| 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 | 42.8 | Very low | 44.8 | Very low | 238 Ų | 238 | 162.5 Ų | 162.5 | 100% | 1.172 | 83% | 0.827 | S | S | * | * | 0 | 126 | 0 | -69.3 | -172 | -177.8 | 0 | 0 | 107.4 | |||||
| 2 | K | 45.4 | Very low | 45.1 | Very low | 190 Ų | 190 | 157.8 Ų | 157.8 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | trans | -100 | 113.2 | 174.4 | -77.2 | -178.3 | 177.2 | -178.4 | 0 | 107.4 | ||||
| 3 | E | 39.8 | Very low | 45 | Very low | 182 Ų | 182 | 156.3 Ų | 156.3 | 85% | 0.85 | 81% | 0.814 | S | S | * | * | trans | -73.7 | 120.7 | 177.2 | -64.9 | -179.7 | -174.4 | 0 | 0 | 108.8 | S5 | E3-S5 PolarHBondContact O-N 2.9Š| ||
| 4 | Y | 49.9 | Very low | 45.4 | Very low | 210 Ų | 210 | 153.5 Ų | 153.5 | 82% | 0.824 | 81% | 0.81 | S | S | * | * | trans | -86.7 | 98.7 | 174.9 | -72.9 | -87.2 | 0 | 0 | 0 | 108.7 | S6 | Y4-S6 PolarHBondContact O-N 3.25Š| ||
| 5 | S | 48.3 | Very low | 45.8 | Very low | 110 Ų | 110 | 149.3 Ų | 149.3 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -58 | 117.1 | 171.7 | -60.4 | 0 | 0 | 0 | 0 | 110.7 | E3 S7 | E3-S5 PolarHBondContact O-N 2.9Å; S5-S7 PolarHBondContact O-N 3.43Å | ||
| 6 | S | 45.5 | Very low | 46.3 | Very low | 125 Ų | 125 | 150.6 Ų | 150.6 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -92.3 | 95 | 179.1 | -3.6 | 0 | 0 | 0 | 0 | 108.9 | Y4 | Y4-S6 PolarHBondContact O-N 3.25Š| ||
| 7 | S | 47.2 | Very low | 46.7 | Very low | 94 Ų | 94 | 147.3 Ų | 147.3 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | trans | -148.1 | 83.1 | 173.1 | 63.3 | 0 | 0 | 0 | 0 | 111.7 | S5 | S5-S7 PolarHBondContact O-N 3.43Š| ||
| 8 | I | 49.2 | Very low | 47.2 | Very low | 139 Ų | 139 | 144.5 Ų | 144.5 | 71% | 0.713 | 78% | 0.775 | S | S | * | * | trans | -127.3 | 83.7 | 147.8 | -56.3 | 177.9 | 0 | 0 | 0 | 106.2 | H10 | I8-H10 VanDerWaalsContact C-N 3.25Å; I8-H10 PolarHBondContact O-N 2.99Å | ||
| 9 | L | 39.2 | Very low | 48 | Very low | 163 Ų | 163 | 145.6 Ų | 145.6 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | -53.9 | 93.4 | 156.2 | -87.3 | 143.1 | 0 | 0 | 0 | 107.2 | Q11 | L9-Q11 VanDerWaalsContact C-N 3.3Å; L9-Q11 PolarHBondContact O-N 3.34Å | ||
| 10 | H | 45.6 | Very low | 48.9 | Very low | 163 Ų | 163 | 147.5 Ų | 147.5 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | -66.9 | 99.9 | 164.3 | -80.3 | 98 | 0 | 0 | 0 | 106.7 | I8 S12 | I8-H10 VanDerWaalsContact C-N 3.25Å; I8-H10 PolarHBondContact O-N 2.99Å; H10-S12 VanDerWaalsContact C-N 3.32Å; H10-S12 PolarHBondContact O-N 3.24Å | ||
| 11 | Q | 39.8 | Very low | 49.8 | Very low | 173 Ų | 173 | 150.6 Ų | 150.6 | 81% | 0.808 | 78% | 0.781 | S | S | * | * | trans | -52.7 | 99.5 | 165.5 | -75.4 | 170 | 2 | 0 | 0 | 107.5 | L9 N13 | L9-Q11 VanDerWaalsContact C-N 3.3Å; L9-Q11 PolarHBondContact O-N 3.34Å; Q11-N13 VanDerWaalsContact C-N 3.3Å; Q11-N13 PolarHBondContact O-N 2.86Å | ||
| 12 | S | 47.9 | Very low | 51.4 | Low | 106 Ų | 106 | 144.4 Ų | 144.4 | 74% | 0.741 | 76% | 0.757 | S | S | * | * | trans | -65.3 | 98.4 | 164.8 | 54.8 | 0 | 0 | 0 | 0 | 105.9 | H10 P14 | H10-S12 VanDerWaalsContact C-N 3.32Å; H10-S12 PolarHBondContact O-N 3.24Å; S12-P14 WeakPolarHBondContact O-CD 3.4Å | ||
| 13 | N | 44.6 | Very low | 53.1 | Low | 139 Ų | 139 | 145.4 Ų | 145.4 | 74% | 0.743 | 76% | 0.761 | S | S | * | * | trans | -52 | 115.2 | 167.9 | -81 | -21.8 | 0 | 0 | 0 | 106.8 | Q11 S15 | Q11-N13 VanDerWaalsContact C-N 3.3Å; Q11-N13 PolarHBondContact O-N 2.86Å; N13-S15 PolarHBondContact O-N 3.06Å | ||
| 14 | P | 50.4 | Low | 55.2 | Low | 117 Ų | 117 | 140.4 Ų | 140.4 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | trans | -72.7 | 84.3 | 170.4 | 30.6 | -28.2 | 0 | 0 | 0 | 104.5 | S12 H16 | S12-P14 WeakPolarHBondContact O-CD 3.4Å; P14-H16 PolarHBondContact O-N 3.25Å | ||
| 15 | S | 51.4 | Low | 57.2 | Low | 90 Ų | 90 | 133.1 Ų | 133.1 | 63% | 0.629 | 72% | 0.719 | S | S | * | * | trans | -60.9 | 90.8 | 156.8 | 178.8 | 0 | 0 | 0 | 0 | 103.7 | N13 N17 | N13-S15 PolarHBondContact O-N 3.06Å; S15-N17 PolarHBondContact O-N 3.33Å | ||
| 16 | H | 52.9 | Low | 59.3 | Low | 170 Ų | 170 | 132.4 Ų | 132.4 | 79% | 0.787 | 71% | 0.712 | S | S | * | * | trans | -68.2 | 70.6 | 171.6 | -160.7 | -45 | 0 | 0 | 0 | 104.4 | P14 S18 | P14-H16 PolarHBondContact O-N 3.25Å; H16-S18 PolarHBondContact O-N 3.4Å | ||
