| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.1 | Very low | 47.4 | Very low | 236 Ų | 236 | 143 Ų | 143 | 100% | 1.163 | 80% | 0.797 | S | S | * | * | 0 | 89 | 0 | -65.8 | -173.2 | -79.9 | 0 | 0 | 105.4 | |||||
| 2 | L | 46.1 | Very low | 47 | Very low | 151 Ų | 151 | 143.8 Ų | 143.8 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | 87.6 | 120.3 | 93.2 | -86.3 | 162.2 | 0 | 0 | 0 | 111.5 | |||||
| 3 | E | 44.4 | Very low | 47.4 | Very low | 165 Ų | 165 | 140.5 Ų | 140.5 | 77% | 0.771 | 79% | 0.788 | S | S | * | * | trans | 61.8 | 125.3 | 149.5 | -119.9 | 70.4 | 82.8 | 0 | 0 | 120.2 | ||||
| 4 | A | 47 | Very low | 47.5 | Very low | 85 Ų | 85 | 138.3 Ų | 138.3 | 70% | 0.702 | 78% | 0.782 | S | S | * | * | -179.2 | 119 | 102.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | A6 | A4-A6 PolarHBondContact O-N 3.28Š| |||
| 5 | M | 50.5 | Low | 48 | Very low | 192 Ų | 192 | 136.1 Ų | 136.1 | 95% | 0.946 | 78% | 0.776 | S | S | * | * | trans | -51.1 | 116.9 | 153.2 | -66.4 | -86 | 176.7 | 0 | 0 | 108.7 | ||||
| 6 | A | 49.8 | Very low | 47.9 | Very low | 89 Ų | 89 | 136.2 Ų | 136.2 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | trans | -124.9 | 91.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | A4 P8 | A4-A6 PolarHBondContact O-N 3.28Å; A6-P8 VanDerWaalsContact O-CD 3.24Å; A6-P8 WeakPolarHBondContact O-CD 2.75Å | ||
| 7 | E | 46.8 | Very low | 47.9 | Very low | 152 Ų | 152 | 137.3 Ų | 137.3 | 71% | 0.71 | 78% | 0.782 | S | S | * | * | trans | -68.5 | 125.5 | 158.3 | -160.7 | -105.7 | 165.7 | 0 | 0 | 107.5 | ||||
| 8 | P | 50.4 | Low | 47.9 | Very low | 122 Ų | 122 | 139.9 Ų | 139.9 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | trans | -101 | 108.5 | 153.2 | 31.7 | -28.9 | 0 | 0 | 0 | 108.8 | A6 | A6-P8 VanDerWaalsContact O-CD 3.24Å; A6-P8 WeakPolarHBondContact O-CD 2.75Å | ||
| 9 | S | 40.9 | Very low | 47.8 | Very low | 78 Ų | 78 | 138.8 Ų | 138.8 | 55% | 0.545 | 78% | 0.782 | S | S | . | * | trans | -62.9 | -179.2 | 164.4 | -145.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 10 | P | 57 | Low | 47.9 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 71% | 0.708 | 79% | 0.785 | S | S | * | * | -101.9 | -170.1 | -117.2 | 28.8 | -5.2 | 0 | 0 | 0 | 111.5 | |||||
| 11 | E | 46.8 | Very low | 48.2 | Very low | 194 Ų | 194 | 140 Ų | 140 | 91% | 0.907 | 78% | 0.784 | S | S | * | * | trans | 105.4 | 86.4 | 170.9 | -54.1 | -157.9 | 94.6 | 0 | 0 | 115.9 | ||||
| 12 | D | 42 | Very low | 48.5 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 81% | 0.813 | 76% | 0.76 | S | S | * | * | trans | -125 | 129 | 140.3 | -156.2 | -82 | 0 | 0 | 0 | 106.8 | ||||
| 13 | P | 52.4 | Low | 49 | Very low | 102 Ų | 102 | 134 Ų | 134 | 66% | 0.662 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 147.9 | -165.5 | 26.6 | -35.6 | 0 | 0 | 0 | 112.5 | ||
| 14 | P | 48.6 | Very low | 49.8 | Very low | 109 Ų | 109 | 131.6 Ų | 131.6 | 71% | 0.708 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 137.9 | 178.3 | 26.7 | -33.2 | 0 | 0 | 0 | 110.2 | T16 | P14-T16 PolarHBondContact O-N 3.35Å; P14-T16 VanDerWaalsContact O-N 3.12Å |
| 15 | P | 55.1 | Low | 50.5 | Low | 106 Ų | 106 | 134 Ų | 134 | 69% | 0.688 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 124.7 | 162.7 | 24.2 | -30.4 | 0 | 0 | 0 | 107.4 | L17 | P15-L17 PolarHBondContact O-N 2.71Š|
| 16 | T | 45.8 | Very low | 50.6 | Low | 137 Ų | 137 | 131.8 Ų | 131.8 | 84% | 0.84 | 74% | 0.74 | S | S | * | * | trans | -59.5 | 77.6 | 176.4 | 42 | 0 | 0 | 0 | 0 | 110.7 | P14 K18 | P14-T16 PolarHBondContact O-N 3.35Å; P14-T16 VanDerWaalsContact O-N 3.12Å; T16-K18 PolarHBondContact O-N 3.27Å | ||
| 17 | L | 48 | Very low | 51.2 | Low | 155 Ų | 155 | 139.6 Ų | 139.6 | 81% | 0.812 | 75% | 0.75 | S | S | * | * | trans | -84.5 | 99.1 | 168.3 | -62.9 | -175.6 | 0 | 0 | 0 | 107.4 | P15 | P15-L17 PolarHBondContact O-N 2.71Š| ||
| 18 | K | 47.8 | Very low | 52 | Low | 185 Ų | 185 | 142.2 Ų | 142.2 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | trans | -40 | 136.5 | 176.1 | -55.8 | -179.4 | -175.2 | 173.5 | 0 | 110.7 | T16 E20 | T16-K18 PolarHBondContact O-N 3.27Å; K18-E20 VanDerWaalsContact C-N 3.3Å; K18-E20 PolarHBondContact O-N 2.93Å | ||
| 19 | P | 46.3 | Very low | 53.4 | Low | 118 Ų | 118 | 146.9 Ų | 146.9 | 77% | 0.766 | 76% | 0.755 | S | S | * | * | trans | -69.5 | 92.1 | 167.7 | 29.1 | -30.4 | 0 | 0 | 0 | 107.9 | T21 | P19-T21 PolarHBondContact O-N 3.3Š| ||
| 20 | E | 49.7 | Very low | 55.6 | Low | 180 Ų | 180 | 146.2 Ų | 146.2 | 84% | 0.841 | 75% | 0.748 | S | S | * | * | trans | -76.6 | 82.1 | 165.5 | -166.3 | 175.3 | 99.7 | 0 | 0 | 107.7 | K18 Q22 | K18-E20 VanDerWaalsContact C-N 3.3Å; K18-E20 PolarHBondContact O-N 2.93Å; E20-Q22 PolarHBondContact O-N 3.3Å; E20-Q22 VanDerWaalsContact O-N 3.15Å | ||
| 21 | T | 55 | Low | 57 | Low | 123 Ų | 123 | 147.1 Ų | 147.1 | 76% | 0.755 | 75% | 0.746 | S | S | * | * | trans | -47.2 | 110.1 | 160.6 | 41.3 | 0 | 0 | 0 | 0 | 110 | P19 | P19-T21 PolarHBondContact O-N 3.3Š| ||
| 22 | Q | 48.9 | Very low | 59.1 | Low | 140 Ų | 140 | 143.4 Ų | 143.4 | 65% | 0.654 | 73% | 0.728 | S | S | * | * | S | Bend | trans | 149.4 | 126.2 | 147.3 | -173.8 | 167.4 | 19.7 | 0 | 0 | 109.5 | E20 P24 | E20-Q22 PolarHBondContact O-N 3.3Å; E20-Q22 VanDerWaalsContact O-N 3.15Å; Q22-P24 VanDerWaalsContact O-CD 3.22Å; Q22-P24 WeakPolarHBondContact O-CD 3.43Å; Q22-P24 VanDerWaalsContact O-N 3.08Å |
| 23 | P | 55.8 | Low | 61.4 | Low | 120 Ų | 120 | 139.7 Ų | 139.7 | 78% | 0.779 | 71% | 0.708 | S | S | * | * | trans | -60.4 | 116.8 | 169.5 | 3 | 3.7 | 0 | 0 | 0 | 107.8 | E25 | P23-E25 PolarHBondContact O-N 3.32Š| ||
| 24 | P | 60.2 | Low | 63.3 | Low | 115 Ų | 115 | 140.5 Ų | 140.5 | 75% | 0.747 | 70% | 0.702 | S | S | * | * | trans | -60.7 | 117.9 | -170.2 | 18.7 | -29.1 | 0 | 0 | 0 | 110.4 | Q22 K26 | Q22-P24 VanDerWaalsContact O-CD 3.22Å; Q22-P24 WeakPolarHBondContact O-CD 3.43Å; Q22-P24 VanDerWaalsContact O-N 3.08Å; P24-K26 PolarHBondContact O-N 3.35Å; P24-K26 VanDerWaalsContact O-N 3.16Å | ||
| 25 | E | 61.7 | Low | 65.3 | Low | 137 Ų | 137 | 139.4 Ų | 139.4 | 64% | 0.64 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -55.9 | 113.6 | -176.8 | -161 | -166.9 | 138.4 | 0 | 0 | 109.4 | P23 | P23-E25 PolarHBondContact O-N 3.32Š|
| 26 | K | 53.7 | Low | 67 | Low | 144 Ų | 144 | 141 Ų | 141 | 63% | 0.626 | 69% | 0.686 | S | S | * | * | S | Bend | trans | 80.7 | 99.6 | -179.9 | -46.4 | 137.7 | -169.7 | 156.8 | 0 | 112.7 | P24 R28 | P24-K26 PolarHBondContact O-N 3.35Å; P24-K26 VanDerWaalsContact O-N 3.16Å; K26-R28 HydrophobicContact CB-CG 4.02Å; K26-R28 PolarHBondContact O-N 2.66Å |
