| 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 | N | 43.8 | Very low | 52.2 | Low | 208 Ų | 208 | 148.3 Ų | 148.3 | 100% | 1.112 | 77% | 0.768 | S | S | * | * | 0 | 132.3 | 0 | -128.2 | 28.6 | 0 | 0 | 0 | 107.4 | |||||
| 2 | M | 47.9 | Very low | 52.9 | Low | 166 Ų | 166 | 138.1 Ų | 138.1 | 82% | 0.818 | 73% | 0.726 | S | S | * | * | trans | 68.6 | 74.6 | -161.9 | -71.9 | 88.7 | -174.3 | 0 | 0 | 113 | ||||
| 3 | S | 48.1 | Very low | 53.4 | Low | 95 Ų | 95 | 136.2 Ų | 136.2 | 66% | 0.664 | 72% | 0.716 | S | S | * | * | 69 | 94.4 | 84.5 | -56.6 | 0 | 0 | 0 | 0 | 110.2 | K5 | S3-K5 PolarHBondContact O-N 2.63Š| |||
| 4 | D | 54.1 | Low | 53.9 | Low | 164 Ų | 164 | 132.8 Ų | 132.8 | 88% | 0.877 | 70% | 0.698 | S | S | * | * | 40.8 | 66.1 | 81.2 | -64.5 | -61.9 | 0 | 0 | 0 | 111.9 | |||||
| 5 | K | 52.1 | Low | 54.2 | Low | 193 Ų | 193 | 132.7 Ų | 132.7 | 84% | 0.839 | 69% | 0.692 | S | S | * | * | trans | -133.2 | 97.2 | 143.3 | -74.7 | -176.5 | -178.7 | 155.8 | 0 | 106.6 | S3 Q7 | S3-K5 PolarHBondContact O-N 2.63Å; K5-Q7 PolarHBondContact O-N 3.2Å | ||
| 6 | K | 56 | Low | 54.4 | Low | 200 Ų | 200 | 132.3 Ų | 132.3 | 87% | 0.87 | 69% | 0.686 | S | S | * | * | trans | -44.7 | 98.9 | 146.8 | -74.2 | 172.6 | 173.1 | 175.1 | 0 | 105.7 | T8 | K6-T8 PolarHBondContact O-N 3.31Š| ||
| 7 | Q | 49.9 | Very low | 54.7 | Low | 175 Ų | 175 | 131.7 Ų | 131.7 | 82% | 0.818 | 68% | 0.684 | S | S | * | * | trans | -69.4 | 97.7 | 158.1 | -167.4 | 166.9 | -28.9 | 0 | 0 | 102 | K5 V9 | K5-Q7 PolarHBondContact O-N 3.2Å; Q7-V9 PolarHBondContact O-N 2.7Å | ||
| 8 | T | 51.1 | Low | 55.4 | Low | 119 Ų | 119 | 131.1 Ų | 131.1 | 73% | 0.73 | 68% | 0.682 | S | S | * | * | trans | -47.8 | 93.7 | 161.9 | 46.7 | 0 | 0 | 0 | 0 | 104.7 | K6 D10 | K6-T8 PolarHBondContact O-N 3.31Å; T8-D10 PolarHBondContact O-N 3.23Å | ||
| 9 | V | 56.5 | Low | 56.3 | Low | 93 Ų | 93 | 130.9 Ų | 130.9 | 56% | 0.564 | 68% | 0.678 | S | S | * | * | trans | -57.5 | 115.2 | 169.6 | -158.4 | 0 | 0 | 0 | 0 | 102.2 | Q7 L11 L14 | Q7-V9 PolarHBondContact O-N 2.7Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 3.22Å; V9-L14 HydrophobicContact CB-CD1 4.03Å; V9-L14 HydrophobicContact CG1-CD1 3.59Å; V9-L14 HydrophobicContact CG1-CD2 4.4Å; V9-L14 HydrophobicContact CG1-CG 4.06Å | ||
| 10 | D | 57.5 | Low | 56.8 | Low | 104 Ų | 104 | 133 Ų | 133 | 56% | 0.556 | 68% | 0.681 | S | S | * | * | trans | -61.7 | 104.4 | -171.9 | -170.1 | 6.5 | 0 | 0 | 0 | 105.9 | T8 G12 L13 L14 | T8-D10 PolarHBondContact O-N 3.23Å; D10-G12 PolarHBondContact O-N 3.14Å; D10-G12 VanDerWaalsContact O-N 3.17Å; D10-L13 HydrophobicContact CB-CB 4.19Å; D10-L13 HydrophobicContact CB-CD1 4.03Å; D10-L13 WeakPolarHBondContact O-CA 3.37Å; D10-L13 WeakPolarHBondContact O-CB 3.4Å; D10-L13 PolarHBondContact O-N 3.02Å; D10-L14 PolarHBondContact O-N 3.14Å | ||
| 11 | L | 57.3 | Low | 57.4 | Low | 114 Ų | 114 | 134.7 Ų | 134.7 | 60% | 0.597 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -63 | -24.8 | -169.6 | -70.5 | 166.1 | 0 | 0 | 0 | 110.1 | V9 L14 E15 | V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 3.22Å; L11-L14 HydrophobicContact CD2-CD1 4.34Å; L11-L14 PolarHBondContact O-N 3.5Å; L11-E15 WeakPolarHBondContact O-CB 3.3Å; L11-E15 VanDerWaalsContact O-CG 3.27Å; L11-E15 WeakPolarHBondContact O-CG 3.29Å; L11-E15 PolarHBondContact O-N 2.85Å |
| 12 | G | 60.3 | Low | 58.7 | Low | 26 Ų | 26 | 132.4 Ų | 132.4 | 27% | 0.268 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -61.1 | -43.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | D10 L14 E15 E16 | D10-G12 PolarHBondContact O-N 3.14Å; D10-G12 VanDerWaalsContact O-N 3.17Å; G12-L14 PolarHBondContact O-N 3.44Å; G12-E15 PolarHBondContact O-N 2.82Å; G12-E16 VanDerWaalsContact O-CB 3.28Å; G12-E16 WeakPolarHBondContact O-CB 3.11Å; G12-E16 WeakPolarHBondContact O-CG 3.47Å; G12-E16 PolarHBondContact O-N 3.14Å |
