| 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 | 36.9 | Very low | 42.2 | Very low | 223 Ų | 223 | 139.4 Ų | 139.4 | 100% | 1.099 | 83% | 0.83 | S | S | * | * | 0 | 59.8 | 0 | -59.4 | -176 | 110.1 | 0 | 0 | 106.3 | |||||
| 2 | D | 39.7 | Very low | 42 | Very low | 147 Ų | 147 | 136.6 Ų | 136.6 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | 63.4 | 115.7 | 83.2 | -52.3 | -66.7 | 0 | 0 | 0 | 107.9 | |||||
| 3 | S | 45.4 | Very low | 41.8 | Very low | 117 Ų | 117 | 140.6 Ų | 140.6 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | -165.3 | 138.7 | 56.2 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 4 | D | 41.8 | Very low | 41.7 | Very low | 154 Ų | 154 | 142.7 Ų | 142.7 | 82% | 0.824 | 83% | 0.825 | S | S | * | * | trans | -57.3 | 137.7 | 165.6 | -70.4 | -87.3 | 0 | 0 | 0 | 113 | ||||
| 5 | S | 49.8 | Very low | 41.6 | Very low | 126 Ų | 126 | 146.4 Ų | 146.4 | 88% | 0.881 | 82% | 0.822 | S | S | * | * | trans | -109.5 | 94.4 | 161.5 | -164.1 | 0 | 0 | 0 | 0 | 107.5 | A7 | S5-A7 PolarHBondContact O-N 2.66Š| ||
| 6 | C | 40.3 | Very low | 41.2 | Very low | 115 Ų | 115 | 141.6 Ų | 141.6 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | trans | -69.2 | 108.2 | 175.8 | -70.6 | 0 | 0 | 0 | 0 | 109.8 | A8 | C6-A8 PolarHBondContact O-N 3.42Š| ||
| 7 | A | 42.4 | Very low | 41.4 | Very low | 95 Ų | 95 | 140.2 Ų | 140.2 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -61.8 | 112.9 | 154.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | S5 A9 | S5-A7 PolarHBondContact O-N 2.66Å; A7-A9 VanDerWaalsContact C-N 3.31Å; A7-A9 PolarHBondContact O-N 3.1Å | ||
| 8 | A | 47.2 | Very low | 41.7 | Very low | 93 Ų | 93 | 135.9 Ų | 135.9 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -64.6 | 94.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | C6 F10 | C6-A8 PolarHBondContact O-N 3.42Å; A8-F10 PolarHBondContact O-N 3.32Å | ||
| 9 | A | 42.6 | Very low | 41.8 | Very low | 82 Ų | 82 | 134.8 Ų | 134.8 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | -59.9 | 122.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | A7 H11 | A7-A9 VanDerWaalsContact C-N 3.31Å; A7-A9 PolarHBondContact O-N 3.1Å; A9-H11 PolarHBondContact O-N 3.05Å | ||
| 10 | F | 39.2 | Very low | 42.6 | Very low | 204 Ų | 204 | 135.7 Ų | 135.7 | 90% | 0.895 | 77% | 0.773 | S | S | * | * | trans | -52.6 | 104.6 | 164.7 | -69.5 | -88.3 | 0 | 0 | 0 | 107.8 | A8 S12 | A8-F10 PolarHBondContact O-N 3.32Å; F10-S12 PolarHBondContact O-N 3.44Å | ||
| 11 | H | 39.3 | Very low | 43.9 | Very low | 177 Ų | 177 | 138.6 Ų | 138.6 | 82% | 0.819 | 77% | 0.771 | S | S | * | * | trans | -62.3 | 106.8 | 167.6 | -107 | -94.9 | 0 | 0 | 0 | 106.3 | A9 E13 | A9-H11 PolarHBondContact O-N 3.05Å; H11-E13 VanDerWaalsContact C-N 3.27Å; H11-E13 PolarHBondContact O-N 3.49Å | ||
| 12 | S | 39.3 | Very low | 46 | Very low | 106 Ų | 106 | 138.8 Ų | 138.8 | 74% | 0.741 | 76% | 0.76 | S | S | * | * | trans | -56.3 | 103 | 152.3 | -65.9 | 0 | 0 | 0 | 0 | 105.4 | F10 E14 | F10-S12 PolarHBondContact O-N 3.44Å; S12-E14 PolarHBondContact O-N 3.27Å | ||
| 13 | E | 40 | Very low | 48.3 | Very low | 189 Ų | 189 | 142.5 Ų | 142.5 | 88% | 0.883 | 76% | 0.763 | S | S | * | * | trans | -63.4 | 93.1 | 161.4 | -89.2 | -134.2 | 127 | 0 | 0 | 106.6 | H11 Y15 | H11-E13 VanDerWaalsContact C-N 3.27Å; H11-E13 PolarHBondContact O-N 3.49Å; E13-Y15 PolarHBondContact O-N 3.42Å | ||
| 14 | E | 39.8 | Very low | 50.5 | Low | 170 Ų | 170 | 139.5 Ų | 139.5 | 79% | 0.794 | 74% | 0.74 | S | S | * | * | trans | -50 | 83.3 | 163.1 | -171.8 | 168.4 | -164.3 | 0 | 0 | 108.5 | S12 S16 | S12-E14 PolarHBondContact O-N 3.27Å; E14-S16 PolarHBondContact O-N 3.45Å | ||
| 15 | Y | 41.2 | Very low | 52.9 | Low | 198 Ų | 198 | 136.4 Ų | 136.4 | 78% | 0.776 | 73% | 0.726 | S | S | * | * | trans | -69.9 | 77.3 | 161.8 | -166.5 | -96.5 | 0 | 0 | 0 | 107.4 | E13 P17 | E13-Y15 PolarHBondContact O-N 3.42Å; Y15-P17 WeakPolarHBondContact O-CD 3.22Å | ||
| 16 | S | 34 | Very low | 55 | Low | 70 Ų | 70 | 135.7 Ų | 135.7 | 49% | 0.49 | 71% | 0.709 | S | S | . | * | trans | -51.7 | 124.7 | 158.8 | -78.5 | 0 | 0 | 0 | 0 | 107.1 | E14 S18 | E14-S16 PolarHBondContact O-N 3.45Å; S16-S18 PolarHBondContact O-N 2.87Å | ||
| 17 | P | 45.5 | Very low | 57.5 | Low | 118 Ų | 118 | 133.6 Ų | 133.6 | 77% | 0.766 | 69% | 0.69 | S | S | * | * | trans | -68 | 85.1 | 170.1 | 26.9 | -29.9 | 0 | 0 | 0 | 107.1 | Y15 C19 | Y15-P17 WeakPolarHBondContact O-CD 3.22Å; P17-C19 PolarHBondContact O-N 3.25Å | ||
| 18 | S | 46 | Very low | 60 | Low | 63 Ų | 63 | 135.3 Ų | 135.3 | 44% | 0.441 | 68% | 0.68 | S | S | . | * | trans | -58.9 | 107.2 | 175.5 | 51.1 | 0 | 0 | 0 | 0 | 107.5 | S16 K20 | S16-S18 PolarHBondContact O-N 2.87Å; S18-K20 PolarHBondContact O-N 3.29Å | ||
| 19 | C | 44 | Very low | 62.1 | Low | 114 Ų | 114 | 134.9 Ų | 134.9 | 77% | 0.77 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 24.9 | 87 | 153.5 | 40.8 | 0 | 0 | 0 | 0 | 115.1 | P17 R21 | P17-C19 PolarHBondContact O-N 3.25Å; C19-R21 VanDerWaalsContact C-N 3.32Å; C19-R21 PolarHBondContact O-N 3.19Å |
| 20 | K | 57 | Low | 64.6 | Low | 152 Ų | 152 | 138.5 Ų | 138.5 | 66% | 0.661 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 17.2 | 71.5 | 164.1 | -61.7 | 177.5 | -170.8 | 169.4 | 0 | 112.6 | S18 R22 H253 | S18-K20 PolarHBondContact O-N 3.29Å; K20-R22 PolarHBondContact O-N 3.31Å; K20-H253 PolarHBondContact NZ-CD2 3.46Å; K20-H253 PolarHBondContact NZ-NE2 3.42Å |
| 21 | R | 71.4 | Confident | 67.2 | Low | 197 Ų | 197 | 134.6 Ų | 134.6 | 74% | 0.743 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 117.2 | 179.7 | -163.6 | -180 | -164 | 109.7 | -1.7 | 106.5 | C19 R23 | C19-R21 VanDerWaalsContact C-N 3.32Å; C19-R21 PolarHBondContact O-N 3.19Å; R21-R23 PolarHBondContact O-N 3.15Å |
| 22 | R | 80 | Confident | 69.8 | Low | 227 Ų | 227 | 128.5 Ų | 128.5 | 86% | 0.857 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 125.9 | 175 | -76.1 | -177.3 | 171.1 | -95.2 | 0.7 | 106.3 | K20 T24 | K20-R22 PolarHBondContact O-N 3.31Å; R22-T24 WeakPolarHBondContact O-CG2 3.44Å; R22-T24 PolarHBondContact O-N 3.4Å; R22-T24 VanDerWaalsContact O-N 3.16Å |
| 23 | R | 88.8 | Confident | 72.4 | Confident | 225 Ų | 225 | 127 Ų | 127 | 85% | 0.849 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 124.8 | 176.2 | -73 | -175.2 | -170.1 | -162.5 | 1.9 | 108.2 | R21 D27 | R21-R23 PolarHBondContact O-N 3.15Å; R23-D27 WeakPolarHBondContact CA-OD2 3.46Å; R23-D27 HydrophobicContact CB-CB 4.45Å |
| 24 | T | 91.8 | Very high | 74.9 | Confident | 55 Ų | 55 | 125 Ų | 125 | 34% | 0.337 | 60% | 0.6 | S | S | . | * | P | Polyproline II helix | trans | -91 | 170.6 | 177.7 | 75.6 | 0 | 0 | 0 | 0 | 110.1 | R22 E26 D27 F28 | R22-T24 WeakPolarHBondContact O-CG2 3.44Å; R22-T24 PolarHBondContact O-N 3.4Å; R22-T24 VanDerWaalsContact O-N 3.16Å; T24-E26 WeakPolarHBondContact CB-OE2 3.44Å; T24-E26 PolarHBondContact O-N 3Å; T24-E26 PolarHBondContact OG1-N 3.21Å; T24-E26 PolarHBondContact OG1-OE2 2.84Å; T24-D27 PolarHBondContact N-OD2 3.37Å; T24-D27 WeakPolarHBondContact O-CB 3.44Å; T24-D27 PolarHBondContact O-N 3.37Å; T24-D27 VanDerWaalsContact O-N 3.15Å; T24-D27 PolarHBondContact OG1-N 2.84Å; T24-F28 PolarHBondContact O-N 2.83Å |
| 25 | V | 91.9 | Very high | 77.6 | Confident | 88 Ų | 88 | 120 Ų | 120 | 53% | 0.533 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64 | -30.3 | 174.7 | 65.2 | 0 | 0 | 0 | 0 | 110.9 | D27 F28 N29 | V25-D27 VanDerWaalsContact C-N 3.35Å; V25-F28 PolarHBondContact O-N 3.15Å; V25-N29 WeakPolarHBondContact O-CB 3.07Å; V25-N29 PolarHBondContact O-N 3.22Å; V25-N29 PolarHBondContact O-ND2 3.16Å |
| 26 | E | 93.3 | Very high | 80.1 | Confident | 111 Ų | 111 | 113.6 Ų | 113.6 | 52% | 0.519 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.3 | -41.1 | 172.8 | -59.6 | 73 | -158.8 | 0 | 0 | 111 | T24 F28 N29 K30 | T24-E26 WeakPolarHBondContact CB-OE2 3.44Å; T24-E26 PolarHBondContact O-N 3Å; T24-E26 PolarHBondContact OG1-N 3.21Å; T24-E26 PolarHBondContact OG1-OE2 2.84Å; E26-F28 VanDerWaalsContact C-N 3.34Å; E26-F28 PolarHBondContact O-N 3.26Å; E26-N29 PolarHBondContact O-N 3.45Å; E26-K30 VanDerWaalsContact O-CG 3.24Å; E26-K30 WeakPolarHBondContact O-CG 3.49Å; E26-K30 PolarHBondContact O-N 2.98Å |
| 27 | D | 93.1 | Very high | 82.7 | Confident | 71 Ų | 71 | 112.4 Ų | 112.4 | 38% | 0.38 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.1 | -40.1 | 175.4 | -65.3 | -30.2 | 0 | 0 | 0 | 111.8 | R23 T24 V25 K30 F31 | R23-D27 WeakPolarHBondContact CA-OD2 3.46Å; R23-D27 HydrophobicContact CB-CB 4.45Å; T24-D27 PolarHBondContact N-OD2 3.37Å; T24-D27 WeakPolarHBondContact O-CB 3.44Å; T24-D27 PolarHBondContact O-N 3.37Å; T24-D27 VanDerWaalsContact O-N 3.15Å; T24-D27 PolarHBondContact OG1-N 2.84Å; V25-D27 VanDerWaalsContact C-N 3.35Å; D27-K30 PolarHBondContact O-N 3.34Å; D27-F31 WeakPolarHBondContact O-CB 3.49Å; D27-F31 PolarHBondContact O-N 3.01Å |
| 28 | F | 94.3 | Very high | 84.9 | Confident | 132 Ų | 132 | 116.5 Ų | 116.5 | 58% | 0.579 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.7 | -43.4 | 174.3 | 175.9 | -98.4 | 0 | 0 | 0 | 111.7 | T24 V25 E26 K30 F31 C32 | T24-F28 PolarHBondContact O-N 2.83Å; V25-F28 PolarHBondContact O-N 3.15Å; E26-F28 VanDerWaalsContact C-N 3.34Å; E26-F28 PolarHBondContact O-N 3.26Å; F28-K30 VanDerWaalsContact C-N 3.34Å; F28-K30 PolarHBondContact O-N 2.65Å; F28-F31 PolarHBondContact O-N 3.35Å; F28-C32 WeakPolarHBondContact O-CB 3.3Å; F28-C32 PolarHBondContact O-N 3.49Å |
| 29 | N | 92.4 | Very high | 87.1 | Confident | 83 Ų | 83 | 116.3 Ų | 116.3 | 44% | 0.444 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.9 | -40.3 | 177.4 | -70.6 | -21.6 | 0 | 0 | 0 | 111.2 | V25 E26 C32 T33 | V25-N29 WeakPolarHBondContact O-CB 3.07Å; V25-N29 PolarHBondContact O-N 3.22Å; V25-N29 PolarHBondContact O-ND2 3.16Å; E26-N29 PolarHBondContact O-N 3.45Å; N29-C32 PolarHBondContact O-N 3.05Å; N29-T33 WeakPolarHBondContact O-CB 3.38Å; N29-T33 PolarHBondContact O-N 3.48Å; N29-T33 PolarHBondContact O-OG1 3.07Å |
| 30 | K | 93.3 | Very high | 89 | Confident | 158 Ų | 158 | 113.6 Ų | 113.6 | 69% | 0.687 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 173.9 | -69.6 | -63.8 | -178.9 | -176.6 | 0 | 111.9 | E26 D27 F28 T33 F34 | E26-K30 VanDerWaalsContact O-CG 3.24Å; E26-K30 WeakPolarHBondContact O-CG 3.49Å; E26-K30 PolarHBondContact O-N 2.98Å; D27-K30 PolarHBondContact O-N 3.34Å; F28-K30 VanDerWaalsContact C-N 3.34Å; F28-K30 PolarHBondContact O-N 2.65Å; K30-T33 PolarHBondContact O-N 2.74Å; K30-F34 WeakPolarHBondContact O-CB 3.24Å; K30-F34 PolarHBondContact O-N 3.13Å |
| 31 | F | 94.9 | Very high | 90.4 | Very high | 123 Ų | 123 | 115.1 Ų | 115.1 | 54% | 0.539 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.9 | -45.4 | 175.4 | 177.7 | -103.4 | 0 | 0 | 0 | 111.9 | D27 F28 F34 V35 | D27-F31 WeakPolarHBondContact O-CB 3.49Å; D27-F31 PolarHBondContact O-N 3.01Å; F28-F31 PolarHBondContact O-N 3.35Å; F31-F34 WeakPolarHBondContact O-CB 3.4Å; F31-F34 PolarHBondContact O-N 3.32Å; F31-V35 HydrophobicContact CD1-CG2 4.37Å; F31-V35 HydrophobicContact CD2-CG2 4.35Å; F31-V35 HydrophobicContact CE1-CG2 3.93Å; F31-V35 HydrophobicContact CE2-CG2 3.9Å; F31-V35 HydrophobicContact CZ-CG2 3.67Å; F31-V35 WeakPolarHBondContact O-CG2 3.25Å; F31-V35 PolarHBondContact O-N 2.78Å |
| 32 | C | 94.1 | Very high | 90.8 | Very high | 49 Ų | 49 | 108.8 Ų | 108.8 | 33% | 0.331 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60 | -48.4 | 177 | -173.7 | 0 | 0 | 0 | 0 | 111.3 | F28 N29 F34 V35 L36 | F28-C32 WeakPolarHBondContact O-CB 3.3Å; F28-C32 PolarHBondContact O-N 3.49Å; N29-C32 PolarHBondContact O-N 3.05Å; C32-F34 VanDerWaalsContact C-N 3.32Å; C32-F34 PolarHBondContact O-N 3.12Å; C32-V35 PolarHBondContact O-N 2.81Å; C32-L36 WeakPolarHBondContact O-CB 2.9Å; C32-L36 VanDerWaalsContact O-CG 3.27Å; C32-L36 WeakPolarHBondContact O-CG 3.41Å; C32-L36 PolarHBondContact O-N 3.12Å |
| 33 | T | 92.8 | Very high | 90.5 | Very high | 73 Ų | 73 | 103.3 Ų | 103.3 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -58.5 | -42.8 | 175.3 | -58.8 | 0 | 0 | 0 | 0 | 111.9 | N29 K30 L36 A37 I42 | N29-T33 WeakPolarHBondContact O-CB 3.38Å; N29-T33 PolarHBondContact O-N 3.48Å; N29-T33 PolarHBondContact O-OG1 3.07Å; K30-T33 PolarHBondContact O-N 2.74Å; T33-L36 PolarHBondContact O-N 3.02Å; T33-A37 VanDerWaalsContact O-CB 3.31Å; T33-A37 WeakPolarHBondContact O-CB 3.34Å; T33-A37 PolarHBondContact O-N 3.36Å; T33-I42 HydrophobicContact CG2-CD1 3.97Å |