| 27 | R | 61.7 | Low | 69.2 | Low | 254 Ų | 254 | 140.4 Ų | 140.4 | 96% | 0.958 | 67% | 0.672 | S | S | * | * | trans | -58 | 72.1 | 159 | -70.2 | 175.2 | -179.8 | 143.5 | -1.5 | 109.9 | R29 | R27-R29 PolarHBondContact O-N 3.18Š| ||
| 28 | R | 64.1 | Low | 71.3 | Confident | 206 Ų | 206 | 134.8 Ų | 134.8 | 78% | 0.777 | 65% | 0.645 | S | S | * | * | trans | -73.8 | 107.6 | 170.1 | -62.8 | -167.4 | 77.3 | 141.1 | 3.3 | 105.1 | K26 T30 | K26-R28 HydrophobicContact CB-CG 4.02Å; K26-R28 PolarHBondContact O-N 2.66Å; R28-T30 PolarHBondContact O-N 3.36Å; R28-T30 VanDerWaalsContact O-N 3.09Å | ||
| 29 | R | 79.8 | Confident | 73.4 | Confident | 220 Ų | 220 | 129.1 Ų | 129.1 | 83% | 0.83 | 63% | 0.629 | S | S | * | * | trans | -57.1 | 117.7 | 166 | -61.8 | 179.7 | -147.1 | 168.7 | 5.8 | 106 | R27 D33 | R27-R29 PolarHBondContact O-N 3.18Å; R29-D33 HydrophobicContact CB-CB 4.38Å | ||
| 30 | T | 86.6 | Confident | 75.6 | Confident | 65 Ų | 65 | 130.4 Ų | 130.4 | 40% | 0.399 | 62% | 0.623 | S | S | . | * | trans | -75 | 169.1 | 174.4 | 65.3 | 0 | 0 | 0 | 0 | 109.1 | R28 E32 D33 F34 | R28-T30 PolarHBondContact O-N 3.36Å; R28-T30 VanDerWaalsContact O-N 3.09Å; T30-E32 WeakPolarHBondContact CB-OE2 3.39Å; T30-E32 PolarHBondContact O-N 3.49Å; T30-E32 PolarHBondContact OG1-OE2 3.48Å; T30-D33 PolarHBondContact O-N 2.97Å; T30-D33 PolarHBondContact OG1-N 2.84Å; T30-F34 PolarHBondContact O-N 3.46Å; T30-F34 VanDerWaalsContact O-N 3.09Å | ||
| 31 | I | 87.1 | Confident | 77.8 | Confident | 127 Ų | 127 | 124.6 Ų | 124.6 | 65% | 0.651 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -62.9 | -33.9 | 176 | -68 | 164.9 | 0 | 0 | 0 | 109.1 | F34 N35 | I31-F34 PolarHBondContact O-N 3.48Å; I31-N35 WeakPolarHBondContact O-CB 3.28Å; I31-N35 PolarHBondContact O-N 3.15Å; I31-N35 PolarHBondContact O-ND2 3.21Å; I31-N35 PolarHBondContact O-OD1 2.74Å |
| 32 | E | 90.4 | Very high | 79.7 | Confident | 116 Ų | 116 | 122.5 Ų | 122.5 | 54% | 0.542 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.7 | -40.5 | 174.8 | -58.8 | 90.3 | 147.4 | 0 | 0 | 112 | T30 N35 K36 | T30-E32 WeakPolarHBondContact CB-OE2 3.39Å; T30-E32 PolarHBondContact O-N 3.49Å; T30-E32 PolarHBondContact OG1-OE2 3.48Å; E32-N35 PolarHBondContact O-N 2.62Å; E32-K36 VanDerWaalsContact O-CG 3.28Å; E32-K36 WeakPolarHBondContact O-CG 3.5Å; E32-K36 PolarHBondContact O-N 3.01Å |
| 33 | D | 91.7 | Very high | 81.8 | Confident | 74 Ų | 74 | 118.3 Ų | 118.3 | 40% | 0.396 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.9 | -38.7 | 175.5 | -73.9 | -15 | 0 | 0 | 0 | 112.3 | R29 T30 K36 F37 | R29-D33 HydrophobicContact CB-CB 4.38Å; T30-D33 PolarHBondContact O-N 2.97Å; T30-D33 PolarHBondContact OG1-N 2.84Å; D33-K36 PolarHBondContact O-N 3.28Å; D33-F37 WeakPolarHBondContact O-CB 3.3Å; D33-F37 PolarHBondContact O-N 3.26Å |
| 34 | F | 91.4 | Very high | 83.6 | Confident | 119 Ų | 119 | 122.1 Ų | 122.1 | 52% | 0.522 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.2 | -44.4 | 173.8 | 176.8 | -101.4 | 0 | 0 | 0 | 111.2 | T30 I31 K36 F37 C38 | T30-F34 PolarHBondContact O-N 3.46Å; T30-F34 VanDerWaalsContact O-N 3.09Å; I31-F34 PolarHBondContact O-N 3.48Å; F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.36Å; F34-F37 WeakPolarHBondContact O-CB 3.33Å; F34-F37 PolarHBondContact O-N 3.49Å; F34-F37 VanDerWaalsContact O-N 3.16Å; F34-C38 VanDerWaalsContact CE1-SG 3.53Å; F34-C38 WeakPolarHBondContact CZ-SG 3.27Å; F34-C38 PolarHBondContact O-N 2.73Å; F34-C38 PolarHBondContact O-SG 3.07Å; F34-C38 VanDerWaalsContact O-SG 3.4Å |
| 35 | N | 90.6 | Very high | 85.1 | Confident | 86 Ų | 86 | 119.3 Ų | 119.3 | 46% | 0.46 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -61.2 | -43 | 176.8 | -69.6 | -17.1 | 0 | 0 | 0 | 111.4 | I31 E32 F37 C38 S39 | I31-N35 WeakPolarHBondContact O-CB 3.28Å; I31-N35 PolarHBondContact O-N 3.15Å; I31-N35 PolarHBondContact O-ND2 3.21Å; I31-N35 PolarHBondContact O-OD1 2.74Å; E32-N35 PolarHBondContact O-N 2.62Å; N35-F37 VanDerWaalsContact C-N 3.35Å; N35-F37 PolarHBondContact O-N 3.14Å; N35-C38 PolarHBondContact O-N 3.13Å; N35-S39 PolarHBondContact O-N 2.94Å; N35-S39 PolarHBondContact O-OG 2.94Å; N35-S39 VanDerWaalsContact O-OG 3.09Å |
| 36 | K | 90.4 | Very high | 86.5 | Confident | 141 Ų | 141 | 115.7 Ų | 115.7 | 61% | 0.613 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62 | -41.7 | 173.7 | -73.9 | 171.6 | -173.8 | 166.8 | 0 | 112.2 | E32 D33 F34 S39 F40 | E32-K36 VanDerWaalsContact O-CG 3.28Å; E32-K36 WeakPolarHBondContact O-CG 3.5Å; E32-K36 PolarHBondContact O-N 3.01Å; D33-K36 PolarHBondContact O-N 3.28Å; F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.36Å; K36-S39 PolarHBondContact O-N 2.9Å; K36-F40 WeakPolarHBondContact O-CB 3.27Å; K36-F40 PolarHBondContact O-N 3.46Å |
| 37 | F | 92.3 | Very high | 87.9 | Confident | 124 Ų | 124 | 117.6 Ų | 117.6 | 54% | 0.544 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.3 | -45.6 | 176.3 | 175 | -100.2 | 0 | 0 | 0 | 111.8 | D33 F34 N35 F40 V41 | D33-F37 WeakPolarHBondContact O-CB 3.3Å; D33-F37 PolarHBondContact O-N 3.26Å; F34-F37 WeakPolarHBondContact O-CB 3.33Å; F34-F37 PolarHBondContact O-N 3.49Å; F34-F37 VanDerWaalsContact O-N 3.16Å; N35-F37 VanDerWaalsContact C-N 3.35Å; N35-F37 PolarHBondContact O-N 3.14Å; F37-F40 PolarHBondContact O-N 3.11Å; F37-V41 HydrophobicContact CD1-CG2 4.45Å; F37-V41 HydrophobicContact CD2-CG2 4.35Å; F37-V41 HydrophobicContact CE1-CG2 4.01Å; F37-V41 HydrophobicContact CE2-CG2 3.9Å; F37-V41 HydrophobicContact CZ-CG2 3.71Å; F37-V41 WeakPolarHBondContact O-CG2 3.43Å; F37-V41 PolarHBondContact O-N 3.33Å |
| 38 | C | 92.3 | Very high | 88.7 | Confident | 37 Ų | 37 | 108.8 Ų | 108.8 | 25% | 0.25 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -59.1 | -49.3 | 175 | -72.8 | 0 | 0 | 0 | 0 | 111.4 | F34 N35 F40 V41 L42 | F34-C38 VanDerWaalsContact CE1-SG 3.53Å; F34-C38 WeakPolarHBondContact CZ-SG 3.27Å; F34-C38 PolarHBondContact O-N 2.73Å; F34-C38 PolarHBondContact O-SG 3.07Å; F34-C38 VanDerWaalsContact O-SG 3.4Å; N35-C38 PolarHBondContact O-N 3.13Å; C38-F40 VanDerWaalsContact C-N 3.3Å; C38-F40 PolarHBondContact O-N 3.27Å; C38-V41 PolarHBondContact O-N 3.36Å; C38-L42 WeakPolarHBondContact O-CB 3.49Å; C38-L42 VanDerWaalsContact O-CD1 3.26Å; C38-L42 WeakPolarHBondContact O-CD1 3.27Å; C38-L42 PolarHBondContact O-N 3.49Å |
| 39 | S | 91.9 | Very high | 89.3 | Confident | 65 Ų | 65 | 103.7 Ų | 103.7 | 46% | 0.455 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -57.5 | -42.7 | 177.4 | -62 | 0 | 0 | 0 | 0 | 112.3 | N35 K36 A43 I48 | N35-S39 PolarHBondContact O-N 2.94Å; N35-S39 PolarHBondContact O-OG 2.94Å; N35-S39 VanDerWaalsContact O-OG 3.09Å; K36-S39 PolarHBondContact O-N 2.9Å; S39-A43 VanDerWaalsContact O-CB 3.26Å; S39-A43 WeakPolarHBondContact O-CB 3.49Å; S39-A43 PolarHBondContact O-N 2.89Å; S39-I48 WeakPolarHBondContact O-CD1 3.45Å |