| 13 | L | 59.8 | Low | 59.6 | Low | 113 Ų | 113 | 131.9 Ų | 131.9 | 59% | 0.592 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -66.8 | -21.6 | 176.4 | -108.1 | 145.1 | 0 | 0 | 0 | 113.8 | D10 | D10-L13 HydrophobicContact CB-CB 4.19Å; D10-L13 HydrophobicContact CB-CD1 4.03Å; D10-L13 WeakPolarHBondContact O-CA 3.37Å; D10-L13 WeakPolarHBondContact O-CB 3.4Å; D10-L13 PolarHBondContact O-N 3.02Å |
| 14 | L | 60.2 | Low | 60.8 | Low | 89 Ų | 89 | 133.1 Ų | 133.1 | 47% | 0.466 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -90.2 | -35.8 | 174.8 | -69.5 | 171.1 | 0 | 0 | 0 | 111.8 | V9 D10 L11 G12 E16 D17 | V9-L14 HydrophobicContact CB-CD1 4.03Å; V9-L14 HydrophobicContact CG1-CD1 3.59Å; V9-L14 HydrophobicContact CG1-CD2 4.4Å; V9-L14 HydrophobicContact CG1-CG 4.06Å; D10-L14 PolarHBondContact O-N 3.14Å; L11-L14 HydrophobicContact CD2-CD1 4.34Å; L11-L14 PolarHBondContact O-N 3.5Å; G12-L14 PolarHBondContact O-N 3.44Å; L14-E16 VanDerWaalsContact C-N 3.34Å; L14-D17 PolarHBondContact O-N 3.44Å |
| 15 | E | 58.4 | Low | 61.6 | Low | 131 Ų | 131 | 129.9 Ų | 129.9 | 61% | 0.612 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.4 | -32.3 | 173.6 | -72.7 | 171.2 | -167.9 | 0 | 0 | 111.4 | L11 G12 D17 D18 E19 | L11-E15 WeakPolarHBondContact O-CB 3.3Å; L11-E15 VanDerWaalsContact O-CG 3.27Å; L11-E15 WeakPolarHBondContact O-CG 3.29Å; L11-E15 PolarHBondContact O-N 2.85Å; G12-E15 PolarHBondContact O-N 2.82Å; E15-D17 VanDerWaalsContact C-N 3.33Å; E15-D17 PolarHBondContact O-N 3.33Å; E15-D18 PolarHBondContact O-N 3.49Å; E15-E19 PolarHBondContact O-N 3.36Å |
| 16 | E | 57 | Low | 62.5 | Low | 126 Ų | 126 | 127.2 Ų | 127.2 | 59% | 0.589 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -64.5 | -30.7 | 174.6 | -77.8 | 166 | -152.8 | 0 | 0 | 113.3 | G12 L14 | G12-E16 VanDerWaalsContact O-CB 3.28Å; G12-E16 WeakPolarHBondContact O-CB 3.11Å; G12-E16 WeakPolarHBondContact O-CG 3.47Å; G12-E16 PolarHBondContact O-N 3.14Å; L14-E16 VanDerWaalsContact C-N 3.34Å |
| 17 | D | 60.4 | Low | 63.1 | Low | 123 Ų | 123 | 124.9 Ų | 124.9 | 66% | 0.658 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -75.8 | -31.7 | 179 | -151.5 | 27.3 | 0 | 0 | 0 | 111.2 | L14 E15 | L14-D17 PolarHBondContact O-N 3.44Å; E15-D17 VanDerWaalsContact C-N 3.33Å; E15-D17 PolarHBondContact O-N 3.33Å |
| 18 | D | 67.4 | Low | 63.8 | Low | 121 Ų | 121 | 124.2 Ų | 124.2 | 65% | 0.647 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77.1 | -29.4 | 175 | -77.5 | -24.7 | 0 | 0 | 0 | 112.5 | E15 F20 E21 | E15-D18 PolarHBondContact O-N 3.49Å; D18-F20 VanDerWaalsContact C-N 3.29Å; D18-F20 PolarHBondContact O-N 3.43Å; D18-E21 PolarHBondContact O-N 2.91Å |
| 19 | E | 71.9 | Confident | 64.2 | Low | 128 Ų | 128 | 122.4 Ų | 122.4 | 60% | 0.598 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.1 | -24.9 | -179.9 | -168.6 | 168.8 | -177.4 | 0 | 0 | 112.4 | E15 | E15-E19 PolarHBondContact O-N 3.36Å |
| 20 | F | 66.5 | Low | 64.3 | Low | 172 Ų | 172 | 120 Ų | 120 | 75% | 0.754 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -76.2 | -22.5 | 177.4 | -152.8 | -100.5 | 0 | 0 | 0 | 113 | D18 E22 | D18-F20 VanDerWaalsContact C-N 3.29Å; D18-F20 PolarHBondContact O-N 3.43Å; F20-E22 VanDerWaalsContact C-N 3.31Å; F20-E22 PolarHBondContact O-N 3.46Å |
| 21 | E | 69.1 | Low | 64.5 | Low | 168 Ų | 168 | 121.8 Ų | 121.8 | 79% | 0.785 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -82.7 | -1.1 | 176.1 | -65.8 | -151.9 | -173.5 | 0 | 0 | 113.9 | D18 F23 | D18-E21 PolarHBondContact O-N 2.91Å; E21-F23 VanDerWaalsContact C-N 3.28Å; E21-F23 PolarHBondContact O-N 3.26Å |
