| 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 | 56.1 | Low | 67.3 | Low | 204 Ų | 204 | 123.9 Ų | 123.9 | 100% | 1.005 | 67% | 0.672 | S | S | * | * | 0 | -33 | 0 | -60.8 | -53.4 | -86.6 | 0 | 0 | 113.7 | E3 | M1-E3 PolarHBondContact O-N 3.08Š| |||
| 2 | A | 72.8 | Confident | 66.4 | Low | 87 Ų | 87 | 122.1 Ų | 122.1 | 72% | 0.719 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -68.3 | -30.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | K6 | A2-K6 PolarHBondContact O-N 3.45Å |
| 3 | E | 73.6 | Confident | 64.7 | Low | 164 Ų | 164 | 120.4 Ų | 120.4 | 77% | 0.766 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -72 | -41.2 | -177.7 | -122.8 | 178.5 | 152.2 | 0 | 0 | 113.1 | M1 A5 K6 S7 | M1-E3 PolarHBondContact O-N 3.08Å; E3-A5 VanDerWaalsContact C-N 3.3Å; E3-A5 PolarHBondContact O-N 3.24Å; E3-K6 PolarHBondContact O-N 2.73Å; E3-K6 VanDerWaalsContact O-N 3.16Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 VanDerWaalsContact O-N 3.09Å; E3-S7 PolarHBondContact O-OG 3.43Å |
| 4 | L | 73.1 | Confident | 63.5 | Low | 128 Ų | 128 | 122.7 Ų | 122.7 | 67% | 0.67 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -62.5 | -37.8 | 175.5 | -83.2 | 165.7 | 0 | 0 | 0 | 112 | K6 S7 L8 | L4-K6 VanDerWaalsContact C-N 3.29Å; L4-K6 PolarHBondContact O-N 3.11Å; L4-S7 PolarHBondContact O-N 2.84Å; L4-L8 WeakPolarHBondContact O-CB 3.31Å; L4-L8 PolarHBondContact O-N 3.47Å |
| 5 | A | 73.6 | Confident | 62.7 | Low | 62 Ų | 62 | 125.7 Ų | 125.7 | 51% | 0.512 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -64.4 | -34.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | E3 S9 | E3-A5 VanDerWaalsContact C-N 3.3Å; E3-A5 PolarHBondContact O-N 3.24Å; A5-S9 PolarHBondContact O-N 3.41Å; A5-S9 VanDerWaalsContact O-N 3.07Å; A5-S9 PolarHBondContact O-OG 3.45Å |
| 6 | K | 72.5 | Confident | 61.8 | Low | 147 Ų | 147 | 123.6 Ų | 123.6 | 64% | 0.639 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -73.8 | -31.2 | 177.3 | -164.7 | 174.8 | -174.1 | 176.9 | 0 | 112.7 | A2 E3 L4 S9 | A2-K6 PolarHBondContact O-N 3.45Å; E3-K6 PolarHBondContact O-N 2.73Å; E3-K6 VanDerWaalsContact O-N 3.16Å; L4-K6 VanDerWaalsContact C-N 3.29Å; L4-K6 PolarHBondContact O-N 3.11Å; K6-S9 PolarHBondContact O-OG 3.16Å; K6-S9 VanDerWaalsContact O-OG 3.07Å |
| 7 | S | 71 | Confident | 61.3 | Low | 78 Ų | 78 | 120.9 Ų | 120.9 | 55% | 0.545 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -75.3 | -37.1 | 173.2 | -60.6 | 0 | 0 | 0 | 0 | 111.8 | E3 L4 K10 | E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 VanDerWaalsContact O-N 3.09Å; E3-S7 PolarHBondContact O-OG 3.43Å; L4-S7 PolarHBondContact O-N 2.84Å; S7-K10 PolarHBondContact O-N 2.89Å |
| 8 | L | 65 | Low | 60.7 | Low | 114 Ų | 114 | 122.5 Ų | 122.5 | 60% | 0.597 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -68.5 | -38.7 | 178.3 | -165.8 | 66.5 | 0 | 0 | 0 | 111.9 | L4 K10 L11 T12 | L4-L8 WeakPolarHBondContact O-CB 3.31Å; L4-L8 PolarHBondContact O-N 3.47Å; L8-K10 PolarHBondContact O-N 3.39Å; L8-L11 PolarHBondContact O-N 2.93Å; L8-L11 VanDerWaalsContact O-N 3.09Å; L8-T12 PolarHBondContact O-N 3.33Å; L8-T12 PolarHBondContact O-OG1 2.88Å |
| 9 | S | 63.5 | Low | 60.4 | Low | 59 Ų | 59 | 123.7 Ų | 123.7 | 41% | 0.413 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -65 | -24.7 | 177.1 | 67.7 | 0 | 0 | 0 | 0 | 113.4 | A5 K6 L11 T12 T13 | A5-S9 PolarHBondContact O-N 3.41Å; A5-S9 VanDerWaalsContact O-N 3.07Å; A5-S9 PolarHBondContact O-OG 3.45Å; K6-S9 PolarHBondContact O-OG 3.16Å; K6-S9 VanDerWaalsContact O-OG 3.07Å; S9-L11 VanDerWaalsContact C-N 3.32Å; S9-T12 PolarHBondContact O-OG1 3.18Å; S9-T13 PolarHBondContact O-OG1 2.93Å |
| 10 | K | 64.2 | Low | 60.3 | Low | 166 Ų | 166 | 121.4 Ų | 121.4 | 72% | 0.722 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -16.9 | 175.4 | -75.7 | -175.9 | 175.7 | -168.8 | 0 | 113.5 | S7 L8 | S7-K10 PolarHBondContact O-N 2.89Å; L8-K10 PolarHBondContact O-N 3.39Å |
| 11 | L | 54.8 | Low | 60.1 | Low | 154 Ų | 154 | 121.2 Ų | 121.2 | 81% | 0.806 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -11.5 | 179.3 | -152.9 | 70.6 | 0 | 0 | 0 | 112.2 | L8 S9 | L8-L11 PolarHBondContact O-N 2.93Å; L8-L11 VanDerWaalsContact O-N 3.09Å; S9-L11 VanDerWaalsContact C-N 3.32Å |
| 12 | T | 56.5 | Low | 60.4 | Low | 102 Ų | 102 | 114.1 Ų | 114.1 | 63% | 0.626 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -107.7 | 1.6 | -172.1 | 54.3 | 0 | 0 | 0 | 0 | 114.8 | L8 S9 | L8-T12 PolarHBondContact O-N 3.33Å; L8-T12 PolarHBondContact O-OG1 2.88Å; S9-T12 PolarHBondContact O-OG1 3.18Å |
| 13 | T | 45 | Very low | 60.7 | Low | 100 Ų | 100 | 116.6 Ų | 116.6 | 61% | 0.613 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -140.8 | 91.8 | -178 | 42 | 0 | 0 | 0 | 0 | 109.8 | S9 | S9-T13 PolarHBondContact O-OG1 2.93Š|
| 14 | D | 48 | Very low | 61.2 | Low | 153 Ų | 153 | 120 Ų | 120 | 82% | 0.818 | 67% | 0.671 | S | S | * | * | S | Bend | 175.1 | -2.3 | 125.2 | -116.6 | -14.1 | 0 | 0 | 0 | 115.5 | S16 | D14-S16 PolarHBondContact O-N 2.95Š| |
| 15 | D | 50.4 | Low | 61.8 | Low | 168 Ų | 168 | 119.6 Ų | 119.6 | 90% | 0.898 | 67% | 0.674 | S | S | * | * | trans | -84.3 | 34.8 | 178.3 | -63.7 | -45.6 | 0 | 0 | 0 | 114 | P17 | D15-P17 WeakPolarHBondContact O-CD 3.46Š| ||
