| 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 | 58.8 | Low | 70.4 | Confident | 224 Ų | 224 | 115.3 Ų | 115.3 | 100% | 1.103 | 64% | 0.638 | S | S | * | * | 0 | 111.9 | 0 | -62 | -75.7 | -147.1 | 0 | 0 | 106.3 | |||||
| 2 | S | 69.8 | Low | 70.9 | Confident | 85 Ų | 85 | 115.7 Ų | 115.7 | 59% | 0.594 | 64% | 0.637 | S | S | * | * | trans | -73 | 140 | 176.5 | -78.1 | 0 | 0 | 0 | 0 | 109.4 | K4 S5 | S2-K4 PolarHBondContact O-N 3.46Å; S2-S5 PolarHBondContact N-OG 3.16Å; S2-S5 PolarHBondContact O-N 3.09Å; S2-S5 PolarHBondContact O-OG 3.34Å | ||
| 3 | E | 67.1 | Low | 71.3 | Confident | 173 Ų | 173 | 111.8 Ų | 111.8 | 81% | 0.808 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -57.7 | -32.4 | 177.4 | -68.7 | 156.5 | 106 | 0 | 0 | 111.5 | S5 V6 E7 | E3-S5 VanDerWaalsContact C-N 3.31Å; E3-S5 PolarHBondContact O-N 2.78Å; E3-V6 PolarHBondContact O-N 2.84Å; E3-V6 VanDerWaalsContact O-N 3.08Å; E3-E7 PolarHBondContact O-N 3.2Å; E3-E7 VanDerWaalsContact O-N 3.09Å |
| 4 | K | 66.2 | Low | 72.2 | Confident | 183 Ų | 183 | 108.4 Ų | 108.4 | 80% | 0.796 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -57.7 | -33.8 | 171.4 | -99.6 | 148.1 | 174.7 | 162.4 | 0 | 115.2 | S2 A8 | S2-K4 PolarHBondContact O-N 3.46Å; K4-A8 PolarHBondContact O-N 2.94Å |
| 5 | S | 70.6 | Confident | 72.9 | Confident | 65 Ų | 65 | 109.3 Ų | 109.3 | 46% | 0.455 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -76.8 | -26.1 | 176.3 | 36.5 | 0 | 0 | 0 | 0 | 112.8 | S2 E3 A9 | S2-S5 PolarHBondContact N-OG 3.16Å; S2-S5 PolarHBondContact O-N 3.09Å; S2-S5 PolarHBondContact O-OG 3.34Å; E3-S5 VanDerWaalsContact C-N 3.31Å; E3-S5 PolarHBondContact O-N 2.78Å; S5-A9 WeakPolarHBondContact O-CB 3.22Å; S5-A9 PolarHBondContact O-N 3.5Å |
| 6 | V | 73.4 | Confident | 73.7 | Confident | 94 Ų | 94 | 107 Ų | 107 | 57% | 0.57 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -74.5 | -40.4 | 175.4 | 179.5 | 0 | 0 | 0 | 0 | 110.2 | E3 A9 A10 | E3-V6 PolarHBondContact O-N 2.84Å; E3-V6 VanDerWaalsContact O-N 3.08Å; V6-A9 PolarHBondContact O-N 3.02Å; V6-A10 PolarHBondContact O-N 2.96Å |
| 7 | E | 70.4 | Confident | 73.9 | Confident | 154 Ų | 154 | 107.4 Ų | 107.4 | 72% | 0.72 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.2 | -42.8 | 177.5 | -163.8 | 152.5 | 110.7 | 0 | 0 | 112.3 | E3 A9 A10 E11 | E3-E7 PolarHBondContact O-N 3.2Å; E3-E7 VanDerWaalsContact O-N 3.09Å; E7-A9 PolarHBondContact O-N 2.95Å; E7-A10 PolarHBondContact O-N 2.97Å; E7-E11 PolarHBondContact O-N 2.87Å |
| 8 | A | 77.4 | Confident | 74.6 | Confident | 53 Ų | 53 | 110.1 Ų | 110.1 | 44% | 0.438 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.8 | -38.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | K4 E11 L12 | K4-A8 PolarHBondContact O-N 2.94Å; A8-E11 PolarHBondContact O-N 3.49Å; A8-L12 WeakPolarHBondContact O-CB 3.12Å; A8-L12 WeakPolarHBondContact O-CG 3.22Å; A8-L12 PolarHBondContact O-N 3.39Å |
| 9 | A | 70.3 | Confident | 74.7 | Confident | 57 Ų | 57 | 110.6 Ų | 110.6 | 47% | 0.471 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -68.1 | -35.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S5 V6 E7 S13 | S5-A9 WeakPolarHBondContact O-CB 3.22Å; S5-A9 PolarHBondContact O-N 3.5Å; V6-A9 PolarHBondContact O-N 3.02Å; E7-A9 PolarHBondContact O-N 2.95Å; A9-S13 WeakPolarHBondContact O-CB 3.14Å; A9-S13 PolarHBondContact O-N 2.95Å |
| 10 | A | 78.6 | Confident | 74.7 | Confident | 62 Ų | 62 | 111.1 Ų | 111.1 | 51% | 0.512 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -67.5 | -42.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V6 E7 S13 A14 | V6-A10 PolarHBondContact O-N 2.96Å; E7-A10 PolarHBondContact O-N 2.97Å; A10-S13 PolarHBondContact O-N 3.2Å; A10-A14 PolarHBondContact O-N 3.09Å |
| 11 | E | 71.8 | Confident | 75 | Confident | 118 Ų | 118 | 113 Ų | 113 | 55% | 0.551 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.5 | -39.5 | 177.8 | -171.4 | 170.3 | 110.4 | 0 | 0 | 112.5 | E7 A8 A14 K15 | E7-E11 PolarHBondContact O-N 2.87Å; A8-E11 PolarHBondContact O-N 3.49Å; E11-A14 PolarHBondContact O-N 3.29Å; E11-K15 HydrophobicContact CG-CD 4.49Å; E11-K15 WeakPolarHBondContact O-CG 3.49Å; E11-K15 PolarHBondContact O-N 2.61Å; E11-K15 IonicContact OE1-NZ 2.67Å; E11-K15 PolarHBondContact OE1-NZ 3.48Å |