| 40 | F | 92.8 | Very high | 88.4 | Confident | 145 Ų | 145 | 98.6 Ų | 98.6 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.8 | -48.6 | 176.8 | 173.5 | -96 | 0 | 0 | 0 | 112.2 | K36 F37 C38 A43 Y44 | K36-F40 WeakPolarHBondContact O-CB 3.27Å; K36-F40 PolarHBondContact O-N 3.46Å; F37-F40 PolarHBondContact O-N 3.11Å; C38-F40 VanDerWaalsContact C-N 3.3Å; C38-F40 PolarHBondContact O-N 3.27Å; F40-A43 PolarHBondContact O-N 2.98Å; F40-Y44 WeakPolarHBondContact O-CB 3.34Å; F40-Y44 PolarHBondContact O-N 3.01Å |
| 41 | V | 96.5 | Very high | 87.3 | Confident | 58 Ų | 58 | 100.4 Ų | 100.4 | 35% | 0.352 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.9 | -43.2 | -179.6 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | F37 C38 Y44 A45 | F37-V41 HydrophobicContact CD1-CG2 4.45Å; F37-V41 HydrophobicContact CD2-CG2 4.35Å; F37-V41 HydrophobicContact CE1-CG2 4.01Å; F37-V41 HydrophobicContact CE2-CG2 3.9Å; F37-V41 HydrophobicContact CZ-CG2 3.71Å; F37-V41 WeakPolarHBondContact O-CG2 3.43Å; F37-V41 PolarHBondContact O-N 3.33Å; C38-V41 PolarHBondContact O-N 3.36Å; V41-Y44 PolarHBondContact O-N 3.19Å; V41-A45 WeakPolarHBondContact O-CB 3.33Å; V41-A45 PolarHBondContact O-N 3.33Å |
| 42 | L | 95 | Very high | 85.8 | Confident | 80 Ų | 80 | 103.6 Ų | 103.6 | 42% | 0.419 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.8 | -40.7 | 178.8 | -93.1 | 67.5 | 0 | 0 | 0 | 111.7 | C38 A45 G46 Y47 I48 | C38-L42 WeakPolarHBondContact O-CB 3.49Å; C38-L42 VanDerWaalsContact O-CD1 3.26Å; C38-L42 WeakPolarHBondContact O-CD1 3.27Å; C38-L42 PolarHBondContact O-N 3.49Å; L42-A45 PolarHBondContact O-N 3.45Å; L42-G46 PolarHBondContact O-N 2.89Å; L42-Y47 PolarHBondContact O-N 3.27Å; L42-I48 HydrophobicContact CB-CD1 3.54Å; L42-I48 HydrophobicContact CB-CG1 3.81Å; L42-I48 HydrophobicContact CD2-CD1 4.35Å; L42-I48 HydrophobicContact CD2-CG1 4.38Å; L42-I48 PolarHBondContact O-N 3.41Å |
| 43 | A | 92 | Very high | 84.3 | Confident | 52 Ų | 52 | 106.7 Ų | 106.7 | 43% | 0.43 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.4 | -43.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | S39 F40 A45 G46 I48 | S39-A43 VanDerWaalsContact O-CB 3.26Å; S39-A43 WeakPolarHBondContact O-CB 3.49Å; S39-A43 PolarHBondContact O-N 2.89Å; F40-A43 PolarHBondContact O-N 2.98Å; A43-A45 VanDerWaalsContact C-N 3.32Å; A43-A45 PolarHBondContact O-N 3.38Å; A43-G46 PolarHBondContact O-N 2.98Å; A43-I48 HydrophobicContact CB-CB 4.3Å; A43-I48 HydrophobicContact CB-CD1 4.47Å |
| 44 | Y | 93.3 | Very high | 82.6 | Confident | 200 Ų | 200 | 110.2 Ų | 110.2 | 78% | 0.784 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59.6 | -42.1 | 176.3 | 175.1 | -101.9 | 0 | 0 | 0 | 112.4 | F40 V41 G46 | F40-Y44 WeakPolarHBondContact O-CB 3.34Å; F40-Y44 PolarHBondContact O-N 3.01Å; V41-Y44 PolarHBondContact O-N 3.19Å; Y44-G46 PolarHBondContact O-N 3.47Å |
| 45 | A | 93.1 | Very high | 80.6 | Confident | 56 Ų | 56 | 108.7 Ų | 108.7 | 46% | 0.463 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77 | 1.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.7 | V41 L42 A43 Y47 | V41-A45 WeakPolarHBondContact O-CB 3.33Å; V41-A45 PolarHBondContact O-N 3.33Å; L42-A45 PolarHBondContact O-N 3.45Å; A43-A45 VanDerWaalsContact C-N 3.32Å; A43-A45 PolarHBondContact O-N 3.38Å; A45-Y47 VanDerWaalsContact C-N 3.27Å; A45-Y47 HydrophobicContact CB-CD2 3.57Å; A45-Y47 HydrophobicContact CB-CE2 3.9Å; A45-Y47 PolarHBondContact O-N 2.93Å |
| 46 | G | 89.3 | Confident | 78.6 | Confident | 60 Ų | 60 | 110.4 Ų | 110.4 | 62% | 0.619 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 74.9 | 12.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L42 A43 Y44 | L42-G46 PolarHBondContact O-N 2.89Å; A43-G46 PolarHBondContact O-N 2.98Å; Y44-G46 PolarHBondContact O-N 3.47Å |
| 47 | Y | 84.3 | Confident | 76.6 | Confident | 184 Ų | 184 | 114.3 Ų | 114.3 | 72% | 0.722 | 60% | 0.6 | S | S | * | * | trans | -79.9 | -26.1 | 177.6 | -77 | -80.8 | 0 | 0 | 0 | 113.4 | L42 A45 P49 | L42-Y47 PolarHBondContact O-N 3.27Å; A45-Y47 VanDerWaalsContact C-N 3.27Å; A45-Y47 HydrophobicContact CB-CD2 3.57Å; A45-Y47 HydrophobicContact CB-CE2 3.9Å; A45-Y47 PolarHBondContact O-N 2.93Å; Y47-P49 WeakPolarHBondContact O-CD 3.46Å | ||
| 48 | I | 78.9 | Confident | 74.4 | Confident | 69 Ų | 69 | 114 Ų | 114 | 35% | 0.354 | 61% | 0.611 | S | S | . | * | S | Bend | trans | -94.6 | 110.2 | 170.7 | -68.9 | 163.8 | 0 | 0 | 0 | 107.3 | S39 L42 A43 | S39-I48 WeakPolarHBondContact O-CD1 3.45Å; L42-I48 HydrophobicContact CB-CD1 3.54Å; L42-I48 HydrophobicContact CB-CG1 3.81Å; L42-I48 HydrophobicContact CD2-CD1 4.35Å; L42-I48 HydrophobicContact CD2-CG1 4.38Å; L42-I48 PolarHBondContact O-N 3.41Å; A43-I48 HydrophobicContact CB-CB 4.3Å; A43-I48 HydrophobicContact CB-CD1 4.47Å |
| 49 | P | 75.5 | Confident | 72 | Confident | 99 Ų | 99 | 116.4 Ų | 116.4 | 64% | 0.643 | 63% | 0.634 | S | S | * | * | trans | -57.4 | 141.7 | 170.8 | -20.7 | 33.1 | 0 | 0 | 0 | 109.6 | Y47 S51 | Y47-P49 WeakPolarHBondContact O-CD 3.46Å; P49-S51 PolarHBondContact O-N 2.9Å; P49-S51 VanDerWaalsContact O-N 3.15Å | ||
| 50 | P | 61.7 | Low | 70.1 | Confident | 114 Ų | 114 | 119.8 Ų | 119.8 | 74% | 0.74 | 66% | 0.657 | S | S | * | * | trans | -58 | 124.2 | 176.5 | 23.7 | -32.1 | 0 | 0 | 0 | 109.1 | K52 | P50-K52 VanDerWaalsContact C-N 3.32Å; P50-K52 PolarHBondContact O-N 3.24Å | ||
| 51 | S | 63.5 | Low | 67.9 | Low | 103 Ų | 103 | 116 Ų | 116 | 72% | 0.72 | 66% | 0.659 | S | S | * | * | trans | -68 | 89.1 | 179.9 | 57.9 | 0 | 0 | 0 | 0 | 109.4 | P49 E53 | P49-S51 PolarHBondContact O-N 2.9Å; P49-S51 VanDerWaalsContact O-N 3.15Å; S51-E53 VanDerWaalsContact C-N 3.27Å; S51-E53 PolarHBondContact O-N 2.97Å; S51-E53 VanDerWaalsContact O-N 3.09Å | ||
| 52 | K | 54.7 | Low | 65.9 | Low | 193 Ų | 193 | 119 Ų | 119 | 84% | 0.839 | 68% | 0.683 | S | S | * | * | trans | -76.2 | 89.4 | 161.8 | 33.9 | -176.1 | 170.2 | 71.8 | 0 | 106.7 | P50 | P50-K52 VanDerWaalsContact C-N 3.32Å; P50-K52 PolarHBondContact O-N 3.24Å | ||
| 53 | E | 59.2 | Low | 63.3 | Low | 182 Ų | 182 | 121.1 Ų | 121.1 | 85% | 0.85 | 70% | 0.704 | S | S | * | * | S | Bend | trans | 58.3 | 116.4 | 165.6 | -159.2 | 155.5 | 88.8 | 0 | 0 | 115 | S51 | S51-E53 VanDerWaalsContact C-N 3.27Å; S51-E53 PolarHBondContact O-N 2.97Å; S51-E53 VanDerWaalsContact O-N 3.09Å |
| 54 | E | 55.3 | Low | 60.9 | Low | 148 Ų | 148 | 124 Ų | 124 | 69% | 0.692 | 72% | 0.721 | S | S | * | * | trans | 56.1 | 85.2 | 171.1 | -166.9 | 176.9 | -156 | 0 | 0 | 115.6 | D56 | E54-D56 PolarHBondContact O-N 3.16Å; E54-D56 VanDerWaalsContact O-N 3.07Å | ||