| 16 | S | 48.3 | Very low | 62.4 | Low | 92 Ų | 92 | 122.4 Ų | 122.4 | 64% | 0.643 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -95.3 | 93.5 | 157 | -179.6 | 0 | 0 | 0 | 0 | 106.2 | D14 E18 | D14-S16 PolarHBondContact O-N 2.95Å; S16-E18 PolarHBondContact O-N 3.37Å |
| 17 | P | 53.2 | Low | 63.2 | Low | 78 Ų | 78 | 118 Ų | 118 | 51% | 0.506 | 67% | 0.672 | S | S | . | * | trans | -54.1 | 119.4 | 177.6 | 21.8 | -31.9 | 0 | 0 | 0 | 107.7 | D15 | D15-P17 WeakPolarHBondContact O-CD 3.46Š| ||
| 18 | E | 51.2 | Low | 64.1 | Low | 149 Ų | 149 | 118.4 Ų | 118.4 | 70% | 0.696 | 67% | 0.671 | S | S | * | * | trans | -50.1 | 132.2 | 169.1 | -70.6 | -159.2 | 157.5 | 0 | 0 | 107.2 | S16 G20 N21 | S16-E18 PolarHBondContact O-N 3.37Å; E18-G20 PolarHBondContact O-N 3.37Å; E18-N21 PolarHBondContact O-N 3.11Å | ||
| 19 | P | 55.2 | Low | 65.3 | Low | 145 Ų | 145 | 117.9 Ų | 117.9 | 94% | 0.942 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | 84.2 | -176.9 | 27.6 | -33.4 | 0 | 0 | 0 | 109 | ||
| 20 | G | 59 | Low | 66.5 | Low | 78 Ų | 78 | 120.9 Ų | 120.9 | 80% | 0.804 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 148.2 | -11.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 117 | E18 | E18-G20 PolarHBondContact O-N 3.37Š|
| 21 | N | 55.8 | Low | 67.6 | Low | 118 Ų | 118 | 117.2 Ų | 117.2 | 63% | 0.631 | 66% | 0.657 | S | S | * | * | trans | -133.6 | 43.3 | -176.5 | -161.1 | 35.5 | 0 | 0 | 0 | 114.3 | E18 D23 | E18-N21 PolarHBondContact O-N 3.11Å; N21-D23 PolarHBondContact O-N 3.04Å | ||
| 22 | S | 61.6 | Low | 69.3 | Low | 55 Ų | 55 | 117.7 Ų | 117.7 | 39% | 0.385 | 65% | 0.648 | S | S | . | * | trans | -85.8 | 104.1 | 165.3 | 56.4 | 0 | 0 | 0 | 0 | 108.5 | W24 | S22-W24 VanDerWaalsContact C-N 3.32Å; S22-W24 PolarHBondContact O-N 2.96Å; S22-W24 PolarHBondContact OG-NE1 2.89Å; S22-W24 VanDerWaalsContact OG-NE1 3.12Å | ||
| 23 | D | 79 | Confident | 71 | Confident | 139 Ų | 139 | 117.1 Ų | 117.1 | 74% | 0.743 | 64% | 0.641 | S | S | * | * | trans | -63.8 | 96.2 | 165.1 | -74.7 | -33.4 | 0 | 0 | 0 | 107.7 | N21 V25 | N21-D23 PolarHBondContact O-N 3.04Å; D23-V25 PolarHBondContact O-N 2.59Å; D23-V25 VanDerWaalsContact O-N 3.1Å | ||
| 24 | W | 83.4 | Confident | 73.1 | Confident | 234 Ų | 234 | 115 Ų | 115 | 89% | 0.886 | 63% | 0.634 | S | S | * | * | trans | -66.9 | 110.6 | 174.2 | -65.7 | 94.3 | 0 | 0 | 0 | 108.2 | S22 | S22-W24 VanDerWaalsContact C-N 3.32Å; S22-W24 PolarHBondContact O-N 2.96Å; S22-W24 PolarHBondContact OG-NE1 2.89Å; S22-W24 VanDerWaalsContact OG-NE1 3.12Å | ||
| 25 | V | 85.8 | Confident | 75.2 | Confident | 121 Ų | 121 | 110.1 Ų | 110.1 | 73% | 0.733 | 61% | 0.611 | S | S | * | * | trans | -91.2 | 124.7 | 171.9 | -178.7 | 0 | 0 | 0 | 0 | 107.8 | D23 A27 | D23-V25 PolarHBondContact O-N 2.59Å; D23-V25 VanDerWaalsContact O-N 3.1Å; V25-A27 PolarHBondContact O-N 2.93Å | ||
| 26 | D | 87.1 | Confident | 77.1 | Confident | 121 Ų | 121 | 106.3 Ų | 106.3 | 65% | 0.647 | 60% | 0.598 | S | S | * | * | trans | -68.8 | 115 | 168 | -175 | -1.1 | 0 | 0 | 0 | 108.4 | T28 | D26-T28 WeakPolarHBondContact OD1-CB 3.31Å; D26-T28 PolarHBondContact OD1-N 3.38Å; D26-T28 PolarHBondContact OD1-OG1 3.26Å | ||
| 27 | A | 89.2 | Confident | 79.3 | Confident | 55 Ų | 55 | 109.4 Ų | 109.4 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | trans | -110.6 | 18 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | V25 E29 E30 F31 | V25-A27 PolarHBondContact O-N 2.93Å; A27-E29 PolarHBondContact O-N 3.27Å; A27-E30 WeakPolarHBondContact CA-OE2 3.42Å; A27-E30 PolarHBondContact O-N 3.48Å; A27-F31 WeakPolarHBondContact O-CB 3.33Å; A27-F31 PolarHBondContact O-N 3.1Å | ||
| 28 | T | 89.1 | Confident | 81 | Confident | 85 Ų | 85 | 109 Ų | 109 | 52% | 0.521 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -60.1 | -45 | -172.3 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | D26 R32 | D26-T28 WeakPolarHBondContact OD1-CB 3.31Å; D26-T28 PolarHBondContact OD1-N 3.38Å; D26-T28 PolarHBondContact OD1-OG1 3.26Å; T28-R32 VanDerWaalsContact O-CB 3.31Å; T28-R32 WeakPolarHBondContact O-CB 3.47Å; T28-R32 PolarHBondContact O-N 3.3Å |
| 29 | E | 90.5 | Very high | 82.9 | Confident | 104 Ų | 104 | 108.9 Ų | 108.9 | 49% | 0.486 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -74.7 | -38.4 | -177.4 | -69.5 | -60.1 | 128 | 0 | 0 | 111.9 | A27 F31 R32 N33 | A27-E29 PolarHBondContact O-N 3.27Å; E29-F31 VanDerWaalsContact C-N 3.34Å; E29-R32 PolarHBondContact O-N 3.09Å; E29-N33 VanDerWaalsContact O-CB 3.31Å; E29-N33 WeakPolarHBondContact O-CB 3.19Å; E29-N33 PolarHBondContact O-N 3.43Å; E29-N33 PolarHBondContact O-ND2 3.12Å; E29-N33 VanDerWaalsContact O-ND2 3.08Å |
| 30 | E | 90.3 | Very high | 84.6 | Confident | 121 Ų | 121 | 109.5 Ų | 109.5 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -60.9 | -45.4 | 173.2 | -66.8 | 78.2 | -176.1 | 0 | 0 | 110.9 | A27 N33 A34 | A27-E30 WeakPolarHBondContact CA-OE2 3.42Å; A27-E30 PolarHBondContact O-N 3.48Å; E30-N33 PolarHBondContact O-N 3.16Å; E30-A34 WeakPolarHBondContact O-CB 3.48Å; E30-A34 PolarHBondContact O-N 3.09Å |