| 12 | L | 76 | Confident | 75.7 | Confident | 120 Ų | 120 | 108.4 Ų | 108.4 | 63% | 0.628 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.5 | -41.2 | 172.9 | -77.2 | 166 | 0 | 0 | 0 | 112 | A8 A14 K15 D16 | A8-L12 WeakPolarHBondContact O-CB 3.12Å; A8-L12 WeakPolarHBondContact O-CG 3.22Å; A8-L12 PolarHBondContact O-N 3.39Å; L12-A14 PolarHBondContact O-N 3.17Å; L12-K15 PolarHBondContact O-N 3.08Å; L12-D16 WeakPolarHBondContact O-CB 3.37Å; L12-D16 PolarHBondContact O-N 3.3Å |
| 13 | S | 76.8 | Confident | 75.9 | Confident | 66 Ų | 66 | 109.6 Ų | 109.6 | 46% | 0.462 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63 | -40.3 | 177 | -177 | 0 | 0 | 0 | 0 | 112.3 | A9 A10 D16 L17 | A9-S13 WeakPolarHBondContact O-CB 3.14Å; A9-S13 PolarHBondContact O-N 2.95Å; A10-S13 PolarHBondContact O-N 3.2Å; S13-D16 PolarHBondContact O-N 3.02Å; S13-L17 WeakPolarHBondContact O-CB 3.33Å; S13-L17 VanDerWaalsContact O-CG 3.31Å; S13-L17 WeakPolarHBondContact O-CG 3.42Å; S13-L17 PolarHBondContact O-N 3.36Å |
| 14 | A | 83.8 | Confident | 76.2 | Confident | 63 Ų | 63 | 106.1 Ų | 106.1 | 52% | 0.521 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.6 | -40.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A10 E11 L12 K18 | A10-A14 PolarHBondContact O-N 3.09Å; E11-A14 PolarHBondContact O-N 3.29Å; L12-A14 PolarHBondContact O-N 3.17Å; A14-K18 PolarHBondContact O-N 3.19Å |
| 15 | K | 82.8 | Confident | 76.2 | Confident | 123 Ų | 123 | 103.3 Ų | 103.3 | 54% | 0.535 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.4 | -44.4 | 175.4 | -69.6 | 171.9 | -173.5 | 167.2 | 0 | 111.3 | E11 L12 L17 K18 E19 | E11-K15 HydrophobicContact CG-CD 4.49Å; E11-K15 WeakPolarHBondContact O-CG 3.49Å; E11-K15 PolarHBondContact O-N 2.61Å; E11-K15 IonicContact OE1-NZ 2.67Å; E11-K15 PolarHBondContact OE1-NZ 3.48Å; L12-K15 PolarHBondContact O-N 3.08Å; K15-L17 PolarHBondContact O-N 3.29Å; K15-K18 PolarHBondContact O-N 2.71Å; K15-E19 PolarHBondContact O-N 3.01Å |
| 16 | D | 85.1 | Confident | 75.6 | Confident | 72 Ų | 72 | 106.6 Ų | 106.6 | 39% | 0.385 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.4 | -37.8 | 179.1 | -168.1 | -93.9 | 0 | 0 | 0 | 112.6 | L12 S13 K20 | L12-D16 WeakPolarHBondContact O-CB 3.37Å; L12-D16 PolarHBondContact O-N 3.3Å; S13-D16 PolarHBondContact O-N 3.02Å; D16-K20 VanDerWaalsContact O-CB 3.32Å; D16-K20 WeakPolarHBondContact O-CB 3.42Å; D16-K20 WeakPolarHBondContact O-CG 3.45Å; D16-K20 PolarHBondContact O-N 3.49Å; D16-K20 WeakPolarHBondContact OD1-CD 3.19Å; D16-K20 WeakPolarHBondContact OD1-CE 3.34Å; D16-K20 IonicContact OD1-NZ 2.81Å; D16-K20 PolarHBondContact OD1-NZ 3.45Å |
| 17 | L | 78.1 | Confident | 75.1 | Confident | 113 Ų | 113 | 108.6 Ų | 108.6 | 59% | 0.592 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.5 | -38.4 | 174.5 | -75.7 | 170.3 | 0 | 0 | 0 | 112.7 | S13 K15 K21 | S13-L17 WeakPolarHBondContact O-CB 3.33Å; S13-L17 VanDerWaalsContact O-CG 3.31Å; S13-L17 WeakPolarHBondContact O-CG 3.42Å; S13-L17 PolarHBondContact O-N 3.36Å; K15-L17 PolarHBondContact O-N 3.29Å; L17-K21 WeakPolarHBondContact O-CB 3.31Å; L17-K21 PolarHBondContact O-N 2.84Å; L17-K21 VanDerWaalsContact O-N 3.11Å |
| 18 | K | 86.3 | Confident | 74.6 | Confident | 156 Ų | 156 | 103.5 Ų | 103.5 | 68% | 0.678 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.7 | -48.6 | 176.6 | -171 | -175.3 | 176.7 | -168.9 | 0 | 110.7 | A14 K15 K20 K21 E22 | A14-K18 PolarHBondContact O-N 3.19Å; K15-K18 PolarHBondContact O-N 2.71Å; K18-K20 PolarHBondContact O-N 2.96Å; K18-K21 WeakPolarHBondContact O-CB 3.21Å; K18-K21 PolarHBondContact O-N 2.67Å; K18-K21 VanDerWaalsContact O-N 3.17Å; K18-E22 PolarHBondContact O-N 3.35Å; K18-E22 VanDerWaalsContact O-N 3.09Å |
| 19 | E | 76.8 | Confident | 73.6 | Confident | 120 Ų | 120 | 103.8 Ų | 103.8 | 56% | 0.561 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.3 | -43.1 | 177.9 | -171 | -172.4 | 109.9 | 0 | 0 | 111.8 | K15 K21 E22 K23 | K15-E19 PolarHBondContact O-N 3.01Å; E19-K21 VanDerWaalsContact C-N 3.29Å; E19-K21 PolarHBondContact O-N 2.96Å; E19-E22 PolarHBondContact O-N 3.36Å; E19-K23 VanDerWaalsContact O-CB 3.31Å; E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 PolarHBondContact O-N 2.81Å |
