| 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 | 51.3 | Low | 52.7 | Low | 246 Ų | 246 | 138.2 Ų | 138.2 | 100% | 1.212 | 82% | 0.819 | S | S | * | * | 0 | 139.6 | 0 | -59.4 | 167.5 | 177.9 | 0 | 0 | 107.3 | |||||
| 2 | A | 56.1 | Low | 51.6 | Low | 91 Ų | 91 | 135.1 Ų | 135.1 | 75% | 0.752 | 81% | 0.809 | S | S | * | * | cis | -165.9 | 128.3 | -26.8 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 3 | E | 53 | Low | 51.4 | Low | 197 Ų | 197 | 137.7 Ų | 137.7 | 92% | 0.921 | 82% | 0.816 | S | S | * | * | trans | -75.2 | 143.2 | -178.2 | -59.7 | 179.9 | 148.7 | 0 | 0 | 110.9 | ||||
| 4 | T | 56.7 | Low | 51.1 | Low | 128 Ų | 128 | 138.1 Ų | 138.1 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | trans | -139.6 | 119.2 | 172.6 | 57.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 5 | S | 57 | Low | 50.4 | Low | 106 Ų | 106 | 136.6 Ų | 136.6 | 74% | 0.741 | 82% | 0.819 | S | S | * | * | trans | 51.3 | 90.7 | 148.8 | -161.9 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 6 | S | 47.9 | Very low | 50.5 | Low | 107 Ų | 107 | 133.2 Ų | 133.2 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | 48.3 | 104 | 79.1 | 81.6 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 7 | G | 52.6 | Low | 50.3 | Low | 79 Ų | 79 | 132.6 Ų | 132.6 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | -115.3 | 61.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112 | M9 | G7-M9 PolarHBondContact O-N 3.16Š| ||
| 8 | S | 46.9 | Very low | 50.4 | Low | 114 Ų | 114 | 130.9 Ų | 130.9 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -83.6 | 92.2 | 179.8 | -177.2 | 0 | 0 | 0 | 0 | 111.1 | N10 | S8-N10 PolarHBondContact O-N 3.38Š| ||
| 9 | M | 58.3 | Low | 50.9 | Low | 175 Ų | 175 | 128.3 Ų | 128.3 | 86% | 0.862 | 80% | 0.804 | S | S | * | * | trans | -84.9 | 102.7 | 173.6 | -70.6 | -176.1 | 108.8 | 0 | 0 | 111.4 | G7 | G7-M9 PolarHBondContact O-N 3.16Š| ||
| 10 | N | 49.6 | Very low | 51.6 | Low | 114 Ų | 114 | 128 Ų | 128 | 61% | 0.61 | 80% | 0.804 | S | S | * | * | trans | 49 | 111.4 | 141.7 | -63.9 | -15.3 | 0 | 0 | 0 | 118.4 | S8 | S8-N10 PolarHBondContact O-N 3.38Š| ||
| 11 | Q | 50.4 | Low | 52.1 | Low | 163 Ų | 163 | 126.1 Ų | 126.1 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | 60 | 92.7 | 87.4 | -66.6 | 176.5 | 90.5 | 0 | 0 | 110.9 | |||||
| 12 | S | 39.9 | Very low | 53.3 | Low | 101 Ų | 101 | 117.7 Ų | 117.7 | 71% | 0.706 | 75% | 0.749 | S | S | * | * | 68.3 | 100.1 | 77.4 | 74.4 | 0 | 0 | 0 | 0 | 113 | |||||
| 13 | D | 49.2 | Very low | 54.5 | Low | 169 Ų | 169 | 119.3 Ų | 119.3 | 90% | 0.904 | 75% | 0.745 | S | S | * | * | trans | -142.1 | 126.1 | 156.5 | -114.9 | -37.3 | 0 | 0 | 0 | 109.7 | ||||
| 14 | V | 46.1 | Very low | 56.1 | Low | 143 Ų | 143 | 118 Ų | 118 | 87% | 0.867 | 74% | 0.736 | S | S | * | * | trans | -103.6 | 113.1 | -177.7 | 173.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 15 | S | 41.5 | Very low | 57.4 | Low | 116 Ų | 116 | 115.7 Ų | 115.7 | 81% | 0.811 | 72% | 0.716 | S | S | * | * | trans | -156.3 | 138 | 168.1 | -152.5 | 0 | 0 | 0 | 0 | 116 | ||||
| 16 | A | 51.2 | Low | 58.7 | Low | 82 Ų | 82 | 115.8 Ų | 115.8 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | trans | 57.4 | 128.6 | 160.2 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 17 | P | 47.2 | Very low | 60.4 | Low | 124 Ų | 124 | 117.8 Ų | 117.8 | 81% | 0.805 | 70% | 0.695 | S | S | * | * | trans | -64.5 | 143.8 | 161 | 30.9 | -33.9 | 0 | 0 | 0 | 109.4 | A19 | P17-A19 PolarHBondContact O-N 2.98Š| ||
| 18 | A | 52.3 | Low | 62.1 | Low | 102 Ų | 102 | 122.4 Ų | 122.4 | 84% | 0.843 | 69% | 0.688 | S | S | * | * | trans | -56.4 | 111.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 19 | A | 59.5 | Low | 64 | Low | 80 Ų | 80 | 119 Ų | 119 | 66% | 0.661 | 66% | 0.66 | S | S | * | * | trans | -53.8 | 135 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109 | P17 M21 | P17-A19 PolarHBondContact O-N 2.98Å; A19-M21 PolarHBondContact O-N 2.98Å | ||
| 20 | P | 64.4 | Low | 65.5 | Low | 122 Ų | 122 | 116.2 Ų | 116.2 | 79% | 0.792 | 65% | 0.648 | S | S | * | * | trans | -66.6 | 97.1 | -171.7 | 25.9 | -34.2 | 0 | 0 | 0 | 110 | T22 | P20-T22 PolarHBondContact O-N 3.01Š| ||
| 21 | M | 63.5 | Low | 67.2 | Low | 90 Ų | 90 | 117 Ų | 117 | 44% | 0.443 | 65% | 0.646 | S | S | . | * | trans | -43.8 | 127.3 | -176.1 | -62.6 | -180 | 80.2 | 0 | 0 | 109.8 | A19 E25 K26 E29 | A19-M21 PolarHBondContact O-N 2.98Å; M21-E25 WeakPolarHBondContact CA-OE2 3.39Å; M21-E25 HydrophobicContact CB-CB 4.17Å; M21-E25 HydrophobicContact CE-CB 4.13Å; M21-K26 HydrophobicContact CB-CG 3.96Å; M21-K26 WeakPolarHBondContact O-CE 3.3Å; M21-K26 PolarHBondContact O-NZ 2.58Å; M21-E29 HydrophobicContact CE-CB 4.28Å | ||
| 22 | T | 76 | Confident | 69 | Low | 68 Ų | 68 | 114.8 Ų | 114.8 | 42% | 0.417 | 63% | 0.634 | S | S | . | * | trans | -59.7 | 152.2 | -178.3 | 76.4 | 0 | 0 | 0 | 0 | 109 | P20 K24 E25 K26 | P20-T22 PolarHBondContact O-N 3.01Å; T22-K24 PolarHBondContact O-N 2.99Å; T22-E25 WeakPolarHBondContact CB-OE1 3.11Å; T22-E25 WeakPolarHBondContact CG2-OE1 3.19Å; T22-E25 PolarHBondContact N-OE2 3.05Å; T22-E25 WeakPolarHBondContact O-CA 3.49Å; T22-E25 WeakPolarHBondContact O-CB 3.49Å; T22-E25 PolarHBondContact O-N 2.79Å; T22-E25 PolarHBondContact OG1-N 3.24Å; T22-E25 PolarHBondContact OG1-OE1 2.84Å; T22-K26 PolarHBondContact O-N 3.48Å | ||
| 23 | N | 81.6 | Confident | 71.2 | Confident | 125 Ų | 125 | 117.6 Ų | 117.6 | 67% | 0.668 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -60.1 | -21.8 | -179.2 | -67.1 | -11.6 | 0 | 0 | 0 | 112 | K26 Y27 | N23-K26 PolarHBondContact OD1-NZ 2.89Å; N23-Y27 WeakPolarHBondContact O-CB 3.37Å; N23-Y27 PolarHBondContact O-N 3.44Å; N23-Y27 VanDerWaalsContact O-N 3.16Å |
| 24 | K | 85.3 | Confident | 73.1 | Confident | 171 Ų | 171 | 116 Ų | 116 | 74% | 0.743 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -70.1 | -42.4 | 168.9 | -63.2 | -179.6 | 179.4 | 178.3 | 0 | 112.6 | T22 R28 | T22-K24 PolarHBondContact O-N 2.99Å; K24-R28 VanDerWaalsContact O-CG 3.3Å; K24-R28 WeakPolarHBondContact O-CG 3.44Å; K24-R28 PolarHBondContact O-N 2.95Å |
| 25 | E | 84.5 | Confident | 74.8 | Confident | 78 Ų | 78 | 117 Ų | 117 | 36% | 0.364 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.1 | -43.7 | 172.5 | -75.7 | 124.6 | -121.5 | 0 | 0 | 112.5 | M21 T22 Y27 R28 E29 | M21-E25 WeakPolarHBondContact CA-OE2 3.39Å; M21-E25 HydrophobicContact CB-CB 4.17Å; M21-E25 HydrophobicContact CE-CB 4.13Å; T22-E25 WeakPolarHBondContact CB-OE1 3.11Å; T22-E25 WeakPolarHBondContact CG2-OE1 3.19Å; T22-E25 PolarHBondContact N-OE2 3.05Å; T22-E25 WeakPolarHBondContact O-CA 3.49Å; T22-E25 WeakPolarHBondContact O-CB 3.49Å; T22-E25 PolarHBondContact O-N 2.79Å; T22-E25 PolarHBondContact OG1-N 3.24Å; T22-E25 PolarHBondContact OG1-OE1 2.84Å; E25-Y27 VanDerWaalsContact C-N 3.27Å; E25-Y27 PolarHBondContact O-N 3.34Å; E25-R28 PolarHBondContact O-N 2.83Å; E25-R28 VanDerWaalsContact O-N 3.09Å; E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 PolarHBondContact O-N 2.91Å |
| 26 | K | 83.9 | Confident | 76.8 | Confident | 108 Ų | 108 | 117.6 Ų | 117.6 | 47% | 0.47 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -54.6 | -45.7 | 175.3 | -67.3 | 176.5 | -175.1 | 150 | 0 | 111 | M21 T22 N23 E29 L30 | M21-K26 HydrophobicContact CB-CG 3.96Å; M21-K26 WeakPolarHBondContact O-CE 3.3Å; M21-K26 PolarHBondContact O-NZ 2.58Å; T22-K26 PolarHBondContact O-N 3.48Å; N23-K26 PolarHBondContact OD1-NZ 2.89Å; K26-E29 PolarHBondContact O-N 2.99Å; K26-L30 VanDerWaalsContact O-CB 3.3Å; K26-L30 WeakPolarHBondContact O-CB 3.4Å; K26-L30 PolarHBondContact O-N 3.42Å |