| 31 | F | 87.3 | Confident | 86.1 | Confident | 89 Ų | 89 | 109.6 Ų | 109.6 | 39% | 0.39 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -63 | -47 | 176.6 | -176.5 | -101.1 | 0 | 0 | 0 | 111.2 | A27 E29 N33 A34 C35 L103 V105 | A27-F31 WeakPolarHBondContact O-CB 3.33Å; A27-F31 PolarHBondContact O-N 3.1Å; E29-F31 VanDerWaalsContact C-N 3.34Å; F31-N33 VanDerWaalsContact C-N 3.35Å; F31-N33 PolarHBondContact O-N 3.33Å; F31-A34 WeakPolarHBondContact O-CB 3.45Å; F31-A34 PolarHBondContact O-N 3.27Å; F31-C35 PolarHBondContact O-N 3.35Å; F31-C35 PolarHBondContact O-SG 2.91Å; F31-C35 VanDerWaalsContact O-SG 3.33Å; F31-L103 HydrophobicContact CE2-CD2 4.47Å; F31-L103 HydrophobicContact CZ-CD2 4.37Å; F31-V105 HydrophobicContact CD1-CG2 4.44Å; F31-V105 HydrophobicContact CE1-CB 3.99Å; F31-V105 HydrophobicContact CE1-CG2 3.72Å; F31-V105 HydrophobicContact CZ-CG2 4.3Å |
| 32 | R | 90 | Very high | 87.7 | Confident | 165 Ų | 165 | 108.9 Ų | 108.9 | 62% | 0.623 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -60.6 | -42.8 | 177.9 | -171.6 | 179.8 | -173.7 | 178.2 | 3.9 | 112.4 | T28 E29 C35 S36 | T28-R32 VanDerWaalsContact O-CB 3.31Å; T28-R32 WeakPolarHBondContact O-CB 3.47Å; T28-R32 PolarHBondContact O-N 3.3Å; E29-R32 PolarHBondContact O-N 3.09Å; R32-C35 PolarHBondContact O-N 3.07Å; R32-S36 PolarHBondContact O-N 3.21Å |
| 33 | N | 91.7 | Very high | 88.9 | Confident | 90 Ų | 90 | 111.8 Ų | 111.8 | 48% | 0.481 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.1 | -37.7 | 176.4 | -73 | -31.2 | 0 | 0 | 0 | 111.9 | E29 E30 F31 S36 Q37 | E29-N33 VanDerWaalsContact O-CB 3.31Å; E29-N33 WeakPolarHBondContact O-CB 3.19Å; E29-N33 PolarHBondContact O-N 3.43Å; E29-N33 PolarHBondContact O-ND2 3.12Å; E29-N33 VanDerWaalsContact O-ND2 3.08Å; E30-N33 PolarHBondContact O-N 3.16Å; F31-N33 VanDerWaalsContact C-N 3.35Å; F31-N33 PolarHBondContact O-N 3.33Å; N33-S36 PolarHBondContact O-N 3.41Å; N33-S36 PolarHBondContact O-OG 3.48Å; N33-Q37 PolarHBondContact O-NE2 2.8Å |
| 34 | A | 90.2 | Very high | 89.4 | Confident | 55 Ų | 55 | 110.7 Ų | 110.7 | 46% | 0.455 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.4 | -45.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | E30 F31 S36 Q37 | E30-A34 WeakPolarHBondContact O-CB 3.48Å; E30-A34 PolarHBondContact O-N 3.09Å; F31-A34 WeakPolarHBondContact O-CB 3.45Å; F31-A34 PolarHBondContact O-N 3.27Å; A34-S36 VanDerWaalsContact C-N 3.3Å; A34-S36 PolarHBondContact O-N 3.23Å; A34-Q37 WeakPolarHBondContact O-CB 3.48Å; A34-Q37 PolarHBondContact O-N 2.9Å |
| 35 | C | 90.6 | Very high | 89.6 | Confident | 50 Ų | 50 | 103.5 Ų | 103.5 | 34% | 0.338 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.6 | -33.1 | 176.9 | -68.6 | 0 | 0 | 0 | 0 | 113.1 | F31 R32 Q37 L38 | F31-C35 PolarHBondContact O-N 3.35Å; F31-C35 PolarHBondContact O-SG 2.91Å; F31-C35 VanDerWaalsContact O-SG 3.33Å; R32-C35 PolarHBondContact O-N 3.07Å; C35-Q37 PolarHBondContact O-N 2.9Å; C35-Q37 VanDerWaalsContact O-N 3.16Å; C35-L38 WeakPolarHBondContact O-CB 3.2Å; C35-L38 PolarHBondContact O-N 3.17Å; C35-L38 VanDerWaalsContact O-N 3.11Å |
| 36 | S | 91.8 | Very high | 89.7 | Confident | 89 Ų | 89 | 100 Ų | 100 | 62% | 0.622 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | -13.9 | 177.5 | 73 | 0 | 0 | 0 | 0 | 114.6 | R32 N33 A34 | R32-S36 PolarHBondContact O-N 3.21Å; N33-S36 PolarHBondContact O-N 3.41Å; N33-S36 PolarHBondContact O-OG 3.48Å; A34-S36 VanDerWaalsContact C-N 3.3Å; A34-S36 PolarHBondContact O-N 3.23Å |
| 37 | Q | 92.7 | Very high | 89.8 | Confident | 156 Ų | 156 | 103.7 Ų | 103.7 | 73% | 0.729 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -9.7 | 176.5 | -65.6 | 169.6 | 60.3 | 0 | 0 | 112.8 | N33 A34 C35 | N33-Q37 PolarHBondContact O-NE2 2.8Å; A34-Q37 WeakPolarHBondContact O-CB 3.48Å; A34-Q37 PolarHBondContact O-N 2.9Å; C35-Q37 PolarHBondContact O-N 2.9Å; C35-Q37 VanDerWaalsContact O-N 3.16Å |
| 38 | L | 89.9 | Confident | 89.8 | Confident | 69 Ų | 69 | 108.4 Ų | 108.4 | 36% | 0.361 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -80.5 | 134.7 | 177.5 | -68 | 166.4 | 0 | 0 | 0 | 110.8 | C35 E42 V44 | C35-L38 WeakPolarHBondContact O-CB 3.2Å; C35-L38 PolarHBondContact O-N 3.17Å; C35-L38 VanDerWaalsContact O-N 3.11Å; L38-E42 HydrophobicContact CB-CB 4.42Å; L38-E42 HydrophobicContact CD2-CB 3.96Å; L38-V44 HydrophobicContact CD1-CG2 4.13Å; L38-V44 HydrophobicContact CD2-CG2 3.67Å; L38-V44 HydrophobicContact CG-CG2 4.5Å |
| 39 | E | 90.2 | Very high | 89.7 | Confident | 148 Ų | 148 | 107.4 Ų | 107.4 | 69% | 0.692 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 157.7 | 170.2 | -63.5 | -171.4 | 174.3 | 0 | 0 | 111 | G41 E42 | E39-G41 PolarHBondContact O-N 3.41Å; E39-G41 VanDerWaalsContact O-N 3.11Å; E39-E42 HydrophobicContact CB-CG 4.05Å; E39-E42 PolarHBondContact N-OE2 2.73Å; E39-E42 WeakPolarHBondContact O-CB 3.32Å; E39-E42 PolarHBondContact O-N 3.3Å |
| 40 | T | 91 | Very high | 89.6 | Confident | 157 Ų | 157 | 105.7 Ų | 105.7 | 96% | 0.963 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | 118.7 | 177.3 | -58.9 | 0 | 0 | 0 | 0 | 110.2 | ||
| 41 | G | 90.4 | Very high | 89.3 | Confident | 81 Ų | 81 | 104.7 Ų | 104.7 | 84% | 0.835 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.9 | -5.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | E39 | E39-G41 PolarHBondContact O-N 3.41Å; E39-G41 VanDerWaalsContact O-N 3.11Å |