| 20 | K | 73.5 | Confident | 73.1 | Confident | 120 Ų | 120 | 109.9 Ų | 109.9 | 52% | 0.522 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.1 | -37.1 | 175.3 | -82.8 | 174.4 | 174.4 | 154.8 | 0 | 112.9 | D16 K18 V24 | D16-K20 VanDerWaalsContact O-CB 3.32Å; D16-K20 WeakPolarHBondContact O-CB 3.42Å; D16-K20 WeakPolarHBondContact O-CG 3.45Å; D16-K20 PolarHBondContact O-N 3.49Å; D16-K20 WeakPolarHBondContact OD1-CD 3.19Å; D16-K20 WeakPolarHBondContact OD1-CE 3.34Å; D16-K20 IonicContact OD1-NZ 2.81Å; D16-K20 PolarHBondContact OD1-NZ 3.45Å; K18-K20 PolarHBondContact O-N 2.96Å; K20-V24 WeakPolarHBondContact O-CB 3.41Å; K20-V24 WeakPolarHBondContact O-CG2 3.31Å; K20-V24 PolarHBondContact O-N 2.98Å; K20-V24 VanDerWaalsContact O-N 3.1Å |
| 21 | K | 80.8 | Confident | 72.1 | Confident | 151 Ų | 151 | 115 Ų | 115 | 66% | 0.657 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68 | -47.2 | 178.7 | -170.5 | -175 | 173.9 | -167.2 | 0 | 111.1 | L17 K18 E19 K23 V24 E25 | L17-K21 WeakPolarHBondContact O-CB 3.31Å; L17-K21 PolarHBondContact O-N 2.84Å; L17-K21 VanDerWaalsContact O-N 3.11Å; K18-K21 WeakPolarHBondContact O-CB 3.21Å; K18-K21 PolarHBondContact O-N 2.67Å; K18-K21 VanDerWaalsContact O-N 3.17Å; E19-K21 VanDerWaalsContact C-N 3.29Å; E19-K21 PolarHBondContact O-N 2.96Å; K21-K23 VanDerWaalsContact C-N 3.34Å; K21-K23 PolarHBondContact O-N 3.18Å; K21-V24 PolarHBondContact O-N 3.45Å; K21-V24 VanDerWaalsContact O-N 3.16Å; K21-E25 PolarHBondContact O-N 3.44Å |
| 22 | E | 73.4 | Confident | 71.3 | Confident | 128 Ų | 128 | 116.1 Ų | 116.1 | 60% | 0.598 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -59.4 | -44.8 | 176.7 | -170.4 | 179.3 | 99.6 | 0 | 0 | 111.4 | K18 E19 V24 E25 E26 | K18-E22 PolarHBondContact O-N 3.35Å; K18-E22 VanDerWaalsContact O-N 3.09Å; E19-E22 PolarHBondContact O-N 3.36Å; E22-V24 VanDerWaalsContact C-N 3.27Å; E22-V24 PolarHBondContact O-N 2.94Å; E22-E25 PolarHBondContact O-N 3Å; E22-E26 PolarHBondContact O-N 3.03Å |
| 23 | K | 74 | Confident | 70.3 | Confident | 111 Ų | 111 | 118.3 Ų | 118.3 | 48% | 0.483 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.8 | -25 | 177.2 | -165.9 | 157.5 | -169.5 | 157.7 | 0 | 114.2 | E19 K21 K27 | E19-K23 VanDerWaalsContact O-CB 3.31Å; E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 PolarHBondContact O-N 2.81Å; K21-K23 VanDerWaalsContact C-N 3.34Å; K21-K23 PolarHBondContact O-N 3.18Å; K23-K27 WeakPolarHBondContact O-CD 3.2Å; K23-K27 WeakPolarHBondContact O-CG 3.41Å; K23-K27 PolarHBondContact O-N 3.24Å |
| 24 | V | 74.9 | Confident | 69.3 | Low | 100 Ų | 100 | 122.6 Ų | 122.6 | 61% | 0.606 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -77.5 | -40.5 | 173.5 | 165 | 0 | 0 | 0 | 0 | 110.4 | K20 K21 E22 K27 A28 | K20-V24 WeakPolarHBondContact O-CB 3.41Å; K20-V24 WeakPolarHBondContact O-CG2 3.31Å; K20-V24 PolarHBondContact O-N 2.98Å; K20-V24 VanDerWaalsContact O-N 3.1Å; K21-V24 PolarHBondContact O-N 3.45Å; K21-V24 VanDerWaalsContact O-N 3.16Å; E22-V24 VanDerWaalsContact C-N 3.27Å; E22-V24 PolarHBondContact O-N 2.94Å; V24-K27 PolarHBondContact O-N 2.98Å; V24-A28 WeakPolarHBondContact O-CB 3.34Å; V24-A28 PolarHBondContact O-N 3.47Å |
| 25 | E | 66.3 | Low | 68 | Low | 124 Ų | 124 | 125.7 Ų | 125.7 | 58% | 0.579 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.8 | -46.8 | 177.3 | -160 | 168.7 | 101.3 | 0 | 0 | 111.2 | K21 E22 K27 A28 S29 | K21-E25 PolarHBondContact O-N 3.44Å; E22-E25 PolarHBondContact O-N 3Å; E25-K27 VanDerWaalsContact C-N 3.31Å; E25-K27 PolarHBondContact O-N 3.1Å; E25-A28 WeakPolarHBondContact O-CB 3.49Å; E25-A28 PolarHBondContact O-N 3.44Å; E25-A28 VanDerWaalsContact O-N 3.07Å; E25-S29 PolarHBondContact O-N 2.74Å; E25-S29 PolarHBondContact O-OG 3.39Å |
| 26 | E | 57.7 | Low | 66.5 | Low | 133 Ų | 133 | 126.6 Ų | 126.6 | 62% | 0.621 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -58.4 | -41.3 | 176.2 | -172.9 | -168.8 | 92.2 | 0 | 0 | 112.5 | E22 R30 | E22-E26 PolarHBondContact O-N 3.03Å; E26-R30 WeakPolarHBondContact O-CB 3.25Å; E26-R30 PolarHBondContact O-N 3.2Å |
| 27 | K | 62 | Low | 64.9 | Low | 136 Ų | 136 | 127.6 Ų | 127.6 | 59% | 0.591 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -70.3 | -31.6 | 177.4 | -74 | 177.6 | -176.3 | -179.3 | 0 | 112.9 | K23 V24 E25 K31 | K23-K27 WeakPolarHBondContact O-CD 3.2Å; K23-K27 WeakPolarHBondContact O-CG 3.41Å; K23-K27 PolarHBondContact O-N 3.24Å; V24-K27 PolarHBondContact O-N 2.98Å; E25-K27 VanDerWaalsContact C-N 3.31Å; E25-K27 PolarHBondContact O-N 3.1Å; K27-K31 PolarHBondContact O-N 3.43Å |