| 34 | F | 92.8 | Very high | 89.2 | Confident | 148 Ų | 148 | 101.3 Ų | 101.3 | 65% | 0.649 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.5 | -48.6 | 177.9 | 177.5 | -95.9 | 0 | 0 | 0 | 112 | K30 F31 C32 L36 A37 Y38 | K30-F34 WeakPolarHBondContact O-CB 3.24Å; K30-F34 PolarHBondContact O-N 3.13Å; F31-F34 WeakPolarHBondContact O-CB 3.4Å; F31-F34 PolarHBondContact O-N 3.32Å; C32-F34 VanDerWaalsContact C-N 3.32Å; C32-F34 PolarHBondContact O-N 3.12Å; F34-L36 PolarHBondContact O-N 2.73Å; F34-A37 PolarHBondContact O-N 3.45Å; F34-Y38 WeakPolarHBondContact O-CB 3.03Å; F34-Y38 PolarHBondContact O-N 3.34Å |
| 35 | V | 96.4 | Very high | 88 | Confident | 64 Ų | 64 | 103.4 Ų | 103.4 | 39% | 0.388 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 178.4 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | F31 C32 Y38 A39 | F31-V35 HydrophobicContact CD1-CG2 4.37Å; F31-V35 HydrophobicContact CD2-CG2 4.35Å; F31-V35 HydrophobicContact CE1-CG2 3.93Å; F31-V35 HydrophobicContact CE2-CG2 3.9Å; F31-V35 HydrophobicContact CZ-CG2 3.67Å; F31-V35 WeakPolarHBondContact O-CG2 3.25Å; F31-V35 PolarHBondContact O-N 2.78Å; C32-V35 PolarHBondContact O-N 2.81Å; V35-Y38 PolarHBondContact O-N 2.94Å; V35-A39 WeakPolarHBondContact O-CB 3.42Å; V35-A39 PolarHBondContact O-N 3.42Å |
| 36 | L | 94.4 | Very high | 86.2 | Confident | 65 Ų | 65 | 108.3 Ų | 108.3 | 34% | 0.34 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68 | -36.8 | 179 | -72.2 | 173 | 0 | 0 | 0 | 112.8 | C32 T33 F34 G40 Y41 I42 | C32-L36 WeakPolarHBondContact O-CB 2.9Å; C32-L36 VanDerWaalsContact O-CG 3.27Å; C32-L36 WeakPolarHBondContact O-CG 3.41Å; C32-L36 PolarHBondContact O-N 3.12Å; T33-L36 PolarHBondContact O-N 3.02Å; F34-L36 PolarHBondContact O-N 2.73Å; L36-G40 PolarHBondContact O-N 3.39Å; L36-Y41 HydrophobicContact CD2-CD2 4.15Å; L36-Y41 HydrophobicContact CD2-CG 4.39Å; L36-Y41 PolarHBondContact O-N 2.88Å; L36-I42 HydrophobicContact CB-CD1 3.59Å; L36-I42 HydrophobicContact CB-CG1 3.89Å; L36-I42 HydrophobicContact CD1-CD1 4.17Å; L36-I42 PolarHBondContact O-N 2.9Å |
| 37 | A | 89.4 | Confident | 84.4 | Confident | 45 Ų | 45 | 110.4 Ų | 110.4 | 37% | 0.372 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -67.4 | -43 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | T33 F34 A39 G40 I42 | T33-A37 VanDerWaalsContact O-CB 3.31Å; T33-A37 WeakPolarHBondContact O-CB 3.34Å; T33-A37 PolarHBondContact O-N 3.36Å; F34-A37 PolarHBondContact O-N 3.45Å; A37-A39 VanDerWaalsContact C-N 3.32Å; A37-A39 PolarHBondContact O-N 3.1Å; A37-G40 PolarHBondContact O-N 3.24Å; A37-I42 HydrophobicContact CB-CB 4.43Å |
| 38 | Y | 91.5 | Very high | 82.2 | Confident | 204 Ų | 204 | 115.2 Ų | 115.2 | 80% | 0.8 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -60.7 | -41.1 | 175.5 | 178.4 | -100.7 | 0 | 0 | 0 | 112.2 | F34 V35 G40 | F34-Y38 WeakPolarHBondContact O-CB 3.03Å; F34-Y38 PolarHBondContact O-N 3.34Å; V35-Y38 PolarHBondContact O-N 2.94Å; Y38-G40 PolarHBondContact O-N 2.94Å |
| 39 | A | 91.2 | Very high | 79.7 | Confident | 58 Ų | 58 | 115.7 Ų | 115.7 | 48% | 0.479 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.5 | 2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | V35 A37 Y41 | V35-A39 WeakPolarHBondContact O-CB 3.42Å; V35-A39 PolarHBondContact O-N 3.42Å; A37-A39 VanDerWaalsContact C-N 3.32Å; A37-A39 PolarHBondContact O-N 3.1Å; A39-Y41 VanDerWaalsContact C-N 3.31Å; A39-Y41 HydrophobicContact CB-CD2 3.64Å; A39-Y41 HydrophobicContact CB-CE2 3.85Å; A39-Y41 PolarHBondContact O-N 3.48Å |
| 40 | G | 84.7 | Confident | 77.5 | Confident | 57 Ų | 57 | 117.7 Ų | 117.7 | 59% | 0.588 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75.9 | 10.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | L36 A37 Y38 | L36-G40 PolarHBondContact O-N 3.39Å; A37-G40 PolarHBondContact O-N 3.24Å; Y38-G40 PolarHBondContact O-N 2.94Å |
| 41 | Y | 85.4 | Confident | 75.2 | Confident | 184 Ų | 184 | 117.3 Ų | 117.3 | 72% | 0.722 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -78.4 | -22.7 | 177.7 | -72 | -74.6 | 0 | 0 | 0 | 113.3 | L36 A39 | L36-Y41 HydrophobicContact CD2-CD2 4.15Å; L36-Y41 HydrophobicContact CD2-CG 4.39Å; L36-Y41 PolarHBondContact O-N 2.88Å; A39-Y41 VanDerWaalsContact C-N 3.31Å; A39-Y41 HydrophobicContact CB-CD2 3.64Å; A39-Y41 HydrophobicContact CB-CE2 3.85Å; A39-Y41 PolarHBondContact O-N 3.48Å |
| 42 | I | 80.4 | Confident | 73.1 | Confident | 65 Ų | 65 | 122.7 Ų | 122.7 | 33% | 0.333 | 63% | 0.625 | S | S | . | * | S | Bend | trans | -109.9 | 106 | 174.4 | -59 | 173.9 | 0 | 0 | 0 | 107 | T33 L36 A37 Y44 | T33-I42 HydrophobicContact CG2-CD1 3.97Å; L36-I42 HydrophobicContact CB-CD1 3.59Å; L36-I42 HydrophobicContact CB-CG1 3.89Å; L36-I42 HydrophobicContact CD1-CD1 4.17Å; L36-I42 PolarHBondContact O-N 2.9Å; A37-I42 HydrophobicContact CB-CB 4.43Å; I42-Y44 PolarHBondContact O-N 3.32Å |
| 43 | P | 73.8 | Confident | 70.8 | Confident | 111 Ų | 111 | 126.1 Ų | 126.1 | 72% | 0.721 | 65% | 0.649 | S | S | * | * | trans | -55.7 | 126.7 | 171 | -19.1 | 29.7 | 0 | 0 | 0 | 108.5 | ||||
| 44 | Y | 61.1 | Low | 68.1 | Low | 184 Ų | 184 | 127.3 Ų | 127.3 | 72% | 0.722 | 66% | 0.66 | S | S | * | * | trans | -55.8 | 127.6 | 168.9 | -156.9 | -98.1 | 0 | 0 | 0 | 106.3 | I42 K46 | I42-Y44 PolarHBondContact O-N 3.32Å; Y44-K46 VanDerWaalsContact C-N 3.32Å; Y44-K46 PolarHBondContact O-N 2.9Å | ||
| 45 | P | 67.4 | Low | 66.4 | Low | 98 Ų | 98 | 126.1 Ų | 126.1 | 64% | 0.636 | 67% | 0.667 | S | S | * | * | trans | -55.9 | 109.4 | 169.7 | 23.3 | -29.6 | 0 | 0 | 0 | 105 | E47 | P45-E47 VanDerWaalsContact C-N 3.3Å; P45-E47 PolarHBondContact O-N 2.83Å | ||
| 46 | K | 53 | Low | 63.7 | Low | 192 Ų | 192 | 128.4 Ų | 128.4 | 84% | 0.835 | 69% | 0.687 | S | S | * | * | trans | -56.3 | 108.4 | 170.8 | -77.4 | 175 | 178.8 | 173.3 | 0 | 103.6 | Y44 E48 | Y44-K46 VanDerWaalsContact C-N 3.32Å; Y44-K46 PolarHBondContact O-N 2.9Å; K46-E48 PolarHBondContact O-N 3.35Å | ||
| 47 | E | 55.1 | Low | 61.5 | Low | 154 Ų | 154 | 131 Ų | 131 | 72% | 0.72 | 71% | 0.707 | S | S | * | * | trans | -56 | 99.4 | 163.5 | -74.3 | -177.7 | 162.7 | 0 | 0 | 104.3 | P45 L49 | P45-E47 VanDerWaalsContact C-N 3.3Å; P45-E47 PolarHBondContact O-N 2.83Å; E47-L49 PolarHBondContact O-N 2.95Å | ||
| 48 | E | 48.4 | Very low | 59.6 | Low | 172 Ų | 172 | 133.8 Ų | 133.8 | 80% | 0.804 | 73% | 0.73 | S | S | * | * | trans | -51.2 | 99.3 | 155.4 | -74.5 | -98.3 | 151.9 | 0 | 0 | 103.9 | K46 P50 | K46-E48 PolarHBondContact O-N 3.35Å; E48-P50 VanDerWaalsContact O-CD 3.26Å; E48-P50 WeakPolarHBondContact O-CD 3.38Å | ||
| 49 | L | 41.8 | Very low | 57.6 | Low | 143 Ų | 143 | 130.7 Ų | 130.7 | 75% | 0.749 | 73% | 0.727 | S | S | * | * | trans | -40.9 | 117.9 | 173.3 | -72.7 | 168 | 0 | 0 | 0 | 106.4 | E47 L51 | E47-L49 PolarHBondContact O-N 2.95Å; L49-L51 VanDerWaalsContact C-N 3.32Å; L49-L51 PolarHBondContact O-N 3.26Å | ||
| 50 | P | 45.8 | Very low | 55.4 | Low | 125 Ų | 125 | 133.3 Ų | 133.3 | 81% | 0.812 | 74% | 0.742 | S | S | * | * | trans | -55.7 | 103.9 | 177.1 | -27.7 | 35.6 | 0 | 0 | 0 | 108 | E48 R52 | E48-P50 VanDerWaalsContact O-CD 3.26Å; E48-P50 WeakPolarHBondContact O-CD 3.38Å; P50-R52 PolarHBondContact O-N 2.98Å | ||
| 51 | L | 45.6 | Very low | 54 | Low | 149 Ų | 149 | 137 Ų | 137 | 78% | 0.78 | 75% | 0.754 | S | S | * | * | trans | -56.8 | 110.9 | 172.8 | -69.9 | 177.1 | 0 | 0 | 0 | 105.7 | L49 S53 | L49-L51 VanDerWaalsContact C-N 3.32Å; L49-L51 PolarHBondContact O-N 3.26Å; L51-S53 PolarHBondContact O-N 2.97Å; L51-S53 PolarHBondContact O-OG 3.48Å; L51-S53 VanDerWaalsContact O-OG 3.09Å | ||
| 52 | R | 49.5 | Very low | 52.2 | Low | 237 Ų | 237 | 133 Ų | 133 | 89% | 0.894 | 76% | 0.758 | S | S | * | * | trans | -14.3 | 95.3 | 171 | -75.1 | -82.9 | 170.5 | 91.3 | -3.8 | 112.2 | P50 | P50-R52 PolarHBondContact O-N 2.98Š| ||
| 53 | S | 45.8 | Very low | 50.6 | Low | 121 Ų | 121 | 133.7 Ų | 133.7 | 85% | 0.846 | 78% | 0.781 | S | S | * | * | trans | -110.9 | 78.8 | 168.1 | -60 | 0 | 0 | 0 | 0 | 108.2 | L51 | L51-S53 PolarHBondContact O-N 2.97Å; L51-S53 PolarHBondContact O-OG 3.48Å; L51-S53 VanDerWaalsContact O-OG 3.09Å | ||
| 54 | S | 37.2 | Very low | 49.7 | Very low | 97 Ų | 97 | 134.9 Ų | 134.9 | 68% | 0.678 | 79% | 0.787 | S | S | * | * | trans | -141.3 | 112.7 | 163.6 | 55.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 55 | P | 56.2 | Low | 49.3 | Very low | 123 Ų | 123 | 133 Ų | 133 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | trans | -81.5 | 139 | 177.2 | 31 | -29.1 | 0 | 0 | 0 | 111.1 | ||||
| 56 | S | 40.8 | Very low | 48 | Very low | 113 Ų | 113 | 134.6 Ų | 134.6 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | trans | 104.5 | 155 | 153.5 | -42.5 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 57 | P | 46.7 | Very low | 47.8 | Very low | 119 Ų | 119 | 130.9 Ų | 130.9 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | cis | -127.3 | 163.3 | -3.3 | 34.2 | -15.6 | 0 | 0 | 0 | 115.5 | N59 | P57-N59 PolarHBondContact O-N 3.44Š| ||
| 58 | A | 51.2 | Low | 47.5 | Very low | 103 Ų | 103 | 131 Ų | 131 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | -70.2 | 106.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 59 | N | 49.2 | Very low | 47.4 | Very low | 139 Ų | 139 | 125.9 Ų | 125.9 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | -171.9 | 129 | 127 | 80.9 | 73.9 | 0 | 0 | 0 | 108.3 | P57 | P57-N59 PolarHBondContact O-N 3.44Š| |||
| 60 | S | 43.4 | Very low | 47.5 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | trans | -179.3 | 100.2 | 140.3 | -81.7 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 61 | T | 55.3 | Low | 47.3 | Very low | 136 Ų | 136 | 132.3 Ų | 132.3 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | trans | -73 | 130.1 | 178.4 | -57.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 62 | A | 48.3 | Very low | 47 | Very low | 99 Ų | 99 | 129.9 Ų | 129.9 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 58.4 | 121.7 | 149 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 63 | G | 46.6 | Very low | 46.5 | Very low | 79 Ų | 79 | 121.5 Ų | 121.5 | 81% | 0.814 | 79% | 0.786 | S | S | * | * | trans | -171.9 | 79.7 | 160.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 64 | T | 56.1 | Low | 46.2 | Very low | 136 Ų | 136 | 125.6 Ų | 125.6 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -65.7 | 141.3 | 165.4 | 57.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 65 | I | 51.3 | Low | 46.1 | Very low | 146 Ų | 146 | 126.4 Ų | 126.4 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | trans | 167.8 | 106.7 | 140.4 | -169.3 | 100 | 0 | 0 | 0 | 109.4 | ||||
| 66 | D | 40.2 | Very low | 45.2 | Very low | 131 Ų | 131 | 127.6 Ų | 127.6 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | 31.5 | 132.4 | 136.5 | -39.9 | -40.1 | 0 | 0 | 0 | 120.2 | ||||
| 67 | S | 49.6 | Very low | 45.2 | Very low | 114 Ų | 114 | 129.6 Ų | 129.6 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | 174.8 | 144.7 | 94.1 | -71.5 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 68 | D | 48.4 | Very low | 44.6 | Very low | 157 Ų | 157 | 128.4 Ų | 128.4 | 84% | 0.84 | 80% | 0.795 | S | S | * | * | trans | -64 | 179.2 | 178.9 | -59.2 | -71 | 0 | 0 | 0 | 115.1 | ||||
| 69 | G | 46.8 | Very low | 43.8 | Very low | 63 Ų | 63 | 129 Ų | 129 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | trans | -56.7 | -172.2 | -174.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 70 | W | 43.6 | Very low | 43.1 | Very low | 247 Ų | 247 | 127.5 Ų | 127.5 | 94% | 0.936 | 79% | 0.793 | S | S | * | * | -156.4 | 163.4 | 63.7 | -65.3 | -14.3 | 0 | 0 | 0 | 112.8 | |||||
| 71 | D | 41.3 | Very low | 42.9 | Very low | 156 Ų | 156 | 128.6 Ų | 128.6 | 83% | 0.834 | 80% | 0.795 | S | S | * | * | trans | -47.7 | 152.2 | 156.7 | 179.8 | 38.1 | 0 | 0 | 0 | 114.1 | ||||
| 72 | A | 38.5 | Very low | 42.5 | Very low | 98 Ų | 98 | 127.8 Ų | 127.8 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -167.5 | 115.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 73 | G | 39.4 | Very low | 42.2 | Very low | 61 Ų | 61 | 130.6 Ų | 130.6 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | trans | -83.1 | 165.8 | 167 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 74 | F | 39.5 | Very low | 42.2 | Very low | 207 Ų | 207 | 132.5 Ų | 132.5 | 91% | 0.908 | 79% | 0.791 | S | S | * | * | trans | 23.4 | 128 | 154.4 | -67.9 | -90.4 | 0 | 0 | 0 | 121.6 | ||||