| 17 | N | 53.4 | Low | 61.6 | Low | 95 Ų | 95 | 134 Ų | 134 | 51% | 0.508 | 71% | 0.706 | S | S | . | * | trans | -56.4 | 99.3 | 165.5 | -88.3 | -41.2 | 0 | 0 | 0 | 103.4 | S15 F19 | S15-N17 PolarHBondContact O-N 3.33Å; N17-F19 HydrophobicContact CB-CD1 4.32Å; N17-F19 HydrophobicContact CB-CD2 3.69Å; N17-F19 HydrophobicContact CB-CE1 3.95Å; N17-F19 HydrophobicContact CB-CE2 3.27Å; N17-F19 HydrophobicContact CB-CG 4.21Å; N17-F19 HydrophobicContact CB-CZ 3.41Å; N17-F19 VanDerWaalsContact CB-CZ 3.41Å; N17-F19 WeakPolarHBondContact O-CD2 3.4Å; N17-F19 PolarHBondContact O-N 3.44Å | ||
| 18 | S | 56.8 | Low | 63.7 | Low | 97 Ų | 97 | 135.2 Ų | 135.2 | 68% | 0.678 | 70% | 0.699 | S | S | * | * | trans | -68.6 | 73.6 | 169.3 | 51.2 | 0 | 0 | 0 | 0 | 105.2 | H16 K20 | H16-S18 PolarHBondContact O-N 3.4Å; S18-K20 PolarHBondContact O-N 2.87Å | ||
| 19 | F | 61.6 | Low | 65.8 | Low | 165 Ų | 165 | 132 Ų | 132 | 72% | 0.724 | 68% | 0.683 | S | S | * | * | trans | -61.6 | 94.7 | 169.5 | -64.4 | -71.1 | 0 | 0 | 0 | 104.6 | N17 K21 | N17-F19 HydrophobicContact CB-CD1 4.32Å; N17-F19 HydrophobicContact CB-CD2 3.69Å; N17-F19 HydrophobicContact CB-CE1 3.95Å; N17-F19 HydrophobicContact CB-CE2 3.27Å; N17-F19 HydrophobicContact CB-CG 4.21Å; N17-F19 HydrophobicContact CB-CZ 3.41Å; N17-F19 VanDerWaalsContact CB-CZ 3.41Å; N17-F19 WeakPolarHBondContact O-CD2 3.4Å; N17-F19 PolarHBondContact O-N 3.44Å; F19-K21 PolarHBondContact O-N 3.03Å | ||
| 20 | K | 66 | Low | 68.3 | Low | 183 Ų | 183 | 129.1 Ų | 129.1 | 80% | 0.796 | 67% | 0.668 | S | S | * | * | trans | -49.2 | 117.4 | 167.2 | -70.8 | -175.3 | 179.4 | 179.7 | 0 | 104.5 | S18 T22 | S18-K20 PolarHBondContact O-N 2.87Å; K20-T22 PolarHBondContact O-N 3.05Å | ||
| 21 | K | 68.5 | Low | 70.4 | Confident | 213 Ų | 213 | 128.7 Ų | 128.7 | 93% | 0.926 | 66% | 0.664 | S | S | * | * | trans | -62.2 | 91 | 179.7 | -70.7 | -176.6 | 179.6 | -179.9 | 0 | 107.1 | F19 K23 | F19-K21 PolarHBondContact O-N 3.03Å; K21-K23 PolarHBondContact O-N 3.03Å | ||
| 22 | T | 75 | Confident | 72.5 | Confident | 109 Ų | 109 | 123.9 Ų | 123.9 | 67% | 0.669 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 121.8 | 177.5 | 48.3 | 0 | 0 | 0 | 0 | 106.7 | K20 L24 | K20-T22 PolarHBondContact O-N 3.05Å; T22-L24 PolarHBondContact O-N 3.22Å |
| 23 | K | 82.7 | Confident | 74.4 | Confident | 211 Ų | 211 | 123 Ų | 123 | 92% | 0.917 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.4 | 170.1 | -70.6 | -176.1 | 179.3 | -179.9 | 0 | 107.3 | K21 | K21-K23 PolarHBondContact O-N 3.03Š|
| 24 | L | 83.8 | Confident | 76.4 | Confident | 77 Ų | 77 | 122 Ų | 122 | 40% | 0.403 | 62% | 0.62 | S | S | . | * | P | Polyproline II helix | trans | -80.9 | 142.7 | 175.9 | -63.5 | 173.3 | 0 | 0 | 0 | 109.3 | T22 K28 I29 I32 | T22-L24 PolarHBondContact O-N 3.22Å; L24-K28 HydrophobicContact CD2-CD 3.77Å; L24-K28 HydrophobicContact CD2-CG 4.28Å; L24-I29 HydrophobicContact CB-CD1 4.22Å; L24-I29 HydrophobicContact CB-CG1 3.88Å; L24-I29 HydrophobicContact CD1-CG1 4.45Å; L24-I32 HydrophobicContact CD1-CD1 4.28Å |
| 25 | S | 91.5 | Very high | 77.8 | Confident | 56 Ų | 56 | 125.1 Ų | 125.1 | 39% | 0.392 | 62% | 0.617 | S | S | . | * | P | Polyproline II helix | trans | -71.3 | 152.1 | 171 | 66.3 | 0 | 0 | 0 | 0 | 110.4 | Q27 K28 I29 | S25-Q27 PolarHBondContact O-N 3.25Å; S25-K28 PolarHBondContact O-N 3.34Å; S25-K28 PolarHBondContact OG-N 3.07Å; S25-I29 WeakPolarHBondContact O-CG1 3.49Å; S25-I29 PolarHBondContact O-N 3.4Å |
| 26 | P | 93.1 | Very high | 79.2 | Confident | 96 Ų | 96 | 127.5 Ų | 127.5 | 62% | 0.623 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -53.6 | -38.4 | 174.9 | -27.6 | 35.2 | 0 | 0 | 0 | 113.3 | K28 I29 N30 | P26-K28 PolarHBondContact O-N 3.24Å; P26-I29 PolarHBondContact O-N 2.8Å; P26-N30 PolarHBondContact O-N 3.24Å |
| 27 | Q | 92.8 | Very high | 80.7 | Confident | 159 Ų | 159 | 123.9 Ų | 123.9 | 74% | 0.743 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -60.4 | -42.5 | 176.2 | -68.1 | 174.3 | -24.1 | 0 | 0 | 112.5 | S25 I29 N30 K31 | S25-Q27 PolarHBondContact O-N 3.25Å; Q27-I29 VanDerWaalsContact C-N 3.35Å; Q27-N30 PolarHBondContact O-N 3.26Å; Q27-K31 PolarHBondContact O-N 3.13Å |