| 28 | A | 60.3 | Low | 63.5 | Low | 48 Ų | 48 | 126.2 Ų | 126.2 | 40% | 0.397 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.3 | -49.1 | 175 | 0 | 0 | 0 | 0 | 0 | 110.4 | V24 E25 R30 K31 E32 | V24-A28 WeakPolarHBondContact O-CB 3.34Å; V24-A28 PolarHBondContact O-N 3.47Å; E25-A28 WeakPolarHBondContact O-CB 3.49Å; E25-A28 PolarHBondContact O-N 3.44Å; E25-A28 VanDerWaalsContact O-N 3.07Å; A28-R30 VanDerWaalsContact C-N 3.3Å; A28-R30 PolarHBondContact O-N 3.36Å; A28-K31 WeakPolarHBondContact O-CB 3.5Å; A28-K31 PolarHBondContact O-N 3.09Å; A28-E32 PolarHBondContact O-N 3.02Å |
| 29 | S | 57.1 | Low | 61.9 | Low | 58 Ų | 58 | 124.3 Ų | 124.3 | 41% | 0.406 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63 | -32.4 | 177.9 | -59.1 | 0 | 0 | 0 | 0 | 112.9 | E25 K31 R33 | E25-S29 PolarHBondContact O-N 2.74Å; E25-S29 PolarHBondContact O-OG 3.39Å; S29-K31 VanDerWaalsContact C-N 3.31Å; S29-K31 PolarHBondContact O-N 2.96Å; S29-R33 VanDerWaalsContact O-CG 3.24Å; S29-R33 WeakPolarHBondContact O-CG 3.48Å; S29-R33 PolarHBondContact O-N 3.46Å; S29-R33 PolarHBondContact O-NE 3.45Å |
| 30 | R | 58.9 | Low | 60.8 | Low | 186 Ų | 186 | 126 Ų | 126 | 70% | 0.702 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67 | -29.8 | 173.2 | -170.2 | 175.2 | -129.4 | -163.8 | 4.4 | 113.3 | E26 A28 K34 | E26-R30 WeakPolarHBondContact O-CB 3.25Å; E26-R30 PolarHBondContact O-N 3.2Å; A28-R30 VanDerWaalsContact C-N 3.3Å; A28-R30 PolarHBondContact O-N 3.36Å; R30-K34 PolarHBondContact O-N 3.17Å |
| 31 | K | 58.5 | Low | 59.7 | Low | 168 Ų | 168 | 128.4 Ų | 128.4 | 73% | 0.73 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -79.5 | -36.3 | -178.9 | -169.3 | 178.9 | 177.2 | -174.5 | 0 | 112 | K27 A28 S29 K35 | K27-K31 PolarHBondContact O-N 3.43Å; A28-K31 WeakPolarHBondContact O-CB 3.5Å; A28-K31 PolarHBondContact O-N 3.09Å; S29-K31 VanDerWaalsContact C-N 3.31Å; S29-K31 PolarHBondContact O-N 2.96Å; K31-K35 PolarHBondContact O-N 2.92Å |
| 32 | E | 54.9 | Low | 58.4 | Low | 142 Ų | 142 | 129.4 Ų | 129.4 | 66% | 0.664 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -70.2 | -44.3 | 177 | -70.8 | -175.9 | 103.7 | 0 | 0 | 111.6 | A28 K34 K35 E36 | A28-E32 PolarHBondContact O-N 3.02Å; E32-K34 PolarHBondContact O-N 3.48Å; E32-K35 PolarHBondContact O-N 3.03Å; E32-E36 PolarHBondContact O-N 3.17Å |
| 33 | R | 55.3 | Low | 57.5 | Low | 167 Ų | 167 | 130 Ų | 130 | 63% | 0.63 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -59.6 | -30 | 174.7 | -65.8 | -172.1 | -61.8 | 158.2 | -6.4 | 114 | S29 V37 | S29-R33 VanDerWaalsContact O-CG 3.24Å; S29-R33 WeakPolarHBondContact O-CG 3.48Å; S29-R33 PolarHBondContact O-N 3.46Å; S29-R33 PolarHBondContact O-NE 3.45Å; R33-V37 VanDerWaalsContact O-CG2 3.26Å; R33-V37 WeakPolarHBondContact O-CG2 3.22Å; R33-V37 PolarHBondContact O-N 3.16Å |
| 34 | K | 54.9 | Low | 56.8 | Low | 156 Ų | 156 | 128.1 Ų | 128.1 | 68% | 0.678 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -78.8 | -23.6 | 175.7 | -170.8 | 172 | 179.9 | 178.7 | 0 | 112.9 | R30 E32 V38 | R30-K34 PolarHBondContact O-N 3.17Å; E32-K34 PolarHBondContact O-N 3.48Å; K34-V38 WeakPolarHBondContact O-CB 3.44Å; K34-V38 WeakPolarHBondContact O-CG2 3.48Å; K34-V38 PolarHBondContact O-N 3.3Å |
| 35 | K | 55.7 | Low | 56.1 | Low | 127 Ų | 127 | 128 Ų | 128 | 55% | 0.552 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -82.4 | -40.7 | 176.7 | -169.5 | 179 | 178.7 | -73.4 | 0 | 111 | K31 E32 V38 E39 | K31-K35 PolarHBondContact O-N 2.92Å; E32-K35 PolarHBondContact O-N 3.03Å; K35-V38 PolarHBondContact O-N 3.11Å; K35-E39 IonicContact NZ-OE1 3.92Å; K35-E39 IonicContact NZ-OE2 2.65Å; K35-E39 PolarHBondContact NZ-OE2 2.73Å; K35-E39 PolarHBondContact O-N 3.17Å |
| 36 | E | 51.6 | Low | 55.4 | Low | 143 Ų | 143 | 130.3 Ų | 130.3 | 67% | 0.668 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -62 | -50.3 | 176.6 | -169.5 | 176.1 | 91.9 | 0 | 0 | 111.7 | E32 V38 E39 E40 | E32-E36 PolarHBondContact O-N 3.17Å; E36-V38 PolarHBondContact O-N 3.48Å; E36-E39 PolarHBondContact O-N 3.02Å; E36-E40 PolarHBondContact O-N 3.29Å |
| 37 | V | 51.6 | Low | 54.9 | Low | 92 Ų | 92 | 132.1 Ų | 132.1 | 56% | 0.558 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -60.5 | -31.2 | 175.4 | 171.9 | 0 | 0 | 0 | 0 | 112.8 | R33 E41 | R33-V37 VanDerWaalsContact O-CG2 3.26Å; R33-V37 WeakPolarHBondContact O-CG2 3.22Å; R33-V37 PolarHBondContact O-N 3.16Å; V37-E41 PolarHBondContact O-N 3.49Å |
| 38 | V | 49.5 | Very low | 54.5 | Low | 85 Ų | 85 | 134.4 Ų | 134.4 | 52% | 0.515 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -77.2 | -32.7 | 178.8 | 157.2 | 0 | 0 | 0 | 0 | 112.8 | K34 K35 E36 | K34-V38 WeakPolarHBondContact O-CB 3.44Å; K34-V38 WeakPolarHBondContact O-CG2 3.48Å; K34-V38 PolarHBondContact O-N 3.3Å; K35-V38 PolarHBondContact O-N 3.11Å; E36-V38 PolarHBondContact O-N 3.48Å |