| 27 | Y | 85 | Confident | 78.5 | Confident | 149 Ų | 149 | 118.2 Ų | 118.2 | 58% | 0.584 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -65 | -42.5 | 174.8 | 177 | -114.9 | 0 | 0 | 0 | 113.1 | N23 E25 E29 K31 | N23-Y27 WeakPolarHBondContact O-CB 3.37Å; N23-Y27 PolarHBondContact O-N 3.44Å; N23-Y27 VanDerWaalsContact O-N 3.16Å; E25-Y27 VanDerWaalsContact C-N 3.27Å; E25-Y27 PolarHBondContact O-N 3.34Å; Y27-E29 VanDerWaalsContact C-N 3.33Å; Y27-E29 PolarHBondContact O-N 3.16Å; Y27-K31 VanDerWaalsContact O-CB 3.24Å; Y27-K31 WeakPolarHBondContact O-CB 3.3Å; Y27-K31 PolarHBondContact O-N 2.82Å |
| 28 | R | 88.4 | Confident | 80.1 | Confident | 176 Ų | 176 | 115.1 Ų | 115.1 | 66% | 0.664 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61.1 | -41.6 | 175.5 | -74.1 | 173.3 | 77.7 | -162.6 | 6.1 | 111.9 | K24 E25 K31 K32 | K24-R28 VanDerWaalsContact O-CG 3.3Å; K24-R28 WeakPolarHBondContact O-CG 3.44Å; K24-R28 PolarHBondContact O-N 2.95Å; E25-R28 PolarHBondContact O-N 2.83Å; E25-R28 VanDerWaalsContact O-N 3.09Å; R28-K31 PolarHBondContact O-N 3.24Å; R28-K32 WeakPolarHBondContact O-CG 3.48Å; R28-K32 PolarHBondContact O-N 3.12Å; R28-K32 VanDerWaalsContact O-N 3.09Å |
| 29 | E | 86.8 | Confident | 81.7 | Confident | 44 Ų | 44 | 117.7 Ų | 117.7 | 21% | 0.206 | 55% | 0.554 | C | S | . | * | H | α-helix | trans | -70.7 | -45.8 | 179.3 | -178.8 | 57.2 | -161.3 | 0 | 0 | 111.6 | M21 E25 K26 Y27 K31 K32 R33 | M21-E29 HydrophobicContact CE-CB 4.28Å; E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 PolarHBondContact O-N 2.91Å; K26-E29 PolarHBondContact O-N 2.99Å; Y27-E29 VanDerWaalsContact C-N 3.33Å; Y27-E29 PolarHBondContact O-N 3.16Å; E29-K31 VanDerWaalsContact C-N 3.27Å; E29-K31 PolarHBondContact O-N 2.98Å; E29-K32 WeakPolarHBondContact O-CB 3.3Å; E29-K32 PolarHBondContact O-N 2.97Å; E29-K32 VanDerWaalsContact O-N 3.11Å; E29-K32 WeakPolarHBondContact OE2-CE 3.48Å; E29-K32 IonicContact OE2-NZ 2.69Å; E29-K32 PolarHBondContact OE2-NZ 3.09Å; E29-R33 WeakPolarHBondContact O-CG 3.24Å; E29-R33 PolarHBondContact O-N 3.37Å; E29-R33 IonicContact OE1-CZ 3.34Å; E29-R33 IonicContact OE1-NE 2.8Å; E29-R33 PolarHBondContact OE1-NE 2.97Å; E29-R33 IonicContact OE1-NH2 2.97Å; E29-R33 PolarHBondContact OE1-NH2 3.49Å |
| 30 | L | 89.4 | Confident | 82.7 | Confident | 115 Ų | 115 | 118.1 Ų | 118.1 | 60% | 0.602 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -58 | -40.2 | 172.6 | -176.1 | 61.3 | 0 | 0 | 0 | 111.5 | K26 K32 R33 F34 | K26-L30 VanDerWaalsContact O-CB 3.3Å; K26-L30 WeakPolarHBondContact O-CB 3.4Å; K26-L30 PolarHBondContact O-N 3.42Å; L30-K32 PolarHBondContact O-N 2.8Å; L30-R33 PolarHBondContact O-N 2.84Å; L30-F34 WeakPolarHBondContact O-CB 3.46Å; L30-F34 PolarHBondContact O-N 3.11Å |
| 31 | K | 85 | Confident | 83.4 | Confident | 131 Ų | 131 | 116.3 Ų | 116.3 | 57% | 0.57 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.7 | -34.2 | 175.7 | -174.7 | 168.6 | -178.1 | 169.4 | 0 | 113.3 | Y27 R28 E29 K35 | Y27-K31 VanDerWaalsContact O-CB 3.24Å; Y27-K31 WeakPolarHBondContact O-CB 3.3Å; Y27-K31 PolarHBondContact O-N 2.82Å; R28-K31 PolarHBondContact O-N 3.24Å; E29-K31 VanDerWaalsContact C-N 3.27Å; E29-K31 PolarHBondContact O-N 2.98Å; K31-K35 PolarHBondContact O-N 3.34Å |
| 32 | K | 88.2 | Confident | 84.1 | Confident | 116 Ų | 116 | 115.7 Ų | 115.7 | 50% | 0.504 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.1 | -52 | 169.7 | -65.9 | -179.7 | -149.7 | 152.8 | 0 | 110.7 | R28 E29 L30 F34 K35 F36 | R28-K32 WeakPolarHBondContact O-CG 3.48Å; R28-K32 PolarHBondContact O-N 3.12Å; R28-K32 VanDerWaalsContact O-N 3.09Å; E29-K32 WeakPolarHBondContact O-CB 3.3Å; E29-K32 PolarHBondContact O-N 2.97Å; E29-K32 VanDerWaalsContact O-N 3.11Å; E29-K32 WeakPolarHBondContact OE2-CE 3.48Å; E29-K32 IonicContact OE2-NZ 2.69Å; E29-K32 PolarHBondContact OE2-NZ 3.09Å; L30-K32 PolarHBondContact O-N 2.8Å; K32-F34 VanDerWaalsContact C-N 3.3Å; K32-F34 PolarHBondContact O-N 3.09Å; K32-K35 WeakPolarHBondContact O-CA 3.34Å; K32-K35 WeakPolarHBondContact O-CB 3.44Å; K32-K35 PolarHBondContact O-N 2.75Å; K32-F36 VanDerWaalsContact O-CD2 3.24Å; K32-F36 WeakPolarHBondContact O-CD2 3.44Å; K32-F36 PolarHBondContact O-N 3.49Å |
| 33 | R | 86 | Confident | 84.2 | Confident | 160 Ų | 160 | 118.1 Ų | 118.1 | 60% | 0.604 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.7 | -40.7 | -177.7 | -68.4 | -180 | -171 | -154.1 | -1 | 111.7 | E29 L30 K35 F36 L37 | E29-R33 WeakPolarHBondContact O-CG 3.24Å; E29-R33 PolarHBondContact O-N 3.37Å; E29-R33 IonicContact OE1-CZ 3.34Å; E29-R33 IonicContact OE1-NE 2.8Å; E29-R33 PolarHBondContact OE1-NE 2.97Å; E29-R33 IonicContact OE1-NH2 2.97Å; E29-R33 PolarHBondContact OE1-NH2 3.49Å; L30-R33 PolarHBondContact O-N 2.84Å; R33-K35 PolarHBondContact O-N 3.3Å; R33-F36 PolarHBondContact O-N 2.88Å; R33-L37 WeakPolarHBondContact O-CB 3.47Å; R33-L37 PolarHBondContact O-N 3.45Å |
| 34 | F | 88.3 | Confident | 84.1 | Confident | 137 Ų | 137 | 119.4 Ų | 119.4 | 60% | 0.601 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.5 | -41.7 | 172.7 | -175.8 | -101.9 | 0 | 0 | 0 | 112.4 | L30 K32 F36 L37 V38 | L30-F34 WeakPolarHBondContact O-CB 3.46Å; L30-F34 PolarHBondContact O-N 3.11Å; K32-F34 VanDerWaalsContact C-N 3.3Å; K32-F34 PolarHBondContact O-N 3.09Å; F34-F36 VanDerWaalsContact C-N 3.34Å; F34-F36 PolarHBondContact O-N 3.45Å; F34-L37 PolarHBondContact O-N 2.95Å; F34-V38 HydrophobicContact CD1-CG2 4.3Å; F34-V38 HydrophobicContact CE1-CG2 3.89Å; F34-V38 HydrophobicContact CE2-CG2 4.22Å; F34-V38 HydrophobicContact CZ-CG2 3.85Å; F34-V38 WeakPolarHBondContact O-CG2 3.36Å; F34-V38 PolarHBondContact O-N 3.26Å |
| 35 | K | 82.9 | Confident | 83.9 | Confident | 164 Ų | 164 | 113.6 Ų | 113.6 | 71% | 0.713 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.5 | -41.2 | 174.5 | -172 | -174.6 | 176.3 | -172.3 | 0 | 112.1 | K31 K32 R33 Y39 | K31-K35 PolarHBondContact O-N 3.34Å; K32-K35 WeakPolarHBondContact O-CA 3.34Å; K32-K35 WeakPolarHBondContact O-CB 3.44Å; K32-K35 PolarHBondContact O-N 2.75Å; R33-K35 PolarHBondContact O-N 3.3Å; K35-Y39 PolarHBondContact O-N 3.38Å; K35-Y39 VanDerWaalsContact O-N 3.14Å |
| 36 | F | 83.3 | Confident | 83.8 | Confident | 127 Ų | 127 | 113.1 Ų | 113.1 | 56% | 0.557 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.2 | -48.2 | 174.6 | -73.7 | -67.6 | 0 | 0 | 0 | 111.9 | K32 R33 F34 V38 Y39 E40 | K32-F36 VanDerWaalsContact O-CD2 3.24Å; K32-F36 WeakPolarHBondContact O-CD2 3.44Å; K32-F36 PolarHBondContact O-N 3.49Å; R33-F36 PolarHBondContact O-N 2.88Å; F34-F36 VanDerWaalsContact C-N 3.34Å; F34-F36 PolarHBondContact O-N 3.45Å; F36-V38 VanDerWaalsContact C-N 3.27Å; F36-V38 PolarHBondContact O-N 3.34Å; F36-Y39 CarbonylContact O-C 3.54Å; F36-Y39 WeakPolarHBondContact O-CA 3.33Å; F36-Y39 WeakPolarHBondContact O-CB 3.4Å; F36-Y39 PolarHBondContact O-N 3.31Å; F36-E40 WeakPolarHBondContact O-CG 3.47Å; F36-E40 PolarHBondContact O-N 3Å |
| 37 | L | 86.3 | Confident | 83.8 | Confident | 95 Ų | 95 | 110.9 Ų | 110.9 | 50% | 0.497 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.6 | -35.7 | 179.7 | -175.8 | 65.3 | 0 | 0 | 0 | 112.9 | R33 F34 N41 | R33-L37 WeakPolarHBondContact O-CB 3.47Å; R33-L37 PolarHBondContact O-N 3.45Å; F34-L37 PolarHBondContact O-N 2.95Å; L37-N41 WeakPolarHBondContact O-CB 3.38Å; L37-N41 PolarHBondContact O-N 3.29Å |
| 38 | V | 82 | Confident | 83.5 | Confident | 60 Ų | 60 | 109.3 Ų | 109.3 | 36% | 0.364 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.2 | -46.8 | 171.7 | 170.2 | 0 | 0 | 0 | 0 | 110.9 | F34 F36 E40 N41 E42 | F34-V38 HydrophobicContact CD1-CG2 4.3Å; F34-V38 HydrophobicContact CE1-CG2 3.89Å; F34-V38 HydrophobicContact CE2-CG2 4.22Å; F34-V38 HydrophobicContact CZ-CG2 3.85Å; F34-V38 WeakPolarHBondContact O-CG2 3.36Å; F34-V38 PolarHBondContact O-N 3.26Å; F36-V38 VanDerWaalsContact C-N 3.27Å; F36-V38 PolarHBondContact O-N 3.34Å; V38-E40 PolarHBondContact O-N 2.83Å; V38-N41 PolarHBondContact O-N 2.8Å; V38-E42 WeakPolarHBondContact O-CG 3.24Å; V38-E42 PolarHBondContact O-N 3.26Å |
