| 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 | 41.8 | Very low | 52.4 | Low | 243 Ų | 243 | 157.5 Ų | 157.5 | 100% | 1.197 | 86% | 0.856 | S | S | * | * | 0 | 112.1 | 0 | -64.5 | 175.1 | -178.6 | 0 | 0 | 105 | |||||
| 2 | E | 47.3 | Very low | 52.6 | Low | 188 Ų | 188 | 151.5 Ų | 151.5 | 88% | 0.879 | 84% | 0.844 | S | S | * | * | cis | -151 | 143.8 | 14.2 | -80 | 178.5 | 116.5 | 0 | 0 | 109.2 | ||||
| 3 | A | 52.8 | Low | 52.8 | Low | 100 Ų | 100 | 152.7 Ų | 152.7 | 83% | 0.826 | 84% | 0.835 | S | S | * | * | trans | 24.2 | 108.2 | 156.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 4 | A | 53.2 | Low | 52.3 | Low | 85 Ų | 85 | 153.6 Ų | 153.6 | 70% | 0.702 | 84% | 0.839 | S | S | * | * | S | Bend | trans | -61.3 | 152.4 | 140.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 5 | T | 60.2 | Low | 52.3 | Low | 138 Ų | 138 | 154 Ų | 154 | 85% | 0.847 | 84% | 0.837 | S | S | * | * | trans | 67.8 | 89.7 | 159.9 | 42.3 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 6 | R | 59.3 | Low | 51.6 | Low | 211 Ų | 211 | 148.4 Ų | 148.4 | 80% | 0.796 | 83% | 0.827 | S | S | * | * | trans | -153.4 | 55.5 | 152.9 | -157.6 | -177.8 | -179 | 79.9 | 3.3 | 114.2 | ||||
| 7 | W | 57.2 | Low | 51.4 | Low | 257 Ų | 257 | 147.9 Ų | 147.9 | 97% | 0.973 | 82% | 0.822 | S | S | * | * | S | Bend | trans | -128.7 | 26.5 | 169 | -84.6 | 64 | 0 | 0 | 0 | 112.7 | ||
| 8 | T | 58.1 | Low | 50.9 | Low | 130 Ų | 130 | 147.1 Ų | 147.1 | 80% | 0.798 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -138.3 | 52.2 | 170.9 | 61.8 | 0 | 0 | 0 | 0 | 110.4 | ||
| 9 | D | 49.5 | Very low | 50.8 | Low | 140 Ų | 140 | 151.1 Ų | 151.1 | 75% | 0.749 | 82% | 0.817 | S | S | * | * | S | Bend | trans | 179.5 | 95.7 | 149.6 | -116.4 | -21.9 | 0 | 0 | 0 | 109.8 | ||
| 10 | S | 56.2 | Low | 50.4 | Low | 114 Ų | 114 | 152.6 Ų | 152.6 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | 166.9 | 80.9 | 141.2 | -161.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 11 | C | 40.9 | Very low | 50.5 | Low | 126 Ų | 126 | 150.1 Ų | 150.1 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -149.7 | 52.7 | 135.3 | -144.4 | 0 | 0 | 0 | 0 | 108.6 | K13 | C11-K13 VanDerWaalsContact C-N 3.32Å; C11-K13 PolarHBondContact O-N 3.11Å | ||
| 12 | A | 54.6 | Low | 51.2 | Low | 86 Ų | 86 | 147.7 Ų | 147.7 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | -79 | 85.6 | 160.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 13 | K | 56 | Low | 51.8 | Low | 167 Ų | 167 | 143 Ų | 143 | 73% | 0.726 | 78% | 0.779 | S | S | * | * | trans | 172.2 | 107.9 | 150.6 | -102.8 | 145.6 | 179.2 | 159.2 | 0 | 109.7 | C11 | C11-K13 VanDerWaalsContact C-N 3.32Å; C11-K13 PolarHBondContact O-N 3.11Å | ||
| 14 | D | 45.5 | Very low | 52.7 | Low | 166 Ų | 166 | 140.7 Ų | 140.7 | 89% | 0.888 | 76% | 0.756 | S | S | * | * | -140.5 | 104.2 | 116.5 | -92.9 | -31.2 | 0 | 0 | 0 | 108.7 | G16 | D14-G16 VanDerWaalsContact C-N 3.26Å; D14-G16 PolarHBondContact O-N 3.28Å; D14-G16 VanDerWaalsContact O-N 3.14Å | |||
| 15 | I | 51.8 | Low | 53.7 | Low | 159 Ų | 159 | 141.8 Ų | 141.8 | 82% | 0.815 | 76% | 0.757 | S | S | * | * | trans | -71.7 | 93.7 | 158.7 | -69 | 168.7 | 0 | 0 | 0 | 104.3 | ||||
| 16 | G | 41.5 | Very low | 54.6 | Low | 65 Ų | 65 | 142.1 Ų | 142.1 | 67% | 0.67 | 75% | 0.748 | S | S | * | * | trans | -141.5 | 61.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | D14 D18 | D14-G16 VanDerWaalsContact C-N 3.26Å; D14-G16 PolarHBondContact O-N 3.28Å; D14-G16 VanDerWaalsContact O-N 3.14Å; G16-D18 PolarHBondContact O-N 3.44Å | ||