| 55 | S | 50.3 | Low | 59.5 | Low | 87 Ų | 87 | 119.4 Ų | 119.4 | 61% | 0.608 | 72% | 0.716 | S | S | * | * | trans | -74.6 | 92.4 | 148.5 | -65.6 | 0 | 0 | 0 | 0 | 107.1 | W57 | S55-W57 PolarHBondContact O-N 3.03Š| ||
| 56 | D | 48.2 | Very low | 57.3 | Low | 121 Ų | 121 | 124 Ų | 124 | 65% | 0.647 | 73% | 0.732 | S | S | * | * | trans | -47.5 | 89.3 | 153.2 | -83.7 | -61 | 0 | 0 | 0 | 107.7 | E54 P58 | E54-D56 PolarHBondContact O-N 3.16Å; E54-D56 VanDerWaalsContact O-N 3.07Å; D56-P58 VanDerWaalsContact O-CD 3.28Å; D56-P58 WeakPolarHBondContact O-CD 3.21Å; D56-P58 VanDerWaalsContact O-N 3.15Å | ||
| 57 | W | 49.1 | Very low | 55.3 | Low | 223 Ų | 223 | 132.8 Ų | 132.8 | 85% | 0.845 | 75% | 0.746 | S | S | * | * | trans | -57 | 119.1 | 156.5 | -73.3 | 98.2 | 0 | 0 | 0 | 104.7 | S55 A59 | S55-W57 PolarHBondContact O-N 3.03Å; W57-A59 VanDerWaalsContact C-N 3.31Å; W57-A59 PolarHBondContact O-N 3.04Å | ||
| 58 | P | 45 | Very low | 53.7 | Low | 119 Ų | 119 | 127.2 Ų | 127.2 | 77% | 0.773 | 74% | 0.744 | S | S | * | * | trans | -60.4 | 110.7 | 169 | 25.7 | -29.8 | 0 | 0 | 0 | 104.7 | D56 S60 | D56-P58 VanDerWaalsContact O-CD 3.28Å; D56-P58 WeakPolarHBondContact O-CD 3.21Å; D56-P58 VanDerWaalsContact O-N 3.15Å; P58-S60 PolarHBondContact O-N 2.68Å | ||
| 59 | A | 41.8 | Very low | 52.5 | Low | 87 Ų | 87 | 133 Ų | 133 | 72% | 0.719 | 77% | 0.77 | S | S | * | * | trans | -43.5 | 130.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | W57 G61 | W57-A59 VanDerWaalsContact C-N 3.31Å; W57-A59 PolarHBondContact O-N 3.04Å; A59-G61 PolarHBondContact O-N 3.08Å | ||
| 60 | S | 51.7 | Low | 51.1 | Low | 136 Ų | 136 | 133.8 Ų | 133.8 | 95% | 0.951 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -26 | 103.6 | 171.8 | -63.9 | 0 | 0 | 0 | 0 | 112.1 | P58 | P58-S60 PolarHBondContact O-N 2.68Š|
| 61 | G | 48.2 | Very low | 50.9 | Low | 65 Ų | 65 | 133.7 Ų | 133.7 | 67% | 0.67 | 79% | 0.787 | S | S | * | * | trans | 178.7 | 79.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | A59 | A59-G61 PolarHBondContact O-N 3.08Š| ||
| 62 | S | 53.5 | Low | 50.8 | Low | 122 Ų | 122 | 132.6 Ų | 132.6 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | trans | 46.3 | 104.1 | 145 | -178.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 63 | S | 41.3 | Very low | 51.1 | Low | 124 Ų | 124 | 130.9 Ų | 130.9 | 87% | 0.867 | 78% | 0.784 | S | S | * | * | -168.1 | 122.8 | 126.9 | 45.4 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 64 | S | 41.8 | Very low | 50.7 | Low | 113 Ų | 113 | 126.8 Ų | 126.8 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -114.4 | 147.4 | 152.9 | -166.4 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 65 | P | 62.8 | Low | 51.1 | Low | 103 Ų | 103 | 127.6 Ų | 127.6 | 67% | 0.669 | 78% | 0.784 | S | S | * | * | cis | -148.6 | -172.6 | 48.4 | 33.2 | -7.7 | 0 | 0 | 0 | 116.2 | ||||
| 66 | L | 48.3 | Very low | 51.6 | Low | 152 Ų | 152 | 126.3 Ų | 126.3 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | trans | 104.5 | 101.3 | 159.4 | -50.4 | 174.8 | 0 | 0 | 0 | 114.9 | ||||
| 67 | R | 45.9 | Very low | 52 | Low | 245 Ų | 245 | 131 Ų | 131 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | 92.5 | 121.9 | 93.8 | -168.5 | -170.5 | -164 | -168.1 | 4.6 | 109.3 | |||||
| 68 | G | 50.6 | Low | 52.4 | Low | 66 Ų | 66 | 127.1 Ų | 127.1 | 68% | 0.68 | 79% | 0.789 | S | S | * | * | cis | 147.2 | 93.3 | 8.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 69 | E | 53.6 | Low | 53 | Low | 192 Ų | 192 | 125.9 Ų | 125.9 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | trans | -174.1 | 110.8 | 162.9 | 55.1 | -166.9 | 120.2 | 0 | 0 | 109.7 | ||||
| 70 | S | 46.8 | Very low | 54 | Low | 115 Ų | 115 | 124.2 Ų | 124.2 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | 173.8 | 78.2 | 137.1 | -162.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 71 | A | 56.9 | Low | 54.9 | Low | 112 Ų | 112 | 122.2 Ų | 122.2 | 93% | 0.926 | 75% | 0.753 | S | S | * | * | trans | -91.1 | 86.5 | 163.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 72 | A | 61.3 | Low | 56.1 | Low | 79 Ų | 79 | 122.9 Ų | 122.9 | 65% | 0.653 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -158.9 | 111.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 73 | D | 61.1 | Low | 57.4 | Low | 157 Ų | 157 | 121.5 Ų | 121.5 | 84% | 0.84 | 73% | 0.731 | S | S | * | * | S | Bend | trans | 60.6 | 88.5 | 173.4 | -80.1 | -17.5 | 0 | 0 | 0 | 118.1 | ||
| 74 | S | 51 | Low | 59.4 | Low | 97 Ų | 97 | 120.7 Ų | 120.7 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | trans | -158.4 | 77.3 | 132.8 | -142 | 0 | 0 | 0 | 0 | 112 | G76 | S74-G76 PolarHBondContact O-N 3.11Š| ||
| 75 | D | 63.1 | Low | 61.4 | Low | 164 Ų | 164 | 124.1 Ų | 124.1 | 88% | 0.877 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 66.9 | 167.4 | -72 | -36.8 | 0 | 0 | 0 | 111 | ||
| 76 | G | 61.7 | Low | 62.6 | Low | 60 Ų | 60 | 121.9 Ų | 121.9 | 62% | 0.619 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.8 | 2.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | S74 | S74-G76 PolarHBondContact O-N 3.11Š|
| 77 | W | 56.8 | Low | 64.5 | Low | 219 Ų | 219 | 118.8 Ų | 118.8 | 83% | 0.83 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -127.2 | -5.8 | -174.5 | -65.3 | 56.4 | 0 | 0 | 0 | 113.4 | S79 A80 | W77-S79 PolarHBondContact O-N 3.16Å; W77-S79 VanDerWaalsContact O-N 3.11Å; W77-A80 PolarHBondContact O-N 3.04Å |
| 78 | D | 56.8 | Low | 66.3 | Low | 142 Ų | 142 | 113 Ų | 113 | 76% | 0.759 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | 1.2 | -177.1 | -104.9 | -72.7 | 0 | 0 | 0 | 115.3 | A80 P81 | D78-A80 PolarHBondContact O-N 3.43Å; D78-P81 WeakPolarHBondContact O-CD 2.99Å |
| 79 | S | 58.7 | Low | 67.9 | Low | 94 Ų | 94 | 113.3 Ų | 113.3 | 66% | 0.657 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -4.9 | 173 | -69.9 | 0 | 0 | 0 | 0 | 113.8 | W77 P81 S82 D83 | W77-S79 PolarHBondContact O-N 3.16Å; W77-S79 VanDerWaalsContact O-N 3.11Å; S79-P81 VanDerWaalsContact C-CD 3.49Å; S79-S82 PolarHBondContact O-N 3.07Å; S79-S82 VanDerWaalsContact O-N 3.16Å; S79-D83 PolarHBondContact O-N 3.38Å |
| 80 | A | 63 | Low | 69.4 | Low | 52 Ų | 52 | 110.9 Ų | 110.9 | 43% | 0.43 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -46.9 | -49.8 | -178 | 0 | 0 | 0 | 0 | 0 | 115 | W77 D78 S82 D83 L84 | W77-A80 PolarHBondContact O-N 3.04Å; D78-A80 PolarHBondContact O-N 3.43Å; A80-S82 VanDerWaalsContact C-N 3.34Å; A80-S82 PolarHBondContact O-N 2.85Å; A80-D83 PolarHBondContact O-N 3.22Å; A80-L84 WeakPolarHBondContact O-CB 3.49Å; A80-L84 WeakPolarHBondContact O-CD1 3.37Å; A80-L84 PolarHBondContact O-N 3.41Å |