| 39 | Y | 85.9 | Confident | 82.9 | Confident | 156 Ų | 156 | 104.8 Ų | 104.8 | 61% | 0.612 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.1 | -43.8 | 177.5 | 174.1 | -99.7 | 0 | 0 | 0 | 112.4 | K35 F36 E42 F43 | K35-Y39 PolarHBondContact O-N 3.38Å; K35-Y39 VanDerWaalsContact O-N 3.14Å; F36-Y39 CarbonylContact O-C 3.54Å; F36-Y39 WeakPolarHBondContact O-CA 3.33Å; F36-Y39 WeakPolarHBondContact O-CB 3.4Å; F36-Y39 PolarHBondContact O-N 3.31Å; Y39-E42 PolarHBondContact O-N 3.25Å; Y39-F43 WeakPolarHBondContact O-CB 3.47Å; Y39-F43 PolarHBondContact O-N 3Å |
| 40 | E | 79.8 | Confident | 82.5 | Confident | 88 Ų | 88 | 104.8 Ų | 104.8 | 41% | 0.411 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 174.8 | -71.9 | 169 | 175.4 | 0 | 0 | 111.4 | F36 V38 F43 Y44 | F36-E40 WeakPolarHBondContact O-CG 3.47Å; F36-E40 PolarHBondContact O-N 3Å; V38-E40 PolarHBondContact O-N 2.83Å; E40-F43 PolarHBondContact O-N 3.46Å; E40-Y44 HydrophobicContact CB-CD2 4.44Å; E40-Y44 HydrophobicContact CB-CE2 4.18Å; E40-Y44 WeakPolarHBondContact O-CD2 3.17Å; E40-Y44 PolarHBondContact O-N 3.02Å |
| 41 | N | 79.3 | Confident | 82.1 | Confident | 84 Ų | 84 | 103.8 Ų | 103.8 | 45% | 0.449 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.7 | -49 | 175.2 | -113.5 | -92.3 | 0 | 0 | 0 | 112.5 | L37 V38 F43 Y44 Q45 | L37-N41 WeakPolarHBondContact O-CB 3.38Å; L37-N41 PolarHBondContact O-N 3.29Å; V38-N41 PolarHBondContact O-N 2.8Å; N41-F43 VanDerWaalsContact C-N 3.29Å; N41-F43 PolarHBondContact O-N 3.5Å; N41-Y44 PolarHBondContact O-N 2.97Å; N41-Q45 WeakPolarHBondContact O-CB 3.4Å; N41-Q45 VanDerWaalsContact O-CG 3.22Å; N41-Q45 WeakPolarHBondContact O-CG 3.33Å; N41-Q45 PolarHBondContact O-N 3.21Å; N41-Q45 PolarHBondContact O-NE2 3Å |
| 42 | E | 77.7 | Confident | 81.7 | Confident | 78 Ų | 78 | 101.7 Ų | 101.7 | 36% | 0.364 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.1 | -36.9 | 178.2 | -61.1 | -67.5 | 98.5 | 0 | 0 | 111.4 | V38 Y39 Q45 E46 R87 | V38-E42 WeakPolarHBondContact O-CG 3.24Å; V38-E42 PolarHBondContact O-N 3.26Å; Y39-E42 PolarHBondContact O-N 3.25Å; E42-Q45 PolarHBondContact O-N 3.47Å; E42-E46 PolarHBondContact O-N 3.23Å; E42-R87 IonicContact OE1-CZ 3.5Å; E42-R87 IonicContact OE1-NE 3.4Å; E42-R87 IonicContact OE1-NH2 2.95Å; E42-R87 PolarHBondContact OE1-NH2 3.15Å; E42-R87 IonicContact OE2-NH2 2.75Å; E42-R87 PolarHBondContact OE2-NH2 3.37Å |
| 43 | F | 79.6 | Confident | 81 | Confident | 119 Ų | 119 | 100.9 Ų | 100.9 | 52% | 0.522 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65 | -47.2 | 176.3 | -176.9 | -95.2 | 0 | 0 | 0 | 112.2 | Y39 E40 N41 Q45 E46 E47 | Y39-F43 WeakPolarHBondContact O-CB 3.47Å; Y39-F43 PolarHBondContact O-N 3Å; E40-F43 PolarHBondContact O-N 3.46Å; N41-F43 VanDerWaalsContact C-N 3.29Å; N41-F43 PolarHBondContact O-N 3.5Å; F43-Q45 VanDerWaalsContact C-N 3.33Å; F43-Q45 PolarHBondContact O-N 3.03Å; F43-E46 PolarHBondContact O-N 2.85Å; F43-E47 PolarHBondContact O-N 3.25Å |
| 44 | Y | 79.2 | Confident | 80.5 | Confident | 151 Ų | 151 | 98.1 Ų | 98.1 | 59% | 0.592 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -63.5 | -38.3 | 174.8 | -70.9 | -55.6 | 0 | 0 | 0 | 112 | E40 N41 L48 | E40-Y44 HydrophobicContact CB-CD2 4.44Å; E40-Y44 HydrophobicContact CB-CE2 4.18Å; E40-Y44 WeakPolarHBondContact O-CD2 3.17Å; E40-Y44 PolarHBondContact O-N 3.02Å; N41-Y44 PolarHBondContact O-N 2.97Å; Y44-L48 VanDerWaalsContact O-CB 3.28Å; Y44-L48 WeakPolarHBondContact O-CB 3.38Å; Y44-L48 VanDerWaalsContact O-CG 3.23Å; Y44-L48 WeakPolarHBondContact O-CG 3.22Å; Y44-L48 PolarHBondContact O-N 3.02Å |
| 45 | Q | 80.8 | Confident | 79.9 | Confident | 49 Ų | 49 | 97.4 Ų | 97.4 | 23% | 0.229 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 174.9 | -72.3 | 170 | 45.9 | 0 | 0 | 112.2 | N41 E42 F43 R49 F83 | N41-Q45 WeakPolarHBondContact O-CB 3.4Å; N41-Q45 VanDerWaalsContact O-CG 3.22Å; N41-Q45 WeakPolarHBondContact O-CG 3.33Å; N41-Q45 PolarHBondContact O-N 3.21Å; N41-Q45 PolarHBondContact O-NE2 3Å; E42-Q45 PolarHBondContact O-N 3.47Å; F43-Q45 VanDerWaalsContact C-N 3.33Å; F43-Q45 PolarHBondContact O-N 3.03Å; Q45-R49 VanDerWaalsContact O-CB 3.25Å; Q45-R49 WeakPolarHBondContact O-CB 3.44Å; Q45-R49 PolarHBondContact O-N 2.95Å; Q45-F83 VanDerWaalsContact OE1-CE2 3.22Å |
| 46 | E | 81.2 | Confident | 78.9 | Confident | 69 Ų | 69 | 92.3 Ų | 92.3 | 32% | 0.322 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -71.5 | -37.2 | 177.4 | -177.2 | 57.6 | -161.5 | 0 | 0 | 112.4 | E42 F43 R49 N50 R53 | E42-E46 PolarHBondContact O-N 3.23Å; F43-E46 PolarHBondContact O-N 2.85Å; E46-R49 CarbonylContact O-C 3.59Å; E46-R49 WeakPolarHBondContact O-CB 3.43Å; E46-R49 PolarHBondContact O-N 3.47Å; E46-R49 WeakPolarHBondContact OE2-CD 3.32Å; E46-R49 IonicContact OE2-CZ 3.73Å; E46-R49 IonicContact OE2-NE 2.72Å; E46-R49 IonicContact OE2-NH1 3.97Å; E46-R49 PolarHBondContact OE2-NH1 3.41Å; E46-N50 PolarHBondContact O-N 3.37Å; E46-R53 VanDerWaalsContact CD-NH2 3.33Å; E46-R53 IonicContact OE1-CZ 2.68Å; E46-R53 IonicContact OE1-NH1 3.56Å; E46-R53 PolarHBondContact OE1-NH1 3.41Å; E46-R53 IonicContact OE1-NH2 2.65Å; E46-R53 PolarHBondContact OE1-NH2 3.38Å; E46-R53 IonicContact OE2-NH2 3.96Å |
| 47 | E | 84.3 | Confident | 77.9 | Confident | 60 Ų | 60 | 92.7 Ų | 92.7 | 28% | 0.28 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -74.8 | -33.2 | 175.8 | -168.1 | 53 | -146.3 | 0 | 0 | 112.6 | F43 R49 N50 L51 K54 | F43-E47 PolarHBondContact O-N 3.25Å; E47-R49 VanDerWaalsContact C-N 3.31Å; E47-R49 PolarHBondContact O-N 3.42Å; E47-N50 CarbonylContact O-C 3.58Å; E47-N50 WeakPolarHBondContact O-CB 3.01Å; E47-N50 PolarHBondContact O-N 2.93Å; E47-N50 VanDerWaalsContact O-N 3.17Å; E47-N50 WeakPolarHBondContact OE2-CB 3.23Å; E47-N50 PolarHBondContact OE2-ND2 3.34Å; E47-L51 HydrophobicContact CG-CD1 4.34Å; E47-L51 HydrophobicContact CG-CG 4.43Å; E47-L51 WeakPolarHBondContact O-CB 3.41Å; E47-L51 WeakPolarHBondContact O-CG 3.43Å; E47-L51 PolarHBondContact O-N 2.99Å; E47-K54 IonicContact OE1-NZ 3.61Å; E47-K54 PolarHBondContact OE1-NZ 3.14Å; E47-K54 IonicContact OE2-NZ 3.87Å |
| 48 | L | 78.5 | Confident | 76.6 | Confident | 116 Ų | 116 | 93.8 Ų | 93.8 | 61% | 0.607 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -60.1 | -42.7 | 166.2 | -75.9 | 170.3 | 0 | 0 | 0 | 110.9 | Y44 N50 L51 Q52 | Y44-L48 VanDerWaalsContact O-CB 3.28Å; Y44-L48 WeakPolarHBondContact O-CB 3.38Å; Y44-L48 VanDerWaalsContact O-CG 3.23Å; Y44-L48 WeakPolarHBondContact O-CG 3.22Å; Y44-L48 PolarHBondContact O-N 3.02Å; L48-N50 VanDerWaalsContact C-N 3.32Å; L48-N50 PolarHBondContact O-N 3.24Å; L48-L51 PolarHBondContact O-N 3.35Å; L48-Q52 VanDerWaalsContact O-CB 3.29Å; L48-Q52 WeakPolarHBondContact O-CB 3.28Å; L48-Q52 PolarHBondContact O-N 2.88Å |
| 49 | R | 77.1 | Confident | 75.5 | Confident | 81 Ų | 81 | 93.1 Ų | 93.1 | 31% | 0.306 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64 | -34.8 | 174 | -166.3 | -175.3 | -67.1 | 138.1 | -3.2 | 111.6 | Q45 E46 E47 R53 | Q45-R49 VanDerWaalsContact O-CB 3.25Å; Q45-R49 WeakPolarHBondContact O-CB 3.44Å; Q45-R49 PolarHBondContact O-N 2.95Å; E46-R49 CarbonylContact O-C 3.59Å; E46-R49 WeakPolarHBondContact O-CB 3.43Å; E46-R49 PolarHBondContact O-N 3.47Å; E46-R49 WeakPolarHBondContact OE2-CD 3.32Å; E46-R49 IonicContact OE2-CZ 3.73Å; E46-R49 IonicContact OE2-NE 2.72Å; E46-R49 IonicContact OE2-NH1 3.97Å; E46-R49 PolarHBondContact OE2-NH1 3.41Å; E47-R49 VanDerWaalsContact C-N 3.31Å; E47-R49 PolarHBondContact O-N 3.42Å; R49-R53 WeakPolarHBondContact O-CB 3.48Å; R49-R53 VanDerWaalsContact O-CG 3.3Å; R49-R53 WeakPolarHBondContact O-CG 3.47Å; R49-R53 PolarHBondContact O-N 3.29Å; R49-R53 PolarHBondContact O-NE 2.92Å |