| 75 | S | 35.4 | Very low | 41.3 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | 170.8 | 114.4 | 114.5 | -71.9 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 76 | D | 37.6 | Very low | 40.7 | Very low | 148 Ų | 148 | 130 Ų | 130 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | 54.5 | 143.6 | 120.9 | -112 | -21 | 0 | 0 | 0 | 126.2 | |||||
| 77 | I | 40.8 | Very low | 40.7 | Very low | 155 Ų | 155 | 128.8 Ų | 128.8 | 80% | 0.795 | 78% | 0.779 | S | S | * | * | trans | 72.9 | 116.1 | 157.5 | 12.4 | 86 | 0 | 0 | 0 | 127.3 | ||||
| 78 | A | 33.3 | Very low | 40.5 | Very low | 93 Ų | 93 | 132.2 Ų | 132.2 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | 86.5 | 119.6 | 127.5 | 0 | 0 | 0 | 0 | 0 | 125.8 | |||||
| 79 | S | 34.8 | Very low | 40.6 | Very low | 115 Ų | 115 | 130.2 Ų | 130.2 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | 87 | 109.3 | 130.1 | -164.3 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 80 | S | 35.3 | Very low | 40 | Very low | 108 Ų | 108 | 136.3 Ų | 136.3 | 76% | 0.755 | 78% | 0.781 | S | S | * | * | 156.8 | 112 | 111.9 | 67 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 81 | V | 39.8 | Very low | 40.3 | Very low | 136 Ų | 136 | 129.4 Ų | 129.4 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | -0.1 | 154.7 | 149.6 | -129.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 82 | P | 45.8 | Very low | 40.3 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | cis | -145.7 | 165.6 | 29.8 | 40 | -17.1 | 0 | 0 | 0 | 121.5 | ||||
| 83 | L | 41.7 | Very low | 40.2 | Very low | 158 Ų | 158 | 132.2 Ų | 132.2 | 83% | 0.827 | 77% | 0.765 | S | S | * | * | trans | -66.8 | 172.2 | 169.4 | -63.7 | 167.8 | 0 | 0 | 0 | 113 | ||||
| 84 | P | 46.6 | Very low | 40.3 | Very low | 118 Ų | 118 | 137 Ų | 137 | 77% | 0.766 | 77% | 0.771 | S | S | * | * | -150.4 | 144.4 | 96.2 | 41.8 | -24.2 | 0 | 0 | 0 | 118 | |||||
| 85 | V | 37.6 | Very low | 40.9 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 79% | 0.788 | 76% | 0.761 | S | S | * | * | trans | 59.2 | 140.6 | 148.8 | -113.9 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 86 | S | 38.1 | Very low | 40.9 | Very low | 99 Ų | 99 | 133.4 Ų | 133.4 | 69% | 0.692 | 76% | 0.764 | S | S | * | * | cis | -160.9 | 123.8 | 20.9 | -175.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 87 | D | 40.8 | Very low | 41.4 | Very low | 106 Ų | 106 | 134.1 Ų | 134.1 | 57% | 0.567 | 77% | 0.766 | S | S | * | * | 55.6 | 131.9 | 78.5 | -88.5 | -18.1 | 0 | 0 | 0 | 114.4 | |||||
| 88 | R | 46.2 | Very low | 41.7 | Very low | 187 Ų | 187 | 135 Ų | 135 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | cis | -164 | 137.6 | 6.1 | -88.3 | 157.6 | -163.4 | -81.2 | -15.9 | 107 | ||||
| 89 | C | 50.1 | Low | 42.1 | Very low | 114 Ų | 114 | 139 Ų | 139 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | 48.7 | 128.7 | 90.9 | -59.1 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 90 | F | 34.5 | Very low | 42.2 | Very low | 192 Ų | 192 | 144.7 Ų | 144.7 | 84% | 0.842 | 78% | 0.779 | S | S | * | * | -177.5 | 135.8 | 109.7 | -114.9 | -93.4 | 0 | 0 | 0 | 113.5 | |||||
| 91 | S | 49 | Very low | 42.3 | Very low | 101 Ų | 101 | 143.2 Ų | 143.2 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | -73.1 | 151.3 | 169.9 | 47.7 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 92 | H | 41.4 | Very low | 42.8 | Very low | 156 Ų | 156 | 146 Ų | 146 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | 145.9 | 123.3 | 139.2 | -172.3 | -109.4 | 0 | 0 | 0 | 111.1 | ||||
| 93 | L | 36.3 | Very low | 42.7 | Very low | 157 Ų | 157 | 146.1 Ų | 146.1 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | 170.1 | 141.7 | 128.3 | -84.9 | 155.6 | 0 | 0 | 0 | 112.1 | |||||
| 94 | Q | 41.5 | Very low | 42.8 | Very low | 161 Ų | 161 | 143.6 Ų | 143.6 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | -65.7 | 169.9 | -174.4 | -76.5 | -80.8 | -25.5 | 0 | 0 | 115.8 | ||||
| 95 | P | 52.2 | Low | 42.4 | Very low | 109 Ų | 109 | 145.3 Ų | 145.3 | 71% | 0.708 | 77% | 0.773 | S | S | * | * | trans | -88.6 | 131.3 | -178.2 | 33.4 | -25.8 | 0 | 0 | 0 | 112 | ||||
| 96 | T | 36.6 | Very low | 42.7 | Very low | 138 Ų | 138 | 148.7 Ų | 148.7 | 85% | 0.847 | 78% | 0.778 | S | S | * | * | trans | -127.2 | 137.5 | 170.4 | 51.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 97 | L | 47.5 | Very low | 43.2 | Very low | 163 Ų | 163 | 151 Ų | 151 | 85% | 0.853 | 78% | 0.781 | S | S | * | * | trans | -51.8 | 148.8 | 178.5 | -59.6 | -179.7 | 0 | 0 | 0 | 113 | ||||
| 98 | L | 47.9 | Very low | 43.5 | Very low | 175 Ų | 175 | 153.1 Ų | 153.1 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | -172.3 | 154.1 | 123.4 | -95.3 | 171.1 | 0 | 0 | 0 | 112.1 | |||||
| 99 | Q | 39.7 | Very low | 43 | Very low | 176 Ų | 176 | 151.9 Ų | 151.9 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | -85.1 | 150.9 | -162.8 | -65.5 | 173.7 | -17 | 0 | 0 | 114.9 | ||||
| 100 | R | 38.6 | Very low | 42.7 | Very low | 234 Ų | 234 | 156 Ų | 156 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | 45.8 | 118.3 | 125.5 | -161.8 | 174.2 | -166.2 | 107.8 | 0.4 | 119.5 | |||||
| 101 | A | 36.2 | Very low | 43.2 | Very low | 77 Ų | 77 | 156.9 Ų | 156.9 | 64% | 0.636 | 80% | 0.802 | S | S | * | * | 164.8 | 124.9 | 107.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 102 | K | 49.9 | Very low | 43.1 | Very low | 195 Ų | 195 | 160.5 Ų | 160.5 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | 64.3 | 139.3 | 138.4 | -62.4 | 163.7 | -178 | 170.6 | 0 | 121.9 | ||||
| 103 | P | 44.3 | Very low | 43.1 | Very low | 122 Ų | 122 | 160.1 Ų | 160.1 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -84 | 139.3 | 171.1 | 34.3 | -31.9 | 0 | 0 | 0 | 112.6 | ||
| 104 | S | 44.8 | Very low | 43.5 | Very low | 106 Ų | 106 | 158.3 Ų | 158.3 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 133.6 | 177.4 | 56.8 | 0 | 0 | 0 | 0 | 112.2 | ||
| 105 | N | 36.8 | Very low | 43.8 | Very low | 153 Ų | 153 | 159.1 Ų | 159.1 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 143 | 171.8 | -76.6 | -100.5 | 0 | 0 | 0 | 111.3 | ||
| 106 | F | 43.5 | Very low | 43.5 | Very low | 202 Ų | 202 | 161.5 Ų | 161.5 | 89% | 0.886 | 81% | 0.812 | S | S | * | * | trans | -116.4 | 109.1 | 155.1 | -92.2 | -88.3 | 0 | 0 | 0 | 109.1 | ||||
| 107 | L | 50.5 | Low | 44.2 | Very low | 147 Ų | 147 | 164.5 Ų | 164.5 | 77% | 0.77 | 81% | 0.814 | S | S | * | * | trans | -98.1 | 141.3 | 153.2 | -99.6 | 177.2 | 0 | 0 | 0 | 105.1 | ||||
| 108 | L | 45.8 | Very low | 44.1 | Very low | 150 Ų | 150 | 166 Ų | 166 | 79% | 0.785 | 81% | 0.813 | S | S | * | * | -170 | 140.9 | 64.8 | -72.8 | 164.5 | 0 | 0 | 0 | 108 | |||||
| 109 | D | 35.3 | Very low | 44.3 | Very low | 162 Ų | 162 | 167.1 Ų | 167.1 | 87% | 0.866 | 81% | 0.811 | S | S | * | * | -151.8 | 159.6 | 123.5 | -146.4 | -83.2 | 0 | 0 | 0 | 110.6 | |||||
| 110 | R | 43.8 | Very low | 44.8 | Very low | 199 Ų | 199 | 167.2 Ų | 167.2 | 75% | 0.751 | 81% | 0.808 | S | S | * | * | trans | -126.4 | 124.7 | -136.9 | 166.5 | 150.9 | 62.7 | 172.5 | 2.5 | 109 | ||||
| 111 | K | 45.9 | Very low | 45.4 | Very low | 212 Ų | 212 | 164.7 Ų | 164.7 | 92% | 0.922 | 80% | 0.804 | S | S | * | * | trans | -148.2 | 113.1 | 149.9 | -152.7 | 150.8 | 174.1 | 177.8 | 0 | 111.8 | ||||
| 112 | K | 47.2 | Very low | 45.7 | Very low | 176 Ų | 176 | 171.8 Ų | 171.8 | 77% | 0.765 | 81% | 0.814 | S | S | * | * | trans | -83.5 | 140.2 | 174.3 | -67.7 | 174.9 | 172 | -178.6 | 0 | 109.3 | ||||
| 113 | T | 41.6 | Very low | 45.3 | Very low | 148 Ų | 148 | 170.3 Ų | 170.3 | 91% | 0.908 | 81% | 0.808 | S | S | * | * | trans | -135 | 127.4 | 140 | 43.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 114 | D | 43.7 | Very low | 45.1 | Very low | 120 Ų | 120 | 174.5 Ų | 174.5 | 64% | 0.642 | 81% | 0.808 | S | S | * | * | trans | -95.2 | 173.8 | -175.3 | -175.1 | -122 | 0 | 0 | 0 | 110.2 | ||||
| 115 | K | 47 | Very low | 44.9 | Very low | 177 Ų | 177 | 179.5 Ų | 179.5 | 77% | 0.77 | 81% | 0.81 | S | S | * | * | trans | 83.2 | 130.9 | 171.2 | -39.1 | -71.4 | 175.5 | -150.9 | 0 | 113.4 | ||||
| 116 | L | 47.6 | Very low | 44.9 | Very low | 159 Ų | 159 | 178.1 Ų | 178.1 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | cis | -167.1 | 138.4 | 18.2 | -175.3 | 61 | 0 | 0 | 0 | 109.7 | ||||
| 117 | K | 49.8 | Very low | 44.5 | Very low | 202 Ų | 202 | 173.7 Ų | 173.7 | 88% | 0.878 | 80% | 0.797 | S | S | * | * | trans | -61.5 | 134.3 | 166.3 | -71.9 | 175.9 | 172.4 | 173.6 | 0 | 111.1 | ||||
| 118 | K | 47.1 | Very low | 43.8 | Very low | 194 Ų | 194 | 174.1 Ų | 174.1 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -147.4 | 99.2 | 146.4 | -156 | 164.5 | -176.8 | 169.6 | 0 | 113 | ||||
| 119 | K | 50.6 | Low | 43.4 | Very low | 199 Ų | 199 | 171 Ų | 171 | 87% | 0.865 | 80% | 0.796 | S | S | * | * | trans | -62.5 | 123.1 | 160 | -173 | 178.2 | -175.7 | 174.4 | 0 | 108.5 | ||||
| 120 | K | 51.8 | Low | 43.7 | Very low | 178 Ų | 178 | 169.3 Ų | 169.3 | 77% | 0.774 | 79% | 0.793 | S | S | * | * | trans | -140.7 | 104.5 | 157 | -166.7 | 168.1 | 178.6 | 174.1 | 0 | 111.1 | ||||
| 121 | K | 50 | Low | 43 | Very low | 180 Ų | 180 | 163.1 Ų | 163.1 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | -82.7 | 125.9 | 165.3 | 165.5 | -178.6 | 179 | 176.2 | 0 | 109 | ||||
| 122 | R | 43.6 | Very low | 42.7 | Very low | 226 Ų | 226 | 162.5 Ų | 162.5 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -166.1 | 113 | 149.6 | -70.4 | -157.2 | 167.3 | -152.1 | -4.2 | 105.3 | ||||
| 123 | K | 41.2 | Very low | 42 | Very low | 164 Ų | 164 | 163.1 Ų | 163.1 | 71% | 0.713 | 80% | 0.795 | S | S | * | * | 66.8 | 106.5 | 56.2 | -163.4 | 172.2 | 178.7 | 177.2 | 0 | 114.9 | |||||
| 124 | R | 39.2 | Very low | 41.5 | Very low | 210 Ų | 210 | 159.4 Ų | 159.4 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | trans | 67.7 | 144.6 | 151.8 | -72.4 | -176.6 | -178.3 | -146.8 | -0.8 | 116.8 | ||||
| 125 | R | 41.5 | Very low | 40.8 | Very low | 211 Ų | 211 | 162.3 Ų | 162.3 | 80% | 0.796 | 79% | 0.789 | S | S | * | * | cis | -147.3 | 148.9 | 26.3 | -100.5 | 169.6 | 168.8 | -86.1 | 5 | 107 | ||||
| 126 | D | 35.5 | Very low | 40.1 | Very low | 125 Ų | 125 | 163.2 Ų | 163.2 | 67% | 0.668 | 79% | 0.788 | S | S | * | * | 70.7 | 110.8 | 65.9 | -151.8 | -96.7 | 0 | 0 | 0 | 114.7 | |||||
| 127 | S | 36.3 | Very low | 39.2 | Very low | 108 Ų | 108 | 159.1 Ų | 159.1 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | trans | 164 | 97 | 150.1 | 55.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 128 | D | 34.9 | Very low | 38.1 | Very low | 157 Ų | 157 | 153 Ų | 153 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | 79.6 | 133.9 | 85 | -101.6 | -51.9 | 0 | 0 | 0 | 115.8 | |||||
| 129 | A | 38.5 | Very low | 37.3 | Very low | 84 Ų | 84 | 151.4 Ų | 151.4 | 69% | 0.694 | 78% | 0.778 | S | S | * | * | trans | -73.3 | -166.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 130 | P | 42 | Very low | 37 | Very low | 126 Ų | 126 | 149 Ų | 149 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | cis | -155.1 | 173.2 | 39.7 | 38 | -12.9 | 0 | 0 | 0 | 118.7 | ||||
| 131 | G | 28.5 | Very low | 36 | Very low | 69 Ų | 69 | 148.5 Ų | 148.5 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | 89.4 | 116.9 | 128.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 132 | K | 39.2 | Very low | 35.3 | Very low | 200 Ų | 200 | 147.1 Ų | 147.1 | 87% | 0.87 | 77% | 0.772 | S | S | * | * | -154.2 | 108.9 | 119.8 | -61.4 | -147.9 | 178.5 | -159.1 | 0 | 106.7 | |||||
| 133 | E | 32.4 | Very low | 34.6 | Very low | 188 Ų | 188 | 144.8 Ų | 144.8 | 88% | 0.879 | 77% | 0.771 | S | S | * | * | 49.7 | 106.7 | 88.1 | -160.4 | 174.3 | -160.1 | 0 | 0 | 110.4 | |||||
| 134 | G | 31.2 | Very low | 34.2 | Very low | 71 Ų | 71 | 141.3 Ų | 141.3 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | 94.2 | 121.7 | 57.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 135 | Y | 29.2 | Very low | 33.9 | Very low | 181 Ų | 181 | 137.5 Ų | 137.5 | 71% | 0.71 | 77% | 0.773 | S | S | * | * | trans | 156.9 | 135.6 | 148.3 | -171.9 | -108.5 | 0 | 0 | 0 | 114.6 | ||||