| 22 | E | 70.6 | Confident | 64.5 | Low | 161 Ų | 161 | 120.4 Ų | 120.4 | 75% | 0.752 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -75.2 | -17.6 | 174.9 | -64.7 | -164.9 | 173.9 | 0 | 0 | 113.2 | F20 | F20-E22 VanDerWaalsContact C-N 3.31Å; F20-E22 PolarHBondContact O-N 3.46Å |
| 23 | F | 67.4 | Low | 64.4 | Low | 155 Ų | 155 | 125.9 Ų | 125.9 | 68% | 0.68 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -84.2 | 145.9 | 173.6 | -68.9 | -82.4 | 0 | 0 | 0 | 110.7 | E21 A25 | E21-F23 VanDerWaalsContact C-N 3.28Å; E21-F23 PolarHBondContact O-N 3.26Å; F23-A25 PolarHBondContact O-N 3.45Å; F23-A25 VanDerWaalsContact O-N 3.14Å |
| 24 | P | 73.9 | Confident | 64.4 | Low | 121 Ų | 121 | 126 Ų | 126 | 79% | 0.786 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -57 | 125.5 | 172.8 | 24.3 | -31.9 | 0 | 0 | 0 | 108.8 | E26 | P24-E26 PolarHBondContact O-N 2.76Š|
| 25 | A | 70.3 | Confident | 64.3 | Low | 95 Ų | 95 | 128.7 Ų | 128.7 | 79% | 0.785 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 117.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | F23 D27 | F23-A25 PolarHBondContact O-N 3.45Å; F23-A25 VanDerWaalsContact O-N 3.14Å; A25-D27 PolarHBondContact O-N 3.35Å |
| 26 | E | 70.4 | Confident | 64.3 | Low | 137 Ų | 137 | 126 Ų | 126 | 64% | 0.64 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 123.1 | 173.5 | -165.7 | 151.6 | -143 | 0 | 0 | 106.8 | P24 W28 | P24-E26 PolarHBondContact O-N 2.76Å; E26-W28 PolarHBondContact O-N 3.09Å |
| 27 | D | 69.4 | Low | 64.5 | Low | 151 Ų | 151 | 121.9 Ų | 121.9 | 81% | 0.807 | 63% | 0.634 | S | S | * | * | trans | -69 | 86.8 | 171.4 | -84.4 | -33.7 | 0 | 0 | 0 | 106.3 | A25 T29 | A25-D27 PolarHBondContact O-N 3.35Å; D27-T29 PolarHBondContact O-N 3.29Å | ||
| 28 | W | 63.8 | Low | 64.5 | Low | 161 Ų | 161 | 120.9 Ų | 120.9 | 61% | 0.61 | 63% | 0.625 | S | S | * | * | trans | -64.8 | 73.8 | 170.6 | -65.2 | 94.7 | 0 | 0 | 0 | 108.5 | E26 G30 D36 | E26-W28 PolarHBondContact O-N 3.09Å; W28-G30 PolarHBondContact O-N 2.94Å; W28-D36 VanDerWaalsContact CZ3-OD2 3.3Å; W28-D36 WeakPolarHBondContact CZ3-OD2 3.39Å | ||
| 29 | T | 61.1 | Low | 64.3 | Low | 82 Ų | 82 | 119 Ų | 119 | 50% | 0.503 | 62% | 0.618 | S | S | . | * | trans | -63.6 | 115.7 | 160.2 | 66.4 | 0 | 0 | 0 | 0 | 103.7 | D27 L31 | D27-T29 PolarHBondContact O-N 3.29Å; T29-L31 PolarHBondContact O-N 3.18Å | ||
| 30 | G | 58.5 | Low | 64 | Low | 42 Ų | 42 | 122.5 Ų | 122.5 | 43% | 0.433 | 63% | 0.626 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.9 | 34.9 | -174.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | W28 | W28-G30 PolarHBondContact O-N 2.94Š|
| 31 | L | 60.4 | Low | 63.6 | Low | 141 Ų | 141 | 120.3 Ų | 120.3 | 74% | 0.738 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -26 | 165.2 | -65.3 | 173.2 | 0 | 0 | 0 | 111.5 | T29 | T29-L31 PolarHBondContact O-N 3.18Š|
| 32 | D | 58 | Low | 63.3 | Low | 86 Ų | 86 | 117.2 Ų | 117.2 | 46% | 0.46 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -98.9 | -4.3 | 177.6 | -60.9 | -30.3 | 0 | 0 | 0 | 112.9 | D34 E35 D36 | D32-D34 PolarHBondContact O-N 3.5Å; D32-E35 PolarHBondContact O-N 3.38Å; D32-E35 VanDerWaalsContact O-N 3.14Å; D32-D36 PolarHBondContact O-N 3.46Å |
| 33 | E | 58.6 | Low | 62.7 | Low | 140 Ų | 140 | 115.7 Ų | 115.7 | 65% | 0.654 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -57.4 | -34 | 177.1 | -95.8 | -179.3 | 174.4 | 0 | 0 | 112.3 | A37 | E33-A37 VanDerWaalsContact O-CB 3.29Å; E33-A37 WeakPolarHBondContact O-CB 2.96Å; E33-A37 PolarHBondContact O-N 3.32Å; E33-A37 VanDerWaalsContact O-N 3.14Å |