| 50 | N | 77.1 | Confident | 74.2 | Confident | 44 Ų | 44 | 91.4 Ų | 91.4 | 24% | 0.235 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -67.6 | -48.4 | 172.5 | -81.5 | -32.3 | 0 | 0 | 0 | 111.6 | E46 E47 L48 R53 K54 | E46-N50 PolarHBondContact O-N 3.37Å; E47-N50 CarbonylContact O-C 3.58Å; E47-N50 WeakPolarHBondContact O-CB 3.01Å; E47-N50 PolarHBondContact O-N 2.93Å; E47-N50 VanDerWaalsContact O-N 3.17Å; E47-N50 WeakPolarHBondContact OE2-CB 3.23Å; E47-N50 PolarHBondContact OE2-ND2 3.34Å; L48-N50 VanDerWaalsContact C-N 3.32Å; L48-N50 PolarHBondContact O-N 3.24Å; N50-R53 CarbonylContact O-C 3.5Å; N50-R53 PolarHBondContact O-N 2.87Å; N50-R53 VanDerWaalsContact OD1-CZ 3.24Å; N50-R53 PolarHBondContact OD1-NH2 3.44Å; N50-K54 WeakPolarHBondContact O-CB 3.35Å; N50-K54 WeakPolarHBondContact O-CD 3.39Å; N50-K54 WeakPolarHBondContact O-CG 3.38Å; N50-K54 PolarHBondContact O-N 3.05Å |
| 51 | L | 80.9 | Confident | 73.1 | Confident | 94 Ų | 94 | 93.3 Ų | 93.3 | 49% | 0.492 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 178.2 | -70.4 | 168.8 | 0 | 0 | 0 | 111.5 | E47 L48 K54 L55 | E47-L51 HydrophobicContact CG-CD1 4.34Å; E47-L51 HydrophobicContact CG-CG 4.43Å; E47-L51 WeakPolarHBondContact O-CB 3.41Å; E47-L51 WeakPolarHBondContact O-CG 3.43Å; E47-L51 PolarHBondContact O-N 2.99Å; L48-L51 PolarHBondContact O-N 3.35Å; L51-K54 HydrophobicContact CD2-CD 4.2Å; L51-K54 PolarHBondContact O-N 3.26Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 PolarHBondContact O-N 2.95Å |
| 52 | Q | 76.8 | Confident | 72.1 | Confident | 87 Ų | 87 | 99.6 Ų | 99.6 | 41% | 0.407 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 171.8 | -172.1 | 178.9 | 4.5 | 0 | 0 | 111.4 | L48 L55 M56 | L48-Q52 VanDerWaalsContact O-CB 3.29Å; L48-Q52 WeakPolarHBondContact O-CB 3.28Å; L48-Q52 PolarHBondContact O-N 2.88Å; Q52-L55 PolarHBondContact O-N 2.72Å; Q52-M56 HydrophobicContact CG-SD 4.08Å; Q52-M56 WeakPolarHBondContact O-CB 3.44Å; Q52-M56 VanDerWaalsContact O-CG 3.25Å; Q52-M56 WeakPolarHBondContact O-CG 3.43Å; Q52-M56 PolarHBondContact O-N 3.43Å |
| 53 | R | 73.2 | Confident | 71.2 | Confident | 100 Ų | 100 | 102.8 Ų | 102.8 | 38% | 0.377 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | 173.8 | -79.7 | 173.2 | -72.1 | -176.2 | -7.9 | 112.6 | E46 R49 N50 M56 K57 | E46-R53 VanDerWaalsContact CD-NH2 3.33Å; E46-R53 IonicContact OE1-CZ 2.68Å; E46-R53 IonicContact OE1-NH1 3.56Å; E46-R53 PolarHBondContact OE1-NH1 3.41Å; E46-R53 IonicContact OE1-NH2 2.65Å; E46-R53 PolarHBondContact OE1-NH2 3.38Å; E46-R53 IonicContact OE2-NH2 3.96Å; R49-R53 WeakPolarHBondContact O-CB 3.48Å; R49-R53 VanDerWaalsContact O-CG 3.3Å; R49-R53 WeakPolarHBondContact O-CG 3.47Å; R49-R53 PolarHBondContact O-N 3.29Å; R49-R53 PolarHBondContact O-NE 2.92Å; N50-R53 CarbonylContact O-C 3.5Å; N50-R53 PolarHBondContact O-N 2.87Å; N50-R53 VanDerWaalsContact OD1-CZ 3.24Å; N50-R53 PolarHBondContact OD1-NH2 3.44Å; R53-M56 PolarHBondContact O-N 2.87Å; R53-K57 WeakPolarHBondContact O-CG 3.42Å; R53-K57 PolarHBondContact O-N 3.24Å |
| 54 | K | 77.2 | Confident | 69.9 | Low | 102 Ų | 102 | 107.2 Ų | 107.2 | 44% | 0.443 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.1 | -47.4 | 177.2 | -70.6 | 159.8 | -174.1 | 171.8 | 0 | 110.5 | E47 N50 L51 K57 L58 | E47-K54 IonicContact OE1-NZ 3.61Å; E47-K54 PolarHBondContact OE1-NZ 3.14Å; E47-K54 IonicContact OE2-NZ 3.87Å; N50-K54 WeakPolarHBondContact O-CB 3.35Å; N50-K54 WeakPolarHBondContact O-CD 3.39Å; N50-K54 WeakPolarHBondContact O-CG 3.38Å; N50-K54 PolarHBondContact O-N 3.05Å; L51-K54 HydrophobicContact CD2-CD 4.2Å; L51-K54 PolarHBondContact O-N 3.26Å; K54-K57 PolarHBondContact O-N 3.49Å; K54-L58 WeakPolarHBondContact O-CG 3.43Å; K54-L58 PolarHBondContact O-N 3.37Å |
| 55 | L | 73.9 | Confident | 68.7 | Low | 121 Ų | 121 | 106.8 Ų | 106.8 | 63% | 0.634 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.1 | -41 | 177 | -177.9 | 63.1 | 0 | 0 | 0 | 112.5 | L51 Q52 K57 L58 S59 | L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 PolarHBondContact O-N 2.95Å; Q52-L55 PolarHBondContact O-N 2.72Å; L55-K57 VanDerWaalsContact C-N 3.33Å; L55-K57 PolarHBondContact O-N 3.43Å; L55-L58 PolarHBondContact O-N 2.9Å; L55-S59 WeakPolarHBondContact O-CB 3.32Å; L55-S59 PolarHBondContact O-N 2.99Å |
| 56 | M | 63.1 | Low | 67.6 | Low | 57 Ų | 57 | 112 Ų | 112 | 28% | 0.281 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.1 | -33.1 | 175.2 | -73.6 | 176.8 | 74.8 | 0 | 0 | 112.4 | Q52 R53 R60 | Q52-M56 HydrophobicContact CG-SD 4.08Å; Q52-M56 WeakPolarHBondContact O-CB 3.44Å; Q52-M56 VanDerWaalsContact O-CG 3.25Å; Q52-M56 WeakPolarHBondContact O-CG 3.43Å; Q52-M56 PolarHBondContact O-N 3.43Å; R53-M56 PolarHBondContact O-N 2.87Å; M56-R60 WeakPolarHBondContact O-CD 3.29Å; M56-R60 WeakPolarHBondContact O-CG 3.19Å; M56-R60 PolarHBondContact O-N 2.88Å |
| 57 | K | 63 | Low | 66.7 | Low | 136 Ų | 136 | 114.8 Ų | 114.8 | 59% | 0.591 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.5 | -54.1 | 170.2 | -73.9 | 175.1 | 177.4 | -170.7 | 0 | 111.2 | R53 K54 L55 S59 R60 D61 | R53-K57 WeakPolarHBondContact O-CG 3.42Å; R53-K57 PolarHBondContact O-N 3.24Å; K54-K57 PolarHBondContact O-N 3.49Å; L55-K57 VanDerWaalsContact C-N 3.33Å; L55-K57 PolarHBondContact O-N 3.43Å; K57-S59 PolarHBondContact O-N 3.46Å; K57-S59 VanDerWaalsContact O-N 3.13Å; K57-R60 WeakPolarHBondContact O-CA 3.25Å; K57-R60 WeakPolarHBondContact O-CB 3.4Å; K57-R60 PolarHBondContact O-N 2.93Å; K57-D61 PolarHBondContact O-N 2.91Å; K57-D61 VanDerWaalsContact O-N 3.11Å |
| 58 | L | 58.8 | Low | 65.6 | Low | 117 Ų | 117 | 115.7 Ų | 115.7 | 61% | 0.613 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -59.4 | -27.7 | 178 | -67.6 | 170.3 | 0 | 0 | 0 | 113.5 | K54 L55 | K54-L58 WeakPolarHBondContact O-CG 3.43Å; K54-L58 PolarHBondContact O-N 3.37Å; L55-L58 PolarHBondContact O-N 2.9Å |
| 59 | S | 59.1 | Low | 64.8 | Low | 47 Ų | 47 | 113.1 Ų | 113.1 | 33% | 0.329 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -82 | -15.3 | 172.2 | -176.3 | 0 | 0 | 0 | 0 | 114.3 | L55 K57 K63 | L55-S59 WeakPolarHBondContact O-CB 3.32Å; L55-S59 PolarHBondContact O-N 2.99Å; K57-S59 PolarHBondContact O-N 3.46Å; K57-S59 VanDerWaalsContact O-N 3.13Å; S59-K63 WeakPolarHBondContact O-CD 3.35Å; S59-K63 PolarHBondContact OG-NZ 3.44Å |
| 60 | R | 57.3 | Low | 64.2 | Low | 119 Ų | 119 | 119.4 Ų | 119.4 | 45% | 0.449 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -81.1 | -42.5 | 171.8 | -74.5 | 163.3 | 178.5 | -170 | -3.5 | 109.9 | M56 K57 R62 K63 E73 | M56-R60 WeakPolarHBondContact O-CD 3.29Å; M56-R60 WeakPolarHBondContact O-CG 3.19Å; M56-R60 PolarHBondContact O-N 2.88Å; K57-R60 WeakPolarHBondContact O-CA 3.25Å; K57-R60 WeakPolarHBondContact O-CB 3.4Å; K57-R60 PolarHBondContact O-N 2.93Å; R60-R62 PolarHBondContact O-N 2.83Å; R60-K63 PolarHBondContact O-N 3.33Å; R60-K63 VanDerWaalsContact O-N 3.15Å; R60-E73 IonicContact NH2-OE1 3.59Å; R60-E73 PolarHBondContact NH2-OE1 3.49Å |
| 61 | D | 56.2 | Low | 63.8 | Low | 128 Ų | 128 | 119.6 Ų | 119.6 | 68% | 0.684 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | 5.2 | -178.7 | -52.5 | -31.1 | 0 | 0 | 0 | 115.1 | K57 | K57-D61 PolarHBondContact O-N 2.91Å; K57-D61 VanDerWaalsContact O-N 3.11Å |
| 62 | R | 59.6 | Low | 63.1 | Low | 216 Ų | 216 | 117.5 Ų | 117.5 | 82% | 0.815 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.3 | -3.7 | -178.9 | -76.2 | -68.3 | -157 | 149.5 | 5.5 | 114 | R60 | R60-R62 PolarHBondContact O-N 2.83Š|
| 63 | K | 57.9 | Low | 62.7 | Low | 145 Ų | 145 | 117.5 Ų | 117.5 | 63% | 0.63 | 56% | 0.557 | S | S | * | * | trans | -136.3 | 100.5 | -166.9 | -66.9 | 178.6 | -174.3 | 163.2 | 0 | 111.8 | S59 R60 | S59-K63 WeakPolarHBondContact O-CD 3.35Å; S59-K63 PolarHBondContact OG-NZ 3.44Å; R60-K63 PolarHBondContact O-N 3.33Å; R60-K63 VanDerWaalsContact O-N 3.15Å | ||
| 64 | Y | 52.6 | Low | 62.7 | Low | 213 Ų | 213 | 118.3 Ų | 118.3 | 84% | 0.835 | 57% | 0.568 | S | S | * | * | trans | -61.8 | -179.1 | 154.2 | -59.7 | -88.9 | 0 | 0 | 0 | 109.7 | ||||