| 136 | R | 31.8 | Very low | 33.5 | Very low | 195 Ų | 195 | 134.4 Ų | 134.4 | 74% | 0.736 | 77% | 0.772 | S | S | * | * | trans | 12.9 | 144 | 160 | -78.8 | -161.5 | -96.4 | -91.3 | 5.8 | 119.7 | ||||
| 137 | G | 28 | Very low | 34.1 | Very low | 73 Ų | 73 | 133.9 Ų | 133.9 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | cis | 125.1 | 127.9 | 22.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 138 | G | 28.3 | Very low | 33.9 | Very low | 73 Ų | 73 | 138.4 Ų | 138.4 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | 88.7 | 146.9 | 145.4 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 139 | L | 30 | Very low | 33.9 | Very low | 161 Ų | 161 | 136 Ų | 136 | 84% | 0.843 | 77% | 0.768 | S | S | * | * | trans | 72.1 | 121.2 | 155.7 | -111.9 | 77.6 | 0 | 0 | 0 | 115.7 | ||||
| 140 | L | 44.2 | Very low | 33.5 | Very low | 150 Ų | 150 | 139.9 Ų | 139.9 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | -151.5 | 127.9 | 52.6 | -66.5 | 157.5 | 0 | 0 | 0 | 108.2 | |||||
| 141 | K | 29.9 | Very low | 33 | Very low | 166 Ų | 166 | 139.6 Ų | 139.6 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | 59.8 | 100.9 | 78.7 | -155.4 | 163.7 | -176.4 | 172.1 | 0 | 111.5 | |||||
| 142 | L | 35.8 | Very low | 33.8 | Very low | 152 Ų | 152 | 141.5 Ų | 141.5 | 80% | 0.796 | 77% | 0.768 | S | S | * | * | 51.7 | 124.3 | 96.9 | -59.3 | 163 | 0 | 0 | 0 | 110.5 | |||||
| 143 | E | 29 | Very low | 33.3 | Very low | 177 Ų | 177 | 138 Ų | 138 | 83% | 0.827 | 76% | 0.764 | S | S | * | * | -161.8 | 152.3 | 64.4 | -71.9 | -171.3 | 116.9 | 0 | 0 | 108.7 | |||||
| 144 | A | 33.1 | Very low | 33.6 | Very low | 90 Ų | 90 | 134.5 Ų | 134.5 | 74% | 0.744 | 76% | 0.76 | S | S | * | * | -158.1 | 117.8 | 75.4 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 145 | T | 32.4 | Very low | 34.3 | Very low | 131 Ų | 131 | 136.5 Ų | 136.5 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | 63.4 | 97.1 | 127 | -14.3 | 0 | 0 | 0 | 0 | 120 | |||||
| 146 | D | 33.7 | Very low | 34.3 | Very low | 145 Ų | 145 | 134.2 Ų | 134.2 | 78% | 0.775 | 77% | 0.765 | S | S | * | * | trans | -37.9 | 174.1 | 136.9 | -117.4 | -26.6 | 0 | 0 | 0 | 113.9 | ||||
| 147 | P | 47.6 | Very low | 34.5 | Very low | 115 Ų | 115 | 132.4 Ų | 132.4 | 75% | 0.747 | 77% | 0.769 | S | S | * | * | cis | -138.2 | 162.8 | 31.9 | 34 | -11.8 | 0 | 0 | 0 | 115.7 | ||||
| 148 | Y | 31.4 | Very low | 34.8 | Very low | 202 Ų | 202 | 138.2 Ų | 138.2 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | 171.7 | 101.8 | 111.1 | -166.4 | -102.7 | 0 | 0 | 0 | 112.9 | |||||
| 149 | V | 36.8 | Very low | 34.9 | Very low | 107 Ų | 107 | 140.9 Ų | 140.9 | 65% | 0.648 | 77% | 0.774 | S | S | * | * | trans | 74.8 | 94.9 | 134.8 | -176.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 150 | E | 28.6 | Very low | 35.4 | Very low | 166 Ų | 166 | 139.9 Ų | 139.9 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | -18.9 | 144.5 | 131.2 | -80.3 | -174.8 | 135.5 | 0 | 0 | 115.7 | ||||
| 151 | T | 31.2 | Very low | 35.4 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 74% | 0.736 | 77% | 0.768 | S | S | * | * | 174.2 | 178.2 | 64.8 | -1.4 | 0 | 0 | 0 | 0 | 107.3 | |||||
| 152 | P | 46.3 | Very low | 35.5 | Very low | 108 Ų | 108 | 139.8 Ų | 139.8 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | trans | -114.1 | -140.4 | -142.2 | 32.3 | -6.8 | 0 | 0 | 0 | 111.2 | ||||
| 153 | T | 28.5 | Very low | 35.4 | Very low | 127 Ų | 127 | 137.1 Ų | 137.1 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | trans | 89 | 96.9 | 166.8 | 18.1 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 154 | S | 38.6 | Very low | 36.1 | Very low | 114 Ų | 114 | 134.4 Ų | 134.4 | 80% | 0.797 | 77% | 0.774 | S | S | * | * | -72.1 | 151.1 | 125.3 | -55 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 155 | P | 46.5 | Very low | 36.3 | Very low | 113 Ų | 113 | 135 Ų | 135 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | -153.3 | 177.8 | 52.9 | 37.5 | -14.8 | 0 | 0 | 0 | 116.6 | |||||
| 156 | T | 28.5 | Very low | 36.5 | Very low | 133 Ų | 133 | 136.6 Ų | 136.6 | 82% | 0.816 | 78% | 0.776 | S | S | * | * | 158.2 | 146 | 126.6 | -61.5 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 157 | L | 37.1 | Very low | 37.1 | Very low | 157 Ų | 157 | 135.1 Ų | 135.1 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | trans | -69.3 | 161.6 | -169.5 | -63.5 | 170.4 | 0 | 0 | 0 | 118.7 | ||||
| 158 | Q | 34.4 | Very low | 36.8 | Very low | 196 Ų | 196 | 135.9 Ų | 135.9 | 92% | 0.916 | 78% | 0.781 | S | S | * | * | trans | 177 | 141.6 | 133 | -93.1 | 167.2 | 51.3 | 0 | 0 | 107 | ||||
| 159 | D | 29.6 | Very low | 37.1 | Very low | 129 Ų | 129 | 131.3 Ų | 131.3 | 69% | 0.69 | 78% | 0.779 | S | S | * | * | cis | -173 | 122 | -9.4 | -165.8 | 43.4 | 0 | 0 | 0 | 106.7 | ||||
| 160 | I | 39.5 | Very low | 36.9 | Very low | 140 Ų | 140 | 129.3 Ų | 129.3 | 72% | 0.718 | 78% | 0.78 | S | S | * | * | trans | 52.8 | 157 | 136.2 | -62.3 | 176.9 | 0 | 0 | 0 | 122 | ||||
| 161 | P | 44.4 | Very low | 37.4 | Very low | 120 Ų | 120 | 132.9 Ų | 132.9 | 78% | 0.779 | 79% | 0.786 | S | S | * | * | cis | -127.9 | 166.2 | -7.9 | 21.4 | 1.4 | 0 | 0 | 0 | 118.2 | ||||
| 162 | Q | 32.5 | Very low | 37.6 | Very low | 194 Ų | 194 | 133.9 Ų | 133.9 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -69 | 159.8 | 167.6 | -58.6 | 168.8 | -77.6 | 0 | 0 | 115.8 | ||||
| 163 | A | 34.3 | Very low | 37.9 | Very low | 95 Ų | 95 | 132.6 Ų | 132.6 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | -175.1 | 171.9 | 126.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 164 | P | 43.8 | Very low | 38.5 | Very low | 121 Ų | 121 | 133.2 Ų | 133.2 | 79% | 0.786 | 78% | 0.779 | S | S | * | * | -124.8 | 176.6 | -93.3 | 31.3 | -9.9 | 0 | 0 | 0 | 114.9 | |||||
| 165 | S | 36.6 | Very low | 38.9 | Very low | 103 Ų | 103 | 133.1 Ų | 133.1 | 72% | 0.72 | 77% | 0.774 | S | S | * | * | trans | -49.9 | 144.6 | 176 | 52.5 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 166 | D | 36.3 | Very low | 38.8 | Very low | 164 Ų | 164 | 134.1 Ų | 134.1 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | trans | -121.1 | 130.8 | 154.1 | -82.8 | -45.2 | 0 | 0 | 0 | 111.7 | ||||
| 167 | P | 47.4 | Very low | 39.5 | Very low | 114 Ų | 114 | 132.9 Ų | 132.9 | 74% | 0.74 | 78% | 0.777 | S | S | * | * | trans | -90.3 | 156.9 | 177.2 | 7.5 | 11.7 | 0 | 0 | 0 | 113.5 | ||||
| 168 | C | 41.7 | Very low | 39.7 | Very low | 131 Ų | 131 | 131.4 Ų | 131.4 | 89% | 0.885 | 78% | 0.78 | S | S | * | * | trans | -80.3 | 122.5 | 170.8 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 169 | S | 36.8 | Very low | 39.5 | Very low | 106 Ų | 106 | 125.5 Ų | 125.5 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | -175.6 | 126.7 | 149.9 | 36.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 170 | G | 33.1 | Very low | 40.1 | Very low | 65 Ų | 65 | 125 Ų | 125 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | 100.9 | 148.9 | 85 | 0 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 171 | W | 39.3 | Very low | 39.8 | Very low | 240 Ų | 240 | 123.5 Ų | 123.5 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | 32.9 | 131.4 | 161.9 | 66.2 | 2.1 | 0 | 0 | 0 | 121.8 | ||||
| 172 | D | 35.2 | Very low | 39.3 | Very low | 141 Ų | 141 | 121.9 Ų | 121.9 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | 171.3 | 167.9 | 89.5 | -162.2 | -133 | 0 | 0 | 0 | 111.2 | |||||
| 173 | S | 52.3 | Low | 39.1 | Very low | 81 Ų | 81 | 119 Ų | 119 | 57% | 0.566 | 77% | 0.772 | S | S | * | * | trans | -101.2 | 176.7 | -151.9 | -48.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 174 | D | 41.4 | Very low | 39 | Very low | 141 Ų | 141 | 121 Ų | 121 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | trans | 78.9 | 114.2 | 145.3 | -65.8 | -47.1 | 0 | 0 | 0 | 122.1 | ||||
| 175 | T | 45.3 | Very low | 38.8 | Very low | 112 Ų | 112 | 120.4 Ų | 120.4 | 69% | 0.687 | 77% | 0.773 | S | S | * | * | 48.4 | 135.2 | 115.2 | -33.4 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 176 | P | 45.7 | Very low | 39.6 | Very low | 133 Ų | 133 | 121 Ų | 121 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | -127.6 | 139.1 | 131 | 33.7 | -22 | 0 | 0 | 0 | 113.6 | ||||
| 177 | S | 42.4 | Very low | 39.5 | Very low | 107 Ų | 107 | 120.5 Ų | 120.5 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | trans | -91.2 | 147.2 | 173.3 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 178 | S | 41.1 | Very low | 39.4 | Very low | 127 Ų | 127 | 123 Ų | 123 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | 157.4 | 133.9 | 144.9 | -73.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 179 | G | 31.3 | Very low | 39.2 | Very low | 71 Ų | 71 | 122.6 Ų | 122.6 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | cis | 174.5 | 145.8 | -1.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 180 | S | 40.6 | Very low | 39.8 | Very low | 118 Ų | 118 | 126.7 Ų | 126.7 | 83% | 0.825 | 77% | 0.771 | S | S | * | * | trans | 37 | 145.8 | 142.3 | -163 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 181 | C | 34 | Very low | 40.2 | Very low | 110 Ų | 110 | 130 Ų | 130 | 74% | 0.743 | 77% | 0.769 | S | S | * | * | cis | -168.6 | 158.9 | -15.6 | 53.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 182 | A | 33.5 | Very low | 40.8 | Very low | 86 Ų | 86 | 125.6 Ų | 125.6 | 71% | 0.711 | 76% | 0.761 | S | S | * | * | trans | 83 | 132.7 | 146.3 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 183 | T | 28.9 | Very low | 41.2 | Very low | 133 Ų | 133 | 127.3 Ų | 127.3 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | trans | 102 | 109.1 | 144.6 | 47.5 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 184 | V | 32.4 | Very low | 41 | Very low | 136 Ų | 136 | 129.5 Ų | 129.5 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | 57.8 | 112 | 143.6 | -100 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 185 | S | 39.7 | Very low | 41 | Very low | 110 Ų | 110 | 131.6 Ų | 131.6 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | 53.3 | 167.5 | 124.5 | -135.4 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 186 | P | 52.7 | Low | 41.1 | Very low | 114 Ų | 114 | 129 Ų | 129 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | -118.1 | 147.8 | -90.8 | 36.4 | -20.2 | 0 | 0 | 0 | 111.7 | |||||
| 187 | D | 34.6 | Very low | 41.8 | Very low | 154 Ų | 154 | 133.4 Ų | 133.4 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -150.6 | 145.4 | 154 | -151.7 | 7.6 | 0 | 0 | 0 | 113.1 | ||||
| 188 | Q | 44.8 | Very low | 42.3 | Very low | 166 Ų | 166 | 135.5 Ų | 135.5 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | trans | -67.6 | 129.2 | -172.2 | -59.2 | 169.4 | 42.6 | 0 | 0 | 110.3 | ||||
| 189 | V | 37 | Very low | 43.1 | Very low | 124 Ų | 124 | 134.2 Ų | 134.2 | 75% | 0.752 | 76% | 0.757 | S | S | * | * | trans | -144 | 113.6 | 145.1 | 119.7 | 0 | 0 | 0 | 0 | 109.3 | E191 | V189-E191 HydrophobicContact CG1-CB 4.33Å; V189-E191 PolarHBondContact O-N 2.85Å | ||
| 190 | K | 51.2 | Low | 44.4 | Very low | 192 Ų | 192 | 134.4 Ų | 134.4 | 84% | 0.835 | 74% | 0.74 | S | S | * | * | trans | -69 | 104.7 | 165.1 | -66.3 | 171.8 | 179.2 | 177.7 | 0 | 106.1 | ||||
| 191 | E | 41.3 | Very low | 45.4 | Very low | 135 Ų | 135 | 132.9 Ų | 132.9 | 63% | 0.631 | 73% | 0.726 | S | S | * | * | trans | -118.1 | 96 | 164.3 | -154.6 | 177.2 | 157.2 | 0 | 0 | 109.2 | V189 K193 | V189-E191 HydrophobicContact CG1-CB 4.33Å; V189-E191 PolarHBondContact O-N 2.85Å; E191-K193 PolarHBondContact O-N 3.25Å; E191-K193 WeakPolarHBondContact OE1-CE 3.44Å; E191-K193 IonicContact OE1-NZ 3.26Å | ||
| 192 | I | 51.6 | Low | 46.9 | Very low | 146 Ų | 146 | 137 Ų | 137 | 75% | 0.749 | 73% | 0.726 | S | S | * | * | trans | -82.1 | 96.4 | 171 | -59.2 | 155.8 | 0 | 0 | 0 | 105.1 | T194 | I192-T194 HydrophobicContact CG2-CG2 4.09Š| ||
| 193 | K | 42.3 | Very low | 47.9 | Very low | 178 Ų | 178 | 140.6 Ų | 140.6 | 77% | 0.774 | 73% | 0.728 | S | S | * | * | trans | -94.9 | 99.8 | 164.4 | -96 | -179.3 | 176.1 | 170.6 | 0 | 108.7 | E191 E195 | E191-K193 PolarHBondContact O-N 3.25Å; E191-K193 WeakPolarHBondContact OE1-CE 3.44Å; E191-K193 IonicContact OE1-NZ 3.26Å; K193-E195 PolarHBondContact O-N 2.95Å | ||