| 28 | K | 91 | Very high | 81.8 | Confident | 119 Ų | 119 | 124.1 Ų | 124.1 | 52% | 0.517 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -69.8 | -35.5 | 178.7 | -170.4 | 163.7 | 177.1 | -178 | 0 | 111.4 | L24 S25 P26 I32 | L24-K28 HydrophobicContact CD2-CD 3.77Å; L24-K28 HydrophobicContact CD2-CG 4.28Å; S25-K28 PolarHBondContact O-N 3.34Å; S25-K28 PolarHBondContact OG-N 3.07Å; P26-K28 PolarHBondContact O-N 3.24Å; K28-I32 HydrophobicContact CG-CD1 4.4Å; K28-I32 WeakPolarHBondContact O-CD1 3.42Å; K28-I32 VanDerWaalsContact O-CG1 3.29Å; K28-I32 WeakPolarHBondContact O-CG1 3.37Å; K28-I32 PolarHBondContact O-N 3.42Å; K28-I32 VanDerWaalsContact O-N 3.13Å |
| 29 | I | 92.8 | Very high | 82.4 | Confident | 72 Ų | 72 | 128.7 Ų | 128.7 | 37% | 0.369 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.2 | -49.7 | 173.6 | -65.7 | 168.3 | 0 | 0 | 0 | 110.1 | L24 S25 P26 Q27 K31 I32 I33 | L24-I29 HydrophobicContact CB-CD1 4.22Å; L24-I29 HydrophobicContact CB-CG1 3.88Å; L24-I29 HydrophobicContact CD1-CG1 4.45Å; S25-I29 WeakPolarHBondContact O-CG1 3.49Å; S25-I29 PolarHBondContact O-N 3.4Å; P26-I29 PolarHBondContact O-N 2.8Å; Q27-I29 VanDerWaalsContact C-N 3.35Å; I29-K31 VanDerWaalsContact C-N 3.3Å; I29-K31 PolarHBondContact O-N 3.39Å; I29-I32 WeakPolarHBondContact O-CB 3.47Å; I29-I32 PolarHBondContact O-N 2.93Å; I29-I33 HydrophobicContact CG2-CD1 3.75Å; I29-I33 HydrophobicContact CG2-CG1 4.3Å; I29-I33 WeakPolarHBondContact O-CG1 3.24Å; I29-I33 PolarHBondContact O-N 3.01Å |
| 30 | N | 93.1 | Very high | 82.8 | Confident | 101 Ų | 101 | 123.8 Ų | 123.8 | 54% | 0.54 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -58.9 | -41.6 | 179 | -71.6 | -11.4 | 0 | 0 | 0 | 112.2 | P26 Q27 I32 I33 E34 | P26-N30 PolarHBondContact O-N 3.24Å; Q27-N30 PolarHBondContact O-N 3.26Å; N30-I32 VanDerWaalsContact C-N 3.31Å; N30-I32 PolarHBondContact O-N 3.34Å; N30-I33 PolarHBondContact O-N 3.17Å; N30-E34 WeakPolarHBondContact O-CB 3.48Å; N30-E34 PolarHBondContact O-N 2.71Å |
| 31 | K | 88.3 | Confident | 82.8 | Confident | 154 Ų | 154 | 123.2 Ų | 123.2 | 67% | 0.67 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -62 | -37.3 | 175 | -174 | 173.1 | -176.5 | 172.9 | 0 | 112.9 | Q27 I29 R35 | Q27-K31 PolarHBondContact O-N 3.13Å; I29-K31 VanDerWaalsContact C-N 3.3Å; I29-K31 PolarHBondContact O-N 3.39Å; K31-R35 WeakPolarHBondContact O-CB 3.31Å; K31-R35 PolarHBondContact O-N 3.25Å; K31-R35 VanDerWaalsContact O-N 3.17Å |
| 32 | I | 85.5 | Confident | 82.7 | Confident | 73 Ų | 73 | 119 Ų | 119 | 37% | 0.374 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.4 | -44.7 | 175.6 | -68 | 163 | 0 | 0 | 0 | 110.2 | L24 K28 I29 N30 R35 L36 | L24-I32 HydrophobicContact CD1-CD1 4.28Å; K28-I32 HydrophobicContact CG-CD1 4.4Å; K28-I32 WeakPolarHBondContact O-CD1 3.42Å; K28-I32 VanDerWaalsContact O-CG1 3.29Å; K28-I32 WeakPolarHBondContact O-CG1 3.37Å; K28-I32 PolarHBondContact O-N 3.42Å; K28-I32 VanDerWaalsContact O-N 3.13Å; I29-I32 WeakPolarHBondContact O-CB 3.47Å; I29-I32 PolarHBondContact O-N 2.93Å; N30-I32 VanDerWaalsContact C-N 3.31Å; N30-I32 PolarHBondContact O-N 3.34Å; I32-R35 PolarHBondContact O-N 2.65Å; I32-L36 HydrophobicContact CG2-CD1 3.71Å; I32-L36 HydrophobicContact CG2-CG 4.32Å; I32-L36 WeakPolarHBondContact O-CB 3.47Å; I32-L36 VanDerWaalsContact O-CG 3.31Å; I32-L36 WeakPolarHBondContact O-CG 3.29Å; I32-L36 PolarHBondContact O-N 3.31Å |
| 33 | I | 88.2 | Confident | 82.1 | Confident | 86 Ų | 86 | 119.7 Ų | 119.7 | 44% | 0.441 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -57.5 | -54.5 | 177.4 | -68.5 | 170.3 | 0 | 0 | 0 | 109.6 | I29 N30 R35 L36 T37 | I29-I33 HydrophobicContact CG2-CD1 3.75Å; I29-I33 HydrophobicContact CG2-CG1 4.3Å; I29-I33 WeakPolarHBondContact O-CG1 3.24Å; I29-I33 PolarHBondContact O-N 3.01Å; N30-I33 PolarHBondContact O-N 3.17Å; I33-R35 VanDerWaalsContact C-N 3.28Å; I33-R35 PolarHBondContact O-N 2.79Å; I33-L36 CarbonylContact O-C 3.57Å; I33-L36 PolarHBondContact O-N 2.95Å; I33-T37 HydrophobicContact CG2-CG2 3.88Å; I33-T37 WeakPolarHBondContact O-CG2 3.15Å; I33-T37 PolarHBondContact O-N 2.73Å; I33-T37 PolarHBondContact O-OG1 3.04Å |
| 34 | E | 86.5 | Confident | 80.9 | Confident | 119 Ų | 119 | 111.3 Ų | 111.3 | 56% | 0.556 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -54.7 | -44.2 | -179.9 | -174.6 | 179.8 | -167.5 | 0 | 0 | 111.9 | N30 L36 T37 N38 | N30-E34 WeakPolarHBondContact O-CB 3.48Å; N30-E34 PolarHBondContact O-N 2.71Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.19Å; E34-T37 PolarHBondContact O-OG1 2.72Å; E34-N38 WeakPolarHBondContact CG-ND2 3.39Å; E34-N38 VanDerWaalsContact O-CB 3.24Å; E34-N38 WeakPolarHBondContact O-CB 3.3Å; E34-N38 PolarHBondContact O-N 2.75Å; E34-N38 PolarHBondContact O-ND2 2.77Å |