| 65 | D | 53.6 | Low | 62.7 | Low | 142 Ų | 142 | 118.9 Ų | 118.9 | 76% | 0.759 | 58% | 0.575 | S | S | * | * | trans | 77 | 22.7 | 174.9 | -43.6 | -29.1 | 0 | 0 | 0 | 117.9 | T67 | D65-T67 PolarHBondContact O-N 3.47Å; D65-T67 PolarHBondContact O-OG1 3.28Å | ||
| 66 | F | 58.4 | Low | 62.7 | Low | 159 Ų | 159 | 116.8 Ų | 116.8 | 70% | 0.697 | 56% | 0.561 | S | S | * | * | trans | 37.1 | -31.7 | 145.6 | -158.1 | -109.7 | 0 | 0 | 0 | 123.2 | P68 L69 | F66-P68 VanDerWaalsContact C-CD 3.46Å; F66-L69 HydrophobicContact CE2-CD2 4.02Å; F66-L69 HydrophobicContact CZ-CD2 4.39Å; F66-L69 WeakPolarHBondContact O-CB 3.31Å; F66-L69 PolarHBondContact O-N 2.79Å | ||
| 67 | T | 61.8 | Low | 63.5 | Low | 127 Ų | 127 | 119 Ų | 119 | 78% | 0.779 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | -35.7 | -171.2 | 53.7 | 0 | 0 | 0 | 0 | 117.6 | D65 L69 | D65-T67 PolarHBondContact O-N 3.47Å; D65-T67 PolarHBondContact O-OG1 3.28Å; T67-L69 PolarHBondContact O-N 2.92Å |
| 68 | P | 61.6 | Low | 64.4 | Low | 78 Ų | 78 | 118.1 Ų | 118.1 | 51% | 0.506 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.9 | -4.6 | -176.2 | 31.7 | -36.6 | 0 | 0 | 0 | 114.1 | F66 W70 A71 C72 | F66-P68 VanDerWaalsContact C-CD 3.46Å; P68-W70 PolarHBondContact O-N 2.94Å; P68-A71 WeakPolarHBondContact O-CB 3.32Å; P68-A71 PolarHBondContact O-N 2.77Å; P68-A71 VanDerWaalsContact O-N 3.15Å; P68-C72 PolarHBondContact O-N 3.17Å; P68-C72 PolarHBondContact O-SG 2.93Å |
| 69 | L | 61.1 | Low | 65.2 | Low | 63 Ų | 63 | 118.8 Ų | 118.8 | 33% | 0.33 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60.7 | -44.2 | -169.1 | -170.7 | 62.5 | 0 | 0 | 0 | 113.1 | F66 T67 C72 E73 | F66-L69 HydrophobicContact CE2-CD2 4.02Å; F66-L69 HydrophobicContact CZ-CD2 4.39Å; F66-L69 WeakPolarHBondContact O-CB 3.31Å; F66-L69 PolarHBondContact O-N 2.79Å; T67-L69 PolarHBondContact O-N 2.92Å; L69-C72 WeakPolarHBondContact O-CB 3.34Å; L69-C72 PolarHBondContact O-N 3.3Å; L69-E73 PolarHBondContact O-N 2.68Å |
| 70 | W | 65.3 | Low | 66.1 | Low | 212 Ų | 212 | 120.3 Ų | 120.3 | 80% | 0.803 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.7 | -34 | 177.1 | -72.4 | 81.3 | 0 | 0 | 0 | 112.9 | P68 E73 L74 | P68-W70 PolarHBondContact O-N 2.94Å; W70-E73 PolarHBondContact O-N 3.48Å; W70-L74 WeakPolarHBondContact O-CB 3.45Å; W70-L74 PolarHBondContact O-N 2.9Å |
| 71 | A | 69.3 | Low | 67.1 | Low | 48 Ų | 48 | 119.6 Ų | 119.6 | 40% | 0.397 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.3 | -39.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | P68 L74 I75 | P68-A71 WeakPolarHBondContact O-CB 3.32Å; P68-A71 PolarHBondContact O-N 2.77Å; P68-A71 VanDerWaalsContact O-N 3.15Å; A71-L74 PolarHBondContact O-N 3.49Å; A71-I75 WeakPolarHBondContact O-CB 3.4Å; A71-I75 WeakPolarHBondContact O-CD1 3.25Å; A71-I75 WeakPolarHBondContact O-CG1 3.17Å; A71-I75 PolarHBondContact O-N 3.33Å |
| 72 | C | 65.7 | Low | 68.1 | Low | 51 Ų | 51 | 116.9 Ų | 116.9 | 35% | 0.345 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.4 | -45.4 | 174.4 | -71.2 | 0 | 0 | 0 | 0 | 112.5 | P68 L69 I75 F76 | P68-C72 PolarHBondContact O-N 3.17Å; P68-C72 PolarHBondContact O-SG 2.93Å; L69-C72 WeakPolarHBondContact O-CB 3.34Å; L69-C72 PolarHBondContact O-N 3.3Å; C72-I75 PolarHBondContact O-N 2.96Å; C72-F76 VanDerWaalsContact O-CB 3.25Å; C72-F76 WeakPolarHBondContact O-CB 3.42Å; C72-F76 PolarHBondContact O-N 3.39Å |
| 73 | E | 68.7 | Low | 68.8 | Low | 87 Ų | 87 | 109.7 Ų | 109.7 | 41% | 0.407 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.7 | -42 | 177.2 | -64 | -57.8 | 140.8 | 0 | 0 | 111.7 | R60 L69 W70 I75 F76 L77 | R60-E73 IonicContact NH2-OE1 3.59Å; R60-E73 PolarHBondContact NH2-OE1 3.49Å; L69-E73 PolarHBondContact O-N 2.68Å; W70-E73 PolarHBondContact O-N 3.48Å; E73-I75 PolarHBondContact O-N 2.95Å; E73-F76 PolarHBondContact O-N 2.89Å; E73-L77 WeakPolarHBondContact O-CG 3.28Å; E73-L77 PolarHBondContact O-N 2.9Å |
| 74 | L | 73.5 | Confident | 69.4 | Low | 116 Ų | 116 | 107.7 Ų | 107.7 | 61% | 0.607 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -61.4 | -46.1 | 175.8 | -165 | 84 | 0 | 0 | 0 | 111.8 | W70 A71 F76 L77 L78 | W70-L74 WeakPolarHBondContact O-CB 3.45Å; W70-L74 PolarHBondContact O-N 2.9Å; A71-L74 PolarHBondContact O-N 3.49Å; L74-F76 VanDerWaalsContact C-N 3.34Å; L74-L77 PolarHBondContact O-N 3.41Å; L74-L78 WeakPolarHBondContact O-CB 3.38Å; L74-L78 PolarHBondContact O-N 2.65Å |
| 75 | I | 77.5 | Confident | 70.5 | Confident | 115 Ų | 115 | 102.7 Ų | 102.7 | 59% | 0.59 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.3 | -39.5 | 177.8 | -69.7 | 164.7 | 0 | 0 | 0 | 110.9 | A71 C72 E73 L78 F79 | A71-I75 WeakPolarHBondContact O-CB 3.4Å; A71-I75 WeakPolarHBondContact O-CD1 3.25Å; A71-I75 WeakPolarHBondContact O-CG1 3.17Å; A71-I75 PolarHBondContact O-N 3.33Å; C72-I75 PolarHBondContact O-N 2.96Å; E73-I75 PolarHBondContact O-N 2.95Å; I75-L78 PolarHBondContact O-N 2.78Å; I75-F79 WeakPolarHBondContact O-CB 3.25Å; I75-F79 PolarHBondContact O-N 3.48Å |
| 76 | F | 72.7 | Confident | 71.6 | Confident | 76 Ų | 76 | 100.9 Ų | 100.9 | 33% | 0.333 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 176.7 | -177.5 | -100.4 | 0 | 0 | 0 | 111.8 | C72 E73 L74 F79 L80 | C72-F76 VanDerWaalsContact O-CB 3.25Å; C72-F76 WeakPolarHBondContact O-CB 3.42Å; C72-F76 PolarHBondContact O-N 3.39Å; E73-F76 PolarHBondContact O-N 2.89Å; L74-F76 VanDerWaalsContact C-N 3.34Å; F76-F79 PolarHBondContact O-N 2.88Å; F76-L80 VanDerWaalsContact O-CB 3.31Å; F76-L80 WeakPolarHBondContact O-CB 3.35Å; F76-L80 PolarHBondContact O-N 3.31Å |
| 77 | L | 79.2 | Confident | 71.9 | Confident | 104 Ų | 104 | 97.2 Ų | 97.2 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.5 | -39.5 | 174.1 | -70.5 | 170.6 | 0 | 0 | 0 | 112.4 | E73 L74 L80 L81 | E73-L77 WeakPolarHBondContact O-CG 3.28Å; E73-L77 PolarHBondContact O-N 2.9Å; L74-L77 PolarHBondContact O-N 3.41Å; L77-L80 PolarHBondContact O-N 3.43Å; L77-L81 VanDerWaalsContact O-CB 3.32Å; L77-L81 WeakPolarHBondContact O-CB 3.3Å; L77-L81 PolarHBondContact O-N 3.3Å |
| 78 | L | 82.4 | Confident | 72 | Confident | 117 Ų | 117 | 96.1 Ų | 96.1 | 61% | 0.613 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.6 | -40.2 | 178.8 | -142.6 | 160.6 | 0 | 0 | 0 | 111.4 | L74 I75 S82 | L74-L78 WeakPolarHBondContact O-CB 3.38Å; L74-L78 PolarHBondContact O-N 2.65Å; I75-L78 PolarHBondContact O-N 2.78Å; L78-S82 WeakPolarHBondContact O-CB 3.5Å; L78-S82 PolarHBondContact O-N 3.4Å |
| 79 | F | 75.6 | Confident | 72 | Confident | 131 Ų | 131 | 96.6 Ų | 96.6 | 58% | 0.575 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -44 | 172.8 | -174.9 | -100.3 | 0 | 0 | 0 | 112 | I75 F76 L81 S82 F83 | I75-F79 WeakPolarHBondContact O-CB 3.25Å; I75-F79 PolarHBondContact O-N 3.48Å; F76-F79 PolarHBondContact O-N 2.88Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 2.77Å; F79-S82 PolarHBondContact O-N 3.05Å; F79-F83 WeakPolarHBondContact O-CB 3.5Å; F79-F83 PolarHBondContact O-N 3.04Å |
| 80 | L | 77.9 | Confident | 71.6 | Confident | 79 Ų | 79 | 100.5 Ų | 100.5 | 41% | 0.414 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 176.4 | -175.6 | 65.5 | 0 | 0 | 0 | 111.9 | F76 L77 F83 L84 | F76-L80 VanDerWaalsContact O-CB 3.31Å; F76-L80 WeakPolarHBondContact O-CB 3.35Å; F76-L80 PolarHBondContact O-N 3.31Å; L77-L80 PolarHBondContact O-N 3.43Å; L80-F83 PolarHBondContact O-N 2.69Å; L80-L84 WeakPolarHBondContact O-CB 3.46Å; L80-L84 PolarHBondContact O-N 2.83Å |
| 81 | L | 79.6 | Confident | 70.8 | Confident | 104 Ų | 104 | 98 Ų | 98 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -42.5 | 174.8 | -177.1 | 64.5 | 0 | 0 | 0 | 111.6 | L77 F79 L84 L85 | L77-L81 VanDerWaalsContact O-CB 3.32Å; L77-L81 WeakPolarHBondContact O-CB 3.3Å; L77-L81 PolarHBondContact O-N 3.3Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 2.77Å; L81-L84 PolarHBondContact O-N 3.22Å; L81-L85 HydrophobicContact CG-CD1 4.21Å; L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.87Å |
