14-D18 PolarHBondContact O-N 3.3Å |
| 19 | G | 56.9 | Low | 64.8 | Low | 58 Ų | 58 | 119.4 Ų | 119.4 | 60% | 0.598 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -74.8 | -25.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | A15 A16 E17 | A15-G19 PolarHBondContact O-N 3.22Å; A16-G19 PolarHBondContact O-N 3.43Å; E17-G19 VanDerWaalsContact C-N 3.32Å; E17-G19 PolarHBondContact O-N 3.31Å |
| 20 | A | 54.4 | Low | 62.4 | Low | 76 Ų | 76 | 116.9 Ų | 116.9 | 63% | 0.628 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -82.6 | -16.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | A16 E17 | A16-A20 PolarHBondContact O-N 3.28Å; E17-A20 PolarHBondContact O-N 3.45Å |
| 21 | G | 51.8 | Low | 60.2 | Low | 51 Ų | 51 | 121 Ų | 121 | 53% | 0.526 | 69% | 0.687 | S | S | . | * | G | 310 helix | trans | -81.1 | -13.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | E17 Q23 | E17-G21 PolarHBondContact O-N 3.45Å; G21-Q23 PolarHBondContact O-N 3.21Å |
| 22 | L | 49.9 | Very low | 58.2 | Low | 159 Ų | 159 | 122.2 Ų | 122.2 | 83% | 0.832 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -78.2 | 4.7 | -178.4 | -71.8 | 175.4 | 0 | 0 | 0 | 114.8 | ||
| 23 | Q | 54.2 | Low | 56.2 | Low | 187 Ų | 187 | 122.8 Ų | 122.8 | 87% | 0.874 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -126.7 | 18.8 | 179 | -81.2 | -134.7 | 63.8 | 0 | 0 | 115.7 | G21 | G21-Q23 PolarHBondContact O-N 3.21Š|
| 24 | R | 48.4 | Very low | 54.7 | Low | 240 Ų | 240 | 123.7 Ų | 123.7 | 91% | 0.906 | 72% | 0.718 | S | S | * | * | trans | -102.5 | 91.7 | 166.5 | -139.9 | 176.6 | -134.1 | 159.5 | 4.1 | 110.6 | ||||
| 25 | Q | 48.2 | Very low | 52.6 | Low | 138 Ų | 138 | 124.8 Ų | 124.8 | 65% | 0.645 | 73% | 0.727 | S | S | * | * | trans | -27.7 | 158.9 | 164.3 | -86.5 | -177.7 | -29.2 | 0 | 0 | 115.8 | E27 | Q25-E27 HydrophobicContact CG-CG 4.43Å; Q25-E27 VanDerWaalsContact NE2-CG 3.33Å; Q25-E27 PolarHBondContact NE2-OE1 2.95Å | ||
| 26 | P | 43.2 | Very low | 51.2 | Low | 122 Ų | 122 | 128.7 Ų | 128.7 | 79% | 0.792 | 74% | 0.744 | S | S | * | * | -111.4 | 106.7 | 127.9 | 27.9 | -16.8 | 0 | 0 | 0 | 110 | T28 | P26-T28 PolarHBondContact O-N 3.48Š| |||
| 27 | E | 48.4 | Very low | 50.5 | Low | 152 Ų | 152 | 134.8 Ų | 134.8 | 71% | 0.71 | 76% | 0.762 | S | S | * | * | trans | -68.8 | 112.1 | 151 | -58.4 | -137.7 | 157.9 | 0 | 0 | 107.2 | Q25 | Q25-E27 HydrophobicContact CG-CG 4.43Å; Q25-E27 VanDerWaalsContact NE2-CG 3.33Å; Q25-E27 PolarHBondContact NE2-OE1 2.95Å | ||
| 28 | T | 45 | Very low | 49.6 | Very low | 131 Ų | 131 | 135.7 Ų | 135.7 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -144.4 | 102.8 | 155.2 | -61.3 | 0 | 0 | 0 | 0 | 106 | P26 | P26-T28 PolarHBondContact O-N 3.48Š| ||
| 29 | G | 45.5 | Very low | 49.3 | Very low | 80 Ų | 80 | 132.3 Ų | 132.3 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | trans | -64.4 | 166.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 30 | G | 42.8 | Very low | 49 | Very low | 76 Ų | 76 | 135.3 Ų | 135.3 | 78% | 0.784 | 78% | 0.779 | S | S | * | * | trans | 147.2 | 97.7 | 161.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 31 | R | 43 | Very low | 48.9 | Very low | 217 Ų | 217 | 137.5 Ų | 137.5 | 82% | 0.819 | 79% | 0.787 | S | S | * | * | trans | 80 | 111 | 141.3 | -156 | 166.5 | -177 | -101.9 | -3 | 117.4 | H33 | R31-H33 PolarHBondContact O-N 2.9Š| ||
| 32 | L | 49.3 | Very low | 49.4 | Very low | 169 Ų | 169 | 140.8 Ų | 140.8 | 89% | 0.885 | 80% | 0.796 | S | S | * | * | trans | -56.2 | 128.4 | 164.8 | -63.2 | 167.9 | 0 | 0 | 0 | 110.7 | ||||
| 33 | H | 48.8 | Very low | 49.6 | Very low | 145 Ų | 145 | 141.7 Ų | 141.7 | 67% | 0.671 | 80% | 0.801 | S | S | * | * | trans | -138.9 | 115.5 | 156.5 | -120 | -84.6 | 0 | 0 | 0 | 108.8 | R31 | R31-H33 PolarHBondContact O-N 2.9Š| ||
| 34 | P | 59.1 | Low | 49.7 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | trans | -84.4 | 120.4 | 166.1 | 30.6 | -24.2 | 0 | 0 | 0 | 108.1 | ||||