| 35 | R | 79.1 | Confident | 79.7 | Confident | 183 Ų | 183 | 111.8 Ų | 111.8 | 69% | 0.691 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.9 | -36.4 | 175.6 | -178.3 | -177 | 175.5 | -164.6 | -0.8 | 113 | K31 I32 I33 | K31-R35 WeakPolarHBondContact O-CB 3.31Å; K31-R35 PolarHBondContact O-N 3.25Å; K31-R35 VanDerWaalsContact O-N 3.17Å; I32-R35 PolarHBondContact O-N 2.65Å; I33-R35 VanDerWaalsContact C-N 3.28Å; I33-R35 PolarHBondContact O-N 2.79Å |
| 36 | L | 80.4 | Confident | 78.1 | Confident | 139 Ų | 139 | 114.6 Ų | 114.6 | 73% | 0.728 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -89.6 | -24 | -175.5 | -67.4 | 177.3 | 0 | 0 | 0 | 113.3 | I32 I33 E34 | I32-L36 HydrophobicContact CG2-CD1 3.71Å; I32-L36 HydrophobicContact CG2-CG 4.32Å; I32-L36 WeakPolarHBondContact O-CB 3.47Å; I32-L36 VanDerWaalsContact O-CG 3.31Å; I32-L36 WeakPolarHBondContact O-CG 3.29Å; I32-L36 PolarHBondContact O-N 3.31Å; I33-L36 CarbonylContact O-C 3.57Å; I33-L36 PolarHBondContact O-N 2.95Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.19Å |
| 37 | T | 84.4 | Confident | 76.3 | Confident | 95 Ų | 95 | 117.2 Ų | 117.2 | 58% | 0.583 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -85 | -30.9 | 176.2 | 53.9 | 0 | 0 | 0 | 0 | 112.2 | I33 E34 Y39 | I33-T37 HydrophobicContact CG2-CG2 3.88Å; I33-T37 WeakPolarHBondContact O-CG2 3.15Å; I33-T37 PolarHBondContact O-N 2.73Å; I33-T37 PolarHBondContact O-OG1 3.04Å; E34-T37 PolarHBondContact O-OG1 2.72Å; T37-Y39 PolarHBondContact O-N 2.73Å |
| 38 | N | 77.5 | Confident | 74.7 | Confident | 100 Ų | 100 | 111.7 Ų | 111.7 | 54% | 0.535 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -85.1 | 98.7 | 178.9 | -64.4 | -18.5 | 0 | 0 | 0 | 109.4 | E34 D40 | E34-N38 WeakPolarHBondContact CG-ND2 3.39Å; E34-N38 VanDerWaalsContact O-CB 3.24Å; E34-N38 WeakPolarHBondContact O-CB 3.3Å; E34-N38 PolarHBondContact O-N 2.75Å; E34-N38 PolarHBondContact O-ND2 2.77Å; N38-D40 PolarHBondContact O-N 3.09Å |
| 39 | Y | 68.8 | Low | 73.2 | Confident | 192 Ų | 192 | 109.4 Ų | 109.4 | 75% | 0.753 | 56% | 0.561 | S | S | * | * | trans | -73.1 | 109.3 | 171.1 | 177 | -110.1 | 0 | 0 | 0 | 110 | T37 K41 | T37-Y39 PolarHBondContact O-N 2.73Å; Y39-K41 HydrophobicContact CD1-CG 4.08Å; Y39-K41 HydrophobicContact CE1-CB 4.41Å; Y39-K41 HydrophobicContact CE1-CD 4.16Å; Y39-K41 HydrophobicContact CE1-CG 3.25Å | ||
| 40 | D | 69 | Low | 71.7 | Confident | 63 Ų | 63 | 110.3 Ų | 110.3 | 34% | 0.337 | 57% | 0.574 | S | S | . | * | trans | -104.8 | 114.8 | 170.2 | -173.7 | -20.8 | 0 | 0 | 0 | 109 | N38 T42 I43 | N38-D40 PolarHBondContact O-N 3.09Å; D40-T42 PolarHBondContact O-N 2.83Å; D40-T42 WeakPolarHBondContact OD1-CA 3.43Å; D40-T42 WeakPolarHBondContact OD1-CB 3.06Å; D40-T42 PolarHBondContact OD1-N 3.37Å; D40-T42 PolarHBondContact OD1-OG1 2.7Å; D40-T42 PolarHBondContact OD2-OG1 2.78Å; D40-I43 HydrophobicContact CB-CB 3.95Å; D40-I43 HydrophobicContact CB-CD1 4.39Å; D40-I43 HydrophobicContact CB-CG1 4.23Å; D40-I43 CarbonylContact O-C 3.55Å; D40-I43 VanDerWaalsContact O-C 3.23Å; D40-I43 PolarHBondContact O-N 2.83Å; D40-I43 VanDerWaalsContact O-O 3.07Å; D40-I43 PolarHBondContact OD1-N 2.83Å; D40-I43 WeakPolarHBondContact OD2-CD1 3.41Å; D40-I43 VanDerWaalsContact OD2-CG1 3.3Å; D40-I43 WeakPolarHBondContact OD2-CG1 3.37Å | ||
| 41 | K | 66.2 | Low | 70.3 | Confident | 171 Ų | 171 | 110.6 Ų | 110.6 | 74% | 0.743 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -61.5 | -27.3 | 178.3 | -71.3 | -179 | -179.7 | -179.4 | 0 | 112.7 | Y39 | Y39-K41 HydrophobicContact CD1-CG 4.08Å; Y39-K41 HydrophobicContact CE1-CB 4.41Å; Y39-K41 HydrophobicContact CE1-CD 4.16Å; Y39-K41 HydrophobicContact CE1-CG 3.25Å |
| 42 | T | 67.6 | Low | 69.7 | Low | 124 Ų | 124 | 107.3 Ų | 107.3 | 76% | 0.761 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -85.3 | -26.5 | 180 | 73.1 | 0 | 0 | 0 | 0 | 111.8 | D40 | D40-T42 PolarHBondContact O-N 2.83Å; D40-T42 WeakPolarHBondContact OD1-CA 3.43Å; D40-T42 WeakPolarHBondContact OD1-CB 3.06Å; D40-T42 PolarHBondContact OD1-N 3.37Å; D40-T42 PolarHBondContact OD1-OG1 2.7Å; D40-T42 PolarHBondContact OD2-OG1 2.78Å |