| 42 | E | 90.3 | Very high | 89.4 | Confident | 103 Ų | 103 | 108.2 Ų | 108.2 | 48% | 0.481 | 58% | 0.584 | S | S | . | * | trans | -82.1 | 148.4 | 171 | -63.2 | -170.6 | 136.9 | 0 | 0 | 111.7 | L38 E39 | L38-E42 HydrophobicContact CB-CB 4.42Å; L38-E42 HydrophobicContact CD2-CB 3.96Å; E39-E42 HydrophobicContact CB-CG 4.05Å; E39-E42 PolarHBondContact N-OE2 2.73Å; E39-E42 WeakPolarHBondContact O-CB 3.32Å; E39-E42 PolarHBondContact O-N 3.3Å | ||
| 43 | L | 86.8 | Confident | 89.3 | Confident | 116 Ų | 116 | 104.5 Ų | 104.5 | 61% | 0.607 | 58% | 0.576 | S | S | * | * | trans | -142.7 | 129.8 | 179.8 | -179.6 | 64.8 | 0 | 0 | 0 | 109.9 | M45 L51 | L43-M45 HydrophobicContact CD1-CG 4.39Å; L43-M45 HydrophobicContact CD2-CG 3.7Å; L43-M45 HydrophobicContact CD2-SD 3.32Å; L43-M45 WeakPolarHBondContact CD2-SD 3.38Å; L43-M45 HydrophobicContact CG-CG 3.58Å; L43-M45 HydrophobicContact CG-SD 3.95Å; L43-L51 HydrophobicContact CD2-CD2 3.51Å | ||
| 44 | V | 88.9 | Confident | 89 | Confident | 116 Ų | 116 | 102.3 Ų | 102.3 | 70% | 0.703 | 57% | 0.566 | S | S | * | * | trans | -99.3 | 121 | 175.5 | -178.8 | 0 | 0 | 0 | 0 | 108.6 | L38 | L38-V44 HydrophobicContact CD1-CG2 4.13Å; L38-V44 HydrophobicContact CD2-CG2 3.67Å; L38-V44 HydrophobicContact CG-CG2 4.5Å | ||
| 45 | M | 87.9 | Confident | 88.8 | Confident | 82 Ų | 82 | 106 Ų | 106 | 40% | 0.404 | 58% | 0.578 | S | S | . | * | trans | -140.1 | 156.3 | 178.4 | -40.1 | -169.1 | -56.8 | 0 | 0 | 110.1 | L43 I49 L51 | L43-M45 HydrophobicContact CD1-CG 4.39Å; L43-M45 HydrophobicContact CD2-CG 3.7Å; L43-M45 HydrophobicContact CD2-SD 3.32Å; L43-M45 WeakPolarHBondContact CD2-SD 3.38Å; L43-M45 HydrophobicContact CG-CG 3.58Å; L43-M45 HydrophobicContact CG-SD 3.95Å; M45-I49 WeakPolarHBondContact CE-O 3.49Å; M45-L51 HydrophobicContact CE-CD2 4.38Å; M45-L51 HydrophobicContact CE-CG 4.31Å; M45-L51 HydrophobicContact SD-CD2 3.77Å; M45-L51 HydrophobicContact SD-CG 4.34Å | ||
| 46 | A | 88.3 | Confident | 88.6 | Confident | 48 Ų | 48 | 110.6 Ų | 110.6 | 40% | 0.397 | 60% | 0.598 | S | S | . | * | trans | -60.7 | 146.7 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | E48 I49 | A46-E48 PolarHBondContact O-N 2.87Å; A46-I49 HydrophobicContact CB-CD1 4.15Å; A46-I49 HydrophobicContact CB-CG1 4.25Å; A46-I49 PolarHBondContact O-N 3.43Å | ||
| 47 | K | 88.8 | Confident | 88.2 | Confident | 198 Ų | 198 | 108.5 Ų | 108.5 | 86% | 0.861 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -23.7 | -175.2 | -176.9 | 177.9 | 177.4 | -178.2 | 0 | 112.5 | ||
| 48 | E | 90.2 | Very high | 87.8 | Confident | 155 Ų | 155 | 105.2 Ų | 105.2 | 72% | 0.724 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -16.6 | -175.7 | -60.3 | 68.8 | -148.7 | 0 | 0 | 112.7 | A46 | A46-E48 PolarHBondContact O-N 2.87Š|
| 49 | I | 86.1 | Confident | 87.4 | Confident | 63 Ų | 63 | 106.6 Ų | 106.6 | 32% | 0.323 | 58% | 0.581 | S | S | . | * | trans | -98.5 | 127.8 | -177.4 | -59.7 | 177.3 | 0 | 0 | 0 | 109 | M45 A46 D53 T54 | M45-I49 WeakPolarHBondContact CE-O 3.49Å; A46-I49 HydrophobicContact CB-CD1 4.15Å; A46-I49 HydrophobicContact CB-CG1 4.25Å; A46-I49 PolarHBondContact O-N 3.43Å; I49-D53 HydrophobicContact CG2-CB 4.15Å; I49-T54 HydrophobicContact CG2-CG2 3.91Å | ||
| 50 | T | 87.2 | Confident | 86.9 | Confident | 68 Ų | 68 | 107.4 Ų | 107.4 | 42% | 0.417 | 58% | 0.583 | S | S | . | * | trans | -94.4 | 158.6 | 173.3 | 73.3 | 0 | 0 | 0 | 0 | 110.7 | F52 D53 T54 | T50-F52 PolarHBondContact O-N 3.4Å; T50-F52 VanDerWaalsContact O-N 3.13Å; T50-F52 PolarHBondContact OG1-N 3.13Å; T50-D53 WeakPolarHBondContact CB-OD2 3.23Å; T50-D53 PolarHBondContact N-OD2 3Å; T50-D53 WeakPolarHBondContact O-CB 3.46Å; T50-D53 PolarHBondContact O-N 3.23Å; T50-D53 VanDerWaalsContact OG1-CG 3.31Å; T50-D53 PolarHBondContact OG1-N 3.47Å; T50-D53 PolarHBondContact OG1-OD2 3.39Å; T50-T54 PolarHBondContact O-N 3.02Å | ||
| 51 | L | 85.9 | Confident | 86.3 | Confident | 101 Ų | 101 | 107.4 Ų | 107.4 | 53% | 0.529 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -57.9 | -24.4 | 171.5 | -74 | 175.7 | 0 | 0 | 0 | 113 | L43 M45 D53 T54 L55 | L43-L51 HydrophobicContact CD2-CD2 3.51Å; M45-L51 HydrophobicContact CE-CD2 4.38Å; M45-L51 HydrophobicContact CE-CG 4.31Å; M45-L51 HydrophobicContact SD-CD2 3.77Å; M45-L51 HydrophobicContact SD-CG 4.34Å; L51-D53 VanDerWaalsContact C-N 3.32Å; L51-T54 PolarHBondContact O-N 3.48Å; L51-T54 PolarHBondContact O-OG1 2.97Å; L51-L55 WeakPolarHBondContact O-CG 3.1Å; L51-L55 PolarHBondContact O-N 3.01Å |
| 52 | F | 89.5 | Confident | 85.7 | Confident | 162 Ų | 162 | 104.4 Ų | 104.4 | 71% | 0.711 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -72.2 | -29.9 | 176.9 | -65.8 | -72 | 0 | 0 | 0 | 112.3 | T50 L55 | T50-F52 PolarHBondContact O-N 3.4Å; T50-F52 VanDerWaalsContact O-N 3.13Å; T50-F52 PolarHBondContact OG1-N 3.13Å; F52-L55 HydrophobicContact CD1-CD1 4.15Å |
| 53 | D | 86.7 | Confident | 85.1 | Confident | 88 Ų | 88 | 103.6 Ų | 103.6 | 47% | 0.471 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -71.6 | -35.5 | 176.4 | -55.3 | -52.9 | 0 | 0 | 0 | 110.6 | I49 T50 L51 L55 L56 | I49-D53 HydrophobicContact CG2-CB 4.15Å; T50-D53 WeakPolarHBondContact CB-OD2 3.23Å; T50-D53 PolarHBondContact N-OD2 3Å; T50-D53 WeakPolarHBondContact O-CB 3.46Å; T50-D53 PolarHBondContact O-N 3.23Å; T50-D53 VanDerWaalsContact OG1-CG 3.31Å; T50-D53 PolarHBondContact OG1-N 3.47Å; T50-D53 PolarHBondContact OG1-OD2 3.39Å; L51-D53 VanDerWaalsContact C-N 3.32Å; D53-L55 VanDerWaalsContact C-N 3.3Å; D53-L55 PolarHBondContact O-N 3Å; D53-L56 PolarHBondContact O-N 3.34Å |