| 81 | P | 69.7 | Low | 71.2 | Confident | 93 Ų | 93 | 109.3 Ų | 109.3 | 60% | 0.604 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.2 | -32.2 | -176.3 | 26.4 | -34 | 0 | 0 | 0 | 113.3 | D78 S79 R85 | D78-P81 WeakPolarHBondContact O-CD 2.99Å; S79-P81 VanDerWaalsContact C-CD 3.49Å; P81-R85 PolarHBondContact O-N 2.96Å |
| 82 | S | 74.6 | Confident | 72.1 | Confident | 79 Ų | 79 | 110.8 Ų | 110.8 | 55% | 0.552 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72.7 | -40.5 | 177.7 | -175.7 | 0 | 0 | 0 | 0 | 111.6 | S79 A80 R85 T86 | S79-S82 PolarHBondContact O-N 3.07Å; S79-S82 VanDerWaalsContact O-N 3.16Å; A80-S82 VanDerWaalsContact C-N 3.34Å; A80-S82 PolarHBondContact O-N 2.85Å; S82-R85 PolarHBondContact O-N 3.43Å; S82-T86 PolarHBondContact O-N 2.96Å; S82-T86 PolarHBondContact O-OG1 3.23Å |
| 83 | D | 79.8 | Confident | 72.8 | Confident | 94 Ų | 94 | 113.6 Ų | 113.6 | 50% | 0.503 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -68.4 | -41.4 | -179.9 | -156.2 | 16.2 | 0 | 0 | 0 | 111 | S79 A80 R85 T86 I87 | S79-D83 PolarHBondContact O-N 3.38Å; A80-D83 PolarHBondContact O-N 3.22Å; D83-R85 VanDerWaalsContact C-N 3.31Å; D83-R85 PolarHBondContact O-N 3.43Å; D83-T86 WeakPolarHBondContact O-CB 3.48Å; D83-T86 PolarHBondContact O-N 3.1Å; D83-T86 VanDerWaalsContact O-N 3.11Å; D83-I87 WeakPolarHBondContact O-CD1 3.47Å; D83-I87 VanDerWaalsContact O-CG1 3.23Å; D83-I87 WeakPolarHBondContact O-CG1 3.44Å; D83-I87 PolarHBondContact O-N 3.09Å |
| 84 | L | 84 | Confident | 73.3 | Confident | 106 Ų | 106 | 109.5 Ų | 109.5 | 56% | 0.555 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -58.3 | -41.6 | 172.8 | -91.1 | 73.2 | 0 | 0 | 0 | 112.1 | A80 T86 Q88 | A80-L84 WeakPolarHBondContact O-CB 3.49Å; A80-L84 WeakPolarHBondContact O-CD1 3.37Å; A80-L84 PolarHBondContact O-N 3.41Å; L84-T86 VanDerWaalsContact C-N 3.32Å; L84-T86 PolarHBondContact O-N 2.86Å; L84-Q88 WeakPolarHBondContact O-CB 3.23Å; L84-Q88 WeakPolarHBondContact O-CG 3.34Å; L84-Q88 PolarHBondContact O-N 2.98Å |
| 85 | R | 84.1 | Confident | 73.9 | Confident | 185 Ų | 185 | 112.6 Ų | 112.6 | 70% | 0.698 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.6 | -36.3 | 177.9 | -158.5 | -91.5 | -177.8 | 153.6 | 1.5 | 111.6 | P81 S82 D83 T89 | P81-R85 PolarHBondContact O-N 2.96Å; S82-R85 PolarHBondContact O-N 3.43Å; D83-R85 VanDerWaalsContact C-N 3.31Å; D83-R85 PolarHBondContact O-N 3.43Å; R85-T89 PolarHBondContact O-N 3.18Å; R85-T89 VanDerWaalsContact O-N 3.13Å; R85-T89 PolarHBondContact O-OG1 2.79Å |
| 86 | T | 86.8 | Confident | 73.6 | Confident | 57 Ų | 57 | 107.5 Ų | 107.5 | 35% | 0.35 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.9 | -48.8 | 177.2 | -60.7 | 0 | 0 | 0 | 0 | 111.2 | S82 D83 L84 Q88 T89 F90 | S82-T86 PolarHBondContact O-N 2.96Å; S82-T86 PolarHBondContact O-OG1 3.23Å; D83-T86 WeakPolarHBondContact O-CB 3.48Å; D83-T86 PolarHBondContact O-N 3.1Å; D83-T86 VanDerWaalsContact O-N 3.11Å; L84-T86 VanDerWaalsContact C-N 3.32Å; L84-T86 PolarHBondContact O-N 2.86Å; T86-Q88 PolarHBondContact O-N 3.46Å; T86-T89 WeakPolarHBondContact O-CB 3.18Å; T86-T89 PolarHBondContact O-N 3.36Å; T86-T89 VanDerWaalsContact O-N 3.07Å; T86-F90 HydrophobicContact CG2-CD2 3.94Å; T86-F90 HydrophobicContact CG2-CE2 3.56Å; T86-F90 WeakPolarHBondContact O-CD2 3.38Å; T86-F90 PolarHBondContact O-N 2.89Å; T86-F90 VanDerWaalsContact O-N 3.09Å |
| 87 | I | 87.7 | Confident | 73.3 | Confident | 87 Ų | 87 | 108.2 Ų | 108.2 | 45% | 0.446 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -58.5 | -46.9 | 175.7 | -64.9 | 161.5 | 0 | 0 | 0 | 110.6 | D83 T89 F90 V91 | D83-I87 WeakPolarHBondContact O-CD1 3.47Å; D83-I87 VanDerWaalsContact O-CG1 3.23Å; D83-I87 WeakPolarHBondContact O-CG1 3.44Å; D83-I87 PolarHBondContact O-N 3.09Å; I87-T89 PolarHBondContact O-N 3.09Å; I87-F90 PolarHBondContact O-N 2.86Å; I87-V91 HydrophobicContact CG2-CG2 4.38Å; I87-V91 WeakPolarHBondContact O-CG2 3.47Å; I87-V91 PolarHBondContact O-N 3.33Å |
| 88 | Q | 84.4 | Confident | 73.3 | Confident | 122 Ų | 122 | 106 Ų | 106 | 57% | 0.57 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.1 | -34.8 | 176.5 | -77.8 | -160.6 | 23.6 | 0 | 0 | 112.8 | L84 T86 K92 | L84-Q88 WeakPolarHBondContact O-CB 3.23Å; L84-Q88 WeakPolarHBondContact O-CG 3.34Å; L84-Q88 PolarHBondContact O-N 2.98Å; T86-Q88 PolarHBondContact O-N 3.46Å; Q88-K92 WeakPolarHBondContact O-CB 3.41Å; Q88-K92 VanDerWaalsContact O-CG 3.3Å; Q88-K92 WeakPolarHBondContact O-CG 3.4Å; Q88-K92 PolarHBondContact O-N 3.31Å |
| 89 | T | 83.9 | Confident | 73.3 | Confident | 74 Ų | 74 | 108.2 Ų | 108.2 | 45% | 0.454 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.7 | -43.4 | 178.5 | -56.9 | 0 | 0 | 0 | 0 | 111.1 | R85 T86 I87 K93 | R85-T89 PolarHBondContact O-N 3.18Å; R85-T89 VanDerWaalsContact O-N 3.13Å; R85-T89 PolarHBondContact O-OG1 2.79Å; T86-T89 WeakPolarHBondContact O-CB 3.18Å; T86-T89 PolarHBondContact O-N 3.36Å; T86-T89 VanDerWaalsContact O-N 3.07Å; I87-T89 PolarHBondContact O-N 3.09Å; T89-K93 VanDerWaalsContact O-CB 3.27Å; T89-K93 WeakPolarHBondContact O-CB 3.28Å; T89-K93 PolarHBondContact O-N 3.23Å |
| 90 | F | 84.7 | Confident | 73.1 | Confident | 140 Ų | 140 | 112.6 Ų | 112.6 | 61% | 0.614 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.4 | -41.9 | 175.1 | -73.9 | -67.5 | 0 | 0 | 0 | 112.5 | T86 I87 K93 A94 | T86-F90 HydrophobicContact CG2-CD2 3.94Å; T86-F90 HydrophobicContact CG2-CE2 3.56Å; T86-F90 WeakPolarHBondContact O-CD2 3.38Å; T86-F90 PolarHBondContact O-N 2.89Å; T86-F90 VanDerWaalsContact O-N 3.09Å; I87-F90 PolarHBondContact O-N 2.86Å; F90-K93 PolarHBondContact O-N 3.16Å; F90-A94 WeakPolarHBondContact O-CB 3.26Å; F90-A94 PolarHBondContact O-N 2.99Å |
| 91 | V | 84.9 | Confident | 72.7 | Confident | 82 Ų | 82 | 114.1 Ų | 114.1 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.2 | -44.5 | 176.6 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | I87 A94 K95 | I87-V91 HydrophobicContact CG2-CG2 4.38Å; I87-V91 WeakPolarHBondContact O-CG2 3.47Å; I87-V91 PolarHBondContact O-N 3.33Å; V91-A94 PolarHBondContact O-N 3.4Å; V91-K95 HydrophobicContact CG1-CD 4.33Å; V91-K95 WeakPolarHBondContact O-CG 3.43Å; V91-K95 PolarHBondContact O-N 3.31Å; V91-K95 VanDerWaalsContact O-N 3.1Å |
| 92 | K | 75.4 | Confident | 71.9 | Confident | 143 Ų | 143 | 113.8 Ų | 113.8 | 62% | 0.622 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.2 | -39.8 | 176.1 | -75.5 | 171.9 | 69.7 | 171.7 | 0 | 111.9 | Q88 K95 S96 | Q88-K92 WeakPolarHBondContact O-CB 3.41Å; Q88-K92 VanDerWaalsContact O-CG 3.3Å; Q88-K92 WeakPolarHBondContact O-CG 3.4Å; Q88-K92 PolarHBondContact O-N 3.31Å; K92-K95 PolarHBondContact O-N 3.19Å; K92-S96 VanDerWaalsContact O-CB 3.27Å; K92-S96 WeakPolarHBondContact O-CB 3.36Å; K92-S96 PolarHBondContact O-N 3.34Å |