| 194 | T | 49.5 | Very low | 49.9 | Very low | 127 Ų | 127 | 138 Ų | 138 | 78% | 0.779 | 73% | 0.727 | S | S | * | * | trans | -80.4 | 106.6 | 168.7 | 39.8 | 0 | 0 | 0 | 0 | 109.6 | I192 | I192-T194 HydrophobicContact CG2-CG2 4.09Š| ||
| 195 | E | 41 | Very low | 51.5 | Low | 184 Ų | 184 | 142 Ų | 142 | 86% | 0.86 | 73% | 0.734 | S | S | * | * | trans | -141.3 | 112.4 | 155.3 | -151.5 | 170.3 | -166.5 | 0 | 0 | 107.8 | K193 | K193-E195 PolarHBondContact O-N 2.95Š| ||
| 196 | G | 47.8 | Very low | 52.2 | Low | 57 Ų | 57 | 143.4 Ų | 143.4 | 59% | 0.588 | 73% | 0.728 | S | S | * | * | S | Bend | trans | 92.7 | 131.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | R198 | G196-R198 PolarHBondContact O-N 3.07Š|
| 197 | K | 60.2 | Low | 52.8 | Low | 227 Ų | 227 | 141.1 Ų | 141.1 | 99% | 0.987 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -69.6 | 55 | -169.3 | -54.1 | 164.6 | -179.6 | 179.8 | 0 | 114 | ||
| 198 | R | 53.5 | Low | 54.3 | Low | 151 Ų | 151 | 137.8 Ų | 137.8 | 57% | 0.57 | 70% | 0.697 | S | S | * | * | trans | -124.6 | 120.7 | 179.1 | 60.8 | -172.4 | 178.4 | 154.1 | -0.6 | 109.6 | G196 I200 | G196-R198 PolarHBondContact O-N 3.07Å; R198-I200 HydrophobicContact CG-CD1 4.43Å; R198-I200 HydrophobicContact CG-CG1 4.4Å; R198-I200 PolarHBondContact O-N 3.02Å | ||
| 199 | T | 57.6 | Low | 54.9 | Low | 100 Ų | 100 | 135.7 Ų | 135.7 | 61% | 0.613 | 69% | 0.685 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.2 | 111.6 | 175.2 | 56.7 | 0 | 0 | 0 | 0 | 108.6 | ||
| 200 | I | 57.9 | Low | 56.3 | Low | 75 Ų | 75 | 139.3 Ų | 139.3 | 39% | 0.385 | 69% | 0.686 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -99.9 | 98.8 | 176.6 | -56.8 | 171.1 | 0 | 0 | 0 | 106.9 | R198 R202 F209 | R198-I200 HydrophobicContact CG-CD1 4.43Å; R198-I200 HydrophobicContact CG-CG1 4.4Å; R198-I200 PolarHBondContact O-N 3.02Å; I200-R202 HydrophobicContact CG2-CG 4.46Å; I200-F209 HydrophobicContact CD1-CE1 4.1Å; I200-F209 HydrophobicContact CG1-CD1 4.2Å; I200-F209 HydrophobicContact CG1-CE1 4.17Å; I200-F209 HydrophobicContact CG2-CE1 4.42Å |
| 201 | V | 62.3 | Low | 56.6 | Low | 85 Ų | 85 | 136.1 Ų | 136.1 | 52% | 0.515 | 68% | 0.678 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.8 | 115.7 | 177.3 | -174.7 | 0 | 0 | 0 | 0 | 108.6 | Q203 | V201-Q203 HydrophobicContact CG1-CG 4.26Å |
| 202 | R | 65.4 | Low | 57.7 | Low | 196 Ų | 196 | 138.6 Ų | 138.6 | 74% | 0.74 | 69% | 0.689 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -95.1 | 112 | 175.2 | -50.1 | -171.6 | 102.1 | 146.2 | 2.7 | 108.9 | I200 V207 | I200-R202 HydrophobicContact CG2-CG 4.46Å; R202-V207 HydrophobicContact CG-CG1 4.04Å |
| 203 | Q | 54 | Low | 57.9 | Low | 162 Ų | 162 | 138.4 Ų | 138.4 | 76% | 0.757 | 69% | 0.69 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -117.4 | 105 | 166 | -66.2 | -167.5 | 18.8 | 0 | 0 | 108.7 | V201 | V201-Q203 HydrophobicContact CG1-CG 4.26Å |
| 204 | G | 71.2 | Confident | 58.6 | Low | 78 Ų | 78 | 135.5 Ų | 135.5 | 80% | 0.804 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62 | -139.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q206 | G204-Q206 PolarHBondContact O-N 3.25Š|
| 205 | K | 66.7 | Low | 59.1 | Low | 222 Ų | 222 | 135.3 Ų | 135.3 | 97% | 0.965 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 3.5 | -171.1 | -159.5 | 134.7 | -179.6 | 179.1 | 0 | 114.6 | ||
| 206 | Q | 53.7 | Low | 60.1 | Low | 138 Ų | 138 | 129.8 Ų | 129.8 | 65% | 0.645 | 68% | 0.683 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.8 | 130.6 | -178.4 | -167 | 172.8 | -15.6 | 0 | 0 | 110.2 | G204 V208 | G204-Q206 PolarHBondContact O-N 3.25Å; Q206-V208 HydrophobicContact CG-CG2 4.17Å |
| 207 | V | 64.4 | Low | 60.6 | Low | 66 Ų | 66 | 132.7 Ų | 132.7 | 40% | 0.4 | 69% | 0.685 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103 | 116.4 | 169.5 | -84.1 | 0 | 0 | 0 | 0 | 107.6 | R202 F209 | R202-V207 HydrophobicContact CG-CG1 4.04Å; V207-F209 HydrophobicContact CB-CE2 4.31Å; V207-F209 HydrophobicContact CG2-CE2 4.18Å |
| 208 | V | 65.9 | Low | 60.6 | Low | 84 Ų | 84 | 128.2 Ų | 128.2 | 51% | 0.509 | 67% | 0.672 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.7 | 116.5 | 175.3 | -174.1 | 0 | 0 | 0 | 0 | 107.1 | Q206 | Q206-V208 HydrophobicContact CG-CG2 4.17Å |
| 209 | F | 58.5 | Low | 61 | Low | 122 Ų | 122 | 128.3 Ų | 128.3 | 54% | 0.535 | 68% | 0.679 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -87.3 | 116.9 | 170.4 | -61.2 | -88.7 | 0 | 0 | 0 | 106.8 | I200 V207 | I200-F209 HydrophobicContact CD1-CE1 4.1Å; I200-F209 HydrophobicContact CG1-CD1 4.2Å; I200-F209 HydrophobicContact CG1-CE1 4.17Å; I200-F209 HydrophobicContact CG2-CE1 4.42Å; V207-F209 HydrophobicContact CB-CE2 4.31Å; V207-F209 HydrophobicContact CG2-CE2 4.18Å |
| 210 | R | 66.6 | Low | 61.2 | Low | 201 Ų | 201 | 130 Ų | 130 | 76% | 0.758 | 69% | 0.685 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -111.5 | 103 | 174.8 | -169.5 | 171.9 | -172.4 | 154.9 | 1.4 | 107.7 | ||
| 211 | D | 56.1 | Low | 61.4 | Low | 125 Ų | 125 | 133.5 Ų | 133.5 | 67% | 0.668 | 70% | 0.702 | S | S | * | * | trans | -81.1 | 121.8 | 170.2 | -61.8 | -56.4 | 0 | 0 | 0 | 108.1 | D213 | D211-D213 PolarHBondContact O-N 2.98Š| ||
| 212 | E | 65.3 | Low | 61.7 | Low | 186 Ų | 186 | 136.9 Ų | 136.9 | 87% | 0.869 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -93.7 | 70.2 | 176.8 | -170.5 | -172.2 | 113.6 | 0 | 0 | 108.9 | ||
| 213 | D | 55.3 | Low | 61.9 | Low | 142 Ų | 142 | 132.8 Ų | 132.8 | 76% | 0.759 | 71% | 0.711 | S | S | * | * | trans | -161.7 | 69.3 | 160.1 | -99.3 | -24.5 | 0 | 0 | 0 | 108.1 | D211 | D211-D213 PolarHBondContact O-N 2.98Š| ||
| 214 | S | 57.4 | Low | 62.4 | Low | 118 Ų | 118 | 131.3 Ų | 131.3 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | trans | -105 | 63.2 | 161 | -60.4 | 0 | 0 | 0 | 0 | 107.6 | G216 | S214-G216 VanDerWaalsContact C-N 3.28Å; S214-G216 PolarHBondContact O-N 2.77Å | ||
| 215 | T | 59.8 | Low | 61.9 | Low | 123 Ų | 123 | 133.2 Ų | 133.2 | 76% | 0.755 | 71% | 0.709 | S | S | * | * | trans | -66.5 | 99.4 | 159.3 | 41.6 | 0 | 0 | 0 | 0 | 106.8 | N217 | T215-N217 PolarHBondContact O-N 2.81Š| ||
| 216 | G | 62.1 | Low | 61.6 | Low | 68 Ų | 68 | 129.2 Ų | 129.2 | 70% | 0.701 | 70% | 0.698 | S | S | * | * | trans | -53.3 | 101.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | S214 | S214-G216 VanDerWaalsContact C-N 3.28Å; S214-G216 PolarHBondContact O-N 2.77Å | ||
| 217 | N | 59.1 | Low | 62.2 | Low | 118 Ų | 118 | 127.5 Ų | 127.5 | 63% | 0.631 | 69% | 0.693 | S | S | * | * | trans | -128.7 | 65.6 | 145.1 | 179.8 | 4.4 | 0 | 0 | 0 | 105.3 | T215 E219 | T215-N217 PolarHBondContact O-N 2.81Å; N217-E219 PolarHBondContact O-N 3.47Å; N217-E219 WeakPolarHBondContact OD1-CB 3.31Å; N217-E219 WeakPolarHBondContact OD1-CG 3.48Å; N217-E219 PolarHBondContact OD1-N 2.82Å; N217-E219 VanDerWaalsContact OD1-N 3.12Å | ||
| 218 | D | 59.3 | Low | 62.4 | Low | 133 Ų | 133 | 129.7 Ų | 129.7 | 71% | 0.711 | 70% | 0.703 | S | S | * | * | trans | -79.3 | 54.7 | 154.9 | 56.4 | -28.5 | 0 | 0 | 0 | 108.3 | D220 | D218-D220 PolarHBondContact O-N 3.5Š| ||
| 219 | E | 63.4 | Low | 62.7 | Low | 152 Ų | 152 | 128.8 Ų | 128.8 | 71% | 0.71 | 70% | 0.701 | S | S | * | * | trans | -64.6 | 98.3 | 156.4 | -78.1 | -177.2 | -165.5 | 0 | 0 | 105.9 | N217 I221 | N217-E219 PolarHBondContact O-N 3.47Å; N217-E219 WeakPolarHBondContact OD1-CB 3.31Å; N217-E219 WeakPolarHBondContact OD1-CG 3.48Å; N217-E219 PolarHBondContact OD1-N 2.82Å; N217-E219 VanDerWaalsContact OD1-N 3.12Å; E219-I221 PolarHBondContact O-N 3.06Å | ||
| 220 | D | 61 | Low | 63.1 | Low | 137 Ų | 137 | 132.8 Ų | 132.8 | 73% | 0.733 | 71% | 0.712 | S | S | * | * | trans | -43.3 | 93.8 | 156.2 | -69.1 | -48.3 | 0 | 0 | 0 | 107 | D218 M222 | D218-D220 PolarHBondContact O-N 3.5Å; D220-M222 HydrophobicContact CB-CG 4.32Å; D220-M222 PolarHBondContact O-N 2.99Å | ||
| 221 | I | 62 | Low | 63.3 | Low | 148 Ų | 148 | 128 Ų | 128 | 76% | 0.759 | 70% | 0.702 | S | S | * | * | trans | -66.8 | 86.4 | 163.9 | -55.5 | 175.1 | 0 | 0 | 0 | 103.2 | E219 V223 | E219-I221 PolarHBondContact O-N 3.06Å; I221-V223 HydrophobicContact CG2-CG2 4.03Å; I221-V223 PolarHBondContact O-N 3.42Å | ||
| 222 | M | 68.1 | Low | 64.6 | Low | 156 Ų | 156 | 127.1 Ų | 127.1 | 77% | 0.768 | 70% | 0.696 | S | S | * | * | trans | -60.8 | 80.5 | 169.3 | -68.1 | -101.2 | -72.5 | 0 | 0 | 105.6 | D220 D224 | D220-M222 HydrophobicContact CB-CG 4.32Å; D220-M222 PolarHBondContact O-N 2.99Å; M222-D224 VanDerWaalsContact C-N 3.26Å; M222-D224 PolarHBondContact O-N 3.34Å | ||
| 223 | V | 69.2 | Low | 65.5 | Low | 109 Ų | 109 | 122.1 Ų | 122.1 | 66% | 0.661 | 68% | 0.679 | S | S | * | * | trans | -63.1 | 102.4 | 163.3 | 176.6 | 0 | 0 | 0 | 0 | 103.2 | I221 S225 | I221-V223 HydrophobicContact CG2-CG2 4.03Å; I221-V223 PolarHBondContact O-N 3.42Å; V223-S225 PolarHBondContact O-N 3.22Å; V223-S225 PolarHBondContact O-OG 3.18Å; V223-S225 VanDerWaalsContact O-OG 3.09Å | ||
| 224 | D | 64.4 | Low | 67.1 | Low | 131 Ų | 131 | 118 Ų | 118 | 70% | 0.701 | 66% | 0.658 | S | S | * | * | trans | -45.5 | 107.4 | 174.6 | -69.5 | -43 | 0 | 0 | 0 | 107.1 | M222 D226 | M222-D224 VanDerWaalsContact C-N 3.26Å; M222-D224 PolarHBondContact O-N 3.34Å; D224-D226 PolarHBondContact O-N 3.47Å | ||
| 225 | S | 62.1 | Low | 68.8 | Low | 118 Ų | 118 | 112.6 Ų | 112.6 | 83% | 0.825 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 12.1 | -171.3 | -59.5 | 0 | 0 | 0 | 0 | 112.1 | V223 | V223-S225 PolarHBondContact O-N 3.22Å; V223-S225 PolarHBondContact O-OG 3.18Å; V223-S225 VanDerWaalsContact O-OG 3.09Å |
| 226 | D | 60.2 | Low | 70.4 | Confident | 138 Ų | 138 | 111 Ų | 111 | 74% | 0.738 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | 26.7 | -177.1 | -63.7 | -33 | 0 | 0 | 0 | 111.9 | D224 D228 | D224-D226 PolarHBondContact O-N 3.47Å; D226-D228 PolarHBondContact O-N 3.19Å |
| 227 | D | 66.7 | Low | 71.8 | Confident | 102 Ų | 102 | 109.6 Ų | 109.6 | 55% | 0.545 | 58% | 0.583 | S | S | . | * | trans | -75.3 | 72.5 | 168.1 | -167.7 | 29.7 | 0 | 0 | 0 | 110 | S229 | D227-S229 PolarHBondContact O-N 2.86Å; D227-S229 WeakPolarHBondContact OD1-CB 3.37Å; D227-S229 PolarHBondContact OD1-OG 3.31Å; D227-S229 WeakPolarHBondContact OD2-CB 3.37Å | ||
| 228 | D | 69 | Low | 73.3 | Confident | 113 Ų | 113 | 111.6 Ų | 111.6 | 60% | 0.604 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -56.8 | 2.1 | 172.7 | -79.4 | -33 | 0 | 0 | 0 | 113.2 | D226 W230 D231 L232 | D226-D228 PolarHBondContact O-N 3.19Å; D228-W230 PolarHBondContact O-N 2.94Å; D228-D231 PolarHBondContact O-N 3.32Å; D228-L232 VanDerWaalsContact O-CD1 3.32Å; D228-L232 WeakPolarHBondContact O-CD1 3.27Å; D228-L232 PolarHBondContact O-N 3.4Å |
| 229 | S | 71.9 | Confident | 74.7 | Confident | 65 Ų | 65 | 110.8 Ų | 110.8 | 46% | 0.455 | 58% | 0.58 | S | S | . | * | G | 310 helix | trans | -44.5 | -33.7 | 174.5 | -75.9 | 0 | 0 | 0 | 0 | 114.2 | D227 | D227-S229 PolarHBondContact O-N 2.86Å; D227-S229 WeakPolarHBondContact OD1-CB 3.37Å; D227-S229 PolarHBondContact OD1-OG 3.31Å; D227-S229 WeakPolarHBondContact OD2-CB 3.37Å |
| 230 | W | 66.6 | Low | 75.8 | Confident | 205 Ų | 205 | 105.4 Ų | 105.4 | 78% | 0.777 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -81.3 | -19.3 | -178.2 | -59.8 | -3.7 | 0 | 0 | 0 | 113.7 | D228 | D228-W230 PolarHBondContact O-N 2.94Š|
| 231 | D | 71.1 | Confident | 76.9 | Confident | 101 Ų | 101 | 103.6 Ų | 103.6 | 54% | 0.54 | 54% | 0.544 | S | S | . | . | G | 310 helix | trans | -98.5 | 4.6 | 177.7 | -79.1 | -24.1 | 0 | 0 | 0 | 113.5 | D228 V233 P240 | D228-D231 PolarHBondContact O-N 3.32Å; D231-V233 PolarHBondContact O-N 3.35Å; D231-V233 VanDerWaalsContact O-N 3.13Å; D231-P240 HydrophobicContact CB-CB 4.28Å; D231-P240 WeakPolarHBondContact O-CB 3.49Å |
| 232 | L | 82.3 | Confident | 78.1 | Confident | 106 Ų | 106 | 100 Ų | 100 | 56% | 0.555 | 54% | 0.537 | S | S | * | . | trans | -61.7 | 122 | 171.6 | -86.5 | 94 | 0 | 0 | 0 | 111.3 | D228 T234 | D228-L232 VanDerWaalsContact O-CD1 3.32Å; D228-L232 WeakPolarHBondContact O-CD1 3.27Å; D228-L232 PolarHBondContact O-N 3.4Å; L232-T234 PolarHBondContact O-N 3.39Å; L232-T234 VanDerWaalsContact O-N 3.16Å | ||
| 233 | V | 85.6 | Confident | 79 | Confident | 82 Ų | 82 | 95.5 Ų | 95.5 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | trans | -72.2 | 108.5 | 176.9 | 175.3 | 0 | 0 | 0 | 0 | 109.5 | D231 M238 | D231-V233 PolarHBondContact O-N 3.35Å; D231-V233 VanDerWaalsContact O-N 3.13Å; V233-M238 VanDerWaalsContact CG1-CA 3.48Å; V233-M238 HydrophobicContact CG1-CB 4.44Å | ||