| 82 | S | 76.8 | Confident | 70.3 | Confident | 71 Ų | 71 | 102.8 Ų | 102.8 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.6 | -39.8 | 176 | -166.7 | 0 | 0 | 0 | 0 | 112.4 | L78 F79 L85 D86 | L78-S82 WeakPolarHBondContact O-CB 3.5Å; L78-S82 PolarHBondContact O-N 3.4Å; F79-S82 PolarHBondContact O-N 3.05Å; S82-L85 PolarHBondContact O-N 3.47Å; S82-D86 PolarHBondContact O-N 2.86Å |
| 83 | F | 73.7 | Confident | 69 | Low | 65 Ų | 65 | 109.6 Ų | 109.6 | 29% | 0.285 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 174.4 | 172.4 | -97.8 | 0 | 0 | 0 | 111.6 | Q45 F79 L80 L85 D86 R87 | Q45-F83 VanDerWaalsContact OE1-CE2 3.22Å; F79-F83 WeakPolarHBondContact O-CB 3.5Å; F79-F83 PolarHBondContact O-N 3.04Å; L80-F83 PolarHBondContact O-N 2.69Å; F83-L85 VanDerWaalsContact C-N 3.34Å; F83-L85 PolarHBondContact O-N 3.5Å; F83-D86 PolarHBondContact O-N 2.85Å; F83-R87 HydrophobicContact CE1-CG 4.41Å; F83-R87 HydrophobicContact CZ-CG 4.24Å; F83-R87 WeakPolarHBondContact O-CB 3.49Å; F83-R87 PolarHBondContact O-N 3.43Å |
| 84 | L | 71.6 | Confident | 67.8 | Low | 103 Ų | 103 | 110.1 Ų | 110.1 | 54% | 0.539 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.6 | -38.1 | 177.9 | -164.9 | 69.4 | 0 | 0 | 0 | 111.7 | L80 L81 L88 | L80-L84 WeakPolarHBondContact O-CB 3.46Å; L80-L84 PolarHBondContact O-N 2.83Å; L81-L84 PolarHBondContact O-N 3.22Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 PolarHBondContact O-N 2.99Å |
| 85 | L | 75.2 | Confident | 66.4 | Low | 108 Ų | 108 | 110.9 Ų | 110.9 | 57% | 0.565 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.7 | -45.5 | 173.1 | -83.2 | 163.3 | 0 | 0 | 0 | 112.5 | L81 S82 F83 L88 L89 | L81-L85 HydrophobicContact CG-CD1 4.21Å; L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 2.87Å; S82-L85 PolarHBondContact O-N 3.47Å; F83-L85 VanDerWaalsContact C-N 3.34Å; F83-L85 PolarHBondContact O-N 3.5Å; L85-L88 PolarHBondContact O-N 3.4Å; L85-L89 WeakPolarHBondContact O-CB 3.22Å; L85-L89 PolarHBondContact O-N 3.19Å |
| 86 | D | 76 | Confident | 64.5 | Low | 104 Ų | 104 | 112.3 Ų | 112.3 | 56% | 0.556 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65.4 | -43.9 | 178.6 | -166.4 | 61.2 | 0 | 0 | 0 | 111.4 | S82 F83 L88 L89 M90 | S82-D86 PolarHBondContact O-N 2.86Å; F83-D86 PolarHBondContact O-N 2.85Å; D86-L88 VanDerWaalsContact C-N 3.32Å; D86-L88 PolarHBondContact O-N 3.04Å; D86-L89 PolarHBondContact O-N 3.49Å; D86-M90 PolarHBondContact O-N 3.32Å |
| 87 | R | 65.7 | Low | 62.7 | Low | 83 Ų | 83 | 114 Ų | 114 | 31% | 0.313 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -56.5 | -41.5 | 170.7 | -101.5 | -66.7 | -163.8 | 157.3 | 3.8 | 112.8 | E42 F83 F91 | E42-R87 IonicContact OE1-CZ 3.5Å; E42-R87 IonicContact OE1-NE 3.4Å; E42-R87 IonicContact OE1-NH2 2.95Å; E42-R87 PolarHBondContact OE1-NH2 3.15Å; E42-R87 IonicContact OE2-NH2 2.75Å; E42-R87 PolarHBondContact OE2-NH2 3.37Å; F83-R87 HydrophobicContact CE1-CG 4.41Å; F83-R87 HydrophobicContact CZ-CG 4.24Å; F83-R87 WeakPolarHBondContact O-CB 3.49Å; F83-R87 PolarHBondContact O-N 3.43Å; R87-F91 WeakPolarHBondContact O-CD2 3.38Å |
| 88 | L | 62.2 | Low | 61.1 | Low | 104 Ų | 104 | 114.3 Ų | 114.3 | 55% | 0.545 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -71 | -38.9 | 177.5 | -124.8 | 69.5 | 0 | 0 | 0 | 112.3 | L84 L85 D86 M90 F91 Q92 | L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 PolarHBondContact O-N 2.99Å; L85-L88 PolarHBondContact O-N 3.4Å; D86-L88 VanDerWaalsContact C-N 3.32Å; D86-L88 PolarHBondContact O-N 3.04Å; L88-M90 PolarHBondContact O-N 3.13Å; L88-F91 CarbonylContact O-C 3.59Å; L88-F91 PolarHBondContact O-N 2.99Å; L88-Q92 PolarHBondContact O-N 2.82Å |
| 89 | L | 62.2 | Low | 59.3 | Low | 87 Ų | 87 | 115.3 Ų | 115.3 | 46% | 0.455 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -61.3 | -33.2 | -178.7 | -174.5 | 62.1 | 0 | 0 | 0 | 112.1 | L85 D86 F91 Q92 R93 | L85-L89 WeakPolarHBondContact O-CB 3.22Å; L85-L89 PolarHBondContact O-N 3.19Å; D86-L89 PolarHBondContact O-N 3.49Å; L89-F91 VanDerWaalsContact C-N 3.29Å; L89-F91 PolarHBondContact O-N 3.3Å; L89-Q92 PolarHBondContact O-N 3.19Å; L89-R93 PolarHBondContact O-N 3.11Å |
| 90 | M | 53.9 | Low | 58.3 | Low | 146 Ų | 146 | 117.2 Ų | 117.2 | 72% | 0.719 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -65.2 | -28.5 | 172.5 | -66.3 | -142.7 | 75.6 | 0 | 0 | 113.8 | D86 L88 | D86-M90 PolarHBondContact O-N 3.32Å; L88-M90 PolarHBondContact O-N 3.13Å |
| 91 | F | 48.4 | Very low | 57.1 | Low | 159 Ų | 159 | 117.9 Ų | 117.9 | 70% | 0.697 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -94.1 | -8.8 | 175.4 | -63.4 | -67.3 | 0 | 0 | 0 | 113.6 | R87 L88 L89 | R87-F91 WeakPolarHBondContact O-CD2 3.38Å; L88-F91 CarbonylContact O-C 3.59Å; L88-F91 PolarHBondContact O-N 2.99Å; L89-F91 VanDerWaalsContact C-N 3.29Å; L89-F91 PolarHBondContact O-N 3.3Å |
| 92 | Q | 57.2 | Low | 55.7 | Low | 149 Ų | 149 | 120.8 Ų | 120.8 | 70% | 0.696 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -98.1 | -7.3 | 178.5 | -158.8 | 173.3 | 23.4 | 0 | 0 | 113.7 | L88 L89 P94 | L88-Q92 PolarHBondContact O-N 2.82Å; L89-Q92 PolarHBondContact O-N 3.19Å; Q92-P94 WeakPolarHBondContact O-CD 3.33Å |
| 93 | R | 40.2 | Very low | 54.6 | Low | 194 Ų | 194 | 122 Ų | 122 | 73% | 0.732 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -78 | 120.4 | 161.5 | -77.2 | -173.7 | 174 | 151.7 | 1.7 | 108.6 | L89 | L89-R93 PolarHBondContact O-N 3.11Š|
| 94 | P | 41.8 | Very low | 53.4 | Low | 98 Ų | 98 | 123.5 Ų | 123.5 | 64% | 0.636 | 68% | 0.678 | S | S | * | * | trans | -62.4 | 151.9 | -176.5 | -22.4 | 33.1 | 0 | 0 | 0 | 112.8 | Q92 D96 | Q92-P94 WeakPolarHBondContact O-CD 3.33Å; P94-D96 HydrophobicContact CB-CB 4Å; P94-D96 VanDerWaalsContact CB-OD2 3.3Å; P94-D96 WeakPolarHBondContact CB-OD2 3.4Å; P94-D96 PolarHBondContact O-N 2.98Å; P94-D96 VanDerWaalsContact O-N 3.12Å | ||
| 95 | S | 44.8 | Very low | 52.8 | Low | 131 Ų | 131 | 123.7 Ų | 123.7 | 92% | 0.916 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -74.1 | 14 | 167.1 | -56.4 | 0 | 0 | 0 | 0 | 112.9 | S97 | S95-S97 PolarHBondContact O-N 3.4Š|
| 96 | D | 36.7 | Very low | 51.6 | Low | 145 Ų | 145 | 124.4 Ų | 124.4 | 78% | 0.775 | 70% | 0.695 | S | S | * | * | trans | -97.4 | 77 | -173.3 | -59.2 | -55.7 | 0 | 0 | 0 | 111.2 | P94 | P94-D96 HydrophobicContact CB-CB 4Å; P94-D96 VanDerWaalsContact CB-OD2 3.3Å; P94-D96 WeakPolarHBondContact CB-OD2 3.4Å; P94-D96 PolarHBondContact O-N 2.98Å; P94-D96 VanDerWaalsContact O-N 3.12Å | ||
| 97 | S | 36.1 | Very low | 50.6 | Low | 111 Ų | 111 | 128.1 Ų | 128.1 | 78% | 0.776 | 71% | 0.706 | S | S | * | * | trans | 174.7 | 106.4 | 146.7 | -175.8 | 0 | 0 | 0 | 0 | 110.2 | S95 | S95-S97 PolarHBondContact O-N 3.4Š| ||
| 98 | S | 45.4 | Very low | 49.8 | Very low | 111 Ų | 111 | 134.5 Ų | 134.5 | 78% | 0.776 | 74% | 0.736 | S | S | * | * | trans | -151.5 | 58.2 | 161.9 | -175.5 | 0 | 0 | 0 | 0 | 108 | E100 | S98-E100 PolarHBondContact O-N 3.17Š| ||
| 99 | D | 44.9 | Very low | 49.4 | Very low | 138 Ų | 138 | 136.5 Ų | 136.5 | 74% | 0.738 | 75% | 0.752 | S | S | * | * | trans | -74.6 | 83.6 | -179.1 | -179.7 | 19.9 | 0 | 0 | 0 | 111.3 | ||||
| 100 | E | 54.9 | Low | 48.8 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -102.4 | 64.1 | 174 | -77.7 | -69 | 138.5 | 0 | 0 | 111.2 | S98 | S98-E100 PolarHBondContact O-N 3.17Š| ||
| 101 | S | 51.4 | Low | 48.8 | Very low | 92 Ų | 92 | 145.2 Ų | 145.2 | 64% | 0.643 | 78% | 0.776 | S | S | * | * | trans | 39.1 | 92.2 | 141.7 | -67.2 | 0 | 0 | 0 | 0 | 117.8 | S103 | S101-S103 PolarHBondContact O-N 2.65Š| ||
| 102 | D | 49.9 | Very low | 48.7 | Very low | 165 Ų | 165 | 143.1 Ų | 143.1 | 88% | 0.882 | 78% | 0.776 | S | S | * | * | trans | -67.2 | 96.9 | 167.9 | -173.1 | 11.4 | 0 | 0 | 0 | 111 | A104 | D102-A104 PolarHBondContact O-N 3.44Š| ||