| 39 | E | 53.1 | Low | 54 | Low | 115 Ų | 115 | 140.8 Ų | 140.8 | 54% | 0.537 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -75.5 | -30.1 | 176.6 | -77.3 | -175.5 | 102.8 | 0 | 0 | 112.2 | K35 E36 | K35-E39 IonicContact NZ-OE1 3.92Å; K35-E39 IonicContact NZ-OE2 2.65Å; K35-E39 PolarHBondContact NZ-OE2 2.73Å; K35-E39 PolarHBondContact O-N 3.17Å; E36-E39 PolarHBondContact O-N 3.02Å |
| 40 | E | 52.2 | Low | 53.6 | Low | 157 Ų | 157 | 146.4 Ų | 146.4 | 73% | 0.734 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -73.1 | -37 | 176.9 | -166.1 | 175.1 | 89.7 | 0 | 0 | 112.6 | E36 E42 | E36-E40 PolarHBondContact O-N 3.29Å; E40-E42 PolarHBondContact O-N 3.48Å |
| 41 | E | 51.3 | Low | 53.3 | Low | 169 Ų | 169 | 147 Ų | 147 | 79% | 0.79 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -69.4 | -28.1 | 179.6 | -165.5 | 179.5 | 97.1 | 0 | 0 | 113.3 | V37 | V37-E41 PolarHBondContact O-N 3.49Å |
| 42 | E | 53.3 | Low | 52.8 | Low | 173 Ų | 173 | 144.4 Ų | 144.4 | 81% | 0.808 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -83 | -18.2 | -178 | -163 | -179.2 | 104.1 | 0 | 0 | 113.7 | E40 | E40-E42 PolarHBondContact O-N 3.48Å |
| 43 | N | 54.6 | Low | 52.8 | Low | 140 Ų | 140 | 142.2 Ų | 142.2 | 75% | 0.749 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -103.7 | 3.9 | -176.3 | -106.5 | -79.7 | 0 | 0 | 0 | 115.2 | ||
| 44 | G | 58.6 | Low | 52.8 | Low | 71 Ų | 71 | 143.1 Ų | 143.1 | 73% | 0.732 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -94.9 | 11.2 | -171.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||
| 45 | A | 61 | Low | 53 | Low | 97 Ų | 97 | 143 Ų | 143 | 80% | 0.802 | 75% | 0.747 | S | S | * | * | trans | -132.9 | 33.8 | -166.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 46 | E | 50.4 | Low | 52.9 | Low | 173 Ų | 173 | 140.3 Ų | 140.3 | 81% | 0.808 | 76% | 0.756 | S | S | * | * | trans | -144.9 | 127.1 | 164.6 | -104.8 | -176.8 | 48.3 | 0 | 0 | 105.6 | ||||
| 47 | E | 48 | Very low | 53.3 | Low | 172 Ų | 172 | 142.5 Ų | 142.5 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | cis | -148.5 | 145.8 | 15.2 | -62.4 | -158.7 | 111.6 | 0 | 0 | 108.6 | ||||
| 48 | E | 53 | Low | 53.6 | Low | 184 Ų | 184 | 147.2 Ų | 147.2 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | trans | -72.7 | 150.9 | 161.9 | -145.9 | -168.7 | 163 | 0 | 0 | 108.6 | ||||
| 49 | E | 51.3 | Low | 54 | Low | 182 Ų | 182 | 151.7 Ų | 151.7 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | 102.7 | 86.1 | 168.7 | -48.3 | -151 | -167.2 | 0 | 0 | 118.3 | ||||
| 50 | E | 47.8 | Very low | 54.2 | Low | 175 Ų | 175 | 153.7 Ų | 153.7 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | -152.6 | 119.6 | 127.5 | -136.8 | -179 | 157.8 | 0 | 0 | 110.4 | T52 | E50-T52 PolarHBondContact O-N 3.3Š| |||
| 51 | E | 52.5 | Low | 54.7 | Low | 199 Ų | 199 | 154.7 Ų | 154.7 | 93% | 0.93 | 82% | 0.817 | S | S | * | * | trans | -70.2 | 113.3 | 166.5 | -72.2 | -157.4 | 145.4 | 0 | 0 | 109.7 | ||||
| 52 | T | 48.3 | Very low | 55.3 | Low | 113 Ų | 113 | 148.8 Ų | 148.8 | 69% | 0.693 | 80% | 0.801 | S | S | * | * | trans | -139.3 | 107.9 | 164.1 | 60.7 | 0 | 0 | 0 | 0 | 112.3 | E50 | E50-T52 PolarHBondContact O-N 3.3Š| ||
| 53 | A | 55.3 | Low | 55.6 | Low | 97 Ų | 97 | 149.3 Ų | 149.3 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | 48.8 | 116 | 142.5 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 54 | E | 54.9 | Low | 55.7 | Low | 186 Ų | 186 | 150.7 Ų | 150.7 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | 44.1 | 121.6 | 119.2 | -148.9 | -158.3 | 90.4 | 0 | 0 | 120.2 | |||||
| 55 | D | 58.4 | Low | 55.6 | Low | 152 Ų | 152 | 154.8 Ų | 154.8 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | 75 | 119.7 | 148.9 | -150 | 54.2 | 0 | 0 | 0 | 119.5 | ||||
| 56 | G | 54.5 | Low | 55.7 | Low | 71 Ų | 71 | 156.3 Ų | 156.3 | 73% | 0.732 | 80% | 0.8 | S | S | * | * | trans | 173.2 | 55.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | E58 | G56-E58 PolarHBondContact O-N 3.45Š| ||
| 57 | E | 58.8 | Low | 56.1 | Low | 189 Ų | 189 | 155.9 Ų | 155.9 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -64.2 | 108.3 | 156.4 | -64.4 | -166 | 132.5 | 0 | 0 | 107.2 | ||||