| 93 | K | 77.6 | Confident | 70.6 | Confident | 139 Ų | 139 | 117.7 Ų | 117.7 | 60% | 0.604 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -64.3 | -40.4 | 177.4 | -172 | 168 | 177.9 | -179.5 | 0 | 111.7 | T89 F90 S96 S97 | T89-K93 VanDerWaalsContact O-CB 3.27Å; T89-K93 WeakPolarHBondContact O-CB 3.28Å; T89-K93 PolarHBondContact O-N 3.23Å; F90-K93 PolarHBondContact O-N 3.16Å; K93-S96 PolarHBondContact O-N 2.94Å; K93-S97 PolarHBondContact O-N 3.47Å |
| 94 | A | 70.4 | Confident | 68.9 | Low | 70 Ų | 70 | 117.6 Ų | 117.6 | 58% | 0.579 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.2 | -43.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | F90 V91 S97 | F90-A94 WeakPolarHBondContact O-CB 3.26Å; F90-A94 PolarHBondContact O-N 2.99Å; V91-A94 PolarHBondContact O-N 3.4Å; A94-S97 WeakPolarHBondContact O-CB 3.33Å; A94-S97 PolarHBondContact O-N 2.83Å |
| 95 | K | 63.1 | Low | 66.8 | Low | 162 Ų | 162 | 115.4 Ų | 115.4 | 70% | 0.704 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68.6 | -35.5 | 177.1 | -68.3 | 178.5 | 72.8 | 165.6 | 0 | 112.8 | V91 K92 | V91-K95 HydrophobicContact CG1-CD 4.33Å; V91-K95 WeakPolarHBondContact O-CG 3.43Å; V91-K95 PolarHBondContact O-N 3.31Å; V91-K95 VanDerWaalsContact O-N 3.1Å; K92-K95 PolarHBondContact O-N 3.19Å |
| 96 | S | 56.8 | Low | 65.4 | Low | 58 Ų | 58 | 112.9 Ų | 112.9 | 41% | 0.406 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -70.9 | -31.9 | 176.1 | 179.4 | 0 | 0 | 0 | 0 | 112.7 | K92 K93 K98 R99 R100 | K92-S96 VanDerWaalsContact O-CB 3.27Å; K92-S96 WeakPolarHBondContact O-CB 3.36Å; K92-S96 PolarHBondContact O-N 3.34Å; K93-S96 PolarHBondContact O-N 2.94Å; S96-K98 PolarHBondContact O-N 3.16Å; S96-R99 PolarHBondContact O-N 2.93Å; S96-R100 PolarHBondContact O-N 3.37Å |
| 97 | S | 56.3 | Low | 63 | Low | 75 Ų | 75 | 117.1 Ų | 117.1 | 52% | 0.524 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -56.1 | -33.5 | 175.9 | -163.8 | 0 | 0 | 0 | 0 | 112.7 | K93 A94 R99 A101 | K93-S97 PolarHBondContact O-N 3.47Å; A94-S97 WeakPolarHBondContact O-CB 3.33Å; A94-S97 PolarHBondContact O-N 2.83Å; S97-R99 PolarHBondContact O-N 3.09Å; S97-A101 PolarHBondContact O-N 3.49Å |
| 98 | K | 57.1 | Low | 61.1 | Low | 171 Ų | 171 | 121.2 Ų | 121.2 | 74% | 0.743 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.9 | -27.5 | 177.8 | -168.5 | 151.8 | -173.9 | 162.1 | 0 | 113.5 | S96 | S96-K98 PolarHBondContact O-N 3.16Å |
| 99 | R | 56.4 | Low | 59.4 | Low | 190 Ų | 190 | 121 Ų | 121 | 72% | 0.717 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -81 | -28.7 | 177.1 | -78.1 | -170.3 | 138.2 | -109.9 | -3.1 | 113.5 | S96 S97 A101 A102 Q103 | S96-R99 PolarHBondContact O-N 2.93Å; S97-R99 PolarHBondContact O-N 3.09Å; R99-A101 VanDerWaalsContact C-N 3.34Å; R99-A102 PolarHBondContact O-N 3.44Å; R99-Q103 PolarHBondContact O-N 3.46Å |
| 100 | R | 55.3 | Low | 57.3 | Low | 185 Ų | 185 | 120.2 Ų | 120.2 | 70% | 0.698 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -72.4 | -27.4 | 173.8 | -75.6 | -161.4 | -79.5 | -155 | -2.4 | 113.2 | S96 A102 | S96-R100 PolarHBondContact O-N 3.37Å; R100-A102 VanDerWaalsContact C-N 3.32Å |
| 101 | A | 53.2 | Low | 55.7 | Low | 84 Ų | 84 | 119.8 Ų | 119.8 | 69% | 0.694 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -21.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S97 R99 | S97-A101 PolarHBondContact O-N 3.49Å; R99-A101 VanDerWaalsContact C-N 3.34Å |
| 102 | A | 53.5 | Low | 53.9 | Low | 86 Ų | 86 | 121.1 Ų | 121.1 | 71% | 0.711 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | -6.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | R99 R100 | R99-A102 PolarHBondContact O-N 3.44Å; R100-A102 VanDerWaalsContact C-N 3.32Å |
| 103 | Q | 47.4 | Very low | 52.4 | Low | 162 Ų | 162 | 124.9 Ų | 124.9 | 76% | 0.757 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -102.1 | 10.4 | 177 | -86.7 | -110.1 | 58.9 | 0 | 0 | 113.4 | R99 G105 | R99-Q103 PolarHBondContact O-N 3.46Å; Q103-G105 PolarHBondContact O-N 2.96Å |
| 104 | A | 44.3 | Very low | 51.2 | Low | 91 Ų | 91 | 122.3 Ų | 122.3 | 75% | 0.752 | 71% | 0.706 | S | S | * | * | trans | -94.6 | 68.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 105 | G | 39.7 | Very low | 50.1 | Low | 60 Ų | 60 | 123.7 Ų | 123.7 | 62% | 0.619 | 71% | 0.707 | S | S | * | * | trans | -98.3 | 157.1 | 164 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q103 | Q103-G105 PolarHBondContact O-N 2.96Š| ||
| 106 | P | 54.4 | Low | 49.4 | Very low | 133 Ų | 133 | 124.2 Ų | 124.2 | 86% | 0.864 | 71% | 0.71 | S | S | * | * | trans | -86.6 | 125.4 | -150.8 | 33.2 | -32.8 | 0 | 0 | 0 | 113.3 | ||||
| 107 | T | 37.7 | Very low | 49.1 | Very low | 145 Ų | 145 | 127.3 Ų | 127.3 | 89% | 0.89 | 73% | 0.731 | S | S | * | * | trans | -145.9 | 117.5 | 157.3 | -40 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 108 | Q | 47.6 | Very low | 48.8 | Very low | 174 Ų | 174 | 134 Ų | 134 | 81% | 0.813 | 75% | 0.745 | S | S | * | * | trans | -69.2 | -179.2 | 173.7 | -71.1 | -82.8 | -32.3 | 0 | 0 | 111.5 | ||||
| 109 | P | 47.6 | Very low | 48.7 | Very low | 117 Ų | 117 | 134 Ų | 134 | 76% | 0.76 | 75% | 0.752 | S | S | * | * | cis | -125.4 | 128.7 | -38.9 | 30.6 | -12.8 | 0 | 0 | 0 | 110.7 | ||||
| 110 | G | 39.1 | Very low | 48.5 | Very low | 57 Ų | 57 | 133 Ų | 133 | 59% | 0.588 | 76% | 0.756 | S | S | * | * | trans | -154.2 | 161.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 106.4 | P112 | G110-P112 VanDerWaalsContact C-CD 3.44Å; G110-P112 WeakPolarHBondContact O-CD 3.41Å | ||
| 111 | P | 51.4 | Low | 48.5 | Very low | 131 Ų | 131 | 127.9 Ų | 127.9 | 85% | 0.851 | 75% | 0.753 | S | S | * | * | trans | -91.1 | 93.4 | -179.1 | 32.9 | -28.3 | 0 | 0 | 0 | 110.5 | R113 | P111-R113 PolarHBondContact O-N 3.2Š| ||
| 112 | P | 47.9 | Very low | 48.7 | Very low | 111 Ų | 111 | 128.4 Ų | 128.4 | 72% | 0.721 | 75% | 0.749 | S | S | * | * | trans | -76.7 | 109.7 | 149.7 | 32.4 | -27.7 | 0 | 0 | 0 | 105.3 | G110 S114 | G110-P112 VanDerWaalsContact C-CD 3.44Å; G110-P112 WeakPolarHBondContact O-CD 3.41Å; P112-S114 PolarHBondContact O-N 3.46Å | ||
| 113 | R | 44.4 | Very low | 49.5 | Very low | 221 Ų | 221 | 129.9 Ų | 129.9 | 83% | 0.834 | 75% | 0.745 | S | S | * | * | trans | -63.6 | 83.8 | 160.4 | -97.7 | 169.7 | 60.3 | 110.6 | -5.3 | 107.2 | P111 T115 | P111-R113 PolarHBondContact O-N 3.2Å; R113-T115 PolarHBondContact O-N 2.67Å | ||
| 114 | S | 50.9 | Low | 50.3 | Low | 86 Ų | 86 | 126.4 Ų | 126.4 | 60% | 0.601 | 74% | 0.739 | S | S | * | * | trans | -62.4 | 84.2 | 154.3 | 173.9 | 0 | 0 | 0 | 0 | 106.3 | P112 F116 | P112-S114 PolarHBondContact O-N 3.46Å; S114-F116 VanDerWaalsContact C-N 3.3Å; S114-F116 PolarHBondContact O-N 3.09Å | ||