| 54 | T | 85.4 | Confident | 84.9 | Confident | 43 Ų | 43 | 108.1 Ų | 108.1 | 26% | 0.264 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -71 | -22.5 | 179 | 66.8 | 0 | 0 | 0 | 0 | 113.3 | I49 T50 L51 L56 A57 | I49-T54 HydrophobicContact CG2-CG2 3.91Å; T50-T54 PolarHBondContact O-N 3.02Å; L51-T54 PolarHBondContact O-N 3.48Å; L51-T54 PolarHBondContact O-OG1 2.97Å; T54-L56 PolarHBondContact O-N 3.29Å; T54-A57 WeakPolarHBondContact O-CB 3.45Å; T54-A57 PolarHBondContact O-N 2.68Å |
| 55 | L | 86.4 | Confident | 84.6 | Confident | 133 Ų | 133 | 107 Ų | 107 | 70% | 0.696 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -21.5 | 174.8 | -68 | 174.2 | 0 | 0 | 0 | 113.4 | L51 F52 D53 A57 | L51-L55 WeakPolarHBondContact O-CG 3.1Å; L51-L55 PolarHBondContact O-N 3.01Å; F52-L55 HydrophobicContact CD1-CD1 4.15Å; D53-L55 VanDerWaalsContact C-N 3.3Å; D53-L55 PolarHBondContact O-N 3Å; L55-A57 VanDerWaalsContact C-N 3.31Å |
| 56 | L | 85.5 | Confident | 84.2 | Confident | 146 Ų | 146 | 104.4 Ų | 104.4 | 76% | 0.764 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | -4.5 | 176.1 | -58.7 | 177 | 0 | 0 | 0 | 112.2 | D53 T54 V58 | D53-L56 PolarHBondContact O-N 3.34Å; T54-L56 PolarHBondContact O-N 3.29Å; L56-V58 PolarHBondContact O-N 3.35Å |
| 57 | A | 84.1 | Confident | 83.8 | Confident | 46 Ų | 46 | 108 Ų | 108 | 38% | 0.38 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -63 | 131.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | T54 L55 | T54-A57 WeakPolarHBondContact O-CB 3.45Å; T54-A57 PolarHBondContact O-N 2.68Å; L55-A57 VanDerWaalsContact C-N 3.31Å |
| 58 | V | 83.5 | Confident | 83.3 | Confident | 87 Ų | 87 | 102 Ų | 102 | 53% | 0.527 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -78.1 | 124.2 | 172.1 | 176.8 | 0 | 0 | 0 | 0 | 107.9 | L56 | L56-V58 PolarHBondContact O-N 3.35Š|
| 59 | E | 81.8 | Confident | 82.7 | Confident | 97 Ų | 97 | 96.3 Ų | 96.3 | 45% | 0.453 | 52% | 0.519 | S | S | . | . | P | Polyproline II helix | trans | -86.9 | 120.4 | 174 | -172.4 | 175.6 | 178.3 | 0 | 0 | 109.6 | D62 L65 | E59-D62 HydrophobicContact CB-CB 4.4Å; E59-D62 HydrophobicContact CG-CB 4.31Å; E59-L65 HydrophobicContact CB-CB 4.46Å; E59-L65 HydrophobicContact CB-CD1 3.84Å |
| 60 | F | 79.4 | Confident | 81.9 | Confident | 165 Ų | 165 | 95.8 Ų | 95.8 | 72% | 0.724 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | 148.2 | 172.5 | -71 | -69.9 | 0 | 0 | 0 | 110.5 | D62 | F60-D62 PolarHBondContact O-N 3.07Š|
| 61 | M | 78.4 | Confident | 80.9 | Confident | 158 Ų | 158 | 104.1 Ų | 104.1 | 78% | 0.778 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70 | -3.8 | 179.7 | -55 | -66.7 | -63.1 | 0 | 0 | 116.6 | P63 D66 | M61-P63 WeakPolarHBondContact O-CD 3.18Å; M61-D66 PolarHBondContact N-OD2 3.47Å |
| 62 | D | 78.1 | Confident | 80 | Confident | 18 Ų | 18 | 103.5 Ų | 103.5 | 10% | 0.096 | 55% | 0.552 | C | S | . | * | trans | -85 | 115.1 | 167.1 | -175.1 | -35.5 | 0 | 0 | 0 | 109.5 | E59 F60 R64 L65 D66 | E59-D62 HydrophobicContact CB-CB 4.4Å; E59-D62 HydrophobicContact CG-CB 4.31Å; F60-D62 PolarHBondContact O-N 3.07Å; D62-R64 PolarHBondContact O-N 3.11Å; D62-R64 VanDerWaalsContact OD1-CB 3.23Å; D62-R64 WeakPolarHBondContact OD1-CB 3.3Å; D62-R64 WeakPolarHBondContact OD1-CG 3.26Å; D62-R64 PolarHBondContact OD1-N 3.29Å; D62-R64 IonicContact OD1-NE 3.17Å; D62-R64 PolarHBondContact OD1-NE 3.49Å; D62-R64 VanDerWaalsContact OD1-NE 3.17Å; D62-R64 IonicContact OD1-NH2 3.99Å; D62-R64 IonicContact OD2-CZ 3.45Å; D62-R64 IonicContact OD2-NE 3.3Å; D62-R64 PolarHBondContact OD2-NE 3.26Å; D62-R64 IonicContact OD2-NH2 2.73Å; D62-R64 PolarHBondContact OD2-NH2 3.49Å; D62-L65 HydrophobicContact CB-CB 4.38Å; D62-L65 PolarHBondContact O-N 3.47Å; D62-D66 WeakPolarHBondContact O-CA 3.4Å; D62-D66 VanDerWaalsContact O-CB 3.26Å; D62-D66 WeakPolarHBondContact O-CB 3.43Å; D62-D66 PolarHBondContact O-N 2.8Å | ||
| 63 | P | 79 | Confident | 78.7 | Confident | 85 Ų | 85 | 102 Ų | 102 | 55% | 0.552 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -10.4 | -177.8 | 26.9 | -36 | 0 | 0 | 0 | 115.3 | M61 | M61-P63 WeakPolarHBondContact O-CD 3.18Š|
| 64 | R | 81.3 | Confident | 77.6 | Confident | 211 Ų | 211 | 104.1 Ų | 104.1 | 80% | 0.796 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -27.4 | 175.8 | -56.5 | 172.5 | -65.3 | 171.4 | 3.3 | 112.8 | D62 | D62-R64 PolarHBondContact O-N 3.11Å; D62-R64 VanDerWaalsContact OD1-CB 3.23Å; D62-R64 WeakPolarHBondContact OD1-CB 3.3Å; D62-R64 WeakPolarHBondContact OD1-CG 3.26Å; D62-R64 PolarHBondContact OD1-N 3.29Å; D62-R64 IonicContact OD1-NE 3.17Å; D62-R64 PolarHBondContact OD1-NE 3.49Å; D62-R64 VanDerWaalsContact OD1-NE 3.17Å; D62-R64 IonicContact OD1-NH2 3.99Å; D62-R64 IonicContact OD2-CZ 3.45Å; D62-R64 IonicContact OD2-NE 3.3Å; D62-R64 PolarHBondContact OD2-NE 3.26Å; D62-R64 IonicContact OD2-NH2 2.73Å; D62-R64 PolarHBondContact OD2-NH2 3.49Å |