| 58 | E | 59.3 | Low | 56.6 | Low | 192 Ų | 192 | 155.4 Ų | 155.4 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | trans | -136.2 | 133.4 | 148.7 | -71.9 | -150.2 | 159.2 | 0 | 0 | 109 | G56 D60 | G56-E58 PolarHBondContact O-N 3.45Å; E58-D60 PolarHBondContact O-N 3.28Å | ||
| 59 | E | 57.8 | Low | 56.8 | Low | 178 Ų | 178 | 154.8 Ų | 154.8 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | trans | -61.1 | 122 | -168.1 | -63.7 | 173.1 | 117.2 | 0 | 0 | 111.7 | E61 | E59-E61 PolarHBondContact O-N 3.25Š| ||
| 60 | D | 57.1 | Low | 57 | Low | 158 Ų | 158 | 154.5 Ų | 154.5 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | -74.5 | 77.7 | 163.7 | -171.6 | 74.6 | 0 | 0 | 0 | 108.4 | E58 | E58-D60 PolarHBondContact O-N 3.28Š| ||
| 61 | E | 63.4 | Low | 57.4 | Low | 178 Ų | 178 | 153.6 Ų | 153.6 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | trans | -98.9 | 74.3 | 162 | -76 | -166.9 | 130 | 0 | 0 | 108.7 | E59 | E59-E61 PolarHBondContact O-N 3.25Š| ||
| 62 | G | 62.6 | Low | 57.6 | Low | 45 Ų | 45 | 152.1 Ų | 152.1 | 46% | 0.464 | 78% | 0.781 | S | S | . | * | trans | -125.1 | 56.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | E64 | G62-E64 VanDerWaalsContact C-N 3.3Å; G62-E64 PolarHBondContact O-N 2.92Å | ||
| 63 | E | 60 | Low | 58 | Low | 183 Ų | 183 | 153.7 Ų | 153.7 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -73.7 | 92.1 | 168.6 | -166.8 | 146.5 | 106 | 0 | 0 | 108.1 | E65 | E63-E65 PolarHBondContact O-N 3.07Å; E63-E65 VanDerWaalsContact O-N 3.16Å | ||
| 64 | E | 56.8 | Low | 58.2 | Low | 170 Ų | 170 | 155 Ų | 155 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | -62.2 | 99.1 | 170 | -62.8 | -79 | 159.7 | 0 | 0 | 109.5 | G62 D66 | G62-E64 VanDerWaalsContact C-N 3.3Å; G62-E64 PolarHBondContact O-N 2.92Å; E64-D66 VanDerWaalsContact C-N 3.32Å; E64-D66 PolarHBondContact O-N 3.5Å | ||
| 65 | E | 57.6 | Low | 58.3 | Low | 157 Ų | 157 | 155.1 Ų | 155.1 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -88.5 | 77 | 155.8 | -72.8 | -168.5 | 165 | 0 | 0 | 108.4 | E63 E67 | E63-E65 PolarHBondContact O-N 3.07Å; E63-E65 VanDerWaalsContact O-N 3.16Å; E65-E67 VanDerWaalsContact C-N 3.27Å; E65-E67 PolarHBondContact O-N 3.32Å | ||
| 66 | D | 63.1 | Low | 58.6 | Low | 129 Ų | 129 | 149.4 Ų | 149.4 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | trans | -78 | 85 | 157 | -166.1 | 25.7 | 0 | 0 | 0 | 106.5 | E64 E68 | E64-D66 VanDerWaalsContact C-N 3.32Å; E64-D66 PolarHBondContact O-N 3.5Å; D66-E68 PolarHBondContact O-N 2.97Å | ||
| 67 | E | 58.1 | Low | 59.1 | Low | 164 Ų | 164 | 152.4 Ų | 152.4 | 77% | 0.766 | 76% | 0.762 | S | S | * | * | trans | -65.9 | 90.6 | 167.7 | -75.6 | -174.7 | 152.1 | 0 | 0 | 107.6 | E65 E69 | E65-E67 VanDerWaalsContact C-N 3.27Å; E65-E67 PolarHBondContact O-N 3.32Å; E67-E69 PolarHBondContact O-N 3.19Å | ||
| 68 | E | 59.2 | Low | 59.2 | Low | 161 Ų | 161 | 146.3 Ų | 146.3 | 75% | 0.752 | 74% | 0.744 | S | S | * | * | trans | -45.9 | 115.9 | 169.8 | -64.2 | -161 | 172.7 | 0 | 0 | 109.3 | D66 E70 | D66-E68 PolarHBondContact O-N 2.97Å; E68-E70 VanDerWaalsContact C-N 3.35Å; E68-E70 PolarHBondContact O-N 3.2Å | ||
| 69 | E | 56.4 | Low | 59.1 | Low | 171 Ų | 171 | 146.1 Ų | 146.1 | 80% | 0.799 | 75% | 0.748 | S | S | * | * | trans | -60.6 | 101 | 163.2 | -68.1 | -166.9 | 158.8 | 0 | 0 | 107.2 | E67 E71 | E67-E69 PolarHBondContact O-N 3.19Å; E69-E71 PolarHBondContact O-N 3Å | ||
| 70 | E | 54.8 | Low | 59.5 | Low | 176 Ų | 176 | 146 Ų | 146 | 82% | 0.822 | 75% | 0.745 | S | S | * | * | trans | -65.1 | 77.5 | 162.1 | -69.1 | -160.3 | 172.2 | 0 | 0 | 108.5 | E68 E72 | E68-E70 VanDerWaalsContact C-N 3.35Å; E68-E70 PolarHBondContact O-N 3.2Å; E70-E72 PolarHBondContact O-N 2.98Å | ||
| 71 | E | 56.3 | Low | 59.7 | Low | 156 Ų | 156 | 150.1 Ų | 150.1 | 73% | 0.729 | 75% | 0.749 | S | S | * | * | trans | -67.6 | 88.4 | 150.1 | -72.1 | -74.9 | 162.5 | 0 | 0 | 105.7 | E69 D73 | E69-E71 PolarHBondContact O-N 3Å; E71-D73 PolarHBondContact O-N 3.38Å | ||
| 72 | E | 57.8 | Low | 59.3 | Low | 169 Ų | 169 | 146.2 Ų | 146.2 | 79% | 0.79 | 75% | 0.747 | S | S | * | * | trans | -64.5 | 72.7 | 165.3 | -152 | 178.8 | -155.5 | 0 | 0 | 107.5 | E70 D74 | E70-E72 PolarHBondContact O-N 2.98Å; E72-D74 PolarHBondContact O-N 2.78Å; E72-D74 VanDerWaalsContact O-N 3.17Å | ||
| 73 | D | 56.7 | Low | 59.3 | Low | 145 Ų | 145 | 149.1 Ų | 149.1 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | trans | -64.7 | 108.8 | 169.5 | -171.4 | -120.9 | 0 | 0 | 0 | 107.4 | E71 | E71-D73 PolarHBondContact O-N 3.38Š| ||