| 35 | A | 38.7 | Very low | 50.3 | Low | 85 Ų | 85 | 132.6 Ų | 132.6 | 70% | 0.702 | 78% | 0.784 | S | S | * | * | trans | -139.6 | 97.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 36 | V | 45.6 | Very low | 51 | Low | 141 Ų | 141 | 132.4 Ų | 132.4 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | 32.4 | 115.8 | 140.8 | -173.8 | 0 | 0 | 0 | 0 | 116.8 | D38 | V36-D38 PolarHBondContact O-N 3.3Š| ||
| 37 | Q | 60.1 | Low | 52.2 | Low | 194 Ų | 194 | 131.6 Ų | 131.6 | 91% | 0.907 | 78% | 0.781 | S | S | * | * | trans | -46.5 | 126.1 | 167.7 | -56.5 | -173.9 | 80.1 | 0 | 0 | 112.4 | ||||
| 38 | D | 45.8 | Very low | 53.1 | Low | 169 Ų | 169 | 129.6 Ų | 129.6 | 90% | 0.904 | 78% | 0.781 | S | S | * | * | trans | -138.6 | 115.5 | 158.3 | -157.3 | 14.6 | 0 | 0 | 0 | 110.6 | V36 | V36-D38 PolarHBondContact O-N 3.3Š| ||
| 39 | G | 55.3 | Low | 54.4 | Low | 64 Ų | 64 | 131.3 Ų | 131.3 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 57.8 | 89.8 | 154.5 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||
| 40 | C | 50.6 | Low | 55.9 | Low | 121 Ų | 121 | 133.3 Ų | 133.3 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | 169.8 | 104.7 | 127 | -90 | 0 | 0 | 0 | 0 | 110.9 | V42 | C40-V42 PolarHBondContact O-N 3.12Å; C40-V42 VanDerWaalsContact O-N 3.11Å | |||
| 41 | P | 54 | Low | 57.9 | Low | 123 Ų | 123 | 133.3 Ų | 133.3 | 80% | 0.799 | 77% | 0.773 | S | S | * | * | trans | -76.2 | 101.9 | 162.1 | 30.4 | -27.6 | 0 | 0 | 0 | 108.1 | L43 | P41-L43 PolarHBondContact O-N 2.69Š| ||
| 42 | V | 60.9 | Low | 60 | Low | 120 Ų | 120 | 125.2 Ų | 125.2 | 73% | 0.727 | 75% | 0.748 | S | S | * | * | trans | -14 | 95 | 161.3 | 177.5 | 0 | 0 | 0 | 0 | 112.7 | C40 G44 | C40-V42 PolarHBondContact O-N 3.12Å; C40-V42 VanDerWaalsContact O-N 3.11Å; V42-G44 PolarHBondContact O-N 3.09Å | ||
| 43 | L | 55 | Low | 62.1 | Low | 177 Ų | 177 | 119.8 Ų | 119.8 | 93% | 0.927 | 73% | 0.725 | S | S | * | * | trans | -70.4 | 99.9 | 164.1 | -75.3 | -179.5 | 0 | 0 | 0 | 108 | P41 Q45 | P41-L43 PolarHBondContact O-N 2.69Å; L43-Q45 PolarHBondContact O-N 2.9Å | ||
| 44 | G | 56.8 | Low | 64.3 | Low | 56 Ų | 56 | 118.6 Ų | 118.6 | 58% | 0.577 | 72% | 0.723 | S | S | * | * | trans | 73.3 | 41.9 | 136.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | V42 L46 | V42-G44 PolarHBondContact O-N 3.09Å; G44-L46 PolarHBondContact O-N 3.47Å | ||
| 45 | Q | 59.8 | Low | 66.2 | Low | 181 Ų | 181 | 118.2 Ų | 118.2 | 85% | 0.846 | 71% | 0.713 | S | S | * | * | trans | -70.7 | 82.9 | 147.9 | -80.2 | -174.6 | -28.9 | 0 | 0 | 107.4 | L43 | L43-Q45 PolarHBondContact O-N 2.9Š| ||
| 46 | L | 64 | Low | 68.9 | Low | 134 Ų | 134 | 119.3 Ų | 119.3 | 70% | 0.702 | 70% | 0.704 | S | S | * | * | trans | -53.5 | 136.3 | 157.6 | -88.2 | 86.9 | 0 | 0 | 0 | 106.3 | G44 | G44-L46 PolarHBondContact O-N 3.47Š| ||
| 47 | P | 67.8 | Low | 71.4 | Confident | 104 Ų | 104 | 117 Ų | 117 | 68% | 0.675 | 68% | 0.684 | S | S | * | * | trans | -46.9 | 142.4 | 169.1 | -23.9 | 32.2 | 0 | 0 | 0 | 108.8 | L49 | P47-L49 PolarHBondContact O-N 2.97Å; P47-L49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | P | 66.9 | Low | 73.2 | Confident | 110 Ų | 110 | 112.8 Ų | 112.8 | 71% | 0.714 | 66% | 0.664 | S | S | * | * | trans | -45.6 | 127.6 | 176.1 | -24.6 | 31.8 | 0 | 0 | 0 | 108 | V50 | P48-V50 HydrophobicContact CB-CG2 4.47Å; P48-V50 WeakPolarHBondContact O-CG2 3.43Å; P48-V50 PolarHBondContact O-N 2.77Å | ||
| 49 | L | 72.2 | Confident | 75.7 | Confident | 168 Ų | 168 | 107.4 Ų | 107.4 | 88% | 0.88 | 64% | 0.637 | S | S | * | * | trans | -69.9 | 80.7 | 178.6 | -151.5 | 117.6 | 0 | 0 | 0 | 106.3 | P47 A51 | P47-L49 PolarHBondContact O-N 2.97Å; P47-L49 VanDerWaalsContact O-N 3.09Å; L49-A51 PolarHBondContact O-N 3.26Å; L49-A51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | V | 78.5 | Confident | 77.7 | Confident | 122 Ų | 122 | 109.8 Ų | 109.8 | 74% | 0.739 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 119.2 | -176.9 | 178.3 | 0 | 0 | 0 | 0 | 105.8 | P48 | P48-V50 HydrophobicContact CB-CG2 4.47Å; P48-V50 WeakPolarHBondContact O-CG2 3.43Å; P48-V50 PolarHBondContact O-N 2.77Å |