| 65 | L | 82.4 | Confident | 76.3 | Confident | 92 Ų | 92 | 110.7 Ų | 110.7 | 48% | 0.482 | 59% | 0.588 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.7 | -30.4 | -178.4 | -62.3 | 176.8 | 0 | 0 | 0 | 111.9 | E59 D62 | E59-L65 HydrophobicContact CB-CB 4.46Å; E59-L65 HydrophobicContact CB-CD1 3.84Å; D62-L65 HydrophobicContact CB-CB 4.38Å; D62-L65 PolarHBondContact O-N 3.47Å |
| 66 | D | 80.9 | Confident | 75.2 | Confident | 28 Ų | 28 | 107 Ų | 107 | 15% | 0.15 | 57% | 0.571 | C | S | . | * | trans | -101.3 | 102.3 | 177.2 | -172.8 | -4.1 | 0 | 0 | 0 | 111 | M61 D62 G68 A69 A70 | M61-D66 PolarHBondContact N-OD2 3.47Å; D62-D66 WeakPolarHBondContact O-CA 3.4Å; D62-D66 VanDerWaalsContact O-CB 3.26Å; D62-D66 WeakPolarHBondContact O-CB 3.43Å; D62-D66 PolarHBondContact O-N 2.8Å; D66-G68 PolarHBondContact O-N 3.25Å; D66-G68 VanDerWaalsContact OD1-CA 3.3Å; D66-G68 WeakPolarHBondContact OD1-CA 3.41Å; D66-G68 PolarHBondContact OD1-N 3.41Å; D66-A69 HydrophobicContact CB-CB 4.11Å; D66-A69 PolarHBondContact O-N 2.66Å; D66-A69 VanDerWaalsContact O-N 3.11Å; D66-A69 PolarHBondContact OD1-N 2.71Å; D66-A70 PolarHBondContact O-N 3.03Å | ||
| 67 | T | 79.6 | Confident | 74.1 | Confident | 125 Ų | 125 | 105 Ų | 105 | 77% | 0.767 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -24.5 | 175 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | A69 A70 | T67-A69 VanDerWaalsContact C-N 3.3Å; T67-A70 WeakPolarHBondContact O-CB 3.41Å; T67-A70 PolarHBondContact O-N 3.3Å |
| 68 | G | 78.7 | Confident | 73.2 | Confident | 72 Ų | 72 | 106.3 Ų | 106.3 | 74% | 0.742 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -27.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | D66 | D66-G68 PolarHBondContact O-N 3.25Å; D66-G68 VanDerWaalsContact OD1-CA 3.3Å; D66-G68 WeakPolarHBondContact OD1-CA 3.41Å; D66-G68 PolarHBondContact OD1-N 3.41Å |
| 69 | A | 75.7 | Confident | 72.6 | Confident | 34 Ų | 34 | 110.5 Ų | 110.5 | 28% | 0.281 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.6 | -13.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | D66 T67 R71 | D66-A69 HydrophobicContact CB-CB 4.11Å; D66-A69 PolarHBondContact O-N 2.66Å; D66-A69 VanDerWaalsContact O-N 3.11Å; D66-A69 PolarHBondContact OD1-N 2.71Å; T67-A69 VanDerWaalsContact C-N 3.3Å; A69-R71 PolarHBondContact O-N 2.94Å |
| 70 | A | 70.7 | Confident | 72.1 | Confident | 52 Ų | 52 | 108 Ų | 108 | 43% | 0.43 | 58% | 0.577 | S | S | . | * | S | Bend | trans | -69.6 | 117.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111 | D66 T67 S72 | D66-A70 PolarHBondContact O-N 3.03Å; T67-A70 WeakPolarHBondContact O-CB 3.41Å; T67-A70 PolarHBondContact O-N 3.3Å; A70-S72 PolarHBondContact O-N 3.31Å; A70-S72 VanDerWaalsContact O-N 3.1Å |
| 71 | R | 66.8 | Low | 71.5 | Confident | 244 Ų | 244 | 104.3 Ų | 104.3 | 92% | 0.921 | 56% | 0.562 | S | S | * | * | trans | -72.9 | 104 | 174.2 | -62.4 | 180 | 98.1 | 172.1 | 7.6 | 109 | A69 T73 | A69-R71 PolarHBondContact O-N 2.94Å; R71-T73 PolarHBondContact O-N 3.34Å | ||
| 72 | S | 65.3 | Low | 70.9 | Confident | 87 Ų | 87 | 98 Ų | 98 | 61% | 0.608 | 54% | 0.535 | S | S | * | . | trans | -68.1 | 123.6 | 167.2 | 73.3 | 0 | 0 | 0 | 0 | 109.2 | A70 H74 | A70-S72 PolarHBondContact O-N 3.31Å; A70-S72 VanDerWaalsContact O-N 3.1Å; S72-H74 WeakPolarHBondContact CB-O 3.5Å; S72-H74 PolarHBondContact O-N 2.78Å; S72-H74 PolarHBondContact OG-O 3.1Å | ||
| 73 | T | 63.1 | Low | 70.3 | Confident | 131 Ų | 131 | 100.5 Ų | 100.5 | 80% | 0.804 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -67.4 | -20.3 | 172 | 50.5 | 0 | 0 | 0 | 0 | 111.8 | R71 | R71-T73 PolarHBondContact O-N 3.34Š|
| 74 | H | 63.5 | Low | 69.6 | Low | 132 Ų | 132 | 103.9 Ų | 103.9 | 61% | 0.611 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -98.9 | 117.5 | 174 | -61.1 | -67.8 | 0 | 0 | 0 | 109.8 | S72 V76 | S72-H74 WeakPolarHBondContact CB-O 3.5Å; S72-H74 PolarHBondContact O-N 2.78Å; S72-H74 PolarHBondContact OG-O 3.1Å; H74-V76 PolarHBondContact O-N 3.35Å; H74-V76 VanDerWaalsContact O-N 3.12Å |
| 75 | K | 59 | Low | 68.3 | Low | 181 Ų | 181 | 98.7 Ų | 98.7 | 79% | 0.787 | 54% | 0.543 | S | S | * | . | trans | -68.2 | 104.3 | 168 | -172.4 | -176.7 | -177.3 | -179 | 0 | 107.7 | T77 | K75-T77 HydrophobicContact CD-CG2 3.87Å; K75-T77 HydrophobicContact CG-CG2 3.83Å; K75-T77 PolarHBondContact O-N 3.03Å | ||
| 76 | V | 61.9 | Low | 67.1 | Low | 57 Ų | 57 | 99.5 Ų | 99.5 | 35% | 0.345 | 55% | 0.547 | S | S | . | . | trans | -76.1 | 104 | 173.5 | -173 | 0 | 0 | 0 | 0 | 107.8 | H74 E81 A82 M85 | H74-V76 PolarHBondContact O-N 3.35Å; H74-V76 VanDerWaalsContact O-N 3.12Å; V76-E81 HydrophobicContact CG1-CB 4.15Å; V76-A82 HydrophobicContact CG1-CB 3.63Å; V76-M85 HydrophobicContact CG2-CE 3.21Å | ||
| 77 | T | 62.3 | Low | 65.4 | Low | 102 Ų | 102 | 102.7 Ų | 102.7 | 63% | 0.626 | 57% | 0.571 | S | S | * | * | trans | -90.6 | -16.6 | -173 | 50 | 0 | 0 | 0 | 0 | 114.2 | K75 | K75-T77 HydrophobicContact CD-CG2 3.87Å; K75-T77 HydrophobicContact CG-CG2 3.83Å; K75-T77 PolarHBondContact O-N 3.03Å | ||
| 78 | N | 66.8 | Low | 63.8 | Low | 75 Ų | 75 | 102.1 Ų | 102.1 | 40% | 0.401 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -137.1 | 152.3 | 178.4 | 76.2 | 56.2 | 0 | 0 | 0 | 112.8 | G80 E81 A82 | N78-G80 VanDerWaalsContact C-N 3.26Å; N78-G80 PolarHBondContact O-N 3.12Å; N78-G80 WeakPolarHBondContact OD1-CA 3.19Å; N78-G80 PolarHBondContact OD1-N 2.93Å; N78-E81 PolarHBondContact ND2-OE1 3.33Å; N78-E81 PolarHBondContact ND2-OE2 3.33Å; N78-E81 PolarHBondContact O-N 2.99Å; N78-E81 WeakPolarHBondContact OD1-CB 3.46Å; N78-E81 WeakPolarHBondContact OD1-CG 3.38Å; N78-E81 PolarHBondContact OD1-N 3.17Å; N78-A82 PolarHBondContact O-N 3.17Å |