| 74 | D | 58.1 | Low | 59.1 | Low | 126 Ų | 126 | 148.9 Ų | 148.9 | 67% | 0.674 | 77% | 0.765 | S | S | * | * | trans | 64.1 | 75.6 | 148.2 | -140.5 | -105.3 | 0 | 0 | 0 | 114.5 | E72 G76 | E72-D74 PolarHBondContact O-N 2.78Å; E72-D74 VanDerWaalsContact O-N 3.17Å; D74-G76 PolarHBondContact O-N 3.23Å; D74-G76 VanDerWaalsContact OD1-CA 3.25Å; D74-G76 WeakPolarHBondContact OD1-CA 3.49Å; D74-G76 PolarHBondContact OD1-N 3.28Å | ||
| 75 | E | 57.2 | Low | 59 | Low | 188 Ų | 188 | 149.5 Ų | 149.5 | 88% | 0.879 | 77% | 0.768 | S | S | * | * | trans | -60.9 | 73.4 | 137.2 | -79.7 | -156.7 | 150.5 | 0 | 0 | 108.6 | ||||
| 76 | G | 65.7 | Low | 58.9 | Low | 31 Ų | 31 | 149.9 Ų | 149.9 | 32% | 0.32 | 77% | 0.77 | S | S | . | * | trans | -53.7 | 150.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | D74 A78 | D74-G76 PolarHBondContact O-N 3.23Å; D74-G76 VanDerWaalsContact OD1-CA 3.25Å; D74-G76 WeakPolarHBondContact OD1-CA 3.49Å; D74-G76 PolarHBondContact OD1-N 3.28Å; G76-A78 PolarHBondContact O-N 3.35Å | ||
| 77 | P | 64.9 | Low | 58.8 | Low | 134 Ų | 134 | 150.3 Ų | 150.3 | 87% | 0.87 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -53.8 | 110 | -170.5 | 21.1 | -32.8 | 0 | 0 | 0 | 110.8 | ||
| 78 | A | 60 | Low | 59 | Low | 62 Ų | 62 | 150.9 Ų | 150.9 | 51% | 0.512 | 78% | 0.775 | S | S | . | * | trans | -1.1 | 122.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | G76 K80 | G76-A78 PolarHBondContact O-N 3.35Å; A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 HydrophobicContact CB-CD 4.48Å; A78-K80 HydrophobicContact CB-CG 4.36Å; A78-K80 WeakPolarHBondContact O-CB 3.47Å; A78-K80 WeakPolarHBondContact O-CG 3.24Å; A78-K80 PolarHBondContact O-N 3.19Å | ||
| 79 | L | 57.3 | Low | 59.2 | Low | 188 Ų | 188 | 147.1 Ų | 147.1 | 98% | 0.984 | 77% | 0.771 | S | S | * | * | trans | -33.6 | 89.1 | 161.9 | -65.9 | 167.2 | 0 | 0 | 0 | 112.4 | ||||
| 80 | K | 66.7 | Low | 59.7 | Low | 176 Ų | 176 | 142.5 Ų | 142.5 | 77% | 0.765 | 75% | 0.752 | S | S | * | * | trans | -144.8 | 75.3 | 176.8 | -62.9 | -176.1 | -168.5 | -177.9 | 0 | 109.5 | A78 | A78-K80 VanDerWaalsContact C-N 3.32Å; A78-K80 HydrophobicContact CB-CD 4.48Å; A78-K80 HydrophobicContact CB-CG 4.36Å; A78-K80 WeakPolarHBondContact O-CB 3.47Å; A78-K80 WeakPolarHBondContact O-CG 3.24Å; A78-K80 PolarHBondContact O-N 3.19Å | ||
| 81 | R | 60.7 | Low | 60.1 | Low | 244 Ų | 244 | 139 Ų | 139 | 92% | 0.921 | 75% | 0.745 | S | S | * | * | trans | -136.2 | 87 | 149.9 | -65.2 | -166 | -166.9 | 97.5 | 2 | 105.6 | ||||
| 82 | A | 55.8 | Low | 60.4 | Low | 95 Ų | 95 | 140.3 Ų | 140.3 | 79% | 0.785 | 75% | 0.748 | S | S | * | * | 68.1 | 109.2 | 96.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | E84 | A82-E84 PolarHBondContact O-N 3.2Š| |||
| 83 | A | 62.7 | Low | 60.8 | Low | 106 Ų | 106 | 141.8 Ų | 141.8 | 88% | 0.876 | 75% | 0.746 | S | S | * | * | trans | -55.1 | 120.5 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 84 | E | 54.7 | Low | 61.3 | Low | 178 Ų | 178 | 142.4 Ų | 142.4 | 83% | 0.832 | 74% | 0.744 | S | S | * | * | trans | -140.8 | 109 | 151.8 | -153.9 | 162.3 | 106.3 | 0 | 0 | 107.5 | A82 E86 | A82-E84 PolarHBondContact O-N 3.2Å; E84-E86 PolarHBondContact O-N 3.01Å | ||
| 85 | E | 55.8 | Low | 62 | Low | 184 Ų | 184 | 145.5 Ų | 145.5 | 86% | 0.86 | 75% | 0.752 | S | S | * | * | trans | -68.1 | 111.1 | 165.5 | 172.8 | -169.2 | 147.7 | 0 | 0 | 107.5 | ||||
| 86 | E | 55.2 | Low | 62.5 | Low | 164 Ų | 164 | 142.5 Ų | 142.5 | 77% | 0.766 | 75% | 0.747 | S | S | * | * | trans | -123.2 | 100.2 | 149 | -79.4 | -145.9 | 111.2 | 0 | 0 | 107.7 | E84 E88 | E84-E86 PolarHBondContact O-N 3.01Å; E86-E88 PolarHBondContact O-N 3.03Å | ||
| 87 | D | 61.1 | Low | 62.7 | Low | 139 Ų | 139 | 149.6 Ų | 149.6 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | trans | -61.1 | 78 | 157.5 | -178.2 | -142 | 0 | 0 | 0 | 107.7 | A89 | D87-A89 VanDerWaalsContact C-N 3.35Å; D87-A89 PolarHBondContact O-N 3.44Å | ||
| 88 | E | 60.9 | Low | 62.8 | Low | 175 Ų | 175 | 151 Ų | 151 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -70.5 | 97.9 | 173.4 | -155.3 | 170 | -159.1 | 0 | 0 | 106.5 | E86 D90 | E86-E88 PolarHBondContact O-N 3.03Å; E88-D90 PolarHBondContact O-N 2.65Å | ||