| 103 | S | 55 | Low | 48.4 | Very low | 97 Ų | 97 | 147 Ų | 147 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | trans | -72.4 | 98 | -176 | 71 | 0 | 0 | 0 | 0 | 111.3 | S101 V105 | S101-S103 PolarHBondContact O-N 2.65Å; S103-V105 PolarHBondContact O-N 3.26Å | ||
| 104 | A | 47.4 | Very low | 48.9 | Very low | 96 Ų | 96 | 144.8 Ų | 144.8 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -55.9 | 103.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | D102 P106 | D102-A104 PolarHBondContact O-N 3.44Å; A104-P106 WeakPolarHBondContact O-CD 3.49Å | ||
| 105 | V | 58.8 | Low | 49.1 | Very low | 108 Ų | 108 | 151.7 Ų | 151.7 | 66% | 0.655 | 81% | 0.806 | S | S | * | * | trans | -83.4 | 114 | 171.6 | 178 | 0 | 0 | 0 | 0 | 110.1 | S103 K107 | S103-V105 PolarHBondContact O-N 3.26Å; V105-K107 PolarHBondContact O-N 3.15Å; V105-K107 VanDerWaalsContact O-N 3.16Å | ||
| 106 | P | 50.4 | Low | 49.2 | Very low | 123 Ų | 123 | 154.6 Ų | 154.6 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | trans | -76.6 | 107.3 | -173.3 | 29.7 | -34.7 | 0 | 0 | 0 | 112.2 | A104 | A104-P106 WeakPolarHBondContact O-CD 3.49Š| ||
| 107 | K | 56.1 | Low | 49.7 | Very low | 182 Ų | 182 | 157.7 Ų | 157.7 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | trans | -109.9 | 118.9 | 172.2 | -73.4 | -177.2 | 179.2 | 174.1 | 0 | 111.7 | V105 V109 | V105-K107 PolarHBondContact O-N 3.15Å; V105-K107 VanDerWaalsContact O-N 3.16Å; K107-V109 PolarHBondContact O-N 2.87Å | ||
| 108 | K | 48.3 | Very low | 50.6 | Low | 216 Ų | 216 | 158.8 Ų | 158.8 | 94% | 0.939 | 80% | 0.8 | S | S | * | * | trans | -63.6 | 119.6 | -174.1 | -59.5 | 167.1 | -177.8 | 172.5 | 0 | 111.4 | ||||
| 109 | V | 54.7 | Low | 50.8 | Low | 147 Ų | 147 | 159.1 Ų | 159.1 | 89% | 0.891 | 80% | 0.8 | S | S | * | * | trans | -124 | 132.9 | 162.3 | -176.6 | 0 | 0 | 0 | 0 | 109.5 | K107 | K107-V109 PolarHBondContact O-N 2.87Š| ||
| 110 | K | 49.5 | Very low | 51.1 | Low | 185 Ų | 185 | 160.3 Ų | 160.3 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -117.3 | 117.6 | -167.6 | 167.9 | -170.8 | 179 | 179.5 | 0 | 108.8 | ||||
| 111 | R | 52.9 | Low | 51.2 | Low | 231 Ų | 231 | 159.5 Ų | 159.5 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | 169.8 | 122.9 | 142.7 | -94.6 | 157.9 | 118.7 | 108.3 | 4.7 | 115.7 | ||||
| 112 | T | 46.8 | Very low | 51.1 | Low | 115 Ų | 115 | 161.6 Ų | 161.6 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | 64.1 | 87 | 127.4 | -41.7 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 113 | R | 50.8 | Low | 51.2 | Low | 231 Ų | 231 | 156.9 Ų | 156.9 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | 39.9 | 111.2 | 110.8 | -177.4 | -168.9 | -177.5 | 176.6 | 1.6 | 119.3 | |||||
| 114 | T | 51.3 | Low | 51.2 | Low | 146 Ų | 146 | 158.7 Ų | 158.7 | 90% | 0.896 | 80% | 0.801 | S | S | * | * | -164.7 | 161.1 | 120.1 | 20.8 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 115 | R | 44.1 | Very low | 51.2 | Low | 244 Ų | 244 | 159.9 Ų | 159.9 | 92% | 0.921 | 80% | 0.799 | S | S | * | * | trans | -99.6 | 148.5 | -176.4 | -68.3 | 167.5 | 159.9 | 169.5 | -9.6 | 112.6 | ||||
| 116 | K | 47.4 | Very low | 51.2 | Low | 192 Ų | 192 | 162.7 Ų | 162.7 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | -169.5 | 139.4 | 128.5 | -111.5 | 175.1 | -179.8 | -179.5 | 0 | 113.4 | |||||
| 117 | R | 47.7 | Very low | 51 | Low | 209 Ų | 209 | 163 Ų | 163 | 79% | 0.789 | 81% | 0.808 | S | S | * | * | trans | 9.9 | 151.6 | 139.4 | -58.2 | -166.5 | 178.1 | 153.3 | -2 | 120 | ||||
| 118 | D | 55.3 | Low | 51.1 | Low | 134 Ų | 134 | 159.2 Ų | 159.2 | 72% | 0.717 | 81% | 0.812 | S | S | * | * | cis | -166.8 | 170 | -12.6 | -97.5 | -30.2 | 0 | 0 | 0 | 107.8 | ||||
| 119 | P | 50.2 | Low | 51.5 | Low | 119 Ų | 119 | 156.7 Ų | 156.7 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -96 | 174.1 | -163.4 | 38.3 | -37.9 | 0 | 0 | 0 | 115.5 | ||||
| 120 | K | 49.8 | Very low | 50.8 | Low | 163 Ų | 163 | 155.8 Ų | 155.8 | 71% | 0.709 | 81% | 0.807 | S | S | * | * | 159.2 | 130.3 | 127.5 | -177.6 | 167.9 | -178.3 | 180 | 0 | 114.5 | |||||
| 121 | E | 57.4 | Low | 51.4 | Low | 154 Ų | 154 | 158.9 Ų | 158.9 | 72% | 0.72 | 81% | 0.814 | S | S | * | * | trans | 55.6 | 155.7 | 160.9 | -66.2 | 155.6 | -168.6 | 0 | 0 | 117.7 | ||||
| 122 | T | 49.6 | Very low | 51.1 | Low | 136 Ų | 136 | 157.8 Ų | 157.8 | 83% | 0.834 | 82% | 0.815 | S | S | * | * | cis | -158.8 | 144.2 | 27.1 | -46.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 123 | G | 51.4 | Low | 51.6 | Low | 67 Ų | 67 | 157 Ų | 157 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | trans | 70.8 | 160.4 | 156.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 124 | T | 55.5 | Low | 51.6 | Low | 134 Ų | 134 | 156.4 Ų | 156.4 | 82% | 0.822 | 82% | 0.818 | S | S | * | * | cis | -148.8 | 134.8 | -8 | -64 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 125 | V | 47.1 | Very low | 51.6 | Low | 122 Ų | 122 | 158.4 Ų | 158.4 | 74% | 0.739 | 81% | 0.814 | S | S | * | * | trans | -96.3 | 128.7 | 176.7 | 176.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 126 | L | 58.7 | Low | 52.1 | Low | 167 Ų | 167 | 152 Ų | 152 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | trans | -138.7 | 98.5 | 163.4 | -77.4 | -179.9 | 0 | 0 | 0 | 111.2 | ||||
| 127 | T | 46.4 | Very low | 52.8 | Low | 128 Ų | 128 | 150.5 Ų | 150.5 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -109 | 130.8 | 166.4 | 53.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 128 | A | 58.4 | Low | 52.9 | Low | 104 Ų | 104 | 146 Ų | 146 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -136.5 | 126.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 129 | N | 55.9 | Low | 52.4 | Low | 162 Ų | 162 | 150.1 Ų | 150.1 | 87% | 0.866 | 81% | 0.809 | S | S | * | * | trans | -94.7 | 153.9 | -172.5 | -83.9 | -27.8 | 0 | 0 | 0 | 113.7 | ||||
| 130 | C | 40.3 | Very low | 52.7 | Low | 128 Ų | 128 | 151.7 Ų | 151.7 | 87% | 0.865 | 81% | 0.81 | S | S | * | * | trans | -63.2 | 150 | 171.7 | -46.7 | 0 | 0 | 0 | 0 | 113 | ||||
| 131 | R | 62.6 | Low | 52.7 | Low | 250 Ų | 250 | 150.1 Ų | 150.1 | 94% | 0.943 | 82% | 0.815 | S | S | * | * | trans | -140.1 | 158.1 | 162.5 | -71.2 | -166.8 | 171.8 | -174.8 | -2.1 | 111.4 | ||||
| 132 | K | 47.4 | Very low | 52.5 | Low | 208 Ų | 208 | 148.4 Ų | 148.4 | 90% | 0.904 | 82% | 0.817 | S | S | * | * | trans | -156.9 | 120.8 | -160.1 | 177.4 | 175.9 | -178.2 | 172.1 | 0 | 114.2 | ||||
| 133 | A | 57 | Low | 52.2 | Low | 98 Ų | 98 | 146.4 Ų | 146.4 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | trans | -164.2 | 151.9 | 163.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 134 | R | 50.9 | Low | 52.3 | Low | 220 Ų | 220 | 152.3 Ų | 152.3 | 83% | 0.83 | 82% | 0.824 | S | S | * | * | cis | 108.6 | 104.3 | -7.9 | -157.1 | -178.3 | -171.3 | -155.7 | 4.3 | 117.4 | ||||
| 135 | K | 50.4 | Low | 52.3 | Low | 187 Ų | 187 | 153.4 Ų | 153.4 | 81% | 0.813 | 82% | 0.824 | S | S | * | * | trans | 79.1 | 151.1 | 177.2 | -52.9 | 174.1 | 173.5 | -174 | 0 | 114.4 | ||||
| 136 | S | 54.6 | Low | 52.5 | Low | 110 Ų | 110 | 152.4 Ų | 152.4 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | cis | -149.9 | -173.6 | 13.9 | -37.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 137 | L | 61.7 | Low | 51.6 | Low | 161 Ų | 161 | 151 Ų | 151 | 84% | 0.843 | 81% | 0.813 | S | S | * | * | cis | -148 | -84 | -5.3 | -169.3 | 50.5 | 0 | 0 | 0 | 114.8 | ||||
| 138 | T | 49.9 | Very low | 51.4 | Low | 114 Ų | 114 | 150.8 Ų | 150.8 | 70% | 0.699 | 81% | 0.812 | S | S | * | * | trans | -130.6 | 152.5 | -169.6 | 38.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 139 | R | 45.2 | Very low | 50.6 | Low | 221 Ų | 221 | 151.3 Ų | 151.3 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | 72.7 | 119.1 | 54.1 | -111.4 | -164.8 | -159.4 | -179.7 | 5.7 | 114.9 | |||||
| 140 | D | 57.1 | Low | 50.5 | Low | 151 Ų | 151 | 152.8 Ų | 152.8 | 81% | 0.807 | 80% | 0.803 | S | S | * | * | 178.9 | 170.4 | 114.5 | -83.1 | -19.6 | 0 | 0 | 0 | 113.6 | |||||