| 51 | A | 84 | Confident | 80 | Confident | 75 Ų | 75 | 113.1 Ų | 113.1 | 62% | 0.62 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 130.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | L49 S53 | L49-A51 PolarHBondContact O-N 3.26Å; L49-A51 VanDerWaalsContact O-N 3.12Å; A51-S53 PolarHBondContact O-N 3.12Å |
| 52 | P | 87.6 | Confident | 82.1 | Confident | 47 Ų | 47 | 111.8 Ų | 111.8 | 31% | 0.305 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -62.5 | 141.8 | -177.3 | 24.4 | -32.7 | 0 | 0 | 0 | 109.8 | E56 Q57 | P52-E56 WeakPolarHBondContact CA-OE2 3.4Å; P52-E56 HydrophobicContact CB-CB 4.21Å; P52-Q57 HydrophobicContact CB-CG 4.42Å; P52-Q57 HydrophobicContact CG-CG 4.13Å; P52-Q57 PolarHBondContact O-NE2 3.27Å |
| 53 | S | 92.8 | Very high | 83.9 | Confident | 56 Ų | 56 | 112.7 Ų | 112.7 | 39% | 0.392 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 159 | 178.2 | 65.6 | 0 | 0 | 0 | 0 | 111.8 | A51 L55 E56 Q57 | A51-S53 PolarHBondContact O-N 3.12Å; S53-L55 VanDerWaalsContact C-N 3.28Å; S53-L55 PolarHBondContact O-N 3.34Å; S53-E56 WeakPolarHBondContact CB-OE2 3.4Å; S53-E56 PolarHBondContact N-OE2 3.36Å; S53-E56 PolarHBondContact O-N 3.02Å; S53-E56 VanDerWaalsContact O-N 3.13Å; S53-E56 WeakPolarHBondContact OG-CB 3.4Å; S53-E56 WeakPolarHBondContact OG-CG 3.48Å; S53-E56 PolarHBondContact OG-N 3.41Å; S53-E56 PolarHBondContact OG-OE2 3.47Å; S53-Q57 WeakPolarHBondContact O-CG 3.41Å; S53-Q57 PolarHBondContact O-N 3.11Å |
| 54 | L | 95.8 | Very high | 86 | Confident | 119 Ų | 119 | 110.1 Ų | 110.1 | 62% | 0.623 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -54.3 | -45.8 | 177.6 | -179.9 | 63.9 | 0 | 0 | 0 | 111.6 | E56 Q57 E58 | L54-E56 PolarHBondContact O-N 3.33Å; L54-Q57 WeakPolarHBondContact O-CB 3.45Å; L54-Q57 PolarHBondContact O-N 3.01Å; L54-Q57 VanDerWaalsContact O-N 3.12Å; L54-E58 WeakPolarHBondContact O-CG 3.5Å; L54-E58 PolarHBondContact O-N 2.77Å |
| 55 | L | 97.4 | Very high | 87.9 | Confident | 117 Ų | 117 | 113.6 Ų | 113.6 | 61% | 0.613 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -59.5 | -44.5 | 177.8 | 178.8 | 62.4 | 0 | 0 | 0 | 111.8 | S53 Q57 E58 V59 | S53-L55 VanDerWaalsContact C-N 3.28Å; S53-L55 PolarHBondContact O-N 3.34Å; L55-Q57 VanDerWaalsContact C-N 3.25Å; L55-Q57 PolarHBondContact O-N 2.82Å; L55-E58 PolarHBondContact O-N 2.8Å; L55-V59 HydrophobicContact CD1-CG2 4.12Å; L55-V59 HydrophobicContact CG-CG2 4.39Å; L55-V59 WeakPolarHBondContact O-CB 3.18Å; L55-V59 VanDerWaalsContact O-CG2 3.29Å; L55-V59 WeakPolarHBondContact O-CG2 3.26Å; L55-V59 PolarHBondContact O-N 3.23Å |
| 56 | E | 97.2 | Very high | 89.7 | Confident | 107 Ų | 107 | 110.1 Ų | 110.1 | 50% | 0.5 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.8 | -29.2 | 178 | -72.1 | 165.5 | 144.3 | 0 | 0 | 112.6 | P52 S53 L54 R60 | P52-E56 WeakPolarHBondContact CA-OE2 3.4Å; P52-E56 HydrophobicContact CB-CB 4.21Å; S53-E56 WeakPolarHBondContact CB-OE2 3.4Å; S53-E56 PolarHBondContact N-OE2 3.36Å; S53-E56 PolarHBondContact O-N 3.02Å; S53-E56 VanDerWaalsContact O-N 3.13Å; S53-E56 WeakPolarHBondContact OG-CB 3.4Å; S53-E56 WeakPolarHBondContact OG-CG 3.48Å; S53-E56 PolarHBondContact OG-N 3.41Å; S53-E56 PolarHBondContact OG-OE2 3.47Å; L54-E56 PolarHBondContact O-N 3.33Å; E56-R60 WeakPolarHBondContact O-CB 3.5Å; E56-R60 WeakPolarHBondContact O-CG 3.42Å; E56-R60 PolarHBondContact O-N 3.13Å; E56-R60 PolarHBondContact O-NE 3.15Å |
| 57 | Q | 97.2 | Very high | 91.3 | Very high | 93 Ų | 93 | 111 Ų | 111 | 44% | 0.435 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -71.1 | -45.5 | 172.9 | -66.3 | 175.2 | 17.6 | 0 | 0 | 111.2 | P52 S53 L54 L55 R60 R61 | P52-Q57 HydrophobicContact CB-CG 4.42Å; P52-Q57 HydrophobicContact CG-CG 4.13Å; P52-Q57 PolarHBondContact O-NE2 3.27Å; S53-Q57 WeakPolarHBondContact O-CG 3.41Å; S53-Q57 PolarHBondContact O-N 3.11Å; L54-Q57 WeakPolarHBondContact O-CB 3.45Å; L54-Q57 PolarHBondContact O-N 3.01Å; L54-Q57 VanDerWaalsContact O-N 3.12Å; L55-Q57 VanDerWaalsContact C-N 3.25Å; L55-Q57 PolarHBondContact O-N 2.82Å; Q57-R60 PolarHBondContact O-N 2.92Å; Q57-R61 PolarHBondContact O-N 2.99Å |