| 234 | T | 87.6 | Confident | 80.1 | Confident | 54 Ų | 54 | 94.1 Ų | 94.1 | 33% | 0.331 | 51% | 0.513 | S | S | . | . | trans | -109.3 | -19.9 | 179.9 | 49.6 | 0 | 0 | 0 | 0 | 113 | L232 M246 T254 W255 | L232-T234 PolarHBondContact O-N 3.39Å; L232-T234 VanDerWaalsContact O-N 3.16Å; T234-M246 VanDerWaalsContact OG1-CE 3.23Å; T234-M246 WeakPolarHBondContact OG1-CE 3.48Å; T234-T254 WeakPolarHBondContact O-CG2 3.37Å; T234-W255 CarbonylContact C-O 3.56Å; T234-W255 VanDerWaalsContact C-O 3.28Å | ||
| 235 | C | 93.9 | Very high | 81.5 | Confident | 5 Ų | 5 | 90.4 Ų | 90.4 | 3% | 0.034 | 50% | 0.496 | C | S | . | . | S | Bend | trans | -96 | 148.5 | -178.4 | -177.8 | 0 | 0 | 0 | 0 | 112.9 | C237 M238 M246 W255 H257 | C235-C237 PolarHBondContact O-N 3.23Å; C235-C237 PolarHBondContact SG-SG 3.27Å; C235-M238 PolarHBondContact O-N 2.9Å; C235-M246 HydrophobicContact CB-CE 3.97Å; C235-W255 VanDerWaalsContact CA-O 3.22Å; C235-W255 WeakPolarHBondContact CA-O 3.42Å; C235-W255 PolarHBondContact N-O 3.13Å; C235-H257 PolarHBondContact SG-ND1 3.44Å; C235-H257 VanDerWaalsContact SG-ND1 3.36Å |
| 236 | F | 92.3 | Very high | 83 | Confident | 90 Ų | 90 | 86.3 Ų | 86.3 | 40% | 0.395 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -12 | 177.5 | -53.8 | -55.4 | 0 | 0 | 0 | 115.4 | M238 T254 I256 C274 K276 | F236-M238 PolarHBondContact O-N 3.01Å; F236-T254 HydrophobicContact CD1-CG2 4.48Å; F236-T254 HydrophobicContact CE1-CG2 3.85Å; F236-T254 HydrophobicContact CE2-CG2 4.37Å; F236-T254 HydrophobicContact CZ-CG2 3.77Å; F236-I256 HydrophobicContact CD2-CD1 3.78Å; F236-I256 HydrophobicContact CD2-CG1 4.43Å; F236-I256 HydrophobicContact CE2-CD1 3.36Å; F236-I256 HydrophobicContact CE2-CG1 4.21Å; F236-I256 HydrophobicContact CZ-CD1 4.34Å; F236-C274 HydrophobicContact CE2-CB 4.08Å; F236-K276 HydrophobicContact CD1-CD 3.87Å; F236-K276 VanDerWaalsContact CD1-CE 3.48Å; F236-K276 HydrophobicContact CD2-CD 4.12Å; F236-K276 HydrophobicContact CE1-CD 3.68Å; F236-K276 HydrophobicContact CE2-CD 3.92Å; F236-K276 HydrophobicContact CE2-CG 4.44Å; F236-K276 HydrophobicContact CG-CD 4.1Å; F236-K276 HydrophobicContact CZ-CD 3.72Å |
| 237 | C | 92.1 | Very high | 84.7 | Confident | 39 Ų | 39 | 80.5 Ų | 80.5 | 26% | 0.264 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | 3.9 | 174.6 | 71.1 | 0 | 0 | 0 | 0 | 113.4 | C235 K239 H257 C260 | C235-C237 PolarHBondContact O-N 3.23Å; C235-C237 PolarHBondContact SG-SG 3.27Å; C237-K239 HydrophobicContact CB-CD 4.37Å; C237-K239 PolarHBondContact O-N 2.95Å; C237-H257 VanDerWaalsContact SG-CE1 3.56Å; C237-H257 PolarHBondContact SG-ND1 2.83Å; C237-C260 VanDerWaalsContact SG-SG 3.67Å |
| 238 | M | 90.2 | Very high | 86.1 | Confident | 159 Ų | 159 | 79.1 Ų | 79.1 | 78% | 0.783 | 42% | 0.423 | S | S | * | . | S | Bend | trans | 59.4 | 27.5 | 178.2 | -52.1 | -176.3 | 87.4 | 0 | 0 | 113.7 | V233 C235 F236 | V233-M238 VanDerWaalsContact CG1-CA 3.48Å; V233-M238 HydrophobicContact CG1-CB 4.44Å; C235-M238 PolarHBondContact O-N 2.9Å; F236-M238 PolarHBondContact O-N 3.01Å |
| 239 | K | 88.6 | Confident | 87.4 | Confident | 117 Ų | 117 | 73.8 Ų | 73.8 | 51% | 0.509 | 40% | 0.395 | S | S | . | . | trans | -114 | 142 | 179.4 | -67.3 | 157 | -175.6 | 179.8 | 0 | 109.2 | C237 H257 | C237-K239 HydrophobicContact CB-CD 4.37Å; C237-K239 PolarHBondContact O-N 2.95Å; K239-H257 PolarHBondContact O-CE1 2.92Å | ||
| 240 | P | 87.1 | Confident | 88.6 | Confident | 39 Ų | 39 | 74.3 Ų | 74.3 | 25% | 0.253 | 39% | 0.392 | S | S | . | . | trans | -64.5 | -178.6 | 176 | 28.2 | -35.5 | 0 | 0 | 0 | 111.7 | D231 A242 H257 | D231-P240 HydrophobicContact CB-CB 4.28Å; D231-P240 WeakPolarHBondContact O-CB 3.49Å; P240-A242 PolarHBondContact O-N 3.43Å; P240-H257 PolarHBondContact O-CE1 3.42Å; P240-H257 PolarHBondContact O-NE2 3.42Å | ||
| 241 | F | 84.2 | Confident | 90 | Very high | 99 Ų | 99 | 67.4 Ų | 67.4 | 43% | 0.434 | 37% | 0.369 | S | S | . | . | trans | -56.1 | -48.7 | 177.7 | 175.8 | -120.9 | 0 | 0 | 0 | 111.7 | G243 R244 M246 | F241-G243 PolarHBondContact O-N 3.4Å; F241-R244 WeakPolarHBondContact CE2-O 3.47Å; F241-R244 PolarHBondContact O-N 2.95Å; F241-M246 HydrophobicContact CD2-CG 3.99Å; F241-M246 HydrophobicContact CD2-SD 3.67Å; F241-M246 HydrophobicContact CE2-CG 4.24Å; F241-M246 HydrophobicContact CE2-SD 4.4Å | ||
| 242 | A | 86.5 | Confident | 91.1 | Very high | 73 Ų | 73 | 65 Ų | 65 | 60% | 0.603 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 46.4 | 30.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | P240 R244 | P240-A242 PolarHBondContact O-N 3.43Å; A242-R244 VanDerWaalsContact C-N 3.27Å; A242-R244 PolarHBondContact O-N 2.9Å |
| 243 | G | 88.3 | Confident | 91.7 | Very high | 61 Ų | 61 | 63.9 Ų | 63.9 | 63% | 0.629 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.8 | 14.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | F241 | F241-G243 PolarHBondContact O-N 3.4Š|
| 244 | R | 91.4 | Very high | 92.1 | Very high | 79 Ų | 79 | 61.6 Ų | 61.6 | 30% | 0.298 | 34% | 0.337 | S | S | . | . | trans | -91.1 | 137.9 | -177.9 | -64.1 | 169.3 | 71.9 | -155 | 3.6 | 110 | F241 A242 M246 H257 S259 | F241-R244 WeakPolarHBondContact CE2-O 3.47Å; F241-R244 PolarHBondContact O-N 2.95Å; A242-R244 VanDerWaalsContact C-N 3.27Å; A242-R244 PolarHBondContact O-N 2.9Å; R244-M246 WeakPolarHBondContact O-CG 3.45Å; R244-M246 PolarHBondContact O-N 3.44Å; R244-H257 PolarHBondContact NH1-ND1 3.39Å; R244-S259 PolarHBondContact NH2-OG 2.79Å | ||
| 245 | P | 93.6 | Very high | 92.4 | Very high | 53 Ų | 53 | 64.9 Ų | 64.9 | 34% | 0.344 | 34% | 0.344 | S | S | . | . | trans | -61.7 | 138 | 179.9 | 31.6 | -41 | 0 | 0 | 0 | 110.8 | H257 L258 K265 | P245-H257 WeakPolarHBondContact O-CA 3.37Å; P245-L258 HydrophobicContact CB-CD1 4.24Å; P245-L258 HydrophobicContact CB-CD2 4.11Å; P245-L258 HydrophobicContact CG-CB 4.19Å; P245-L258 HydrophobicContact CG-CD2 4.2Å; P245-L258 PolarHBondContact O-N 3.46Å; P245-K265 VanDerWaalsContact CG-CE 3.5Å; P245-K265 HydrophobicContact CG-CG 4.46Å | ||
| 246 | M | 94.8 | Very high | 92.5 | Very high | 32 Ų | 32 | 65 Ų | 65 | 16% | 0.158 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 158.3 | -178.9 | -57 | -169.7 | 81.2 | 0 | 0 | 111.5 | T234 C235 F241 R244 W255 I256 | T234-M246 VanDerWaalsContact OG1-CE 3.23Å; T234-M246 WeakPolarHBondContact OG1-CE 3.48Å; C235-M246 HydrophobicContact CB-CE 3.97Å; F241-M246 HydrophobicContact CD2-CG 3.99Å; F241-M246 HydrophobicContact CD2-SD 3.67Å; F241-M246 HydrophobicContact CE2-CG 4.24Å; F241-M246 HydrophobicContact CE2-SD 4.4Å; R244-M246 WeakPolarHBondContact O-CG 3.45Å; R244-M246 PolarHBondContact O-N 3.44Å; M246-W255 HydrophobicContact CB-CE3 3.67Å; M246-W255 HydrophobicContact CB-CZ3 4.31Å; M246-W255 VanDerWaalsContact CE-C 3.41Å; M246-W255 HydrophobicContact CE-CB 3.55Å; M246-W255 VanDerWaalsContact CE-O 3.24Å; M246-W255 WeakPolarHBondContact CE-O 3.47Å; M246-W255 HydrophobicContact SD-CB 4.19Å; M246-I256 CarbonylContact C-O 3.28Å; M246-I256 VanDerWaalsContact CA-O 3.25Å; M246-I256 WeakPolarHBondContact CA-O 3.31Å |
| 247 | I | 95.8 | Very high | 92.7 | Very high | 17 Ų | 17 | 60.7 Ų | 60.7 | 9% | 0.087 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 139.1 | 174.7 | -173.4 | 166.9 | 0 | 0 | 0 | 109.1 | I256 L258 A261 I263 V268 P269 F272 | I247-I256 WeakPolarHBondContact CG2-O 3.11Å; I247-I256 PolarHBondContact N-O 3.49Å; I247-I256 PolarHBondContact O-N 3.43Å; I247-L258 HydrophobicContact CB-CD1 3.85Å; I247-L258 HydrophobicContact CG2-CD1 4.01Å; I247-A261 HydrophobicContact CG2-CB 4.26Å; I247-I263 HydrophobicContact CD1-CD1 3.98Å; I247-I263 HydrophobicContact CG2-CD1 4.32Å; I247-V268 HydrophobicContact CD1-CG1 3.86Å; I247-P269 HydrophobicContact CD1-CG 4.42Å; I247-F272 HydrophobicContact CB-CD1 4.48Å; I247-F272 HydrophobicContact CD1-CB 3.38Å; I247-F272 HydrophobicContact CD1-CD1 4.12Å; I247-F272 HydrophobicContact CD1-CD2 4.37Å; I247-F272 HydrophobicContact CD1-CG 3.71Å; I247-F272 HydrophobicContact CG1-CB 3.89Å; I247-F272 HydrophobicContact CG1-CD1 4Å; I247-F272 HydrophobicContact CG1-CG 4.11Å; I247-F272 HydrophobicContact CG2-CD1 3.75Å; I247-F272 HydrophobicContact CG2-CE1 3.82Å; I247-F272 HydrophobicContact CG2-CG 4.27Å; I247-F272 HydrophobicContact CG2-CZ 4.41Å |
| 248 | E | 95.9 | Very high | 92.8 | Very high | 73 Ų | 73 | 59.4 Ų | 59.4 | 34% | 0.341 | 32% | 0.315 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 139.1 | 176.7 | -168.4 | -175 | 162.5 | 0 | 0 | 111.1 | H253 W255 | E248-H253 IonicContact OE1-CE1 3.72Å; E248-H253 IonicContact OE1-CG 3.87Å; E248-H253 IonicContact OE1-ND1 3.53Å; E248-H253 PolarHBondContact OE1-ND1 3.23Å; E248-W255 HydrophobicContact CB-CD2 4.34Å; E248-W255 HydrophobicContact CB-CZ2 4.42Å |
| 249 | C | 96.7 | Very high | 93 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 30% | 0.302 | C | S | . | . | trans | -84.1 | 128.1 | 172.3 | -179.8 | 0 | 0 | 0 | 0 | 111.6 | E251 C252 H253 T254 F272 C274 | C249-E251 PolarHBondContact O-N 2.83Å; C249-E251 VanDerWaalsContact O-N 3.15Å; C249-C252 PolarHBondContact SG-SG 2.79Å; C249-H253 WeakPolarHBondContact O-CA 3.43Å; C249-H253 PolarHBondContact O-N 2.78Å; C249-T254 PolarHBondContact N-O 2.69Å; C249-F272 HydrophobicContact CB-CD1 4.49Å; C249-C274 HydrophobicContact CB-CB 4.13Å; C249-C274 PolarHBondContact SG-N 2.73Å | ||
| 250 | N | 96.6 | Very high | 93.3 | Very high | 76 Ų | 76 | 52.2 Ų | 52.2 | 41% | 0.406 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | -14.6 | -179.2 | -75.3 | -11.6 | 0 | 0 | 0 | 115.3 | V271 F272 | N250-V271 WeakPolarHBondContact ND2-CA 3.37Å; N250-V271 WeakPolarHBondContact ND2-CG1 3.37Å; N250-F272 PolarHBondContact N-O 2.92Å |
| 251 | E | 95.2 | Very high | 93.7 | Very high | 61 Ų | 61 | 51.5 Ų | 51.5 | 29% | 0.285 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.4 | -51.9 | -179.2 | -65.7 | -171.3 | -167 | 0 | 0 | 112.1 | C249 V273 C277 K281 | C249-E251 PolarHBondContact O-N 2.83Å; C249-E251 VanDerWaalsContact O-N 3.15Å; E251-V273 VanDerWaalsContact CD-CG1 3.46Å; E251-V273 HydrophobicContact CG-CG1 3.96Å; E251-V273 HydrophobicContact CG-CG2 4.2Å; E251-V273 VanDerWaalsContact OE1-CG1 3.3Å; E251-V273 WeakPolarHBondContact OE1-CG1 3.41Å; E251-C277 HydrophobicContact CB-CB 4.04Å; E251-C277 HydrophobicContact CG-CB 4.47Å; E251-C277 WeakPolarHBondContact OE2-CB 3.48Å; E251-K281 VanDerWaalsContact CD-CE 3.43Å; E251-K281 VanDerWaalsContact OE1-CE 3.25Å; E251-K281 WeakPolarHBondContact OE1-CE 3.46Å; E251-K281 IonicContact OE1-NZ 2.77Å; E251-K281 PolarHBondContact OE1-NZ 2.77Å; E251-K281 WeakPolarHBondContact OE2-CE 3.39Å; E251-K281 IonicContact OE2-NZ 2.65Å; E251-K281 PolarHBondContact OE2-NZ 3.09Å |
| 252 | C | 94.5 | Very high | 94.2 | Very high | 50 Ų | 50 | 56 Ų | 56 | 34% | 0.338 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.8 | -0.6 | -176.1 | 66.8 | 0 | 0 | 0 | 0 | 114.3 | C249 T254 C274 C277 | C249-C252 PolarHBondContact SG-SG 2.79Å; C252-T254 PolarHBondContact O-N 2.96Å; C252-T254 PolarHBondContact O-OG1 3.35Å; C252-T254 PolarHBondContact SG-OG1 2.87Å; C252-C274 VanDerWaalsContact SG-SG 3.69Å; C252-C277 VanDerWaalsContact SG-SG 3.65Å |
| 253 | H | 94.6 | Very high | 94.6 | Very high | 82 Ų | 82 | 53.9 Ų | 53.9 | 38% | 0.38 | 29% | 0.29 | S | S | . | . | trans | 54.6 | 18 | -179.8 | -60.8 | -74.9 | 0 | 0 | 0 | 115.1 | K20 E248 C249 | K20-H253 PolarHBondContact NZ-CD2 3.46Å; K20-H253 PolarHBondContact NZ-NE2 3.42Å; E248-H253 IonicContact OE1-CE1 3.72Å; E248-H253 IonicContact OE1-CG 3.87Å; E248-H253 IonicContact OE1-ND1 3.53Å; E248-H253 PolarHBondContact OE1-ND1 3.23Å; C249-H253 WeakPolarHBondContact O-CA 3.43Å; C249-H253 PolarHBondContact O-N 2.78Å | ||
| 254 | T | 94.3 | Very high | 94.9 | Very high | 34 Ų | 34 | 60.5 Ų | 60.5 | 21% | 0.209 | 30% | 0.296 | C | S | . | . | trans | -80 | 131 | 177.7 | -49.7 | 0 | 0 | 0 | 0 | 109.5 | T234 F236 C249 C252 I256 | T234-T254 WeakPolarHBondContact O-CG2 3.37Å; F236-T254 HydrophobicContact CD1-CG2 4.48Å; F236-T254 HydrophobicContact CE1-CG2 3.85Å; F236-T254 HydrophobicContact CE2-CG2 4.37Å; F236-T254 HydrophobicContact CZ-CG2 3.77Å; C249-T254 PolarHBondContact N-O 2.69Å; C252-T254 PolarHBondContact O-N 2.96Å; C252-T254 PolarHBondContact O-OG1 3.35Å; C252-T254 PolarHBondContact SG-OG1 2.87Å; T254-I256 HydrophobicContact CG2-CG1 4.49Å | ||