| 34 | D | 58.3 | Low | 62.9 | Low | 115 Ų | 115 | 118.4 Ų | 118.4 | 62% | 0.615 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -70.7 | -37.4 | -180 | -66 | -32.4 | 0 | 0 | 0 | 111.4 | D32 H38 | D32-D34 PolarHBondContact O-N 3.5Å; D34-H38 PolarHBondContact O-CD2 2.92Å; D34-H38 PolarHBondContact O-N 3.15Å; D34-H38 PolarHBondContact O-NE2 3.29Å |
| 35 | E | 59.1 | Low | 62.2 | Low | 146 Ų | 146 | 119.6 Ų | 119.6 | 68% | 0.682 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -72.6 | -41.3 | 179.6 | -94.4 | -171.8 | 179.6 | 0 | 0 | 112.3 | D32 H38 | D32-E35 PolarHBondContact O-N 3.38Å; D32-E35 VanDerWaalsContact O-N 3.14Å; E35-H38 PolarHBondContact O-N 3.39Å |
| 36 | D | 58.7 | Low | 61.8 | Low | 75 Ų | 75 | 118.9 Ų | 118.9 | 40% | 0.401 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -68.1 | -42.3 | 177.9 | -85.5 | -26.9 | 0 | 0 | 0 | 111.2 | W28 D32 H38 V39 W40 | W28-D36 VanDerWaalsContact CZ3-OD2 3.3Å; W28-D36 WeakPolarHBondContact CZ3-OD2 3.39Å; D32-D36 PolarHBondContact O-N 3.46Å; D36-H38 VanDerWaalsContact C-N 3.27Å; D36-H38 PolarHBondContact O-N 3.27Å; D36-V39 PolarHBondContact O-N 2.87Å; D36-V39 VanDerWaalsContact O-N 3.09Å; D36-W40 PolarHBondContact O-N 3.37Å |
| 37 | A | 59.9 | Low | 61.2 | Low | 39 Ų | 39 | 117.4 Ų | 117.4 | 32% | 0.322 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -57.6 | -39.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | E33 V39 W40 E41 | E33-A37 VanDerWaalsContact O-CB 3.29Å; E33-A37 WeakPolarHBondContact O-CB 2.96Å; E33-A37 PolarHBondContact O-N 3.32Å; E33-A37 VanDerWaalsContact O-N 3.14Å; A37-V39 VanDerWaalsContact C-N 3.31Å; A37-V39 PolarHBondContact O-N 3.16Å; A37-W40 PolarHBondContact O-N 2.96Å; A37-E41 WeakPolarHBondContact O-CB 3.28Å; A37-E41 WeakPolarHBondContact O-CG 3.5Å; A37-E41 PolarHBondContact O-N 2.84Å |
| 38 | H | 61.7 | Low | 60.7 | Low | 102 Ų | 102 | 116.3 Ų | 116.3 | 47% | 0.472 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.4 | -36.5 | 176.7 | -70.2 | -39.1 | 0 | 0 | 0 | 113 | D34 E35 D36 W40 D42 | D34-H38 PolarHBondContact O-CD2 2.92Å; D34-H38 PolarHBondContact O-N 3.15Å; D34-H38 PolarHBondContact O-NE2 3.29Å; E35-H38 PolarHBondContact O-N 3.39Å; D36-H38 VanDerWaalsContact C-N 3.27Å; D36-H38 PolarHBondContact O-N 3.27Å; H38-W40 VanDerWaalsContact C-N 3.35Å; H38-W40 PolarHBondContact O-N 3.36Å; H38-D42 WeakPolarHBondContact O-CB 3.27Å; H38-D42 PolarHBondContact O-N 3.27Å |
| 39 | V | 62.7 | Low | 60.4 | Low | 81 Ų | 81 | 113.2 Ų | 113.2 | 49% | 0.491 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.7 | -32.3 | -180 | 179.7 | 0 | 0 | 0 | 0 | 112.2 | D36 A37 N43 | D36-V39 PolarHBondContact O-N 2.87Å; D36-V39 VanDerWaalsContact O-N 3.09Å; A37-V39 VanDerWaalsContact C-N 3.31Å; A37-V39 PolarHBondContact O-N 3.16Å; V39-N43 WeakPolarHBondContact O-CB 3.1Å; V39-N43 PolarHBondContact O-ND2 2.99Å |
| 40 | W | 65.2 | Low | 60.2 | Low | 203 Ų | 203 | 116 Ų | 116 | 77% | 0.769 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -87.2 | -32.1 | 179.8 | -65.4 | 92.6 | 0 | 0 | 0 | 112.8 | D36 A37 H38 | D36-W40 PolarHBondContact O-N 3.37Å; A37-W40 PolarHBondContact O-N 2.96Å; H38-W40 VanDerWaalsContact C-N 3.35Å; H38-W40 PolarHBondContact O-N 3.36Å |
| 41 | E | 58.8 | Low | 60.5 | Low | 125 Ų | 125 | 118.2 Ų | 118.2 | 58% | 0.584 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -76.3 | -43.2 | 176 | -69.1 | -176.8 | 174.2 | 0 | 0 | 111.9 | A37 N43 W44 D45 | A37-E41 WeakPolarHBondContact O-CB 3.28Å; A37-E41 WeakPolarHBondContact O-CG 3.5Å; A37-E41 PolarHBondContact O-N 2.84Å; E41-N43 VanDerWaalsContact C-N 3.33Å; E41-N43 PolarHBondContact O-N 3.17Å; E41-W44 PolarHBondContact O-N 2.85Å; E41-D45 PolarHBondContact O-N 2.99Å; E41-D45 VanDerWaalsContact O-N 3.15Å |