| 79 | F | 70.2 | Confident | 62.1 | Low | 175 Ų | 175 | 106.2 Ų | 106.2 | 77% | 0.768 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -60.9 | -32.9 | -179.4 | -177.5 | -101.9 | 0 | 0 | 0 | 112.7 | A82 V83 | F79-A82 WeakPolarHBondContact O-CB 3.43Å; F79-A82 PolarHBondContact O-N 3.32Å; F79-V83 HydrophobicContact CD1-CG2 4.12Å; F79-V83 HydrophobicContact CE1-CG2 3.76Å; F79-V83 HydrophobicContact CE2-CG2 4.24Å; F79-V83 HydrophobicContact CZ-CG2 3.83Å; F79-V83 VanDerWaalsContact O-CG2 3.3Å; F79-V83 WeakPolarHBondContact O-CG2 3.3Å; F79-V83 PolarHBondContact O-N 3.02Å |
| 80 | G | 70.8 | Confident | 59.9 | Low | 43 Ų | 43 | 114.2 Ų | 114.2 | 44% | 0.443 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67.3 | -37.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | N78 K84 | N78-G80 VanDerWaalsContact C-N 3.26Å; N78-G80 PolarHBondContact O-N 3.12Å; N78-G80 WeakPolarHBondContact OD1-CA 3.19Å; N78-G80 PolarHBondContact OD1-N 2.93Å; G80-K84 PolarHBondContact O-N 3.16Å |
| 81 | E | 68 | Low | 58 | Low | 88 Ų | 88 | 120.6 Ų | 120.6 | 41% | 0.411 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -69.8 | -40.5 | 173.8 | -77.5 | 167.2 | -171.7 | 0 | 0 | 111 | V76 N78 K84 M85 | V76-E81 HydrophobicContact CG1-CB 4.15Å; N78-E81 PolarHBondContact ND2-OE1 3.33Å; N78-E81 PolarHBondContact ND2-OE2 3.33Å; N78-E81 PolarHBondContact O-N 2.99Å; N78-E81 WeakPolarHBondContact OD1-CB 3.46Å; N78-E81 WeakPolarHBondContact OD1-CG 3.38Å; N78-E81 PolarHBondContact OD1-N 3.17Å; E81-K84 PolarHBondContact O-N 3.46Å; E81-M85 PolarHBondContact O-N 3.37Å |
| 82 | A | 64.7 | Low | 56.4 | Low | 27 Ų | 27 | 117.2 Ų | 117.2 | 22% | 0.223 | 62% | 0.615 | C | S | . | * | H | α-helix | trans | -57.8 | -50.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111 | V76 N78 F79 K84 M85 I86 | V76-A82 HydrophobicContact CG1-CB 3.63Å; N78-A82 PolarHBondContact O-N 3.17Å; F79-A82 WeakPolarHBondContact O-CB 3.43Å; F79-A82 PolarHBondContact O-N 3.32Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 3.18Å; A82-M85 PolarHBondContact O-N 3.35Å; A82-I86 WeakPolarHBondContact O-CD1 3.41Å; A82-I86 WeakPolarHBondContact O-CG1 3.39Å; A82-I86 PolarHBondContact O-N 3.05Å |
| 83 | V | 66 | Low | 54.8 | Low | 70 Ų | 70 | 120.8 Ų | 120.8 | 42% | 0.424 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -63.8 | -35.2 | -179.2 | 174.3 | 0 | 0 | 0 | 0 | 112 | F79 I86 S87 | F79-V83 HydrophobicContact CD1-CG2 4.12Å; F79-V83 HydrophobicContact CE1-CG2 3.76Å; F79-V83 HydrophobicContact CE2-CG2 4.24Å; F79-V83 HydrophobicContact CZ-CG2 3.83Å; F79-V83 VanDerWaalsContact O-CG2 3.3Å; F79-V83 WeakPolarHBondContact O-CG2 3.3Å; F79-V83 PolarHBondContact O-N 3.02Å; V83-I86 PolarHBondContact O-N 2.72Å; V83-S87 PolarHBondContact O-N 2.88Å |
| 84 | K | 64 | Low | 53.2 | Low | 156 Ų | 156 | 119.6 Ų | 119.6 | 68% | 0.678 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68.3 | -36.8 | 174.2 | -82.4 | -177.1 | 178.1 | 179.6 | 0 | 113.3 | G80 E81 A82 S87 | G80-K84 PolarHBondContact O-N 3.16Å; E81-K84 PolarHBondContact O-N 3.46Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 3.18Å; K84-S87 PolarHBondContact O-N 3.17Å; K84-S87 PolarHBondContact O-OG 2.96Å; K84-S87 VanDerWaalsContact O-OG 3.06Å |
| 85 | M | 54.4 | Low | 51.4 | Low | 101 Ų | 101 | 123.7 Ų | 123.7 | 50% | 0.498 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -71.7 | -36.4 | 175.2 | -71.4 | -146.5 | -69.3 | 0 | 0 | 111.7 | V76 E81 A82 S87 C88 | V76-M85 HydrophobicContact CG2-CE 3.21Å; E81-M85 PolarHBondContact O-N 3.37Å; A82-M85 PolarHBondContact O-N 3.35Å; M85-S87 VanDerWaalsContact C-N 3.34Å; M85-C88 PolarHBondContact O-N 3.37Å |
| 86 | I | 56.5 | Low | 50.1 | Low | 110 Ų | 110 | 121.1 Ų | 121.1 | 56% | 0.564 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.9 | -36 | 174.5 | -64.9 | 161.2 | 0 | 0 | 0 | 110.8 | A82 V83 C88 Q89 | A82-I86 WeakPolarHBondContact O-CD1 3.41Å; A82-I86 WeakPolarHBondContact O-CG1 3.39Å; A82-I86 PolarHBondContact O-N 3.05Å; V83-I86 PolarHBondContact O-N 2.72Å; I86-C88 PolarHBondContact O-N 3Å; I86-C88 VanDerWaalsContact O-N 3.17Å; I86-Q89 PolarHBondContact O-N 3.36Å; I86-Q89 VanDerWaalsContact O-N 3.16Å; I86-Q89 VanDerWaalsContact O-O 3.04Å |
| 87 | S | 45.3 | Very low | 48.5 | Very low | 95 Ų | 95 | 125.3 Ų | 125.3 | 66% | 0.664 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | -15.3 | 179.7 | 78.1 | 0 | 0 | 0 | 0 | 114.5 | V83 K84 M85 | V83-S87 PolarHBondContact O-N 2.88Å; K84-S87 PolarHBondContact O-N 3.17Å; K84-S87 PolarHBondContact O-OG 2.96Å; K84-S87 VanDerWaalsContact O-OG 3.06Å; M85-S87 VanDerWaalsContact C-N 3.34Å |
| 88 | C | 47 | Very low | 46.9 | Very low | 112 Ų | 112 | 130.5 Ų | 130.5 | 76% | 0.757 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -8 | 176.1 | -77.5 | 0 | 0 | 0 | 0 | 113.7 | M85 I86 | M85-C88 PolarHBondContact O-N 3.37Å; I86-C88 PolarHBondContact O-N 3Å; I86-C88 VanDerWaalsContact O-N 3.17Å |