| 255 | W | 94.9 | Very high | 94.9 | Very high | 124 Ų | 124 | 64.5 Ų | 64.5 | 47% | 0.47 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 127.7 | 173.5 | -72.8 | 82.4 | 0 | 0 | 0 | 110.7 | T234 C235 M246 E248 | T234-W255 CarbonylContact C-O 3.56Å; T234-W255 VanDerWaalsContact C-O 3.28Å; C235-W255 VanDerWaalsContact CA-O 3.22Å; C235-W255 WeakPolarHBondContact CA-O 3.42Å; C235-W255 PolarHBondContact N-O 3.13Å; M246-W255 HydrophobicContact CB-CE3 3.67Å; M246-W255 HydrophobicContact CB-CZ3 4.31Å; M246-W255 VanDerWaalsContact CE-C 3.41Å; M246-W255 HydrophobicContact CE-CB 3.55Å; M246-W255 VanDerWaalsContact CE-O 3.24Å; M246-W255 WeakPolarHBondContact CE-O 3.47Å; M246-W255 HydrophobicContact SD-CB 4.19Å; E248-W255 HydrophobicContact CB-CD2 4.34Å; E248-W255 HydrophobicContact CB-CZ2 4.42Å |
| 256 | I | 95.5 | Very high | 94.9 | Very high | 7 Ų | 7 | 67.3 Ų | 67.3 | 4% | 0.036 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 133.2 | -173.7 | -51.1 | -169 | 0 | 0 | 0 | 109.2 | F236 M246 I247 T254 L258 C260 A261 F272 C274 | F236-I256 HydrophobicContact CD2-CD1 3.78Å; F236-I256 HydrophobicContact CD2-CG1 4.43Å; F236-I256 HydrophobicContact CE2-CD1 3.36Å; F236-I256 HydrophobicContact CE2-CG1 4.21Å; F236-I256 HydrophobicContact CZ-CD1 4.34Å; M246-I256 CarbonylContact C-O 3.28Å; M246-I256 VanDerWaalsContact CA-O 3.25Å; M246-I256 WeakPolarHBondContact CA-O 3.31Å; I247-I256 WeakPolarHBondContact CG2-O 3.11Å; I247-I256 PolarHBondContact N-O 3.49Å; I247-I256 PolarHBondContact O-N 3.43Å; T254-I256 HydrophobicContact CG2-CG1 4.49Å; I256-L258 PolarHBondContact O-N 2.84Å; I256-C260 HydrophobicContact CG2-CB 3.92Å; I256-A261 HydrophobicContact CG2-CB 4.06Å; I256-F272 HydrophobicContact CB-CE1 4.44Å; I256-F272 HydrophobicContact CD1-CE1 3.96Å; I256-F272 HydrophobicContact CD1-CZ 4.42Å; I256-F272 HydrophobicContact CG1-CE1 4.46Å; I256-C274 HydrophobicContact CD1-CB 3.25Å |
| 257 | H | 95.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.5 | 138.1 | 173.2 | -53.7 | 115.7 | 0 | 0 | 0 | 110.5 | C235 C237 K239 P240 R244 P245 S259 C260 A261 | C235-H257 PolarHBondContact SG-ND1 3.44Å; C235-H257 VanDerWaalsContact SG-ND1 3.36Å; C237-H257 VanDerWaalsContact SG-CE1 3.56Å; C237-H257 PolarHBondContact SG-ND1 2.83Å; K239-H257 PolarHBondContact O-CE1 2.92Å; P240-H257 PolarHBondContact O-CE1 3.42Å; P240-H257 PolarHBondContact O-NE2 3.42Å; R244-H257 PolarHBondContact NH1-ND1 3.39Å; P245-H257 WeakPolarHBondContact O-CA 3.37Å; H257-S259 PolarHBondContact O-N 2.82Å; H257-S259 VanDerWaalsContact O-N 3.13Å; H257-C260 HydrophobicContact CB-CB 4.21Å; H257-C260 WeakPolarHBondContact O-CA 3.44Å; H257-C260 WeakPolarHBondContact O-CB 3.26Å; H257-C260 PolarHBondContact O-N 2.94Å; H257-A261 PolarHBondContact O-N 3.31Å |
| 258 | L | 95.4 | Very high | 94.8 | Very high | 11 Ų | 11 | 74.4 Ų | 74.4 | 6% | 0.058 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.7 | -38.5 | 178.8 | -94.9 | 59.8 | 0 | 0 | 0 | 112.4 | P245 I247 I256 C260 A261 K262 I263 K265 V268 | P245-L258 HydrophobicContact CB-CD1 4.24Å; P245-L258 HydrophobicContact CB-CD2 4.11Å; P245-L258 HydrophobicContact CG-CB 4.19Å; P245-L258 HydrophobicContact CG-CD2 4.2Å; P245-L258 PolarHBondContact O-N 3.46Å; I247-L258 HydrophobicContact CB-CD1 3.85Å; I247-L258 HydrophobicContact CG2-CD1 4.01Å; I256-L258 PolarHBondContact O-N 2.84Å; L258-C260 VanDerWaalsContact C-N 3.32Å; L258-C260 PolarHBondContact O-N 2.82Å; L258-A261 CarbonylContact O-C 3.42Å; L258-A261 PolarHBondContact O-N 3.38Å; L258-K262 PolarHBondContact O-N 2.96Å; L258-I263 HydrophobicContact CD2-CG2 4.43Å; L258-I263 HydrophobicContact CG-CB 4.22Å; L258-I263 HydrophobicContact CG-CG2 4.15Å; L258-I263 PolarHBondContact O-N 2.72Å; L258-K265 HydrophobicContact CD2-CG 3.97Å; L258-V268 HydrophobicContact CD2-CG2 3.87Å |
| 259 | S | 94.4 | Very high | 94.8 | Very high | 71 Ų | 71 | 73.3 Ų | 73.3 | 50% | 0.497 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -33 | 175.4 | 55.2 | 0 | 0 | 0 | 0 | 113.4 | R244 H257 K262 | R244-S259 PolarHBondContact NH2-OG 2.79Å; H257-S259 PolarHBondContact O-N 2.82Å; H257-S259 VanDerWaalsContact O-N 3.13Å; S259-K262 PolarHBondContact O-N 2.97Å |
| 260 | C | 95 | Very high | 94.7 | Very high | 54 Ų | 54 | 82.5 Ų | 82.5 | 37% | 0.365 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.6 | -35 | 176.5 | -65.8 | 0 | 0 | 0 | 0 | 111.1 | C237 I256 H257 L258 K262 | C237-C260 VanDerWaalsContact SG-SG 3.67Å; I256-C260 HydrophobicContact CG2-CB 3.92Å; H257-C260 HydrophobicContact CB-CB 4.21Å; H257-C260 WeakPolarHBondContact O-CA 3.44Å; H257-C260 WeakPolarHBondContact O-CB 3.26Å; H257-C260 PolarHBondContact O-N 2.94Å; L258-C260 VanDerWaalsContact C-N 3.32Å; L258-C260 PolarHBondContact O-N 2.82Å; C260-K262 PolarHBondContact O-N 2.82Å |
| 261 | A | 94.6 | Very high | 94.7 | Very high | 24 Ų | 24 | 83.8 Ų | 83.8 | 20% | 0.198 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -6.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | I247 I256 H257 L258 I263 F272 | I247-A261 HydrophobicContact CG2-CB 4.26Å; I256-A261 HydrophobicContact CG2-CB 4.06Å; H257-A261 PolarHBondContact O-N 3.31Å; L258-A261 CarbonylContact O-C 3.42Å; L258-A261 PolarHBondContact O-N 3.38Å; A261-I263 HydrophobicContact CB-CD1 3.85Å; A261-I263 HydrophobicContact CB-CG1 4.06Å; A261-I263 PolarHBondContact O-N 2.91Å; A261-F272 HydrophobicContact CB-CE1 4.27Å; A261-F272 HydrophobicContact CB-CE2 3.9Å; A261-F272 HydrophobicContact CB-CZ 3.5Å |
| 262 | K | 94.4 | Very high | 94.7 | Very high | 195 Ų | 195 | 81.4 Ų | 81.4 | 85% | 0.848 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 35.3 | -173.4 | -56.4 | 179.6 | -179 | 177.2 | 0 | 113.1 | L258 S259 C260 | L258-K262 PolarHBondContact O-N 2.96Å; S259-K262 PolarHBondContact O-N 2.97Å; C260-K262 PolarHBondContact O-N 2.82Å |
| 263 | I | 94.1 | Very high | 94.8 | Very high | 28 Ų | 28 | 80.3 Ų | 80.3 | 14% | 0.144 | 41% | 0.41 | C | S | . | . | trans | -100.1 | 135.1 | 176.9 | -67 | 170 | 0 | 0 | 0 | 109 | I247 L258 A261 V268 P269 F272 | I247-I263 HydrophobicContact CD1-CD1 3.98Å; I247-I263 HydrophobicContact CG2-CD1 4.32Å; L258-I263 HydrophobicContact CD2-CG2 4.43Å; L258-I263 HydrophobicContact CG-CB 4.22Å; L258-I263 HydrophobicContact CG-CG2 4.15Å; L258-I263 PolarHBondContact O-N 2.72Å; A261-I263 HydrophobicContact CB-CD1 3.85Å; A261-I263 HydrophobicContact CB-CG1 4.06Å; A261-I263 PolarHBondContact O-N 2.91Å; I263-V268 HydrophobicContact CG2-CG2 4.23Å; I263-P269 HydrophobicContact CD1-CG 4.13Å; I263-F272 HydrophobicContact CD1-CD2 3.51Å; I263-F272 HydrophobicContact CD1-CE2 3.59Å; I263-F272 HydrophobicContact CD1-CG 4.23Å; I263-F272 HydrophobicContact CD1-CZ 4.37Å | ||
| 264 | R | 94.6 | Very high | 94.9 | Very high | 199 Ų | 199 | 76.4 Ų | 76.4 | 75% | 0.751 | 39% | 0.393 | S | S | * | . | trans | -84.5 | 139.8 | 174 | -63.2 | -175.5 | 179.4 | -170.5 | -0 | 109.1 | S266 N267 | R264-S266 PolarHBondContact O-N 2.93Å; R264-N267 CarbonylContact O-C 3.48Å; R264-N267 PolarHBondContact O-N 3.29Å | ||
| 265 | K | 92.9 | Very high | 94.8 | Very high | 164 Ų | 164 | 80.4 Ų | 80.4 | 71% | 0.713 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.5 | -27 | 176.6 | -75.3 | 170 | 170.3 | -176.6 | 0 | 113.5 | P245 L258 | P245-K265 VanDerWaalsContact CG-CE 3.5Å; P245-K265 HydrophobicContact CG-CG 4.46Å; L258-K265 HydrophobicContact CD2-CG 3.97Å |
| 266 | S | 93.9 | Very high | 94.7 | Very high | 112 Ų | 112 | 80.5 Ų | 80.5 | 78% | 0.783 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -16.2 | 179.8 | 63.6 | 0 | 0 | 0 | 0 | 114.5 | R264 | R264-S266 PolarHBondContact O-N 2.93Š|
| 267 | N | 92.9 | Very high | 94.6 | Very high | 125 Ų | 125 | 80.9 Ų | 80.9 | 67% | 0.668 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -144.5 | 75.7 | -177.6 | -174.8 | 26.1 | 0 | 0 | 0 | 109.4 | R264 | R264-N267 CarbonylContact O-C 3.48Å; R264-N267 PolarHBondContact O-N 3.29Å |
| 268 | V | 95.8 | Very high | 94.4 | Very high | 72 Ų | 72 | 86.4 Ų | 86.4 | 44% | 0.436 | 44% | 0.436 | S | S | . | . | trans | -91.2 | 116.7 | 177.6 | -174.4 | 0 | 0 | 0 | 0 | 107.9 | I247 L258 I263 | I247-V268 HydrophobicContact CD1-CG1 3.86Å; L258-V268 HydrophobicContact CD2-CG2 3.87Å; I263-V268 HydrophobicContact CG2-CG2 4.23Å | ||
| 269 | P | 95.4 | Very high | 94.2 | Very high | 51 Ų | 51 | 89 Ų | 89 | 33% | 0.331 | 45% | 0.45 | S | S | . | . | trans | -69.8 | 143.8 | 177.2 | 29.6 | -33.7 | 0 | 0 | 0 | 110.5 | I247 I263 V271 | I247-P269 HydrophobicContact CD1-CG 4.42Å; I263-P269 HydrophobicContact CD1-CG 4.13Å; P269-V271 VanDerWaalsContact C-N 3.32Å | ||
| 270 | E | 94.1 | Very high | 93.8 | Very high | 193 Ų | 193 | 88.3 Ų | 88.3 | 90% | 0.902 | 45% | 0.445 | S | S | * | . | S | Bend | trans | -65.7 | -37.2 | 174.2 | -174.5 | 175.9 | -172.9 | 0 | 0 | 111.7 | ||
| 271 | V | 96.1 | Very high | 93.2 | Very high | 102 Ų | 102 | 90.3 Ų | 90.3 | 62% | 0.618 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -108.9 | 114.6 | 178 | 178 | 0 | 0 | 0 | 0 | 109.2 | N250 P269 | N250-V271 WeakPolarHBondContact ND2-CA 3.37Å; N250-V271 WeakPolarHBondContact ND2-CG1 3.37Å; P269-V271 VanDerWaalsContact C-N 3.32Å |
| 272 | F | 96.7 | Very high | 92.3 | Very high | 12 Ų | 12 | 94.7 Ų | 94.7 | 5% | 0.053 | 46% | 0.463 | C | S | . | . | trans | -121.3 | 136.6 | 177.9 | 175 | -109.1 | 0 | 0 | 0 | 112.7 | I247 C249 N250 I256 A261 I263 C274 | I247-F272 HydrophobicContact CB-CD1 4.48Å; I247-F272 HydrophobicContact CD1-CB 3.38Å; I247-F272 HydrophobicContact CD1-CD1 4.12Å; I247-F272 HydrophobicContact CD1-CD2 4.37Å; I247-F272 HydrophobicContact CD1-CG 3.71Å; I247-F272 HydrophobicContact CG1-CB 3.89Å; I247-F272 HydrophobicContact CG1-CD1 4Å; I247-F272 HydrophobicContact CG1-CG 4.11Å; I247-F272 HydrophobicContact CG2-CD1 3.75Å; I247-F272 HydrophobicContact CG2-CE1 3.82Å; I247-F272 HydrophobicContact CG2-CG 4.27Å; I247-F272 HydrophobicContact CG2-CZ 4.41Å; C249-F272 HydrophobicContact CB-CD1 4.49Å; N250-F272 PolarHBondContact N-O 2.92Å; I256-F272 HydrophobicContact CB-CE1 4.44Å; I256-F272 HydrophobicContact CD1-CE1 3.96Å; I256-F272 HydrophobicContact CD1-CZ 4.42Å; I256-F272 HydrophobicContact CG1-CE1 4.46Å; A261-F272 HydrophobicContact CB-CE1 4.27Å; A261-F272 HydrophobicContact CB-CE2 3.9Å; A261-F272 HydrophobicContact CB-CZ 3.5Å; I263-F272 HydrophobicContact CD1-CD2 3.51Å; I263-F272 HydrophobicContact CD1-CE2 3.59Å; I263-F272 HydrophobicContact CD1-CG 4.23Å; I263-F272 HydrophobicContact CD1-CZ 4.37Å; F272-C274 HydrophobicContact CE1-CB 4.15Å; F272-C274 HydrophobicContact CZ-CB 4.3Å | ||
| 273 | V | 95.9 | Very high | 91.4 | Very high | 26 Ų | 26 | 90.1 Ų | 90.1 | 16% | 0.158 | 45% | 0.447 | C | S | . | . | trans | -126.1 | 125.2 | 173.3 | -178.6 | 0 | 0 | 0 | 0 | 108.1 | E251 C277 R278 | E251-V273 VanDerWaalsContact CD-CG1 3.46Å; E251-V273 HydrophobicContact CG-CG1 3.96Å; E251-V273 HydrophobicContact CG-CG2 4.2Å; E251-V273 VanDerWaalsContact OE1-CG1 3.3Å; E251-V273 WeakPolarHBondContact OE1-CG1 3.41Å; V273-C277 HydrophobicContact CG1-CB 3.58Å; V273-R278 HydrophobicContact CB-CG 4.43Å; V273-R278 HydrophobicContact CG1-CG 3.97Å; V273-R278 PolarHBondContact O-NE 3.49Å; V273-R278 PolarHBondContact O-NH2 2.97Å | ||
| 274 | C | 95.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 93.8 Ų | 93.8 | 1% | 0.007 | 47% | 0.466 | C | S | . | . | trans | -69.8 | 161.8 | -175.6 | 79.5 | 0 | 0 | 0 | 0 | 112.9 | F236 C249 C252 I256 F272 K276 C277 R278 | F236-C274 HydrophobicContact CE2-CB 4.08Å; C249-C274 HydrophobicContact CB-CB 4.13Å; C249-C274 PolarHBondContact SG-N 2.73Å; C252-C274 VanDerWaalsContact SG-SG 3.69Å; I256-C274 HydrophobicContact CD1-CB 3.25Å; F272-C274 HydrophobicContact CE1-CB 4.15Å; F272-C274 HydrophobicContact CZ-CB 4.3Å; C274-K276 VanDerWaalsContact C-N 3.33Å; C274-K276 PolarHBondContact O-N 3.06Å; C274-C277 PolarHBondContact O-N 3.45Å; C274-C277 PolarHBondContact SG-N 3.36Å; C274-C277 VanDerWaalsContact SG-N 3.42Å; C274-C277 PolarHBondContact SG-SG 2.89Å; C274-R278 WeakPolarHBondContact O-CG 3.23Å; C274-R278 PolarHBondContact O-N 3.43Å | ||