| 58 | E | 97.9 | Very high | 92.7 | Very high | 105 Ų | 105 | 110.1 Ų | 110.1 | 49% | 0.491 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.4 | -46.9 | 178.4 | -70.3 | 179.5 | 155.1 | 0 | 0 | 111.9 | L54 L55 R60 R61 V62 | L54-E58 WeakPolarHBondContact O-CG 3.5Å; L54-E58 PolarHBondContact O-N 2.77Å; L55-E58 PolarHBondContact O-N 2.8Å; E58-R60 VanDerWaalsContact C-N 3.26Å; E58-R60 PolarHBondContact O-N 3.02Å; E58-R61 PolarHBondContact O-N 3.18Å; E58-R61 VanDerWaalsContact O-N 3.15Å; E58-V62 WeakPolarHBondContact O-CG2 3.42Å; E58-V62 PolarHBondContact O-N 3.09Å |
| 59 | V | 98.3 | Very high | 94.1 | Very high | 57 Ų | 57 | 108.4 Ų | 108.4 | 35% | 0.345 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.2 | -40.6 | 176.5 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | L55 R63 | L55-V59 HydrophobicContact CD1-CG2 4.12Å; L55-V59 HydrophobicContact CG-CG2 4.39Å; L55-V59 WeakPolarHBondContact O-CB 3.18Å; L55-V59 VanDerWaalsContact O-CG2 3.29Å; L55-V59 WeakPolarHBondContact O-CG2 3.26Å; L55-V59 PolarHBondContact O-N 3.23Å; V59-R63 WeakPolarHBondContact O-CB 3.47Å; V59-R63 VanDerWaalsContact O-CG 3.26Å; V59-R63 WeakPolarHBondContact O-CG 3.47Å; V59-R63 PolarHBondContact O-N 3.44Å; V59-R63 VanDerWaalsContact O-N 3.09Å |
| 60 | R | 98 | Very high | 95.1 | Very high | 114 Ų | 114 | 105.2 Ų | 105.2 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 175.5 | -84.6 | 179.9 | -71.9 | 159.5 | 8.7 | 111.9 | E56 Q57 E58 V62 R63 E64 | E56-R60 WeakPolarHBondContact O-CB 3.5Å; E56-R60 WeakPolarHBondContact O-CG 3.42Å; E56-R60 PolarHBondContact O-N 3.13Å; E56-R60 PolarHBondContact O-NE 3.15Å; Q57-R60 PolarHBondContact O-N 2.92Å; E58-R60 VanDerWaalsContact C-N 3.26Å; E58-R60 PolarHBondContact O-N 3.02Å; R60-V62 VanDerWaalsContact C-N 3.32Å; R60-V62 PolarHBondContact O-N 3.31Å; R60-R63 PolarHBondContact O-N 3.37Å; R60-E64 WeakPolarHBondContact O-CG 3.29Å; R60-E64 PolarHBondContact O-N 2.93Å |
| 61 | R | 98.1 | Very high | 95.9 | Very high | 190 Ų | 190 | 104.8 Ų | 104.8 | 72% | 0.717 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.6 | -42.5 | 178.4 | -173.5 | -177.4 | -70.1 | 175.3 | -0.9 | 112.1 | Q57 E58 E64 R65 | Q57-R61 PolarHBondContact O-N 2.99Å; E58-R61 PolarHBondContact O-N 3.18Å; E58-R61 VanDerWaalsContact O-N 3.15Å; R61-E64 PolarHBondContact O-N 2.9Å; R61-R65 WeakPolarHBondContact O-CB 3.46Å; R61-R65 PolarHBondContact O-N 2.9Å |
| 62 | V | 98.3 | Very high | 96.4 | Very high | 96 Ų | 96 | 105.3 Ų | 105.3 | 58% | 0.582 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.7 | -46.9 | 176.8 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | E58 R60 E64 R65 E66 | E58-V62 WeakPolarHBondContact O-CG2 3.42Å; E58-V62 PolarHBondContact O-N 3.09Å; R60-V62 VanDerWaalsContact C-N 3.32Å; R60-V62 PolarHBondContact O-N 3.31Å; V62-E64 VanDerWaalsContact C-N 3.33Å; V62-E64 PolarHBondContact O-N 3.31Å; V62-R65 PolarHBondContact O-N 3.47Å; V62-E66 WeakPolarHBondContact O-CB 3.36Å; V62-E66 PolarHBondContact O-N 3.35Å |
| 63 | R | 98.1 | Very high | 96.5 | Very high | 139 Ų | 139 | 108.2 Ų | 108.2 | 53% | 0.525 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.2 | -34.7 | 179.3 | -72 | 174 | 178.2 | -178.9 | 1.2 | 113.1 | V59 R60 R67 | V59-R63 WeakPolarHBondContact O-CB 3.47Å; V59-R63 VanDerWaalsContact O-CG 3.26Å; V59-R63 WeakPolarHBondContact O-CG 3.47Å; V59-R63 PolarHBondContact O-N 3.44Å; V59-R63 VanDerWaalsContact O-N 3.09Å; R60-R63 PolarHBondContact O-N 3.37Å; R63-R67 WeakPolarHBondContact O-CG 3.4Å; R63-R67 PolarHBondContact O-N 3.3Å; R63-R67 PolarHBondContact O-NE 3.29Å |
| 64 | E | 98.5 | Very high | 96.4 | Very high | 122 Ų | 122 | 112.2 Ų | 112.2 | 57% | 0.57 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.1 | -46.9 | 173.7 | -75.5 | 167.8 | -175.5 | 0 | 0 | 110.6 | R60 R61 V62 E66 R67 E68 | R60-E64 WeakPolarHBondContact O-CG 3.29Å; R60-E64 PolarHBondContact O-N 2.93Å; R61-E64 PolarHBondContact O-N 2.9Å; V62-E64 VanDerWaalsContact C-N 3.33Å; V62-E64 PolarHBondContact O-N 3.31Å; E64-E66 PolarHBondContact O-N 2.9Å; E64-R67 PolarHBondContact O-N 2.95Å; E64-E68 PolarHBondContact O-N 2.99Å |