| 42 | D | 62.2 | Low | 61.2 | Low | 104 Ų | 104 | 115.9 Ų | 115.9 | 56% | 0.556 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.2 | -34.6 | -179.3 | -72.8 | -16.5 | 0 | 0 | 0 | 111.7 | H38 D46 | H38-D42 WeakPolarHBondContact O-CB 3.27Å; H38-D42 PolarHBondContact O-N 3.27Å; D42-D46 WeakPolarHBondContact O-CB 3.38Å; D42-D46 PolarHBondContact O-N 3.43Å; D42-D46 VanDerWaalsContact O-N 3.16Å |
| 43 | N | 58.5 | Low | 62 | Low | 128 Ų | 128 | 118.6 Ų | 118.6 | 68% | 0.684 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -83.2 | -8.9 | -178.5 | -71 | -39.7 | 0 | 0 | 0 | 114.4 | V39 E41 | V39-N43 WeakPolarHBondContact O-CB 3.1Å; V39-N43 PolarHBondContact O-ND2 2.99Å; E41-N43 VanDerWaalsContact C-N 3.33Å; E41-N43 PolarHBondContact O-N 3.17Å |
| 44 | W | 70.7 | Confident | 63 | Low | 213 Ų | 213 | 114.9 Ų | 114.9 | 81% | 0.807 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -105 | -31.1 | 178.8 | -170.3 | 19.1 | 0 | 0 | 0 | 112.7 | E41 | E41-W44 PolarHBondContact O-N 2.85Å |
| 45 | D | 60.5 | Low | 64 | Low | 146 Ų | 146 | 113.1 Ų | 113.1 | 78% | 0.781 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -93.7 | -10.6 | 173.7 | -92.2 | -14.1 | 0 | 0 | 0 | 113.6 | E41 D47 | E41-D45 PolarHBondContact O-N 2.99Å; E41-D45 VanDerWaalsContact O-N 3.15Å; D45-D47 PolarHBondContact O-N 2.98Å |
| 46 | D | 61.2 | Low | 65.3 | Low | 79 Ų | 79 | 111.5 Ų | 111.5 | 42% | 0.422 | 56% | 0.559 | S | S | . | * | trans | -80.6 | 47.7 | 171.5 | -163.5 | 14.5 | 0 | 0 | 0 | 112.6 | D42 N48 V49 | D42-D46 WeakPolarHBondContact O-CB 3.38Å; D42-D46 PolarHBondContact O-N 3.43Å; D42-D46 VanDerWaalsContact O-N 3.16Å; D46-N48 PolarHBondContact O-N 3.24Å; D46-V49 PolarHBondContact O-N 3.49Å; D46-V49 WeakPolarHBondContact OD2-CG2 3.32Å | ||
| 47 | D | 57.8 | Low | 66.4 | Low | 106 Ų | 106 | 112.1 Ų | 112.1 | 57% | 0.567 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -55.2 | -10.6 | 165.5 | -86.5 | -18.3 | 0 | 0 | 0 | 112.4 | D45 D51 | D45-D47 PolarHBondContact O-N 2.98Å; D47-D51 PolarHBondContact O-N 2.97Å |
| 48 | N | 59.5 | Low | 67.5 | Low | 128 Ų | 128 | 117.7 Ų | 117.7 | 68% | 0.684 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -76.6 | -28.2 | -176.3 | -166.4 | 50.5 | 0 | 0 | 0 | 112.8 | D46 | D46-N48 PolarHBondContact O-N 3.24Å |
| 49 | V | 57.8 | Low | 68.6 | Low | 96 Ų | 96 | 115.6 Ų | 115.6 | 58% | 0.582 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -81.2 | -35.4 | 174.7 | 179.3 | 0 | 0 | 0 | 0 | 111.5 | D46 D51 D52 F53 | D46-V49 PolarHBondContact O-N 3.49Å; D46-V49 WeakPolarHBondContact OD2-CG2 3.32Å; V49-D51 VanDerWaalsContact C-N 3.33Å; V49-D51 PolarHBondContact O-N 3.48Å; V49-D52 PolarHBondContact O-N 2.95Å; V49-F53 PolarHBondContact O-N 3.13Å |
| 50 | E | 57.1 | Low | 69.6 | Low | 140 Ų | 140 | 115.8 Ų | 115.8 | 65% | 0.654 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -70.3 | -29.3 | 178.7 | -147.1 | 178.7 | -159.4 | 0 | 0 | 112.1 | S54 | E50-S54 WeakPolarHBondContact O-CB 3.36Å; E50-S54 PolarHBondContact O-N 2.81Å; E50-S54 PolarHBondContact O-OG 3.17Å |
| 51 | D | 63.3 | Low | 70.4 | Confident | 89 Ų | 89 | 108.5 Ų | 108.5 | 48% | 0.476 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.8 | -38.9 | 174 | -167.7 | 40 | 0 | 0 | 0 | 112.8 | D47 V49 S54 N55 | D47-D51 PolarHBondContact O-N 2.97Å; V49-D51 VanDerWaalsContact C-N 3.33Å; V49-D51 PolarHBondContact O-N 3.48Å; D51-S54 PolarHBondContact O-N 2.75Å; D51-N55 VanDerWaalsContact O-CB 3.3Å; D51-N55 WeakPolarHBondContact O-CB 3.42Å; D51-N55 PolarHBondContact O-N 3.38Å; D51-N55 PolarHBondContact O-ND2 2.97Å; D51-N55 PolarHBondContact OD1-ND2 3.32Å; D51-N55 VanDerWaalsContact OD1-ND2 3.13Å; D51-N55 PolarHBondContact OD2-ND2 2.85Å; D51-N55 VanDerWaalsContact OD2-ND2 3.1Å |