| 89 | Q | 41.2 | Very low | 45.3 | Very low | 158 Ų | 158 | 135.8 Ų | 135.8 | 74% | 0.738 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -118.8 | 112.8 | 174.9 | -66.4 | -159.8 | -12.8 | 0 | 0 | 109.9 | I86 F91 | I86-Q89 PolarHBondContact O-N 3.36Å; I86-Q89 VanDerWaalsContact O-N 3.16Å; I86-Q89 VanDerWaalsContact O-O 3.04Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.17Å |
| 90 | H | 29.6 | Very low | 43.7 | Very low | 202 Ų | 202 | 130.2 Ų | 130.2 | 94% | 0.935 | 66% | 0.661 | S | S | * | * | trans | -60.9 | 94.4 | 170.4 | -127.4 | 88.1 | 0 | 0 | 0 | 108.5 | ||||
| 91 | F | 32.2 | Very low | 42.4 | Very low | 187 Ų | 187 | 137.3 Ų | 137.3 | 82% | 0.82 | 68% | 0.682 | S | S | * | * | trans | -148.6 | 124.6 | 163.6 | -138.2 | -96.8 | 0 | 0 | 0 | 110.6 | Q89 | Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.17Å | ||
| 92 | Q | 32.3 | Very low | 41 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 81% | 0.808 | 69% | 0.689 | S | S | * | * | trans | -66.2 | 133 | 180 | -74.1 | -179.9 | -50.2 | 0 | 0 | 110.2 | V94 | Q92-V94 PolarHBondContact O-N 2.94Š| ||
| 93 | I | 31.2 | Very low | 39.8 | Very low | 161 Ų | 161 | 142.3 Ų | 142.3 | 83% | 0.826 | 71% | 0.711 | S | S | * | * | trans | -59.7 | 102.8 | 159.9 | -81.1 | 163.3 | 0 | 0 | 0 | 107.4 | ||||
| 94 | V | 30.5 | Very low | 38.3 | Very low | 107 Ų | 107 | 146.2 Ų | 146.2 | 65% | 0.648 | 72% | 0.722 | S | S | * | * | trans | -85 | 108.8 | 159.5 | -176 | 0 | 0 | 0 | 0 | 106.4 | Q92 I96 | Q92-V94 PolarHBondContact O-N 2.94Å; V94-I96 VanDerWaalsContact C-N 3.32Å; V94-I96 HydrophobicContact CB-CG1 4.41Å; V94-I96 HydrophobicContact CG1-CD1 4.16Å; V94-I96 HydrophobicContact CG1-CG1 3.6Å; V94-I96 PolarHBondContact O-N 3.06Å | ||
| 95 | R | 25.9 | Very low | 37 | Very low | 217 Ų | 217 | 142.5 Ų | 142.5 | 82% | 0.819 | 71% | 0.712 | S | S | * | * | trans | -72.6 | 85.7 | 172.4 | -160.1 | -177 | -163.1 | -162.7 | 4.1 | 107.7 | L97 | R95-L97 PolarHBondContact O-N 3.5Š| ||
| 96 | I | 31.4 | Very low | 36 | Very low | 127 Ų | 127 | 142.5 Ų | 142.5 | 65% | 0.651 | 72% | 0.722 | S | S | * | * | trans | -87.2 | 89.8 | 170.2 | -55.8 | -177.9 | 0 | 0 | 0 | 107.5 | V94 | V94-I96 VanDerWaalsContact C-N 3.32Å; V94-I96 HydrophobicContact CB-CG1 4.41Å; V94-I96 HydrophobicContact CG1-CD1 4.16Å; V94-I96 HydrophobicContact CG1-CG1 3.6Å; V94-I96 PolarHBondContact O-N 3.06Å | ||
| 97 | L | 28.7 | Very low | 34.8 | Very low | 145 Ų | 145 | 146.3 Ų | 146.3 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | trans | -123.9 | 120.1 | 162.2 | -86.7 | 165.7 | 0 | 0 | 0 | 106.2 | R95 | R95-L97 PolarHBondContact O-N 3.5Š| ||
| 98 | R | 28.1 | Very low | 34.3 | Very low | 212 Ų | 212 | 148.9 Ų | 148.9 | 80% | 0.8 | 76% | 0.761 | S | S | * | * | trans | 73.2 | 98.9 | -174.4 | -59.4 | -155.2 | -171.9 | -145.1 | 5.7 | 116.2 | ||||
| 99 | F | 33.9 | Very low | 33.6 | Very low | 186 Ų | 186 | 150.8 Ų | 150.8 | 82% | 0.816 | 76% | 0.761 | S | S | * | * | trans | -125.7 | 115 | 136 | -106.8 | -91.4 | 0 | 0 | 0 | 107.2 | ||||
| 100 | G | 35.8 | Very low | 33.2 | Very low | 57 Ų | 57 | 150.4 Ų | 150.4 | 59% | 0.588 | 76% | 0.762 | S | S | * | * | trans | -62.9 | 150.7 | 156.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 101 | E | 43 | Very low | 33.4 | Very low | 193 Ų | 193 | 147.4 Ų | 147.4 | 90% | 0.902 | 75% | 0.752 | S | S | * | * | S | Bend | trans | 87.4 | 17.4 | 158.4 | -48.2 | -171.6 | 155.1 | 0 | 0 | 119.9 | ||
| 102 | V | 39.6 | Very low | 33.5 | Very low | 92 Ų | 92 | 144.9 Ų | 144.9 | 56% | 0.558 | 75% | 0.748 | S | S | * | * | trans | -133.4 | 100 | 167.2 | -169 | 0 | 0 | 0 | 0 | 112.2 | F104 | V102-F104 HydrophobicContact CG1-CD2 3.65Å; V102-F104 HydrophobicContact CG1-CE2 3.86Å | ||
| 103 | L | 38.3 | Very low | 33.5 | Very low | 128 Ų | 128 | 143 Ų | 143 | 67% | 0.67 | 74% | 0.744 | S | S | * | * | trans | -99.8 | 109.2 | 167 | -172.7 | 78 | 0 | 0 | 0 | 107.6 | F31 V105 | F31-L103 HydrophobicContact CE2-CD2 4.47Å; F31-L103 HydrophobicContact CZ-CD2 4.37Å; L103-V105 HydrophobicContact CD2-CG2 3.76Å; L103-V105 HydrophobicContact CG-CG2 3.89Å | ||
| 104 | F | 35.9 | Very low | 33.7 | Very low | 151 Ų | 151 | 141.7 Ų | 141.7 | 66% | 0.662 | 74% | 0.738 | S | S | * | * | trans | -92.3 | 110.5 | 164.9 | -98.1 | -91.5 | 0 | 0 | 0 | 108.4 | V102 | V102-F104 HydrophobicContact CG1-CD2 3.65Å; V102-F104 HydrophobicContact CG1-CE2 3.86Å | ||
| 105 | V | 35.8 | Very low | 34 | Very low | 79 Ų | 79 | 144.4 Ų | 144.4 | 48% | 0.479 | 75% | 0.745 | S | S | . | * | trans | -102.9 | 111.5 | 165.1 | -178.2 | 0 | 0 | 0 | 0 | 106.8 | F31 L103 | F31-V105 HydrophobicContact CD1-CG2 4.44Å; F31-V105 HydrophobicContact CE1-CB 3.99Å; F31-V105 HydrophobicContact CE1-CG2 3.72Å; F31-V105 HydrophobicContact CZ-CG2 4.3Å; L103-V105 HydrophobicContact CD2-CG2 3.76Å; L103-V105 HydrophobicContact CG-CG2 3.89Å | ||
| 106 | S | 34.6 | Very low | 34.6 | Very low | 101 Ų | 101 | 138.3 Ų | 138.3 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | trans | -82.1 | 122.9 | 160.1 | -164.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 107 | C | 30.6 | Very low | 34.9 | Very low | 189 Ų | 189 | 139.4 Ų | 139.4 | 100% | 1.277 | 75% | 0.747 | S | S | * | * | trans | -69.6 | 0 | 170 | -86.5 | 0 | 0 | 0 | 0 | 111.3 |
Retrieved 107 of 107 residues in 43.3 ms
(Link to these results)