| 65 | R | 98.3 | Very high | 96.2 | Very high | 130 Ų | 130 | 111.6 Ų | 111.6 | 49% | 0.491 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.3 | -41.7 | 178.4 | -176.7 | 54.9 | 173.8 | -165.8 | -1.5 | 112.5 | R61 V62 R67 E68 L69 | R61-R65 WeakPolarHBondContact O-CB 3.46Å; R61-R65 PolarHBondContact O-N 2.9Å; V62-R65 PolarHBondContact O-N 3.47Å; R65-R67 VanDerWaalsContact C-N 3.33Å; R65-R67 PolarHBondContact O-N 3.22Å; R65-E68 IonicContact CZ-OE2 3.83Å; R65-E68 IonicContact NH1-OE1 3.18Å; R65-E68 IonicContact NH1-OE2 3.75Å; R65-E68 PolarHBondContact NH1-OE2 3.48Å; R65-E68 PolarHBondContact O-N 2.92Å; R65-L69 HydrophobicContact CG-CD1 4.31Å; R65-L69 WeakPolarHBondContact O-CG 3.48Å; R65-L69 PolarHBondContact O-N 3.28Å |
| 66 | E | 96.9 | Very high | 95.9 | Very high | 107 Ų | 107 | 111.5 Ų | 111.5 | 50% | 0.5 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -43.6 | 176.9 | -175.7 | 177.4 | -161.4 | 0 | 0 | 111.4 | V62 E64 L69 Q70 | V62-E66 WeakPolarHBondContact O-CB 3.36Å; V62-E66 PolarHBondContact O-N 3.35Å; E64-E66 PolarHBondContact O-N 2.9Å; E66-L69 PolarHBondContact O-N 3.18Å; E66-Q70 WeakPolarHBondContact O-CG 3.41Å; E66-Q70 PolarHBondContact O-N 3.47Å |
| 67 | R | 97.1 | Very high | 95.5 | Very high | 153 Ų | 153 | 113.8 Ų | 113.8 | 58% | 0.577 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.4 | -43.4 | 175.1 | -77.5 | -178.7 | -108.2 | -127.4 | 7.9 | 112.5 | R63 E64 R65 L69 Q70 L71 | R63-R67 WeakPolarHBondContact O-CG 3.4Å; R63-R67 PolarHBondContact O-N 3.3Å; R63-R67 PolarHBondContact O-NE 3.29Å; E64-R67 PolarHBondContact O-N 2.95Å; R65-R67 VanDerWaalsContact C-N 3.33Å; R65-R67 PolarHBondContact O-N 3.22Å; R67-L69 VanDerWaalsContact C-N 3.32Å; R67-L69 PolarHBondContact O-N 3.46Å; R67-Q70 PolarHBondContact O-N 3.22Å; R67-L71 WeakPolarHBondContact O-CG 3.48Å; R67-L71 PolarHBondContact O-N 3.47Å |
| 68 | E | 97.6 | Very high | 94.9 | Very high | 85 Ų | 85 | 111 Ų | 111 | 40% | 0.397 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.2 | -45 | 175.9 | -172 | -171.4 | -174.5 | 0 | 0 | 111 | E64 R65 Q70 L71 Q72 | E64-E68 PolarHBondContact O-N 2.99Å; R65-E68 IonicContact CZ-OE2 3.83Å; R65-E68 IonicContact NH1-OE1 3.18Å; R65-E68 IonicContact NH1-OE2 3.75Å; R65-E68 PolarHBondContact NH1-OE2 3.48Å; R65-E68 PolarHBondContact O-N 2.92Å; E68-Q70 VanDerWaalsContact C-N 3.35Å; E68-Q70 PolarHBondContact O-N 3.24Å; E68-L71 WeakPolarHBondContact O-CB 3.48Å; E68-L71 PolarHBondContact O-N 2.91Å; E68-Q72 WeakPolarHBondContact O-CG 3.36Å; E68-Q72 PolarHBondContact O-N 3.42Å |
| 69 | L | 95.4 | Very high | 94 | Very high | 74 Ų | 74 | 111.7 Ų | 111.7 | 39% | 0.387 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -41.2 | 176.3 | -71.9 | 171.2 | 0 | 0 | 0 | 111.9 | R65 E66 R67 L71 Q72 R73 | R65-L69 HydrophobicContact CG-CD1 4.31Å; R65-L69 WeakPolarHBondContact O-CG 3.48Å; R65-L69 PolarHBondContact O-N 3.28Å; E66-L69 PolarHBondContact O-N 3.18Å; R67-L69 VanDerWaalsContact C-N 3.32Å; R67-L69 PolarHBondContact O-N 3.46Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.86Å; L69-Q72 PolarHBondContact O-N 3.5Å; L69-R73 WeakPolarHBondContact O-CB 3.36Å; L69-R73 VanDerWaalsContact O-CG 3.27Å; L69-R73 WeakPolarHBondContact O-CG 3.43Å; L69-R73 PolarHBondContact O-N 3.24Å |
| 70 | Q | 93.4 | Very high | 92.7 | Very high | 101 Ų | 101 | 112.1 Ų | 112.1 | 47% | 0.472 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.9 | -41.3 | 174.7 | -73.6 | -175.8 | 1.7 | 0 | 0 | 111.8 | E66 R67 E68 R73 R74 | E66-Q70 WeakPolarHBondContact O-CG 3.41Å; E66-Q70 PolarHBondContact O-N 3.47Å; R67-Q70 PolarHBondContact O-N 3.22Å; E68-Q70 VanDerWaalsContact C-N 3.35Å; E68-Q70 PolarHBondContact O-N 3.24Å; Q70-R73 PolarHBondContact O-N 2.98Å; Q70-R74 WeakPolarHBondContact O-CG 3.4Å; Q70-R74 PolarHBondContact O-N 3.19Å |
| 71 | L | 95.1 | Very high | 91.1 | Very high | 114 Ų | 114 | 114.6 Ų | 114.6 | 60% | 0.597 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63 | -45.4 | 175.1 | -72.5 | 170.3 | 0 | 0 | 0 | 111.9 | R67 E68 L69 R73 R74 S75 | R67-L71 WeakPolarHBondContact O-CG 3.48Å; R67-L71 PolarHBondContact O-N 3.47Å; E68-L71 WeakPolarHBondContact O-CB 3.48Å; E68-L71 PolarHBondContact O-N 2.91Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.86Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.45Å; L71-R74 PolarHBondContact O-N 2.88Å; L71-S75 WeakPolarHBondContact O-CB 3.49Å; L71-S75 PolarHBondContact O-N 3.28Å |