| 43 | I | 62.4 | Low | 69.3 | Low | 123 Ų | 123 | 107.9 Ų | 107.9 | 63% | 0.631 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -105.7 | 73 | 175.2 | -49.7 | 173.3 | 0 | 0 | 0 | 107.8 | D40 | D40-I43 HydrophobicContact CB-CB 3.95Å; D40-I43 HydrophobicContact CB-CD1 4.39Å; D40-I43 HydrophobicContact CB-CG1 4.23Å; D40-I43 CarbonylContact O-C 3.55Å; D40-I43 VanDerWaalsContact O-C 3.23Å; D40-I43 PolarHBondContact O-N 2.83Å; D40-I43 VanDerWaalsContact O-O 3.07Å; D40-I43 PolarHBondContact OD1-N 2.83Å; D40-I43 WeakPolarHBondContact OD2-CD1 3.41Å; D40-I43 VanDerWaalsContact OD2-CG1 3.3Å; D40-I43 WeakPolarHBondContact OD2-CG1 3.37Å |
| 44 | G | 57 | Low | 68.9 | Low | 35 Ų | 35 | 110.4 Ų | 110.4 | 36% | 0.361 | 57% | 0.565 | S | S | . | * | trans | -57.2 | 157.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 45 | P | 59 | Low | 68.9 | Low | 87 Ų | 87 | 109 Ų | 109 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | trans | -51.8 | 144.1 | 168.9 | 15.8 | -23.9 | 0 | 0 | 0 | 109.4 | E47 S48 | P45-E47 PolarHBondContact O-N 2.71Å; P45-S48 WeakPolarHBondContact O-CA 3.22Å; P45-S48 WeakPolarHBondContact O-CB 3.4Å; P45-S48 PolarHBondContact O-N 2.9Å | ||
| 46 | P | 57.5 | Low | 68.9 | Low | 116 Ų | 116 | 101.1 Ų | 101.1 | 75% | 0.753 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -20.9 | 178.5 | 22.6 | -32.2 | 0 | 0 | 0 | 112.4 | ||
| 47 | E | 55.3 | Low | 69.4 | Low | 150 Ų | 150 | 105.3 Ų | 105.3 | 70% | 0.701 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.7 | 12.1 | 173.5 | -60.1 | 175.6 | -175.2 | 0 | 0 | 112.7 | P45 N49 | P45-E47 PolarHBondContact O-N 2.71Å; E47-N49 VanDerWaalsContact C-N 3.32Å; E47-N49 PolarHBondContact O-N 3.2Å; E47-N49 PolarHBondContact O-OD1 2.85Å |
| 48 | S | 58.2 | Low | 69.3 | Low | 44 Ų | 44 | 103.4 Ų | 103.4 | 31% | 0.308 | 54% | 0.544 | S | S | . | . | trans | -59.6 | 100.5 | 176.4 | -167.8 | 0 | 0 | 0 | 0 | 108.3 | P45 S50 | P45-S48 WeakPolarHBondContact O-CA 3.22Å; P45-S48 WeakPolarHBondContact O-CB 3.4Å; P45-S48 PolarHBondContact O-N 2.9Å; S48-S50 PolarHBondContact O-N 3.09Å; S48-S50 VanDerWaalsContact O-N 3.09Å; S48-S50 WeakPolarHBondContact OG-CB 3.39Å; S48-S50 PolarHBondContact OG-OG 3Å | ||
| 49 | N | 60 | Low | 69.5 | Low | 70 Ų | 70 | 106.9 Ų | 106.9 | 37% | 0.374 | 55% | 0.549 | S | S | . | . | G | 310 helix | trans | -73.3 | 11.7 | 173.1 | -76.4 | -17.9 | 0 | 0 | 0 | 111.6 | E47 E51 K52 Y62 | E47-N49 VanDerWaalsContact C-N 3.32Å; E47-N49 PolarHBondContact O-N 3.2Å; E47-N49 PolarHBondContact O-OD1 2.85Å; N49-E51 PolarHBondContact O-N 3.25Å; N49-K52 HydrophobicContact CB-CB 4.42Å; N49-K52 HydrophobicContact CB-CD 3.96Å; N49-K52 HydrophobicContact CB-CG 4.41Å; N49-K52 WeakPolarHBondContact O-CB 3.2Å; N49-K52 WeakPolarHBondContact O-CG 3.25Å; N49-K52 PolarHBondContact O-N 2.76Å; N49-Y62 VanDerWaalsContact OD1-CE1 3.25Å; N49-Y62 WeakPolarHBondContact OD1-CE1 3.44Å |
| 50 | S | 61.2 | Low | 70.2 | Confident | 92 Ų | 92 | 102.2 Ų | 102.2 | 64% | 0.643 | 53% | 0.531 | S | S | * | . | G | 310 helix | trans | -57 | -31.4 | -179.7 | 48.6 | 0 | 0 | 0 | 0 | 112.1 | S48 | S48-S50 PolarHBondContact O-N 3.09Å; S48-S50 VanDerWaalsContact O-N 3.09Å; S48-S50 WeakPolarHBondContact OG-CB 3.39Å; S48-S50 PolarHBondContact OG-OG 3Å |
| 51 | E | 65.3 | Low | 70.7 | Confident | 106 Ų | 106 | 103.8 Ų | 103.8 | 50% | 0.495 | 54% | 0.536 | S | S | . | . | G | 310 helix | trans | -103.6 | 15.7 | 179.1 | -65.9 | 164.1 | 120.5 | 0 | 0 | 112.5 | N49 I53 P63 H64 | N49-E51 PolarHBondContact O-N 3.25Å; E51-I53 PolarHBondContact O-N 2.96Å; E51-P63 WeakPolarHBondContact O-CD 3.32Å; E51-H64 VanDerWaalsContact CD-CD2 3.43Å; E51-H64 IonicContact OE1-CD2 2.83Å; E51-H64 IonicContact OE1-CE1 2.83Å; E51-H64 IonicContact OE1-NE2 3.73Å; E51-H64 PolarHBondContact OE1-NE2 2.85Å; E51-H64 IonicContact OE2-CD2 3.56Å; E51-H64 PolarHBondContact OE2-CD2 2.71Å; E51-H64 IonicContact OE2-NE2 2.83Å; E51-H64 PolarHBondContact OE2-NE2 2.74Å |
| 52 | K | 75.4 | Confident | 71.5 | Confident | 86 Ų | 86 | 98.7 Ų | 98.7 | 37% | 0.374 | 51% | 0.513 | S | S | . | . | P | Polyproline II helix | trans | -65 | 125.3 | 172.3 | 80.5 | -178.2 | 165.7 | 174.3 | 0 | 108.4 | N49 Y60 E61 Y62 | N49-K52 HydrophobicContact CB-CB 4.42Å; N49-K52 HydrophobicContact CB-CD 3.96Å; N49-K52 HydrophobicContact CB-CG 4.41Å; N49-K52 WeakPolarHBondContact O-CB 3.2Å; N49-K52 WeakPolarHBondContact O-CG 3.25Å; N49-K52 PolarHBondContact O-N 2.76Å; K52-Y60 HydrophobicContact CB-CD1 4.26Å; K52-Y60 HydrophobicContact CD-CD1 3.48Å; K52-Y60 VanDerWaalsContact CD-CD1 3.48Å; K52-Y60 HydrophobicContact CD-CE1 3.67Å; K52-Y60 HydrophobicContact CD-CG 4.2Å; K52-Y60 HydrophobicContact CG-CD1 3.75Å; K52-Y60 HydrophobicContact CG-CE1 4.2Å; K52-E61 CarbonylContact C-O 3.23Å; K52-E61 WeakPolarHBondContact CA-O 3.38Å; K52-Y62 HydrophobicContact CB-CD1 4.01Å; K52-Y62 HydrophobicContact CB-CE1 3.7Å |