| 115 | T | 47.6 | Very low | 51.4 | Low | 98 Ų | 98 | 125 Ų | 125 | 60% | 0.601 | 73% | 0.727 | S | S | * | * | trans | -77.8 | 101 | 148.8 | 54.2 | 0 | 0 | 0 | 0 | 104.1 | R113 S117 | R113-T115 PolarHBondContact O-N 2.67Å; T115-S117 PolarHBondContact O-N 3.05Å; T115-S117 VanDerWaalsContact O-N 3.14Å | ||
| 116 | F | 48.1 | Very low | 52.7 | Low | 174 Ų | 174 | 125.2 Ų | 125.2 | 76% | 0.763 | 72% | 0.716 | S | S | * | * | trans | -27.1 | 124.7 | 145.7 | -66 | -94.5 | 0 | 0 | 0 | 107.3 | S114 R118 | S114-F116 VanDerWaalsContact C-N 3.3Å; S114-F116 PolarHBondContact O-N 3.09Å; F116-R118 PolarHBondContact O-N 2.78Å | ||
| 117 | S | 52.3 | Low | 53.6 | Low | 123 Ų | 123 | 122.8 Ų | 122.8 | 86% | 0.86 | 70% | 0.696 | S | S | * | * | trans | -65.2 | 69.8 | 166.8 | -59.2 | 0 | 0 | 0 | 0 | 107.6 | T115 L119 | T115-S117 PolarHBondContact O-N 3.05Å; T115-S117 VanDerWaalsContact O-N 3.14Å; S117-L119 PolarHBondContact O-N 3.07Å; S117-L119 VanDerWaalsContact O-N 3.08Å | ||
| 118 | R | 48.5 | Very low | 55.4 | Low | 214 Ų | 214 | 121.6 Ų | 121.6 | 81% | 0.808 | 68% | 0.684 | S | S | * | * | trans | -49.7 | 112.4 | 150.5 | 173.9 | 175.5 | -70.9 | -121.5 | -1.1 | 102.3 | F116 Q120 | F116-R118 PolarHBondContact O-N 2.78Å; R118-Q120 PolarHBondContact O-N 3.41Å | ||
| 119 | L | 55.1 | Low | 56.5 | Low | 172 Ų | 172 | 120.4 Ų | 120.4 | 90% | 0.901 | 68% | 0.678 | S | S | * | * | trans | -48.9 | 91.5 | 166.9 | -65 | 162.8 | 0 | 0 | 0 | 105.9 | S117 A121 | S117-L119 PolarHBondContact O-N 3.07Å; S117-L119 VanDerWaalsContact O-N 3.08Å; L119-A121 VanDerWaalsContact C-N 3.3Å; L119-A121 PolarHBondContact O-N 2.85Å | ||
| 120 | Q | 52.3 | Low | 57.7 | Low | 170 Ų | 170 | 123.5 Ų | 123.5 | 79% | 0.794 | 68% | 0.679 | S | S | * | * | trans | -68.1 | 105.2 | 164.5 | -91.2 | -169.2 | -35.4 | 0 | 0 | 102.9 | R118 | R118-Q120 PolarHBondContact O-N 3.41Š| ||
| 121 | A | 54.8 | Low | 59.3 | Low | 77 Ų | 77 | 127.1 Ų | 127.1 | 64% | 0.636 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 124.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 106.1 | L119 D123 | L119-A121 VanDerWaalsContact C-N 3.3Å; L119-A121 PolarHBondContact O-N 2.85Å; A121-D123 PolarHBondContact O-N 3.27Å |
| 122 | P | 57.9 | Low | 60.4 | Low | 95 Ų | 95 | 129.1 Ų | 129.1 | 62% | 0.617 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 120.1 | 179.1 | 20.9 | -29.4 | 0 | 0 | 0 | 107.6 | S124 | P122-S124 PolarHBondContact O-N 3.02Å; P122-S124 VanDerWaalsContact O-N 3.16Å |
| 123 | D | 69.6 | Low | 61.3 | Low | 117 Ų | 117 | 130.4 Ų | 130.4 | 63% | 0.626 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 125 | 178.7 | -69.8 | -47.9 | 0 | 0 | 0 | 107.5 | A121 A125 T126 | A121-D123 PolarHBondContact O-N 3.27Å; D123-A125 PolarHBondContact O-N 3.21Å; D123-T126 HydrophobicContact CB-CG2 4.49Å; D123-T126 PolarHBondContact O-N 3.43Å; D123-T126 PolarHBondContact O-OG1 3.36Å |
| 124 | S | 65.6 | Low | 62.3 | Low | 88 Ų | 88 | 129.5 Ų | 129.5 | 62% | 0.615 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -54.3 | -25.9 | -173.7 | 52.9 | 0 | 0 | 0 | 0 | 112.7 | P122 T126 L127 L128 | P122-S124 PolarHBondContact O-N 3.02Å; P122-S124 VanDerWaalsContact O-N 3.16Å; S124-T126 PolarHBondContact O-N 2.95Å; S124-L127 PolarHBondContact O-N 2.93Å; S124-L128 WeakPolarHBondContact O-CB 3.41Å; S124-L128 VanDerWaalsContact O-CG 3.27Å; S124-L128 WeakPolarHBondContact O-CG 3.38Å; S124-L128 PolarHBondContact O-N 2.87Å |
| 125 | A | 66.6 | Low | 62.8 | Low | 61 Ų | 61 | 132 Ų | 132 | 50% | 0.504 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -56.9 | -44 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | D123 L127 L128 E129 | D123-A125 PolarHBondContact O-N 3.21Å; A125-L127 VanDerWaalsContact C-N 3.31Å; A125-L127 PolarHBondContact O-N 3.41Å; A125-L128 PolarHBondContact O-N 3.37Å; A125-E129 PolarHBondContact O-N 2.95Å |
| 126 | T | 67.2 | Low | 63.4 | Low | 65 Ų | 65 | 132.1 Ų | 132.1 | 40% | 0.399 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -71.8 | -28.2 | 178.8 | 67 | 0 | 0 | 0 | 0 | 112.4 | D123 S124 K130 | D123-T126 HydrophobicContact CB-CG2 4.49Å; D123-T126 PolarHBondContact O-N 3.43Å; D123-T126 PolarHBondContact O-OG1 3.36Å; S124-T126 PolarHBondContact O-N 2.95Å; T126-K130 WeakPolarHBondContact O-CB 3.43Å; T126-K130 VanDerWaalsContact O-CG 3.28Å; T126-K130 WeakPolarHBondContact O-CG 3.26Å; T126-K130 PolarHBondContact O-N 3.15Å; T126-K130 VanDerWaalsContact O-N 3.15Å |
| 127 | L | 74.2 | Confident | 63.7 | Low | 83 Ų | 83 | 130.4 Ų | 130.4 | 44% | 0.435 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -74.9 | -43.1 | 177.1 | -148.3 | 169.9 | 0 | 0 | 0 | 110 | S124 A125 K130 M131 | S124-L127 PolarHBondContact O-N 2.93Å; A125-L127 VanDerWaalsContact C-N 3.31Å; A125-L127 PolarHBondContact O-N 3.41Å; L127-K130 PolarHBondContact O-N 2.85Å; L127-M131 HydrophobicContact CD2-CG 3.84Å; L127-M131 HydrophobicContact CD2-SD 3.33Å; L127-M131 WeakPolarHBondContact CD2-SD 3.28Å; L127-M131 WeakPolarHBondContact O-CB 3.46Å; L127-M131 WeakPolarHBondContact O-CG 3.22Å; L127-M131 PolarHBondContact O-N 2.88Å |
| 128 | L | 74.2 | Confident | 63.8 | Low | 120 Ų | 120 | 133.4 Ų | 133.4 | 63% | 0.628 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -63.7 | -40.1 | 173.8 | -69.6 | 169.1 | 0 | 0 | 0 | 112 | S124 A125 K130 M131 K132 | S124-L128 WeakPolarHBondContact O-CB 3.41Å; S124-L128 VanDerWaalsContact O-CG 3.27Å; S124-L128 WeakPolarHBondContact O-CG 3.38Å; S124-L128 PolarHBondContact O-N 2.87Å; A125-L128 PolarHBondContact O-N 3.37Å; L128-K130 VanDerWaalsContact C-N 3.33Å; L128-K130 PolarHBondContact O-N 3.44Å; L128-M131 PolarHBondContact O-N 3.23Å; L128-K132 PolarHBondContact O-N 2.96Å |
| 129 | E | 71.9 | Confident | 63.8 | Low | 149 Ų | 149 | 129.4 Ų | 129.4 | 70% | 0.696 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -59.8 | -42.1 | 171.8 | -90.3 | -163.8 | 147 | 0 | 0 | 112.3 | A125 M131 K132 | A125-E129 PolarHBondContact O-N 2.95Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.99Å; E129-K132 WeakPolarHBondContact O-CB 3.24Å; E129-K132 PolarHBondContact O-N 3.15Å |
| 130 | K | 73 | Confident | 63.8 | Low | 181 Ų | 181 | 129 Ų | 129 | 79% | 0.787 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -73.1 | -24.5 | 178.8 | -74.7 | 172.8 | 64.9 | -171 | 0 | 113.5 | T126 L127 L128 | T126-K130 WeakPolarHBondContact O-CB 3.43Å; T126-K130 VanDerWaalsContact O-CG 3.28Å; T126-K130 WeakPolarHBondContact O-CG 3.26Å; T126-K130 PolarHBondContact O-N 3.15Å; T126-K130 VanDerWaalsContact O-N 3.15Å; L127-K130 PolarHBondContact O-N 2.85Å; L128-K130 VanDerWaalsContact C-N 3.33Å; L128-K130 PolarHBondContact O-N 3.44Å |