| 72 | Q | 94.6 | Very high | 89.4 | Confident | 86 Ų | 86 | 108.8 Ų | 108.8 | 40% | 0.402 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.5 | -44.9 | 175.6 | -72 | 178.4 | 2.6 | 0 | 0 | 111.3 | E68 L69 R74 S75 I76 | E68-Q72 WeakPolarHBondContact O-CG 3.36Å; E68-Q72 PolarHBondContact O-N 3.42Å; L69-Q72 PolarHBondContact O-N 3.5Å; Q72-R74 PolarHBondContact O-N 3.46Å; Q72-S75 WeakPolarHBondContact O-CB 3.38Å; Q72-S75 PolarHBondContact O-N 2.97Å; Q72-I76 VanDerWaalsContact O-CG1 3.28Å; Q72-I76 WeakPolarHBondContact O-CG1 3.28Å; Q72-I76 PolarHBondContact O-N 3.37Å |
| 73 | R | 91.3 | Very high | 87.9 | Confident | 108 Ų | 108 | 111.2 Ų | 111.2 | 41% | 0.408 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 176.4 | -72.4 | 173.8 | 79.3 | -105.8 | 11 | 111.8 | L69 Q70 L71 S75 I76 Y77 | L69-R73 WeakPolarHBondContact O-CB 3.36Å; L69-R73 VanDerWaalsContact O-CG 3.27Å; L69-R73 WeakPolarHBondContact O-CG 3.43Å; L69-R73 PolarHBondContact O-N 3.24Å; Q70-R73 PolarHBondContact O-N 2.98Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.45Å; R73-S75 VanDerWaalsContact C-N 3.3Å; R73-S75 PolarHBondContact O-N 3.45Å; R73-I76 PolarHBondContact O-N 2.9Å; R73-Y77 HydrophobicContact CB-CD2 4.5Å; R73-Y77 WeakPolarHBondContact O-CB 3.27Å; R73-Y77 WeakPolarHBondContact O-CD2 3.49Å; R73-Y77 PolarHBondContact O-N 2.87Å |
| 74 | R | 90.1 | Very high | 86.1 | Confident | 139 Ų | 139 | 112.7 Ų | 112.7 | 53% | 0.525 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64 | -36.2 | 177 | -69.5 | 176.8 | 80.6 | -171.9 | 6 | 112 | Q70 L71 Q72 I76 G78 D79 | Q70-R74 WeakPolarHBondContact O-CG 3.4Å; Q70-R74 PolarHBondContact O-N 3.19Å; L71-R74 PolarHBondContact O-N 2.88Å; Q72-R74 PolarHBondContact O-N 3.46Å; R74-I76 VanDerWaalsContact C-N 3.34Å; R74-I76 PolarHBondContact O-N 3.48Å; R74-G78 CarbonylContact O-C 3.53Å; R74-G78 WeakPolarHBondContact O-CA 3.08Å; R74-G78 PolarHBondContact O-N 2.73Å; R74-D79 IonicContact CZ-OD1 2.73Å; R74-D79 IonicContact NE-OD1 3.54Å; R74-D79 PolarHBondContact NE-OD1 3.26Å; R74-D79 IonicContact NH2-OD1 2.79Å; R74-D79 PolarHBondContact NH2-OD1 3.12Å; R74-D79 IonicContact NH2-OD2 3.81Å |
| 75 | S | 91.6 | Very high | 84.4 | Confident | 107 Ų | 107 | 111.5 Ų | 111.5 | 75% | 0.748 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -66.8 | -34.1 | 175.7 | -174.9 | 0 | 0 | 0 | 0 | 113.1 | L71 Q72 R73 | L71-S75 WeakPolarHBondContact O-CB 3.49Å; L71-S75 PolarHBondContact O-N 3.28Å; Q72-S75 WeakPolarHBondContact O-CB 3.38Å; Q72-S75 PolarHBondContact O-N 2.97Å; R73-S75 VanDerWaalsContact C-N 3.3Å; R73-S75 PolarHBondContact O-N 3.45Å |
| 76 | I | 91.9 | Very high | 82.5 | Confident | 114 Ų | 114 | 109 Ų | 109 | 59% | 0.585 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -85.5 | -45 | -176.6 | -65.7 | 165.8 | 0 | 0 | 0 | 111.1 | Q72 R73 R74 | Q72-I76 VanDerWaalsContact O-CG1 3.28Å; Q72-I76 WeakPolarHBondContact O-CG1 3.28Å; Q72-I76 PolarHBondContact O-N 3.37Å; R73-I76 PolarHBondContact O-N 2.9Å; R74-I76 VanDerWaalsContact C-N 3.34Å; R74-I76 PolarHBondContact O-N 3.48Å |
| 77 | Y | 87.2 | Confident | 80.8 | Confident | 155 Ų | 155 | 109.9 Ų | 109.9 | 61% | 0.608 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -107.4 | -2.7 | -170.2 | -56.6 | -69.1 | 0 | 0 | 0 | 113.5 | R73 | R73-Y77 HydrophobicContact CB-CD2 4.5Å; R73-Y77 WeakPolarHBondContact O-CB 3.27Å; R73-Y77 WeakPolarHBondContact O-CD2 3.49Å; R73-Y77 PolarHBondContact O-N 2.87Å |
| 78 | G | 85 | Confident | 79.3 | Confident | 36 Ų | 36 | 107 Ų | 107 | 37% | 0.371 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 72.9 | -167 | -172.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R74 A80 | R74-G78 CarbonylContact O-C 3.53Å; R74-G78 WeakPolarHBondContact O-CA 3.08Å; R74-G78 PolarHBondContact O-N 2.73Å; G78-A80 PolarHBondContact O-N 2.79Å |