| 52 | D | 76.1 | Confident | 71.5 | Confident | 92 Ų | 92 | 108 Ų | 108 | 49% | 0.492 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.5 | -41.5 | 179.8 | -170.3 | 26.2 | 0 | 0 | 0 | 112 | V49 S54 N55 Q56 | V49-D52 PolarHBondContact O-N 2.95Å; D52-S54 VanDerWaalsContact C-N 3.34Å; D52-S54 PolarHBondContact O-N 3.1Å; D52-N55 PolarHBondContact O-N 3.33Å; D52-Q56 WeakPolarHBondContact O-CB 3.24Å; D52-Q56 VanDerWaalsContact O-CG 3.25Å; D52-Q56 WeakPolarHBondContact O-CG 3.3Å; D52-Q56 PolarHBondContact O-N 3.48Å; D52-Q56 PolarHBondContact OD1-NE2 2.89Å; D52-Q56 PolarHBondContact OD2-NE2 3.47Å |
| 53 | F | 74.8 | Confident | 72.2 | Confident | 144 Ų | 144 | 110 Ų | 110 | 63% | 0.632 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.2 | -41.9 | 174.1 | -172.6 | -98.7 | 0 | 0 | 0 | 111.7 | V49 Q56 L57 | V49-F53 PolarHBondContact O-N 3.13Å; F53-Q56 PolarHBondContact O-N 3.43Å; F53-L57 VanDerWaalsContact O-CB 3.24Å; F53-L57 WeakPolarHBondContact O-CB 3.3Å; F53-L57 PolarHBondContact O-N 2.92Å |
| 54 | S | 78.8 | Confident | 73.1 | Confident | 61 Ų | 61 | 109.3 Ų | 109.3 | 43% | 0.427 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 177.2 | -64 | 0 | 0 | 0 | 0 | 112.2 | E50 D51 D52 L57 R58 | E50-S54 WeakPolarHBondContact O-CB 3.36Å; E50-S54 PolarHBondContact O-N 2.81Å; E50-S54 PolarHBondContact O-OG 3.17Å; D51-S54 PolarHBondContact O-N 2.75Å; D52-S54 VanDerWaalsContact C-N 3.34Å; D52-S54 PolarHBondContact O-N 3.1Å; S54-L57 PolarHBondContact O-N 3.36Å; S54-R58 VanDerWaalsContact O-CB 3.3Å; S54-R58 WeakPolarHBondContact O-CB 3.25Å; S54-R58 PolarHBondContact O-N 2.85Å |
| 55 | N | 80.4 | Confident | 72.9 | Confident | 79 Ų | 79 | 101.8 Ų | 101.8 | 42% | 0.422 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.5 | -43 | 177.1 | -75 | -43.8 | 0 | 0 | 0 | 112 | D51 D52 R58 A59 | D51-N55 VanDerWaalsContact O-CB 3.3Å; D51-N55 WeakPolarHBondContact O-CB 3.42Å; D51-N55 PolarHBondContact O-N 3.38Å; D51-N55 PolarHBondContact O-ND2 2.97Å; D51-N55 PolarHBondContact OD1-ND2 3.32Å; D51-N55 VanDerWaalsContact OD1-ND2 3.13Å; D51-N55 PolarHBondContact OD2-ND2 2.85Å; D51-N55 VanDerWaalsContact OD2-ND2 3.1Å; D52-N55 PolarHBondContact O-N 3.33Å; N55-R58 PolarHBondContact O-N 2.88Å; N55-A59 WeakPolarHBondContact O-CB 3.47Å; N55-A59 PolarHBondContact O-N 3.49Å |
| 56 | Q | 84.9 | Confident | 73.1 | Confident | 111 Ų | 111 | 102.7 Ų | 102.7 | 52% | 0.519 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 175 | -71.7 | 175.6 | 39.8 | 0 | 0 | 111.9 | D52 F53 R58 A59 E60 | D52-Q56 WeakPolarHBondContact O-CB 3.24Å; D52-Q56 VanDerWaalsContact O-CG 3.25Å; D52-Q56 WeakPolarHBondContact O-CG 3.3Å; D52-Q56 PolarHBondContact O-N 3.48Å; D52-Q56 PolarHBondContact OD1-NE2 2.89Å; D52-Q56 PolarHBondContact OD2-NE2 3.47Å; F53-Q56 PolarHBondContact O-N 3.43Å; Q56-R58 VanDerWaalsContact C-N 3.35Å; Q56-R58 PolarHBondContact O-N 2.92Å; Q56-A59 PolarHBondContact O-N 2.99Å; Q56-E60 PolarHBondContact O-N 3.44Å |
| 57 | L | 82.7 | Confident | 73.1 | Confident | 88 Ų | 88 | 106.2 Ų | 106.2 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 176.7 | 178.2 | 61.8 | 0 | 0 | 0 | 111.2 | F53 S54 E60 L61 | F53-L57 VanDerWaalsContact O-CB 3.24Å; F53-L57 WeakPolarHBondContact O-CB 3.3Å; F53-L57 PolarHBondContact O-N 2.92Å; S54-L57 PolarHBondContact O-N 3.36Å; L57-E60 PolarHBondContact O-N 3.38Å; L57-L61 HydrophobicContact CD1-CD1 4.3Å; L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.14Å; L57-L61 WeakPolarHBondContact O-CB 3.28Å; L57-L61 VanDerWaalsContact O-CG 3.32Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.38Å |