| 53 | I | 77.2 | Confident | 71.6 | Confident | 84 Ų | 84 | 96 Ų | 96 | 43% | 0.431 | 50% | 0.498 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 120.3 | 175.4 | -51.4 | 177.6 | 0 | 0 | 0 | 106.8 | E51 L55 Y60 E61 P63 | E51-I53 PolarHBondContact O-N 2.96Å; I53-L55 HydrophobicContact CG2-CD2 4.18Å; I53-L55 PolarHBondContact O-N 2.75Å; I53-Y60 CarbonylContact O-C 3.6Å; I53-Y60 VanDerWaalsContact O-CA 3.3Å; I53-Y60 WeakPolarHBondContact O-CA 3.48Å; I53-E61 HydrophobicContact CB-CB 4.15Å; I53-E61 PolarHBondContact N-O 2.93Å; I53-E61 PolarHBondContact O-N 2.86Å; I53-P63 HydrophobicContact CD1-CG 3.86Å; I53-P63 HydrophobicContact CG1-CG 4.23Å |
| 54 | Y | 79.8 | Confident | 71.8 | Confident | 139 Ų | 139 | 96.2 Ų | 96.2 | 55% | 0.545 | 50% | 0.496 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.4 | 119.8 | 175.5 | -178.2 | -118.6 | 0 | 0 | 0 | 109.8 | G56 R59 Y60 | Y54-G56 VanDerWaalsContact CZ-CA 3.49Å; Y54-R59 WeakPolarHBondContact CD2-O 3.43Å; Y54-Y60 AromaticContact CD2-CD1 3.9Å; Y54-Y60 HydrophobicContact CD2-CD1 3.9Å; Y54-Y60 AromaticContact CD2-CE1 3.43Å; Y54-Y60 HydrophobicContact CD2-CE1 3.43Å; Y54-Y60 VanDerWaalsContact CD2-CE1 3.43Å; Y54-Y60 HydrophobicContact CD2-CE2 4.24Å; Y54-Y60 AromaticContact CD2-CZ 3.62Å; Y54-Y60 HydrophobicContact CE2-CE1 4.3Å; Y54-Y60 HydrophobicContact CE2-CE2 4.44Å; Y54-Y60 HydrophobicContact CG-CE1 4.15Å |
| 55 | L | 85 | Confident | 72.2 | Confident | 91 Ų | 91 | 101 Ų | 101 | 48% | 0.476 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 1.8 | -178.1 | -60.5 | -177.6 | 0 | 0 | 0 | 113.1 | I53 R59 E61 | I53-L55 HydrophobicContact CG2-CD2 4.18Å; I53-L55 PolarHBondContact O-N 2.75Å; L55-R59 HydrophobicContact CB-CB 4.19Å; L55-R59 PolarHBondContact N-O 2.71Å; L55-E61 HydrophobicContact CD1-CB 3.94Å; L55-E61 HydrophobicContact CD2-CB 4.34Å; L55-E61 HydrophobicContact CG-CB 4.14Å |
| 56 | G | 79.7 | Confident | 72.3 | Confident | 16 Ų | 16 | 105.5 Ų | 105.5 | 17% | 0.165 | 51% | 0.514 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 88.6 | 165.7 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y54 G58 R59 | Y54-G56 VanDerWaalsContact CZ-CA 3.49Å; G56-G58 PolarHBondContact O-N 2.67Å; G56-G58 VanDerWaalsContact O-N 3.12Å; G56-R59 VanDerWaalsContact O-CB 3.28Å; G56-R59 WeakPolarHBondContact O-CB 3.46Å; G56-R59 PolarHBondContact O-N 3.1Å |
| 57 | Y | 91.3 | Very high | 72.5 | Confident | 227 Ų | 227 | 107.7 Ų | 107.7 | 89% | 0.89 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.4 | 34.6 | 176.1 | -52.6 | -82.3 | 0 | 0 | 0 | 114.5 | R59 | Y57-R59 PolarHBondContact O-N 2.65Š|
| 58 | G | 82.2 | Confident | 72.5 | Confident | 56 Ų | 56 | 109 Ų | 109 | 58% | 0.577 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72 | 8.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | G56 | G56-G58 PolarHBondContact O-N 2.67Å; G56-G58 VanDerWaalsContact O-N 3.12Å |
| 59 | R | 80.6 | Confident | 72.3 | Confident | 172 Ų | 172 | 113.6 Ų | 113.6 | 65% | 0.649 | 53% | 0.533 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.6 | 141.8 | 178.3 | -56.7 | 179.2 | 67.8 | -170.6 | -0.7 | 110.8 | Y54 L55 G56 Y57 | Y54-R59 WeakPolarHBondContact CD2-O 3.43Å; L55-R59 HydrophobicContact CB-CB 4.19Å; L55-R59 PolarHBondContact N-O 2.71Å; G56-R59 VanDerWaalsContact O-CB 3.28Å; G56-R59 WeakPolarHBondContact O-CB 3.46Å; G56-R59 PolarHBondContact O-N 3.1Å; Y57-R59 PolarHBondContact O-N 2.65Å |
| 60 | Y | 85 | Confident | 72.2 | Confident | 94 Ų | 94 | 116.6 Ų | 116.6 | 37% | 0.369 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 137.7 | 177 | -64 | -89.8 | 0 | 0 | 0 | 109.7 | K52 I53 Y54 | K52-Y60 HydrophobicContact CB-CD1 4.26Å; K52-Y60 HydrophobicContact CD-CD1 3.48Å; K52-Y60 VanDerWaalsContact CD-CD1 3.48Å; K52-Y60 HydrophobicContact CD-CE1 3.67Å; K52-Y60 HydrophobicContact CD-CG 4.2Å; K52-Y60 HydrophobicContact CG-CD1 3.75Å; K52-Y60 HydrophobicContact CG-CE1 4.2Å; I53-Y60 CarbonylContact O-C 3.6Å; I53-Y60 VanDerWaalsContact O-CA 3.3Å; I53-Y60 WeakPolarHBondContact O-CA 3.48Å; Y54-Y60 AromaticContact CD2-CD1 3.9Å; Y54-Y60 HydrophobicContact CD2-CD1 3.9Å; Y54-Y60 AromaticContact CD2-CE1 3.43Å; Y54-Y60 HydrophobicContact CD2-CE1 3.43Å; Y54-Y60 VanDerWaalsContact CD2-CE1 3.43Å; Y54-Y60 HydrophobicContact CD2-CE2 4.24Å; Y54-Y60 AromaticContact CD2-CZ 3.62Å; Y54-Y60 HydrophobicContact CE2-CE1 4.3Å; Y54-Y60 HydrophobicContact CE2-CE2 4.44Å; Y54-Y60 HydrophobicContact CG-CE1 4.15Å |