| 131 | M | 71.6 | Confident | 63.5 | Low | 134 Ų | 134 | 127.8 Ų | 127.8 | 66% | 0.66 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -89.3 | -8.4 | 175.9 | -69.7 | -177.2 | 86.4 | 0 | 0 | 113 | L127 L128 E129 L133 | L127-M131 HydrophobicContact CD2-CG 3.84Å; L127-M131 HydrophobicContact CD2-SD 3.33Å; L127-M131 WeakPolarHBondContact CD2-SD 3.28Å; L127-M131 WeakPolarHBondContact O-CB 3.46Å; L127-M131 WeakPolarHBondContact O-CG 3.22Å; L127-M131 PolarHBondContact O-N 2.88Å; L128-M131 PolarHBondContact O-N 3.23Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.99Å; M131-L133 VanDerWaalsContact C-N 3.32Å; M131-L133 PolarHBondContact O-N 3.09Å |
| 132 | K | 74.6 | Confident | 62.9 | Low | 172 Ų | 172 | 126.9 Ų | 126.9 | 75% | 0.748 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -65.2 | 98 | 166.2 | -119.4 | -177.7 | 162.4 | -178.5 | 0 | 107.2 | L128 E129 | L128-K132 PolarHBondContact O-N 2.96Å; E129-K132 WeakPolarHBondContact O-CB 3.24Å; E129-K132 PolarHBondContact O-N 3.15Å |
| 133 | L | 67.1 | Low | 62.3 | Low | 139 Ų | 139 | 128.3 Ų | 128.3 | 73% | 0.728 | 69% | 0.687 | S | S | * | * | trans | -53.3 | 149.2 | 166.9 | -66 | 174.6 | 0 | 0 | 0 | 107.5 | M131 D135 | M131-L133 VanDerWaalsContact C-N 3.32Å; M131-L133 PolarHBondContact O-N 3.09Å; L133-D135 PolarHBondContact O-N 3.25Å | ||
| 134 | K | 64.4 | Low | 61.3 | Low | 201 Ų | 201 | 132.1 Ų | 132.1 | 87% | 0.874 | 70% | 0.697 | S | S | * | * | trans | -63.4 | 72 | 176.9 | -81.2 | -173.2 | 159.5 | -164.3 | 0 | 110 | S136 | K134-S136 PolarHBondContact O-N 2.73Š| ||
| 135 | D | 63.2 | Low | 60 | Low | 140 Ų | 140 | 135 Ų | 135 | 75% | 0.749 | 71% | 0.711 | S | S | * | * | trans | -76.8 | 10.5 | 171.8 | -71.6 | -60.4 | 0 | 0 | 0 | 111.8 | L133 | L133-D135 PolarHBondContact O-N 3.25Š| ||
| 136 | S | 58.7 | Low | 58.7 | Low | 99 Ų | 99 | 136.3 Ų | 136.3 | 69% | 0.692 | 72% | 0.722 | S | S | * | * | trans | -99.5 | 35.2 | 173.5 | -143.3 | 0 | 0 | 0 | 0 | 112.2 | K134 F138 | K134-S136 PolarHBondContact O-N 2.73Å; S136-F138 VanDerWaalsContact C-N 3.33Å | ||
| 137 | L | 55.9 | Low | 57.9 | Low | 138 Ų | 138 | 137.7 Ų | 137.7 | 72% | 0.723 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -83.1 | -12.9 | 169.1 | -172.7 | 57.3 | 0 | 0 | 0 | 112.2 | ||
| 138 | F | 52.7 | Low | 56.5 | Low | 187 Ų | 187 | 139.9 Ų | 139.9 | 82% | 0.82 | 75% | 0.754 | S | S | * | * | trans | -110.5 | 26.6 | -179.9 | -67.6 | -74.2 | 0 | 0 | 0 | 114.5 | S136 L140 | S136-F138 VanDerWaalsContact C-N 3.33Å; F138-L140 PolarHBondContact O-N 3.12Å | ||
| 139 | D | 50.2 | Low | 54.8 | Low | 129 Ų | 129 | 143 Ų | 143 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | trans | -91.8 | 65.6 | 162.6 | -152.7 | 47.7 | 0 | 0 | 0 | 108.9 | D141 | D139-D141 VanDerWaalsContact C-N 3.27Å; D139-D141 PolarHBondContact O-N 3.27Å | ||
| 140 | L | 54.1 | Low | 53.7 | Low | 165 Ų | 165 | 141.2 Ų | 141.2 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | trans | -82.1 | 80.9 | 161.3 | -72.6 | -179.3 | 0 | 0 | 0 | 107.5 | F138 | F138-L140 PolarHBondContact O-N 3.12Š| ||
| 141 | D | 46.7 | Very low | 52.6 | Low | 144 Ų | 144 | 138 Ų | 138 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | trans | -122.3 | 124.1 | 153.4 | -161.6 | -116.5 | 0 | 0 | 0 | 108.5 | D139 | D139-D141 VanDerWaalsContact C-N 3.27Å; D139-D141 PolarHBondContact O-N 3.27Å | ||
| 142 | G | 42.3 | Very low | 51.5 | Low | 58 Ų | 58 | 137.6 Ų | 137.6 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | trans | -69.1 | -174.6 | -169 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 143 | P | 45.6 | Very low | 49.6 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 81% | 0.812 | 78% | 0.775 | S | S | * | * | -151.9 | 156.6 | 68.5 | 37.6 | -17 | 0 | 0 | 0 | 117.3 | |||||
| 144 | K | 47.4 | Very low | 48.9 | Very low | 196 Ų | 196 | 133.4 Ų | 133.4 | 85% | 0.852 | 78% | 0.78 | S | S | * | * | trans | 64.3 | 100.3 | 134.7 | -168.2 | 178.8 | -173.3 | 171.1 | 0 | 118.6 | ||||
| 145 | V | 39.5 | Very low | 48.1 | Very low | 148 Ų | 148 | 128.8 Ų | 128.8 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | trans | -133.8 | 114.9 | 137.1 | -65 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 146 | A | 39.2 | Very low | 47.3 | Very low | 90 Ų | 90 | 129.1 Ų | 129.1 | 74% | 0.744 | 78% | 0.781 | S | S | * | * | trans | 19.3 | 113.8 | 154.8 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 147 | S | 49.4 | Very low | 46.5 | Very low | 94 Ų | 94 | 130.3 Ų | 130.3 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | trans | -56.3 | 150.3 | 145.2 | -44.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 148 | P | 44.4 | Very low | 46.6 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | -120.6 | 114.2 | 129.9 | 30.9 | -18.6 | 0 | 0 | 0 | 109.1 | |||||
| 149 | F | 38.8 | Very low | 46.3 | Very low | 185 Ų | 185 | 130.4 Ų | 130.4 | 81% | 0.811 | 81% | 0.81 | S | S | * | * | trans | -56.8 | 174.6 | 170.3 | -76.6 | -89.1 | 0 | 0 | 0 | 113 | ||||
| 150 | P | 49.8 | Very low | 46.1 | Very low | 112 Ų | 112 | 130.5 Ų | 130.5 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | cis | -130.1 | 170.4 | -8.9 | 22 | 2 | 0 | 0 | 0 | 114.3 | ||||
| 151 | S | 49.9 | Very low | 45.7 | Very low | 114 Ų | 114 | 128.6 Ų | 128.6 | 80% | 0.797 | 81% | 0.814 | S | S | * | * | trans | -54.8 | 157.2 | 170.2 | -40.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 152 | P | 47.3 | Very low | 45.6 | Very low | 124 Ų | 124 | 127.6 Ų | 127.6 | 81% | 0.805 | 82% | 0.817 | S | S | * | * | trans | -121.4 | 112.5 | 133.9 | 33.1 | -20.9 | 0 | 0 | 0 | 108.1 | ||||
| 153 | C | 35.8 | Very low | 45.8 | Very low | 123 Ų | 123 | 132 Ų | 132 | 83% | 0.831 | 83% | 0.83 | S | S | * | * | 104.6 | 124.6 | 85.9 | -148.8 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 154 | A | 51.8 | Low | 45.9 | Very low | 101 Ų | 101 | 132.5 Ų | 132.5 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | trans | -61 | 147.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 155 | A | 48.2 | Very low | 45.7 | Very low | 104 Ų | 104 | 127.9 Ų | 127.9 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | trans | -151.2 | 116.9 | 149.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 156 | N | 46.5 | Very low | 46.2 | Very low | 146 Ų | 146 | 126.4 Ų | 126.4 | 78% | 0.781 | 83% | 0.825 | S | S | * | * | trans | -58 | 155.8 | 175.2 | -111.8 | -44 | 0 | 0 | 0 | 114.9 | ||||
| 157 | T | 40.7 | Very low | 46.8 | Very low | 124 Ų | 124 | 129.4 Ų | 129.4 | 76% | 0.761 | 83% | 0.832 | S | S | * | * | trans | 70.2 | 163.1 | 138 | 48.5 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 158 | P | 59.3 | Low | 46.6 | Very low | 197 Ų | 197 | 132.6 Ų | 132.6 | 100% | 1.279 | 85% | 0.848 | S | S | * | * | cis | -108.1 | 0 | -13.9 | 36.6 | -28.8 | 0 | 0 | 0 | 114.7 |
Retrieved 158 of 158 residues in 86.4 ms
(Link to these results)