| 89 | A | 64 | Low | 62.8 | Low | 82 Ų | 82 | 150.9 Ų | 150.9 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | trans | -32.4 | 107.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | D87 P91 | D87-A89 VanDerWaalsContact C-N 3.35Å; D87-A89 PolarHBondContact O-N 3.44Å; A89-P91 WeakPolarHBondContact O-CD 3.47Å | ||
| 90 | D | 67.1 | Low | 62.7 | Low | 74 Ų | 74 | 146.7 Ų | 146.7 | 40% | 0.396 | 77% | 0.769 | S | S | . | * | trans | -57.6 | 110.2 | 177.7 | 179 | 7.6 | 0 | 0 | 0 | 109.4 | E88 K92 R93 | E88-D90 PolarHBondContact O-N 2.65Å; D90-K92 PolarHBondContact O-N 2.93Å; D90-K92 WeakPolarHBondContact OD1-CB 3.18Å; D90-K92 WeakPolarHBondContact OD1-CG 3.35Å; D90-K92 PolarHBondContact OD1-N 2.89Å; D90-R93 HydrophobicContact CB-CG 4.24Å; D90-R93 PolarHBondContact O-N 3.06Å | ||
| 91 | P | 62.7 | Low | 62.3 | Low | 102 Ų | 102 | 144.6 Ų | 144.6 | 66% | 0.662 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -62.4 | -16 | 178.9 | 25.3 | -32.2 | 0 | 0 | 0 | 111.8 | A89 R93 Q94 | A89-P91 WeakPolarHBondContact O-CD 3.47Å; P91-R93 PolarHBondContact O-N 3.22Å; P91-Q94 VanDerWaalsContact O-CB 3.22Å; P91-Q94 WeakPolarHBondContact O-CB 3.26Å; P91-Q94 PolarHBondContact O-N 3Å; P91-Q94 VanDerWaalsContact O-N 3.16Å |
| 92 | K | 64.3 | Low | 62.2 | Low | 184 Ų | 184 | 141.2 Ų | 141.2 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | G | 310 helix | trans | -69.8 | -16.2 | 173.6 | -57.1 | 171 | -176 | 155.6 | 0 | 113.3 | D90 Q94 | D90-K92 PolarHBondContact O-N 2.93Å; D90-K92 WeakPolarHBondContact OD1-CB 3.18Å; D90-K92 WeakPolarHBondContact OD1-CG 3.35Å; D90-K92 PolarHBondContact OD1-N 2.89Å; K92-Q94 PolarHBondContact O-N 3.39Å |
| 93 | R | 64.2 | Low | 62.5 | Low | 201 Ų | 201 | 143.6 Ų | 143.6 | 76% | 0.758 | 80% | 0.802 | S | S | * | * | G | 310 helix | trans | -81.2 | -3.2 | 172.5 | -65.1 | -177.6 | 67 | -165.9 | -0.1 | 112.9 | D90 P91 K95 | D90-R93 HydrophobicContact CB-CG 4.24Å; D90-R93 PolarHBondContact O-N 3.06Å; P91-R93 PolarHBondContact O-N 3.22Å; R93-K95 PolarHBondContact O-N 3.16Å |
| 94 | Q | 69.1 | Low | 62.5 | Low | 157 Ų | 157 | 145.5 Ų | 145.5 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | trans | -70.6 | 76.4 | 172.2 | -160.2 | 178.8 | 20.4 | 0 | 0 | 109.8 | P91 K92 T96 | P91-Q94 VanDerWaalsContact O-CB 3.22Å; P91-Q94 WeakPolarHBondContact O-CB 3.26Å; P91-Q94 PolarHBondContact O-N 3Å; P91-Q94 VanDerWaalsContact O-N 3.16Å; K92-Q94 PolarHBondContact O-N 3.39Å; Q94-T96 PolarHBondContact O-N 3.44Å; Q94-T96 VanDerWaalsContact O-N 3.09Å | ||
| 95 | K | 70.9 | Confident | 63 | Low | 192 Ų | 192 | 143.7 Ų | 143.7 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | trans | -61.4 | 111.8 | 164.5 | -81.2 | -176.8 | 174.8 | -178.7 | 0 | 107.5 | R93 E97 | R93-K95 PolarHBondContact O-N 3.16Å; K95-E97 PolarHBondContact O-N 3.35Å | ||
| 96 | T | 68.5 | Low | 63.4 | Low | 125 Ų | 125 | 141.4 Ų | 141.4 | 77% | 0.767 | 79% | 0.792 | S | S | * | * | trans | -70.6 | 83.3 | 163.2 | 54.4 | 0 | 0 | 0 | 0 | 108.3 | Q94 N98 | Q94-T96 PolarHBondContact O-N 3.44Å; Q94-T96 VanDerWaalsContact O-N 3.09Å; T96-N98 PolarHBondContact O-N 3.01Å | ||
| 97 | E | 70.9 | Confident | 63.9 | Low | 179 Ų | 179 | 139.9 Ų | 139.9 | 84% | 0.836 | 79% | 0.794 | S | S | * | * | trans | -85.5 | 66.2 | 160.7 | -167.7 | 170.9 | 83 | 0 | 0 | 108.6 | K95 G99 | K95-E97 PolarHBondContact O-N 3.35Å; E97-G99 VanDerWaalsContact C-N 3.33Å; E97-G99 PolarHBondContact O-N 3.22Å | ||
| 98 | N | 66.9 | Low | 64.1 | Low | 164 Ų | 164 | 140 Ų | 140 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -85.9 | 89.3 | 150.2 | -94.3 | -55.5 | 0 | 0 | 0 | 105.7 | T96 | T96-N98 PolarHBondContact O-N 3.01Š| ||
| 99 | G | 60.1 | Low | 64.3 | Low | 60 Ų | 60 | 137.5 Ų | 137.5 | 62% | 0.619 | 80% | 0.796 | S | S | * | * | trans | -140.4 | 91.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112 | E97 | E97-G99 VanDerWaalsContact C-N 3.33Å; E97-G99 PolarHBondContact O-N 3.22Å | ||
| 100 | A | 53.9 | Low | 64.3 | Low | 99 Ų | 99 | 141.8 Ų | 141.8 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | 79.4 | 92.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 101 | S | 59.8 | Low | 64.1 | Low | 133 Ų | 133 | 147.4 Ų | 147.4 | 93% | 0.93 | 84% | 0.839 | S | S | * | * | trans | -64 | 121.7 | 131.2 | -58.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 102 | A | 58.2 | Low | 64.2 | Low | 173 Ų | 173 | 151.5 Ų | 151.5 | 100% | 1.43 | 86% | 0.855 | S | S | * | * | trans | -159.8 | 0 | 153.5 | 0 | 0 | 0 | 0 | 0 | 109.2 |
Retrieved 102 of 102 residues in 15.6 ms
(Link to these results)