| 61 | E | 79.6 | Confident | 72.1 | Confident | 97 Ų | 97 | 120.7 Ų | 120.7 | 45% | 0.453 | 56% | 0.558 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -94.1 | 142 | 168.1 | -166.5 | 171.5 | -170.5 | 0 | 0 | 109.6 | K52 I53 L55 | K52-E61 CarbonylContact C-O 3.23Å; K52-E61 WeakPolarHBondContact CA-O 3.38Å; I53-E61 HydrophobicContact CB-CB 4.15Å; I53-E61 PolarHBondContact N-O 2.93Å; I53-E61 PolarHBondContact O-N 2.86Å; L55-E61 HydrophobicContact CD1-CB 3.94Å; L55-E61 HydrophobicContact CD2-CB 4.34Å; L55-E61 HydrophobicContact CG-CB 4.14Å |
| 62 | Y | 81.5 | Confident | 72.1 | Confident | 63 Ų | 63 | 121 Ų | 121 | 25% | 0.247 | 57% | 0.572 | C | S | . | * | trans | -124.8 | 85.4 | 179.3 | -61.2 | -86.7 | 0 | 0 | 0 | 108.5 | N49 K52 H64 R65 | N49-Y62 VanDerWaalsContact OD1-CE1 3.25Å; N49-Y62 WeakPolarHBondContact OD1-CE1 3.44Å; K52-Y62 HydrophobicContact CB-CD1 4.01Å; K52-Y62 HydrophobicContact CB-CE1 3.7Å; Y62-H64 PolarHBondContact O-N 3.4Å; Y62-H64 VanDerWaalsContact O-N 3.09Å; Y62-R65 WeakPolarHBondContact O-CB 3.33Å; Y62-R65 PolarHBondContact O-N 2.87Å | ||
| 63 | P | 70.1 | Confident | 72 | Confident | 69 Ų | 69 | 123.7 Ų | 123.7 | 45% | 0.448 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -55.7 | -34.3 | -169.3 | -26.1 | 33.7 | 0 | 0 | 0 | 114.1 | E51 I53 | E51-P63 WeakPolarHBondContact O-CD 3.32Å; I53-P63 HydrophobicContact CD1-CG 3.86Å; I53-P63 HydrophobicContact CG1-CG 4.23Å |
| 64 | H | 66.6 | Low | 71.9 | Confident | 127 Ų | 127 | 128.8 Ų | 128.8 | 59% | 0.588 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -7.8 | -178.5 | -56.6 | -60.9 | 0 | 0 | 0 | 114.5 | E51 Y62 K66 | E51-H64 VanDerWaalsContact CD-CD2 3.43Å; E51-H64 IonicContact OE1-CD2 2.83Å; E51-H64 IonicContact OE1-CE1 2.83Å; E51-H64 IonicContact OE1-NE2 3.73Å; E51-H64 PolarHBondContact OE1-NE2 2.85Å; E51-H64 IonicContact OE2-CD2 3.56Å; E51-H64 PolarHBondContact OE2-CD2 2.71Å; E51-H64 IonicContact OE2-NE2 2.83Å; E51-H64 PolarHBondContact OE2-NE2 2.74Å; Y62-H64 PolarHBondContact O-N 3.4Å; Y62-H64 VanDerWaalsContact O-N 3.09Å; H64-K66 PolarHBondContact O-N 2.94Å |
| 65 | R | 65.3 | Low | 72 | Confident | 134 Ų | 134 | 127.4 Ų | 127.4 | 51% | 0.506 | 60% | 0.604 | S | S | . | * | trans | -72.2 | 92.3 | 169.5 | -76.6 | -171.4 | 179 | -151 | -0.6 | 107.1 | Y62 Y67 | Y62-R65 WeakPolarHBondContact O-CB 3.33Å; Y62-R65 PolarHBondContact O-N 2.87Å; R65-Y67 WeakPolarHBondContact O-CD2 3.36Å; R65-Y67 PolarHBondContact O-N 2.9Å | ||
| 66 | K | 62 | Low | 71.9 | Confident | 182 Ų | 182 | 126.5 Ų | 126.5 | 79% | 0.791 | 60% | 0.602 | S | S | * | * | trans | -59.4 | 97.2 | 152.9 | -64.7 | -175.2 | -177.1 | -177.8 | 0 | 105.4 | H64 F68 | H64-K66 PolarHBondContact O-N 2.94Å; K66-F68 VanDerWaalsContact C-N 3.25Å; K66-F68 PolarHBondContact O-N 2.89Å | ||
| 67 | Y | 60.4 | Low | 72.1 | Confident | 162 Ų | 162 | 134 Ų | 134 | 64% | 0.635 | 63% | 0.633 | S | S | * | * | trans | -56.2 | 108.6 | 156.4 | -60.1 | -81.5 | 0 | 0 | 0 | 103.3 | R65 N69 | R65-Y67 WeakPolarHBondContact O-CD2 3.36Å; R65-Y67 PolarHBondContact O-N 2.9Å; Y67-N69 PolarHBondContact O-N 3.3Å | ||
| 68 | F | 55.5 | Low | 71.8 | Confident | 179 Ų | 179 | 128.5 Ų | 128.5 | 79% | 0.785 | 62% | 0.623 | S | S | * | * | trans | -58.9 | 94 | 156.7 | -71.5 | -86.2 | 0 | 0 | 0 | 102.9 | K66 N70 | K66-F68 VanDerWaalsContact C-N 3.25Å; K66-F68 PolarHBondContact O-N 2.89Å; F68-N70 PolarHBondContact O-N 3.34Å | ||
| 69 | N | 53.7 | Low | 71.8 | Confident | 140 Ų | 140 | 129.9 Ų | 129.9 | 75% | 0.749 | 61% | 0.614 | S | S | * | * | trans | -56.7 | 84.3 | 144.3 | -73.8 | -19.7 | 0 | 0 | 0 | 101.8 | Y67 E71 | Y67-N69 PolarHBondContact O-N 3.3Å; N69-E71 PolarHBondContact O-N 3.41Å | ||
| 70 | N | 58.2 | Low | 71.5 | Confident | 133 Ų | 133 | 126.5 Ų | 126.5 | 71% | 0.711 | 61% | 0.613 | S | S | * | * | trans | -50.7 | 99.1 | 146.8 | -66.6 | -14.2 | 0 | 0 | 0 | 100.1 | F68 S72 | F68-N70 PolarHBondContact O-N 3.34Å; N70-S72 VanDerWaalsContact C-N 3.27Å; N70-S72 WeakPolarHBondContact O-CA 3.3Å; N70-S72 PolarHBondContact O-N 3.02Å | ||