| 275 | Q | 92.9 | Very high | 89.4 | Confident | 118 Ų | 118 | 92.3 Ų | 92.3 | 55% | 0.551 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -56.9 | -43.7 | -179.2 | -174.1 | 61.1 | 37.6 | 0 | 0 | 112.5 | C277 R278 D279 | Q275-C277 VanDerWaalsContact C-N 3.35Å; Q275-C277 PolarHBondContact O-N 3.01Å; Q275-R278 WeakPolarHBondContact O-CB 3.36Å; Q275-R278 PolarHBondContact O-N 3.3Å; Q275-D279 WeakPolarHBondContact CG-OD2 3.41Å; Q275-D279 PolarHBondContact NE2-OD1 3.24Å; Q275-D279 PolarHBondContact NE2-OD2 3.49Å; Q275-D279 WeakPolarHBondContact O-CB 3.25Å; Q275-D279 PolarHBondContact O-N 3.44Å |
| 276 | K | 92.4 | Very high | 88.4 | Confident | 126 Ų | 126 | 94 Ų | 94 | 55% | 0.548 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 179.3 | -67.9 | 178 | -178.9 | -84 | 0 | 112.6 | F236 C274 D279 S280 | F236-K276 HydrophobicContact CD1-CD 3.87Å; F236-K276 VanDerWaalsContact CD1-CE 3.48Å; F236-K276 HydrophobicContact CD2-CD 4.12Å; F236-K276 HydrophobicContact CE1-CD 3.68Å; F236-K276 HydrophobicContact CE2-CD 3.92Å; F236-K276 HydrophobicContact CE2-CG 4.44Å; F236-K276 HydrophobicContact CG-CD 4.1Å; F236-K276 HydrophobicContact CZ-CD 3.72Å; C274-K276 VanDerWaalsContact C-N 3.33Å; C274-K276 PolarHBondContact O-N 3.06Å; K276-D279 PolarHBondContact O-N 3.46Å; K276-S280 WeakPolarHBondContact O-CB 3.22Å; K276-S280 PolarHBondContact O-N 2.98Å; K276-S280 PolarHBondContact O-OG 3.16Å |
| 277 | C | 93.8 | Very high | 87.1 | Confident | 14 Ų | 14 | 91.5 Ų | 91.5 | 10% | 0.095 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -69.8 | -34.9 | 176.5 | -75.4 | 0 | 0 | 0 | 0 | 112.7 | E251 C252 V273 C274 Q275 S280 K281 | E251-C277 HydrophobicContact CB-CB 4.04Å; E251-C277 HydrophobicContact CG-CB 4.47Å; E251-C277 WeakPolarHBondContact OE2-CB 3.48Å; C252-C277 VanDerWaalsContact SG-SG 3.65Å; V273-C277 HydrophobicContact CG1-CB 3.58Å; C274-C277 PolarHBondContact O-N 3.45Å; C274-C277 PolarHBondContact SG-N 3.36Å; C274-C277 VanDerWaalsContact SG-N 3.42Å; C274-C277 PolarHBondContact SG-SG 2.89Å; Q275-C277 VanDerWaalsContact C-N 3.35Å; Q275-C277 PolarHBondContact O-N 3.01Å; C277-S280 PolarHBondContact O-OG 3.38Å; C277-K281 WeakPolarHBondContact O-CG 2.97Å; C277-K281 PolarHBondContact O-N 2.97Å |
| 278 | R | 92.2 | Very high | 85.7 | Confident | 116 Ų | 116 | 89.8 Ų | 89.8 | 44% | 0.438 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.8 | -51.7 | 171.5 | -68.6 | 175.8 | -171.6 | -156.2 | -3.3 | 110.1 | V273 C274 Q275 S280 K281 F282 | V273-R278 HydrophobicContact CB-CG 4.43Å; V273-R278 HydrophobicContact CG1-CG 3.97Å; V273-R278 PolarHBondContact O-NE 3.49Å; V273-R278 PolarHBondContact O-NH2 2.97Å; C274-R278 WeakPolarHBondContact O-CG 3.23Å; C274-R278 PolarHBondContact O-N 3.43Å; Q275-R278 WeakPolarHBondContact O-CB 3.36Å; Q275-R278 PolarHBondContact O-N 3.3Å; R278-S280 PolarHBondContact O-N 2.86Å; R278-K281 PolarHBondContact O-N 3.2Å; R278-F282 HydrophobicContact CB-CD2 4.38Å; R278-F282 HydrophobicContact CB-CE2 4.13Å; R278-F282 WeakPolarHBondContact O-CD2 3.18Å; R278-F282 PolarHBondContact O-N 3.2Å |
| 279 | D | 90.4 | Very high | 84.3 | Confident | 65 Ų | 65 | 96.2 Ų | 96.2 | 35% | 0.348 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | -176.8 | -66.1 | -24 | 0 | 0 | 0 | 111.8 | Q275 K276 K281 F282 D283 | Q275-D279 WeakPolarHBondContact CG-OD2 3.41Å; Q275-D279 PolarHBondContact NE2-OD1 3.24Å; Q275-D279 PolarHBondContact NE2-OD2 3.49Å; Q275-D279 WeakPolarHBondContact O-CB 3.25Å; Q275-D279 PolarHBondContact O-N 3.44Å; K276-D279 PolarHBondContact O-N 3.46Å; D279-K281 VanDerWaalsContact C-N 3.31Å; D279-K281 PolarHBondContact O-N 3.25Å; D279-F282 CarbonylContact O-C 3.51Å; D279-F282 PolarHBondContact O-N 2.8Å; D279-D283 WeakPolarHBondContact O-CB 3.24Å; D279-D283 PolarHBondContact O-N 3.13Å |
| 280 | S | 87.4 | Confident | 82.9 | Confident | 57 Ų | 57 | 97.5 Ų | 97.5 | 40% | 0.399 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.2 | -39.1 | 177 | 66.5 | 0 | 0 | 0 | 0 | 112.8 | K276 C277 R278 D283 I284 | K276-S280 WeakPolarHBondContact O-CB 3.22Å; K276-S280 PolarHBondContact O-N 2.98Å; K276-S280 PolarHBondContact O-OG 3.16Å; C277-S280 PolarHBondContact O-OG 3.38Å; R278-S280 PolarHBondContact O-N 2.86Å; S280-D283 PolarHBondContact O-N 2.52Å; S280-I284 WeakPolarHBondContact O-CG1 3.32Å; S280-I284 PolarHBondContact O-N 3.28Å |
| 281 | K | 81.8 | Confident | 81.3 | Confident | 96 Ų | 96 | 97.4 Ų | 97.4 | 42% | 0.417 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -68.6 | -33.3 | 174.7 | -73.7 | -176.4 | 170.9 | -173.8 | 0 | 112.9 | E251 C277 R278 D279 R285 | E251-K281 VanDerWaalsContact CD-CE 3.43Å; E251-K281 VanDerWaalsContact OE1-CE 3.25Å; E251-K281 WeakPolarHBondContact OE1-CE 3.46Å; E251-K281 IonicContact OE1-NZ 2.77Å; E251-K281 PolarHBondContact OE1-NZ 2.77Å; E251-K281 WeakPolarHBondContact OE2-CE 3.39Å; E251-K281 IonicContact OE2-NZ 2.65Å; E251-K281 PolarHBondContact OE2-NZ 3.09Å; C277-K281 WeakPolarHBondContact O-CG 2.97Å; C277-K281 PolarHBondContact O-N 2.97Å; R278-K281 PolarHBondContact O-N 3.2Å; D279-K281 VanDerWaalsContact C-N 3.31Å; D279-K281 PolarHBondContact O-N 3.25Å; K281-R285 WeakPolarHBondContact O-CG 3.5Å |
| 282 | F | 75.3 | Confident | 79.5 | Confident | 117 Ų | 117 | 97.6 Ų | 97.6 | 51% | 0.513 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -77.8 | -33.3 | 176.2 | -69.5 | -63.3 | 0 | 0 | 0 | 112.5 | R278 D279 I284 R285 R286 | R278-F282 HydrophobicContact CB-CD2 4.38Å; R278-F282 HydrophobicContact CB-CE2 4.13Å; R278-F282 WeakPolarHBondContact O-CD2 3.18Å; R278-F282 PolarHBondContact O-N 3.2Å; D279-F282 CarbonylContact O-C 3.51Å; D279-F282 PolarHBondContact O-N 2.8Å; F282-I284 VanDerWaalsContact C-N 3.35Å; F282-I284 PolarHBondContact O-N 2.9Å; F282-R285 PolarHBondContact O-N 3.01Å; F282-R285 VanDerWaalsContact O-N 3.12Å; F282-R286 WeakPolarHBondContact O-CB 3.12Å; F282-R286 PolarHBondContact O-N 3.42Å |
| 283 | D | 75.2 | Confident | 77.7 | Confident | 98 Ų | 98 | 100.1 Ų | 100.1 | 52% | 0.524 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.4 | -36.8 | 177.5 | -80.8 | -25.5 | 0 | 0 | 0 | 112 | D279 S280 R285 R286 S287 | D279-D283 WeakPolarHBondContact O-CB 3.24Å; D279-D283 PolarHBondContact O-N 3.13Å; S280-D283 PolarHBondContact O-N 2.52Å; D283-R285 VanDerWaalsContact C-N 3.32Å; D283-R285 PolarHBondContact O-N 3.33Å; D283-R286 PolarHBondContact O-N 2.97Å; D283-S287 VanDerWaalsContact O-CB 3.31Å; D283-S287 WeakPolarHBondContact O-CB 3.34Å; D283-S287 PolarHBondContact O-N 3.31Å; D283-S287 PolarHBondContact O-OG 3.12Å |
| 284 | I | 74.4 | Confident | 75.8 | Confident | 105 Ų | 105 | 103.7 Ų | 103.7 | 54% | 0.538 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.2 | -40.9 | 171.5 | -63.4 | 163.6 | 0 | 0 | 0 | 110.9 | S280 F282 S287 N288 | S280-I284 WeakPolarHBondContact O-CG1 3.32Å; S280-I284 PolarHBondContact O-N 3.28Å; F282-I284 VanDerWaalsContact C-N 3.35Å; F282-I284 PolarHBondContact O-N 2.9Å; I284-S287 WeakPolarHBondContact CA-OG 3.4Å; I284-S287 PolarHBondContact O-OG 2.74Å; I284-N288 WeakPolarHBondContact O-CB 3.12Å; I284-N288 PolarHBondContact O-N 2.72Å; I284-N288 VanDerWaalsContact O-N 3.12Å |
| 285 | R | 72.6 | Confident | 74 | Confident | 169 Ų | 169 | 114 Ų | 114 | 64% | 0.638 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -71.4 | -38.7 | 178.2 | -64.3 | 179.6 | -161.2 | -167 | 3.8 | 111.9 | K281 F282 D283 N288 R289 | K281-R285 WeakPolarHBondContact O-CG 3.5Å; F282-R285 PolarHBondContact O-N 3.01Å; F282-R285 VanDerWaalsContact O-N 3.12Å; D283-R285 VanDerWaalsContact C-N 3.32Å; D283-R285 PolarHBondContact O-N 3.33Å; R285-N288 PolarHBondContact O-N 2.77Å; R285-R289 PolarHBondContact O-N 3.37Å; R285-R289 VanDerWaalsContact O-N 3.1Å |
| 286 | R | 72.8 | Confident | 72.4 | Confident | 198 Ų | 198 | 117.2 Ų | 117.2 | 75% | 0.747 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.3 | -41.8 | -179.9 | -165.9 | 173.1 | -166.9 | 162.6 | 2.9 | 111.5 | F282 D283 R289 S290 | F282-R286 WeakPolarHBondContact O-CB 3.12Å; F282-R286 PolarHBondContact O-N 3.42Å; D283-R286 PolarHBondContact O-N 2.97Å; R286-R289 PolarHBondContact O-N 2.94Å; R286-S290 PolarHBondContact O-N 3.26Å; R286-S290 VanDerWaalsContact O-N 3.1Å; R286-S290 PolarHBondContact O-OG 3.45Å |
| 287 | S | 66.4 | Low | 70.7 | Confident | 61 Ų | 61 | 118.9 Ų | 118.9 | 43% | 0.427 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -67.7 | -31.7 | 174.9 | 55.8 | 0 | 0 | 0 | 0 | 112.9 | D283 I284 S290 R291 | D283-S287 VanDerWaalsContact O-CB 3.31Å; D283-S287 WeakPolarHBondContact O-CB 3.34Å; D283-S287 PolarHBondContact O-N 3.31Å; D283-S287 PolarHBondContact O-OG 3.12Å; I284-S287 WeakPolarHBondContact CA-OG 3.4Å; I284-S287 PolarHBondContact O-OG 2.74Å; S287-S290 WeakPolarHBondContact CA-OG 3.21Å; S287-S290 PolarHBondContact O-OG 3Å; S287-R291 PolarHBondContact O-N 3.09Å |
| 288 | N | 62.5 | Low | 68.4 | Low | 88 Ų | 88 | 128.2 Ų | 128.2 | 47% | 0.471 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -71.4 | -30.7 | 171.9 | -78.8 | -3 | 0 | 0 | 0 | 113.5 | I284 R285 T292 | I284-N288 WeakPolarHBondContact O-CB 3.12Å; I284-N288 PolarHBondContact O-N 2.72Å; I284-N288 VanDerWaalsContact O-N 3.12Å; R285-N288 PolarHBondContact O-N 2.77Å; N288-T292 PolarHBondContact O-N 2.7Å; N288-T292 PolarHBondContact O-OG1 2.86Å; N288-T292 VanDerWaalsContact O-OG1 3.05Å |
| 289 | R | 66.6 | Low | 66.9 | Low | 207 Ų | 207 | 131.5 Ų | 131.5 | 78% | 0.781 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -74.4 | -38 | 176.6 | -164.4 | 174.9 | -142.2 | 177.9 | 6 | 112.6 | R285 R286 R291 T292 G293 | R285-R289 PolarHBondContact O-N 3.37Å; R285-R289 VanDerWaalsContact O-N 3.1Å; R286-R289 PolarHBondContact O-N 2.94Å; R289-R291 VanDerWaalsContact C-N 3.27Å; R289-R291 PolarHBondContact O-N 2.82Å; R289-T292 PolarHBondContact O-N 2.99Å; R289-T292 PolarHBondContact O-OG1 3.26Å; R289-G293 PolarHBondContact O-N 2.87Å |
| 290 | S | 65.1 | Low | 65.1 | Low | 79 Ų | 79 | 139.5 Ų | 139.5 | 55% | 0.552 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -67 | -29.9 | 175.6 | 55 | 0 | 0 | 0 | 0 | 112.5 | R286 S287 | R286-S290 PolarHBondContact O-N 3.26Å; R286-S290 VanDerWaalsContact O-N 3.1Å; R286-S290 PolarHBondContact O-OG 3.45Å; S287-S290 WeakPolarHBondContact CA-OG 3.21Å; S287-S290 PolarHBondContact O-OG 3Å |
| 291 | R | 60.3 | Low | 64 | Low | 191 Ų | 191 | 143.7 Ų | 143.7 | 72% | 0.721 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -78 | -23.7 | 179.9 | -165.9 | 170.1 | 145.7 | -112.6 | -3.6 | 114.3 | S287 R289 | S287-R291 PolarHBondContact O-N 3.09Å; R289-R291 VanDerWaalsContact C-N 3.27Å; R289-R291 PolarHBondContact O-N 2.82Å |
| 292 | T | 60.3 | Low | 63.1 | Low | 106 Ų | 106 | 146.2 Ų | 146.2 | 65% | 0.65 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -94 | -12 | 179.2 | 46.1 | 0 | 0 | 0 | 0 | 113.9 | N288 R289 | N288-T292 PolarHBondContact O-N 2.7Å; N288-T292 PolarHBondContact O-OG1 2.86Å; N288-T292 VanDerWaalsContact O-OG1 3.05Å; R289-T292 PolarHBondContact O-N 2.99Å; R289-T292 PolarHBondContact O-OG1 3.26Å |
| 293 | G | 58.3 | Low | 62.4 | Low | 65 Ų | 65 | 147.8 Ų | 147.8 | 67% | 0.67 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -90.4 | -7.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | R289 | R289-G293 PolarHBondContact O-N 2.87Š|
| 294 | S | 55.6 | Low | 61.6 | Low | 100 Ų | 100 | 150.7 Ų | 150.7 | 70% | 0.699 | 74% | 0.736 | S | S | * | * | trans | -125.4 | 28.8 | -164.4 | -45.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 295 | R | 58 | Low | 60.8 | Low | 217 Ų | 217 | 153.6 Ų | 153.6 | 82% | 0.819 | 75% | 0.748 | S | S | * | * | trans | -112.2 | 39.1 | 175.9 | -72.5 | -168.3 | -74.6 | 176.6 | -2.6 | 113.4 | ||||
| 296 | K | 58.5 | Low | 60 | Low | 187 Ų | 187 | 152.5 Ų | 152.5 | 81% | 0.813 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -130.8 | 140.1 | 162.8 | -70.6 | -168 | 178.1 | -172.4 | 0 | 107.8 | ||
| 297 | L | 56.5 | Low | 59.1 | Low | 161 Ų | 161 | 149.3 Ų | 149.3 | 84% | 0.843 | 76% | 0.756 | S | S | * | * | trans | 86.6 | 81.6 | 178.4 | -44.8 | 178.4 | 0 | 0 | 0 | 113.8 | ||||
| 298 | F | 47.2 | Very low | 58.6 | Low | 210 Ų | 210 | 156.1 Ų | 156.1 | 92% | 0.921 | 78% | 0.781 | S | S | * | * | trans | -168.2 | 83.7 | 133.3 | -100.5 | -72 | 0 | 0 | 0 | 107.5 | ||||
| 299 | L | 60.4 | Low | 58.2 | Low | 184 Ų | 184 | 161.8 Ų | 161.8 | 96% | 0.963 | 81% | 0.807 | S | S | * | * | trans | -157 | 81.7 | 162.6 | -101.2 | 151.5 | 0 | 0 | 0 | 104.4 | ||||
| 300 | D | 51.9 | Low | 57.5 | Low | 234 Ų | 234 | 157.6 Ų | 157.6 | 100% | 1.251 | 81% | 0.809 | S | S | * | * | trans | -143.1 | 0 | 154.4 | -167.8 | 47.9 | 0 | 0 | 0 | 106.4 |
Retrieved 300 of 300 residues in 936.8 ms
(Link to these results)