| 141 | T | 50.2 | Low | 50.5 | Low | 130 Ų | 130 | 155.4 Ų | 155.4 | 80% | 0.798 | 80% | 0.803 | S | S | * | * | trans | -151.6 | 146.7 | -175.2 | -34.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 142 | P | 52.4 | Low | 49.5 | Very low | 119 Ų | 119 | 147.3 Ų | 147.3 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | -145.2 | 165 | 110.4 | 23 | -0.5 | 0 | 0 | 0 | 112.6 | |||||
| 143 | A | 44.1 | Very low | 49.3 | Very low | 94 Ų | 94 | 142.5 Ų | 142.5 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | cis | 106.7 | 121.3 | 21.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 144 | E | 52.2 | Low | 48.7 | Very low | 191 Ų | 191 | 142.7 Ų | 142.7 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | trans | -158.7 | 159.6 | 158.9 | -132.9 | -178.1 | 156.9 | 0 | 0 | 113.2 | ||||
| 145 | L | 56.1 | Low | 48.5 | Very low | 157 Ų | 157 | 140.2 Ų | 140.2 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -148.3 | -173.4 | 178.3 | -78.7 | 174.3 | 0 | 0 | 0 | 106.2 | ||||
| 146 | P | 50.6 | Low | 48.2 | Very low | 101 Ų | 101 | 135.1 Ų | 135.1 | 66% | 0.656 | 77% | 0.771 | S | S | * | * | cis | -148.4 | -173 | 10.9 | 39.9 | -16.1 | 0 | 0 | 0 | 118.5 | ||||
| 147 | N | 40.5 | Very low | 47.8 | Very low | 137 Ų | 137 | 137 Ų | 137 | 73% | 0.733 | 77% | 0.768 | S | S | * | * | trans | 91.3 | 140 | 131.2 | -92 | -3.6 | 0 | 0 | 0 | 127.2 | ||||
| 148 | T | 42.9 | Very low | 47.3 | Very low | 123 Ų | 123 | 137.3 Ų | 137.3 | 76% | 0.755 | 76% | 0.763 | S | S | * | * | trans | 73 | 154.3 | 147.3 | 59.6 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 149 | T | 40 | Very low | 46.9 | Very low | 115 Ų | 115 | 140.4 Ų | 140.4 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | cis | -174.3 | 149 | -27.3 | -83.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 150 | K | 53.6 | Low | 46.9 | Very low | 194 Ų | 194 | 133.2 Ų | 133.2 | 84% | 0.843 | 76% | 0.764 | S | S | * | * | trans | 134 | 167.6 | 158.3 | -79.8 | 171.1 | 178.3 | -178.9 | 0 | 113.1 | ||||
| 151 | E | 40.7 | Very low | 46.3 | Very low | 182 Ų | 182 | 132.4 Ų | 132.4 | 85% | 0.85 | 76% | 0.764 | S | S | * | * | 179.6 | 148 | -57.7 | -109.9 | -167.5 | 150.9 | 0 | 0 | 110.3 | |||||
| 152 | G | 42.9 | Very low | 46.2 | Very low | 81 Ų | 81 | 133.7 Ų | 133.7 | 84% | 0.835 | 77% | 0.766 | S | S | * | * | trans | 84.3 | 157.9 | 173 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 153 | S | 42.4 | Very low | 46 | Very low | 107 Ų | 107 | 132.8 Ų | 132.8 | 75% | 0.748 | 76% | 0.76 | S | S | * | * | cis | -168.9 | 145.9 | -11.7 | -177.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 154 | S | 44.4 | Very low | 46 | Very low | 101 Ų | 101 | 135.7 Ų | 135.7 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | trans | 60.5 | 157.7 | 154.7 | 41.1 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 155 | E | 46.2 | Very low | 45.9 | Very low | 168 Ų | 168 | 131.9 Ų | 131.9 | 79% | 0.785 | 76% | 0.756 | S | S | * | * | cis | -160.7 | 165 | 1.3 | -132.7 | -168.4 | 92.9 | 0 | 0 | 114.8 | ||||
| 156 | S | 44 | Very low | 45.3 | Very low | 81 Ų | 81 | 132.2 Ų | 132.2 | 57% | 0.566 | 76% | 0.759 | S | S | * | * | trans | 59.2 | 115.4 | 142 | -78.6 | 0 | 0 | 0 | 0 | 126.5 | ||||
| 157 | Q | 47.7 | Very low | 45.3 | Very low | 150 Ų | 150 | 134 Ų | 134 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | 99.6 | 129 | 123.1 | -77.3 | -167 | 28.4 | 0 | 0 | 125.3 | |||||
| 158 | K | 49.3 | Very low | 45.9 | Very low | 167 Ų | 167 | 135.5 Ų | 135.5 | 73% | 0.726 | 78% | 0.775 | S | S | * | * | trans | 71.5 | 153.8 | 149.7 | -69.4 | 168.5 | 177.4 | 162.9 | 0 | 120.8 | ||||
| 159 | E | 41.9 | Very low | 47.1 | Very low | 179 Ų | 179 | 135.1 Ų | 135.1 | 84% | 0.836 | 78% | 0.775 | S | S | * | * | cis | -177.7 | 133.5 | -30.3 | 179.3 | 163.1 | -161.1 | 0 | 0 | 107.2 | ||||
| 160 | G | 44.7 | Very low | 47.7 | Very low | 70 Ų | 70 | 135.4 Ų | 135.4 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | trans | 173.3 | 73 | -175.3 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 161 | T | 44.8 | Very low | 47.6 | Very low | 133 Ų | 133 | 133.2 Ų | 133.2 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | 32.4 | 97.7 | 144.9 | -44.8 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 162 | L | 49.6 | Very low | 48.1 | Very low | 158 Ų | 158 | 133.5 Ų | 133.5 | 83% | 0.827 | 78% | 0.783 | S | S | * | * | 31.1 | 161.2 | 112.5 | -72.4 | -179.9 | 0 | 0 | 0 | 122.6 | |||||
| 163 | P | 47.1 | Very low | 48.7 | Very low | 100 Ų | 100 | 135 Ų | 135 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | cis | -139.2 | 173.6 | -10.5 | 37.8 | -19.2 | 0 | 0 | 0 | 117 | ||||
| 164 | N | 43.7 | Very low | 49.5 | Very low | 155 Ų | 155 | 137.6 Ų | 137.6 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | trans | 51.3 | 139.6 | 145.7 | -80.9 | -18 | 0 | 0 | 0 | 121.8 | ||||
| 165 | S | 50.6 | Low | 50.5 | Low | 110 Ų | 110 | 141.3 Ų | 141.3 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | cis | -159 | 139 | 47.6 | 35.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 166 | N | 42.8 | Very low | 50.9 | Low | 165 Ų | 165 | 136.9 Ų | 136.9 | 88% | 0.882 | 80% | 0.795 | S | S | * | * | trans | -113 | 121.7 | 170.5 | -78.4 | -25.8 | 0 | 0 | 0 | 110.1 | ||||
| 167 | T | 51 | Low | 51.9 | Low | 137 Ų | 137 | 137.7 Ų | 137.7 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | trans | -147.5 | 120.1 | 160.7 | -57.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 168 | L | 53.8 | Low | 52.4 | Low | 169 Ų | 169 | 138.9 Ų | 138.9 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | -113.7 | 135.6 | 162.9 | -77.2 | 170.9 | 0 | 0 | 0 | 108.8 | ||||
| 169 | P | 67.1 | Low | 52.9 | Low | 115 Ų | 115 | 144.2 Ų | 144.2 | 75% | 0.747 | 83% | 0.833 | S | S | * | * | trans | -79.5 | 163.1 | 177.1 | 32.7 | -34.5 | 0 | 0 | 0 | 112.8 | ||||
| 170 | P | 53.2 | Low | 53.5 | Low | 121 Ų | 121 | 142.5 Ų | 142.5 | 79% | 0.786 | 83% | 0.833 | S | S | * | * | trans | -100.4 | 167.8 | -160 | 38.9 | -37.4 | 0 | 0 | 0 | 115.6 | ||||
| 171 | T | 51.5 | Low | 53.9 | Low | 149 Ų | 149 | 146.3 Ų | 146.3 | 91% | 0.914 | 84% | 0.839 | S | S | * | * | trans | -112.2 | 149.4 | 164.9 | -49.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 172 | Q | 51.5 | Low | 54.4 | Low | 188 Ų | 188 | 147 Ų | 147 | 88% | 0.879 | 84% | 0.84 | S | S | * | * | trans | -100.4 | 141.6 | -162.9 | -55.4 | 171.1 | 8.5 | 0 | 0 | 114.4 | ||||
| 173 | S | 56.6 | Low | 54.7 | Low | 111 Ų | 111 | 146.4 Ų | 146.4 | 78% | 0.776 | 84% | 0.841 | S | S | * | * | trans | -157.2 | 108.5 | 144.8 | 56.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 174 | L | 58.5 | Low | 55.2 | Low | 163 Ų | 163 | 149.3 Ų | 149.3 | 85% | 0.853 | 85% | 0.853 | S | S | * | * | 67.2 | 97.6 | 79.8 | -168.9 | 93.6 | 0 | 0 | 0 | 112.7 | |||||
| 175 | I | 65.2 | Low | 56 | Low | 179 Ų | 179 | 148.9 Ų | 148.9 | 92% | 0.918 | 86% | 0.855 | S | S | * | * | trans | -169.8 | 136.9 | 141.8 | -96.4 | 149.3 | 0 | 0 | 0 | 106.8 | ||||
| 176 | G | 54.8 | Low | 56.3 | Low | 74 Ų | 74 | 151.6 Ų | 151.6 | 76% | 0.763 | 86% | 0.861 | S | S | * | * | trans | -169.8 | 116 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 177 | S | 64.6 | Low | 57.4 | Low | 98 Ų | 98 | 150.6 Ų | 150.6 | 69% | 0.685 | 86% | 0.859 | S | S | * | * | trans | -169.9 | 114.7 | 162 | -98.1 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 178 | E | 59.4 | Low | 57.9 | Low | 176 Ų | 176 | 151.8 Ų | 151.8 | 82% | 0.822 | 86% | 0.861 | S | S | * | * | 84.2 | 89.3 | 96.2 | -74.2 | 174.1 | 110.8 | 0 | 0 | 114.2 | |||||
| 179 | Q | 59 | Low | 58.3 | Low | 278 Ų | 278 | 150.2 Ų | 150.2 | 100% | 1.299 | 86% | 0.858 | S | S | * | * | -161.9 | 0 | 113.8 | -102.6 | 173.8 | 21.2 | 0 | 0 | 110.5 |
Retrieved 179 of 179 residues in 143.1 ms
(Link to these results)