| 79 | D | 80.3 | Confident | 77.7 | Confident | 119 Ų | 119 | 111.3 Ų | 111.3 | 64% | 0.636 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | 16.7 | 176 | -74.2 | -28.6 | 0 | 0 | 0 | 113.2 | R74 E81 | R74-D79 IonicContact CZ-OD1 2.73Å; R74-D79 IonicContact NE-OD1 3.54Å; R74-D79 PolarHBondContact NE-OD1 3.26Å; R74-D79 IonicContact NH2-OD1 2.79Å; R74-D79 PolarHBondContact NH2-OD1 3.12Å; R74-D79 IonicContact NH2-OD2 3.81Å; D79-E81 PolarHBondContact O-N 2.88Å; D79-E81 VanDerWaalsContact O-N 3.07Å |
| 80 | A | 70.1 | Confident | 75.8 | Confident | 65 Ų | 65 | 113.8 Ų | 113.8 | 54% | 0.537 | 62% | 0.618 | S | S | . | * | trans | -56.1 | 120.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | G78 V82 | G78-A80 PolarHBondContact O-N 2.79Å; A80-V82 PolarHBondContact O-N 3.09Å | ||
| 81 | E | 63.7 | Low | 74.3 | Confident | 166 Ų | 166 | 119.3 Ų | 119.3 | 78% | 0.776 | 64% | 0.635 | S | S | * | * | trans | -57.9 | 96.2 | 169.4 | -71 | -167.3 | 175.3 | 0 | 0 | 106.5 | D79 Q83 | D79-E81 PolarHBondContact O-N 2.88Å; D79-E81 VanDerWaalsContact O-N 3.07Å; E81-Q83 PolarHBondContact O-N 2.75Å | ||
| 82 | V | 62.1 | Low | 72.8 | Confident | 68 Ų | 68 | 118 Ų | 118 | 41% | 0.412 | 64% | 0.635 | S | S | . | * | trans | -69.8 | 81.2 | 168.8 | 179.7 | 0 | 0 | 0 | 0 | 104.7 | A80 E84 | A80-V82 PolarHBondContact O-N 3.09Å; V82-E84 PolarHBondContact O-N 2.87Å; V82-E84 VanDerWaalsContact O-N 3.12Å | ||
| 83 | Q | 68.4 | Low | 71.3 | Confident | 147 Ų | 147 | 119.2 Ų | 119.2 | 69% | 0.687 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 117.4 | 155.4 | -65.7 | -74.5 | 36.6 | 0 | 0 | 104.5 | E81 P85 | E81-Q83 PolarHBondContact O-N 2.75Å; Q83-P85 WeakPolarHBondContact O-CD 3.36Å |
| 84 | E | 59.4 | Low | 69.8 | Low | 170 Ų | 170 | 119.4 Ų | 119.4 | 79% | 0.794 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 119 | 169.6 | -162.9 | -174.7 | -158.8 | 0 | 0 | 105.6 | V82 A86 | V82-E84 PolarHBondContact O-N 2.87Å; V82-E84 VanDerWaalsContact O-N 3.12Å; E84-A86 PolarHBondContact O-N 3.11Å |
| 85 | P | 62.1 | Low | 68.3 | Low | 98 Ų | 98 | 118.1 Ų | 118.1 | 64% | 0.636 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 120.1 | 179.5 | 22.7 | -30.4 | 0 | 0 | 0 | 105.5 | Q83 | Q83-P85 WeakPolarHBondContact O-CD 3.36Š|
| 86 | A | 58.9 | Low | 66.8 | Low | 78 Ų | 78 | 117.7 Ų | 117.7 | 65% | 0.645 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -46.3 | 131.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | E84 S88 | E84-A86 PolarHBondContact O-N 3.11Å; A86-S88 PolarHBondContact O-N 3.48Å; A86-S88 PolarHBondContact O-OG 3.07Å |
| 87 | P | 62.5 | Low | 65.4 | Low | 125 Ų | 125 | 118.6 Ų | 118.6 | 81% | 0.812 | 67% | 0.668 | S | S | * | * | trans | -53.1 | 107.9 | -174.8 | 20.1 | -31.9 | 0 | 0 | 0 | 107.9 | L89 | P87-L89 PolarHBondContact O-N 3.23Š| ||
| 88 | S | 64.3 | Low | 64 | Low | 91 Ų | 91 | 119 Ų | 119 | 64% | 0.636 | 68% | 0.68 | S | S | * | * | trans | -79.5 | 118.9 | -176.1 | -13.1 | 0 | 0 | 0 | 0 | 105.2 | A86 T90 | A86-S88 PolarHBondContact O-N 3.48Å; A86-S88 PolarHBondContact O-OG 3.07Å; S88-T90 PolarHBondContact O-N 2.73Å | ||
| 89 | L | 64.3 | Low | 62.6 | Low | 176 Ų | 176 | 120.3 Ų | 120.3 | 92% | 0.921 | 69% | 0.693 | S | S | * | * | trans | -65.1 | 81.2 | 164 | -65.5 | 175.5 | 0 | 0 | 0 | 106.9 | P87 R91 | P87-L89 PolarHBondContact O-N 3.23Å; L89-R91 VanDerWaalsContact C-N 3.28Å; L89-R91 PolarHBondContact O-N 2.72Å | ||
| 90 | T | 55.4 | Low | 61.5 | Low | 126 Ų | 126 | 120.7 Ų | 120.7 | 77% | 0.773 | 70% | 0.7 | S | S | * | * | trans | -63.5 | 97.4 | 168.7 | 42.6 | 0 | 0 | 0 | 0 | 106.6 | S88 S92 | S88-T90 PolarHBondContact O-N 2.73Å; T90-S92 PolarHBondContact O-N 2.95Å; T90-S92 VanDerWaalsContact O-N 3.09Å | ||
| 91 | R | 62.8 | Low | 60.6 | Low | 218 Ų | 218 | 126 Ų | 126 | 82% | 0.823 | 72% | 0.719 | S | S | * | * | trans | -56.5 | 114 | 163.3 | -176.7 | 178.3 | -177.7 | -171.8 | -0.7 | 105.9 | L89 | L89-R91 VanDerWaalsContact C-N 3.28Å; L89-R91 PolarHBondContact O-N 2.72Å | ||