| 58 | R | 82.4 | Confident | 73.2 | Confident | 156 Ų | 156 | 108 Ų | 108 | 59% | 0.589 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.6 | -45.9 | 176.4 | -174.9 | 177.3 | -179 | 149.5 | 3.5 | 111.8 | S54 N55 Q56 E60 L61 E62 | S54-R58 VanDerWaalsContact O-CB 3.3Å; S54-R58 WeakPolarHBondContact O-CB 3.25Å; S54-R58 PolarHBondContact O-N 2.85Å; N55-R58 PolarHBondContact O-N 2.88Å; Q56-R58 VanDerWaalsContact C-N 3.35Å; Q56-R58 PolarHBondContact O-N 2.92Å; R58-E60 VanDerWaalsContact C-N 3.33Å; R58-E60 PolarHBondContact O-N 2.94Å; R58-L61 PolarHBondContact O-N 2.99Å; R58-E62 IonicContact NE-OE1 3.38Å; R58-E62 PolarHBondContact NE-OE1 3.29Å; R58-E62 WeakPolarHBondContact O-CG 3.49Å; R58-E62 PolarHBondContact O-N 3.44Å |
| 59 | A | 85.8 | Confident | 73 | Confident | 58 Ų | 58 | 109.3 Ų | 109.3 | 48% | 0.479 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.4 | -40.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | N55 Q56 K63 | N55-A59 WeakPolarHBondContact O-CB 3.47Å; N55-A59 PolarHBondContact O-N 3.49Å; Q56-A59 PolarHBondContact O-N 2.99Å; A59-K63 VanDerWaalsContact O-CB 3.28Å; A59-K63 WeakPolarHBondContact O-CB 3.32Å; A59-K63 PolarHBondContact O-N 2.99Å |
| 60 | E | 83.3 | Confident | 72.7 | Confident | 85 Ų | 85 | 111.3 Ų | 111.3 | 40% | 0.397 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -70.9 | -37.2 | 179.5 | -164.9 | 68 | 177.7 | 0 | 0 | 112.2 | Q56 L57 R58 K63 H64 | Q56-E60 PolarHBondContact O-N 3.44Å; L57-E60 PolarHBondContact O-N 3.38Å; R58-E60 VanDerWaalsContact C-N 3.33Å; R58-E60 PolarHBondContact O-N 2.94Å; E60-K63 PolarHBondContact O-N 2.82Å; E60-K63 IonicContact OE1-NZ 3.12Å; E60-K63 PolarHBondContact OE1-NZ 3.26Å; E60-K63 VanDerWaalsContact OE1-NZ 3.12Å; E60-K63 WeakPolarHBondContact OE2-CD 3.47Å; E60-K63 IonicContact OE2-NZ 2.82Å; E60-K63 PolarHBondContact OE2-NZ 3.46Å; E60-H64 WeakPolarHBondContact O-CB 3.42Å; E60-H64 PolarHBondContact O-N 3.12Å; E60-H64 PolarHBondContact O-ND1 3.04Å; E60-H64 IonicContact OE1-CE1 3.04Å; E60-H64 PolarHBondContact OE1-CE1 2.85Å; E60-H64 IonicContact OE1-ND1 3.66Å |
| 61 | L | 82.8 | Confident | 72 | Confident | 51 Ų | 51 | 113.3 Ų | 113.3 | 27% | 0.267 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.1 | -43.8 | 174 | -73.2 | 173.5 | 0 | 0 | 0 | 112.2 | L57 R58 K63 H64 G65 Y66 M68 | L57-L61 HydrophobicContact CD1-CD1 4.3Å; L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.14Å; L57-L61 WeakPolarHBondContact O-CB 3.28Å; L57-L61 VanDerWaalsContact O-CG 3.32Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 3.38Å; R58-L61 PolarHBondContact O-N 2.99Å; L61-K63 VanDerWaalsContact C-N 3.35Å; L61-H64 CarbonylContact O-C 3.57Å; L61-H64 PolarHBondContact O-N 3.02Å; L61-G65 PolarHBondContact O-N 2.97Å; L61-G65 VanDerWaalsContact O-N 3.17Å; L61-Y66 PolarHBondContact O-N 3.43Å; L61-M68 HydrophobicContact CD1-CE 3.59Å |
| 62 | E | 80.7 | Confident | 72.4 | Confident | 113 Ų | 113 | 114.5 Ų | 114.5 | 53% | 0.528 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -62.3 | -42.1 | 175.1 | -74.5 | 178.7 | -169.6 | 0 | 0 | 111.4 | R58 H64 G65 | R58-E62 IonicContact NE-OE1 3.38Å; R58-E62 PolarHBondContact NE-OE1 3.29Å; R58-E62 WeakPolarHBondContact O-CG 3.49Å; R58-E62 PolarHBondContact O-N 3.44Å; E62-H64 VanDerWaalsContact C-N 3.33Å; E62-H64 PolarHBondContact O-N 3.46Å; E62-G65 PolarHBondContact O-N 3.14Å; E62-G65 VanDerWaalsContact O-N 3.14Å |