| 71 | E | 59.6 | Low | 70.2 | Confident | 177 Ų | 177 | 131.6 Ų | 131.6 | 83% | 0.827 | 64% | 0.644 | S | S | * | * | trans | -44.2 | 109.4 | 179.9 | -70.5 | -168.2 | 158.3 | 0 | 0 | 103.5 | N69 K73 | N69-E71 PolarHBondContact O-N 3.41Å; E71-K73 VanDerWaalsContact C-N 3.27Å; E71-K73 WeakPolarHBondContact O-CA 3.16Å; E71-K73 PolarHBondContact O-N 2.84Å | ||
| 72 | S | 65.8 | Low | 69.7 | Low | 113 Ų | 113 | 133.3 Ų | 133.3 | 79% | 0.79 | 65% | 0.654 | S | S | * | * | trans | -59 | 105.4 | -166.5 | 38.7 | 0 | 0 | 0 | 0 | 103.7 | N70 K74 | N70-S72 VanDerWaalsContact C-N 3.27Å; N70-S72 WeakPolarHBondContact O-CA 3.3Å; N70-S72 PolarHBondContact O-N 3.02Å; S72-K74 PolarHBondContact O-N 2.99Å | ||
| 73 | K | 73.4 | Confident | 69.1 | Low | 143 Ų | 143 | 137 Ų | 137 | 62% | 0.622 | 68% | 0.675 | S | S | * | * | trans | -54.1 | 116.5 | -168.7 | 177.5 | -169.4 | 173.3 | -165.7 | 0 | 104.5 | E71 L75 E79 | E71-K73 VanDerWaalsContact C-N 3.27Å; E71-K73 WeakPolarHBondContact O-CA 3.16Å; E71-K73 PolarHBondContact O-N 2.84Å; K73-L75 PolarHBondContact O-N 2.93Å; K73-E79 IonicContact NZ-OE1 3.8Å; K73-E79 PolarHBondContact NZ-OE1 2.87Å; K73-E79 IonicContact NZ-OE2 2.65Å | ||
| 74 | K | 75.7 | Confident | 69.1 | Low | 190 Ų | 190 | 140.8 Ų | 140.8 | 83% | 0.826 | 69% | 0.688 | S | S | * | * | trans | -61.4 | 110.2 | 178.4 | -167.9 | 179.2 | -176 | -177.3 | 0 | 105.5 | S72 T76 | S72-K74 PolarHBondContact O-N 2.99Å; K74-T76 PolarHBondContact O-N 3.27Å | ||
| 75 | L | 80.1 | Confident | 69.2 | Low | 111 Ų | 111 | 141.6 Ų | 141.6 | 58% | 0.581 | 69% | 0.694 | S | S | * | * | trans | -58.5 | 130.8 | -177.7 | -67.9 | 171.5 | 0 | 0 | 0 | 108.2 | K73 E79 V80 | K73-L75 PolarHBondContact O-N 2.93Å; L75-E79 WeakPolarHBondContact CA-OE2 3.45Å; L75-E79 HydrophobicContact CB-CB 4.38Å; L75-E79 HydrophobicContact CD2-CB 4.04Å; L75-E79 WeakPolarHBondContact CD2-OE2 3.28Å; L75-V80 HydrophobicContact CB-CG2 3.81Å; L75-V80 HydrophobicContact CD1-CG2 4.32Å | ||
| 76 | T | 83.5 | Confident | 69.5 | Low | 71 Ų | 71 | 142.1 Ų | 142.1 | 44% | 0.436 | 71% | 0.706 | S | S | . | * | trans | -76.6 | 156.7 | 172.8 | 54.4 | 0 | 0 | 0 | 0 | 109.2 | K74 T78 E79 | K74-T76 PolarHBondContact O-N 3.27Å; T76-T78 PolarHBondContact O-N 3.12Å; T76-T78 PolarHBondContact OG1-OG1 2.88Å; T76-E79 PolarHBondContact N-OE2 3.48Å; T76-E79 VanDerWaalsContact N-OE2 3.1Å; T76-E79 PolarHBondContact O-N 2.94Å | ||
| 77 | Q | 83.1 | Confident | 70 | Confident | 175 Ų | 175 | 139.4 Ų | 139.4 | 82% | 0.818 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -54.4 | -30.2 | -178.7 | -171.9 | 173.4 | 1.8 | 0 | 0 | 112.6 | E79 V80 I81 | Q77-E79 VanDerWaalsContact C-N 3.29Å; Q77-E79 PolarHBondContact O-N 3.21Å; Q77-V80 PolarHBondContact O-N 3.36Å; Q77-I81 WeakPolarHBondContact O-CG1 3.36Å |
| 78 | T | 86.5 | Confident | 70.6 | Confident | 111 Ų | 111 | 137.8 Ų | 137.8 | 68% | 0.681 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -65.7 | -23.7 | 174.5 | 48.6 | 0 | 0 | 0 | 0 | 114.9 | T76 | T76-T78 PolarHBondContact O-N 3.12Å; T76-T78 PolarHBondContact OG1-OG1 2.88Å |
| 79 | E | 82.4 | Confident | 71.8 | Confident | 84 Ų | 84 | 134.6 Ų | 134.6 | 39% | 0.393 | 70% | 0.698 | S | S | . | * | G | 310 helix | trans | -91.6 | -11.3 | 179.1 | -62.9 | 177.2 | 134.5 | 0 | 0 | 112.5 | K73 L75 T76 Q77 | K73-E79 IonicContact NZ-OE1 3.8Å; K73-E79 PolarHBondContact NZ-OE1 2.87Å; K73-E79 IonicContact NZ-OE2 2.65Å; L75-E79 WeakPolarHBondContact CA-OE2 3.45Å; L75-E79 HydrophobicContact CB-CB 4.38Å; L75-E79 HydrophobicContact CD2-CB 4.04Å; L75-E79 WeakPolarHBondContact CD2-OE2 3.28Å; T76-E79 PolarHBondContact N-OE2 3.48Å; T76-E79 VanDerWaalsContact N-OE2 3.1Å; T76-E79 PolarHBondContact O-N 2.94Å; Q77-E79 VanDerWaalsContact C-N 3.29Å; Q77-E79 PolarHBondContact O-N 3.21Å |
| 80 | V | 74.1 | Confident | 73.3 | Confident | 102 Ų | 102 | 134.2 Ų | 134.2 | 62% | 0.618 | 69% | 0.694 | S | S | * | * | trans | -98.6 | -1.7 | -175.7 | -178.1 | 0 | 0 | 0 | 0 | 112.2 | L75 Q77 | L75-V80 HydrophobicContact CB-CG2 3.81Å; L75-V80 HydrophobicContact CD1-CG2 4.32Å; Q77-V80 PolarHBondContact O-N 3.36Å | ||
| 81 | I | 57.2 | Low | 74.7 | Confident | 200 Ų | 200 | 134.3 Ų | 134.3 | 100% | 1.026 | 69% | 0.692 | S | S | * | * | trans | -75.9 | 0 | -179 | -54.1 | 176 | 0 | 0 | 0 | 110.8 | Q77 | Q77-I81 WeakPolarHBondContact O-CG1 3.36Š|
Retrieved 81 of 81 residues in 20.4 ms
(Link to these results)