| 92 | S | 62.6 | Low | 60.2 | Low | 85 Ų | 85 | 125 Ų | 125 | 59% | 0.594 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 133 | 175.7 | 47.8 | 0 | 0 | 0 | 0 | 109 | T90 H94 | T90-S92 PolarHBondContact O-N 2.95Å; T90-S92 VanDerWaalsContact O-N 3.09Å; S92-H94 PolarHBondContact O-N 3.4Å |
| 93 | P | 62.8 | Low | 59.6 | Low | 112 Ų | 112 | 128 Ų | 128 | 73% | 0.727 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -60 | 125.5 | 171.3 | -18.7 | 30.5 | 0 | 0 | 0 | 108.2 | ||
| 94 | H | 60.8 | Low | 58.4 | Low | 113 Ų | 113 | 124.6 Ų | 124.6 | 52% | 0.523 | 75% | 0.752 | S | S | . | * | P | Polyproline II helix | trans | -68.1 | 139.3 | 168.5 | -86.7 | -86.3 | 0 | 0 | 0 | 107.8 | S92 S96 D97 | S92-H94 PolarHBondContact O-N 3.4Å; H94-S96 PolarHBondContact O-N 2.77Å; H94-D97 PolarHBondContact O-N 3.32Å; H94-D97 VanDerWaalsContact O-N 3.11Å |
| 95 | P | 59 | Low | 57.8 | Low | 112 Ų | 112 | 123 Ų | 123 | 73% | 0.727 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -60.2 | -8.9 | -177.3 | 23 | -33.2 | 0 | 0 | 0 | 114 | D97 | P95-D97 VanDerWaalsContact C-N 3.3Å; P95-D97 PolarHBondContact O-N 2.84Å |
| 96 | S | 60.5 | Low | 57.1 | Low | 98 Ų | 98 | 126.5 Ų | 126.5 | 69% | 0.685 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -70.3 | -19.9 | 175.4 | -40.1 | 0 | 0 | 0 | 0 | 114.2 | H94 L98 | H94-S96 PolarHBondContact O-N 2.77Å; S96-L98 VanDerWaalsContact C-N 3.35Å |
| 97 | D | 60.7 | Low | 56.5 | Low | 133 Ų | 133 | 126.1 Ų | 126.1 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -86.2 | -2.2 | -175 | -68.3 | -21.1 | 0 | 0 | 0 | 113.7 | H94 P95 G99 | H94-D97 PolarHBondContact O-N 3.32Å; H94-D97 VanDerWaalsContact O-N 3.11Å; P95-D97 VanDerWaalsContact C-N 3.3Å; P95-D97 PolarHBondContact O-N 2.84Å; D97-G99 VanDerWaalsContact C-N 3.34Å; D97-G99 PolarHBondContact O-N 3.49Å |
| 98 | L | 58.3 | Low | 55.5 | Low | 164 Ų | 164 | 133.2 Ų | 133.2 | 86% | 0.859 | 79% | 0.792 | S | S | * | * | G | 310 helix | trans | -93.3 | 21.3 | 178 | -67.6 | 175.1 | 0 | 0 | 0 | 113.6 | S96 | S96-L98 VanDerWaalsContact C-N 3.35Š|
| 99 | G | 55.6 | Low | 55.1 | Low | 62 Ų | 62 | 135.4 Ų | 135.4 | 64% | 0.639 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -89 | -8.9 | -169.6 | 0 | 0 | 0 | 0 | 0 | 118 | D97 | D97-G99 VanDerWaalsContact C-N 3.34Å; D97-G99 PolarHBondContact O-N 3.49Å |
| 100 | T | 56.5 | Low | 54.6 | Low | 128 Ų | 128 | 133.2 Ų | 133.2 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -147.2 | 43.6 | -163.6 | -29.2 | 0 | 0 | 0 | 0 | 116.5 | ||
| 101 | L | 51.2 | Low | 54.5 | Low | 177 Ų | 177 | 133.6 Ų | 133.6 | 93% | 0.927 | 80% | 0.795 | S | S | * | * | trans | -141.3 | 67.5 | 163.2 | -68.6 | 176.9 | 0 | 0 | 0 | 111.5 | ||||
| 102 | T | 55.9 | Low | 54 | Low | 144 Ų | 144 | 128.6 Ų | 128.6 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | trans | -119.3 | 88.3 | 157.2 | 73 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 103 | S | 50.4 | Low | 53.5 | Low | 131 Ų | 131 | 131.4 Ų | 131.4 | 92% | 0.916 | 81% | 0.805 | S | S | * | * | trans | -165.7 | 118.6 | 151.1 | -161.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 104 | G | 43.3 | Very low | 52.9 | Low | 76 Ų | 76 | 132.7 Ų | 132.7 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | trans | 170.6 | 49 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 105 | V | 45.4 | Very low | 52.3 | Low | 135 Ų | 135 | 134.1 Ų | 134.1 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -130.8 | 110.2 | 163.3 | 173 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 106 | L | 48 | Very low | 51.8 | Low | 173 Ų | 173 | 135.8 Ų | 135.8 | 91% | 0.906 | 84% | 0.839 | S | S | * | * | trans | 166.2 | 122.6 | 149.1 | -118.6 | 73.7 | 0 | 0 | 0 | 104.1 | ||||
| 107 | G | 46.9 | Very low | 51.1 | Low | 69 Ų | 69 | 138.9 Ų | 138.9 | 71% | 0.711 | 85% | 0.852 | S | S | * | * | cis | 123.6 | 124 | 33.4 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 108 | E | 40.9 | Very low | 50.2 | Low | 275 Ų | 275 | 139.5 Ų | 139.5 | 100% | 1.285 | 87% | 0.865 | S | S | * | * | trans | 81.4 | 0 | -177.5 | -55.3 | -78.4 | 108.9 | 0 | 0 | 117.6 |
Retrieved 108 of 108 residues in 62.7 ms
(Link to these results)