| 63 | K | 78 | Confident | 72.2 | Confident | 146 Ų | 146 | 115.7 Ų | 115.7 | 64% | 0.635 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.8 | -35.2 | 175.5 | 176.3 | 179.7 | 152 | -145.7 | 0 | 112.9 | A59 E60 L61 G65 | A59-K63 VanDerWaalsContact O-CB 3.28Å; A59-K63 WeakPolarHBondContact O-CB 3.32Å; A59-K63 PolarHBondContact O-N 2.99Å; E60-K63 PolarHBondContact O-N 2.82Å; E60-K63 IonicContact OE1-NZ 3.12Å; E60-K63 PolarHBondContact OE1-NZ 3.26Å; E60-K63 VanDerWaalsContact OE1-NZ 3.12Å; E60-K63 WeakPolarHBondContact OE2-CD 3.47Å; E60-K63 IonicContact OE2-NZ 2.82Å; E60-K63 PolarHBondContact OE2-NZ 3.46Å; L61-K63 VanDerWaalsContact C-N 3.35Å; K63-G65 PolarHBondContact O-N 3.24Å |
| 64 | H | 75.7 | Confident | 72.1 | Confident | 114 Ų | 114 | 114.1 Ų | 114.1 | 53% | 0.528 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.9 | 4 | 176.1 | -74.3 | 76.1 | 0 | 0 | 0 | 113.6 | E60 L61 E62 Y66 | E60-H64 WeakPolarHBondContact O-CB 3.42Å; E60-H64 PolarHBondContact O-N 3.12Å; E60-H64 PolarHBondContact O-ND1 3.04Å; E60-H64 IonicContact OE1-CE1 3.04Å; E60-H64 PolarHBondContact OE1-CE1 2.85Å; E60-H64 IonicContact OE1-ND1 3.66Å; L61-H64 CarbonylContact O-C 3.57Å; L61-H64 PolarHBondContact O-N 3.02Å; E62-H64 VanDerWaalsContact C-N 3.33Å; E62-H64 PolarHBondContact O-N 3.46Å; H64-Y66 VanDerWaalsContact C-N 3.32Å; H64-Y66 HydrophobicContact CB-CD2 4Å; H64-Y66 HydrophobicContact CB-CE2 4.26Å; H64-Y66 PolarHBondContact O-N 3.17Å |
| 65 | G | 66.6 | Low | 71.7 | Confident | 56 Ų | 56 | 117.2 Ų | 117.2 | 58% | 0.577 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.4 | 8.9 | 173 | 0 | 0 | 0 | 0 | 0 | 114.7 | L61 E62 K63 K67 | L61-G65 PolarHBondContact O-N 2.97Å; L61-G65 VanDerWaalsContact O-N 3.17Å; E62-G65 PolarHBondContact O-N 3.14Å; E62-G65 VanDerWaalsContact O-N 3.14Å; K63-G65 PolarHBondContact O-N 3.24Å; G65-K67 VanDerWaalsContact C-N 3.32Å; G65-K67 PolarHBondContact O-N 3.12Å; G65-K67 VanDerWaalsContact O-N 3.12Å |
| 66 | Y | 64.6 | Low | 71.1 | Confident | 164 Ų | 164 | 119.6 Ų | 119.6 | 64% | 0.643 | 62% | 0.615 | S | S | * | * | trans | -83.3 | 81.6 | 169.7 | -64.2 | -80.4 | 0 | 0 | 0 | 108.2 | L61 H64 M68 | L61-Y66 PolarHBondContact O-N 3.43Å; H64-Y66 VanDerWaalsContact C-N 3.32Å; H64-Y66 HydrophobicContact CB-CD2 4Å; H64-Y66 HydrophobicContact CB-CE2 4.26Å; H64-Y66 PolarHBondContact O-N 3.17Å; Y66-M68 PolarHBondContact O-N 2.91Å | ||
| 67 | K | 61.8 | Low | 70.2 | Confident | 154 Ų | 154 | 120.2 Ų | 120.2 | 67% | 0.67 | 62% | 0.621 | S | S | * | * | trans | -65.3 | 120.4 | 160.7 | -77.2 | 179.5 | 176.1 | 177.3 | 0 | 105.9 | G65 E69 | G65-K67 VanDerWaalsContact C-N 3.32Å; G65-K67 PolarHBondContact O-N 3.12Å; G65-K67 VanDerWaalsContact O-N 3.12Å; K67-E69 PolarHBondContact O-N 2.74Å | ||
| 68 | M | 61.2 | Low | 69.3 | Low | 142 Ų | 142 | 122.5 Ų | 122.5 | 70% | 0.7 | 63% | 0.633 | S | S | * | * | trans | -62.6 | 90.4 | 165.8 | -63.6 | -173.6 | -159 | 0 | 0 | 106.5 | L61 Y66 T70 | L61-M68 HydrophobicContact CD1-CE 3.59Å; Y66-M68 PolarHBondContact O-N 2.91Å; M68-T70 PolarHBondContact O-N 3Å | ||
| 69 | E | 53.7 | Low | 68.3 | Low | 157 Ų | 157 | 119.9 Ų | 119.9 | 73% | 0.734 | 64% | 0.636 | S | S | * | * | trans | -66.8 | 91.6 | 165.5 | -9.6 | -84.3 | 179.7 | 0 | 0 | 105 | K67 S71 | K67-E69 PolarHBondContact O-N 2.74Å; E69-S71 PolarHBondContact O-N 3.48Å | ||
| 70 | T | 52.9 | Low | 66.9 | Low | 137 Ų | 137 | 125.1 Ų | 125.1 | 84% | 0.84 | 65% | 0.649 | S | S | * | * | trans | -65.3 | 102 | 167.1 | 53 | 0 | 0 | 0 | 0 | 106.7 | M68 | M68-T70 PolarHBondContact O-N 3Š| ||
| 71 | S | 41.4 | Very low | 65.4 | Low | 182 Ų | 182 | 128.7 Ų | 128.7 | 100% | 1.273 | 67% | 0.672 | S | S | * | * | trans | -93.8 | 0 | 175.4 | -164.7 | 0 | 0 | 0 | 0 | 112 | E69 | E69-S71 PolarHBondContact O-N 3.48Š|
Retrieved 71 of 71 residues in 119.8 ms
(Link to these results)