| 17 | N | 47.6 | Very low | 55.6 | Low | 139 Ų | 139 | 137.1 Ų | 137.1 | 74% | 0.743 | 73% | 0.733 | S | S | * | * | trans | -67.6 | 111.4 | 149.1 | 176.6 | 51.6 | 0 | 0 | 0 | 105.4 | ||||
| 18 | D | 42.3 | Very low | 56.7 | Low | 133 Ų | 133 | 127 Ų | 127 | 71% | 0.711 | 70% | 0.704 | S | S | * | * | trans | 179.7 | 138.5 | 135.7 | -82.8 | -28 | 0 | 0 | 0 | 110.2 | G16 | G16-D18 PolarHBondContact O-N 3.44Š| ||
| 19 | R | 48.9 | Very low | 58 | Low | 223 Ų | 223 | 127 Ų | 127 | 84% | 0.842 | 70% | 0.695 | S | S | * | * | trans | 90.8 | 59.3 | 171.7 | -48.6 | -79.1 | -75 | -110 | -10.2 | 116.5 | S21 | R19-S21 PolarHBondContact O-N 3.01Š| ||
| 20 | Q | 42.4 | Very low | 59.5 | Low | 182 Ų | 182 | 126.3 Ų | 126.3 | 85% | 0.85 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.5 | 118.9 | 132.9 | -65.2 | 174.8 | 6.3 | 0 | 0 | 108.7 | ||
| 21 | S | 53.4 | Low | 60.9 | Low | 100 Ų | 100 | 125 Ų | 125 | 70% | 0.699 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 170.1 | -6.2 | 135.9 | 65.9 | 0 | 0 | 0 | 0 | 113.9 | R19 I23 | R19-S21 PolarHBondContact O-N 3.01Å; S21-I23 VanDerWaalsContact C-N 3.33Å; S21-I23 PolarHBondContact O-N 3.28Å |
| 22 | E | 55.6 | Low | 63.1 | Low | 193 Ų | 193 | 125.5 Ų | 125.5 | 90% | 0.902 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -74.1 | 99.4 | 160.4 | -134.8 | 123.1 | -134 | 0 | 0 | 105.7 | S24 | E22-S24 PolarHBondContact O-N 3.29Š|
| 23 | I | 61.3 | Low | 64.4 | Low | 89 Ų | 89 | 125.2 Ų | 125.2 | 46% | 0.456 | 64% | 0.644 | S | S | . | * | trans | -51.3 | 112.5 | -178.4 | -76.3 | 156.2 | 0 | 0 | 0 | 107.6 | S21 K27 A28 L31 | S21-I23 VanDerWaalsContact C-N 3.33Å; S21-I23 PolarHBondContact O-N 3.28Å; I23-K27 HydrophobicContact CG2-CB 4.04Å; I23-K27 HydrophobicContact CG2-CG 4.38Å; I23-A28 HydrophobicContact CG2-CB 3.25Å; I23-L31 HydrophobicContact CD1-CD1 4.05Å | ||
| 24 | S | 72 | Confident | 65.6 | Low | 51 Ų | 51 | 121 Ų | 121 | 36% | 0.357 | 63% | 0.629 | S | S | . | * | trans | -50.8 | 143.5 | 170.8 | 59 | 0 | 0 | 0 | 0 | 107.8 | E22 E26 K27 A28 | E22-S24 PolarHBondContact O-N 3.29Å; S24-E26 PolarHBondContact O-N 3.06Å; S24-K27 WeakPolarHBondContact O-CA 3.49Å; S24-K27 PolarHBondContact O-N 3.49Å; S24-K27 VanDerWaalsContact OG-CB 3.29Å; S24-K27 WeakPolarHBondContact OG-CB 3.34Å; S24-K27 PolarHBondContact OG-N 2.86Å; S24-A28 PolarHBondContact O-N 3.03Å | ||
| 25 | P | 74.3 | Confident | 67.5 | Low | 109 Ų | 109 | 117 Ų | 117 | 71% | 0.708 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -52.7 | -35.5 | -176.7 | 20.7 | -32.7 | 0 | 0 | 0 | 111.5 | A28 E29 | P25-A28 PolarHBondContact O-N 3.29Å; P25-E29 PolarHBondContact O-N 2.68Å |
| 26 | E | 77.2 | Confident | 69.2 | Low | 144 Ų | 144 | 115.7 Ų | 115.7 | 67% | 0.673 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -57.6 | -50.3 | 172 | -62.4 | 162.8 | 175.9 | 0 | 0 | 112.3 | S24 A28 E29 E30 | S24-E26 PolarHBondContact O-N 3.06Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 3.26Å; E26-E29 PolarHBondContact O-N 3.31Å; E26-E30 WeakPolarHBondContact O-CG 3.46Å; E26-E30 PolarHBondContact O-N 3.43Å |
| 27 | K | 81.6 | Confident | 71 | Confident | 107 Ų | 107 | 118.7 Ų | 118.7 | 47% | 0.465 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -68.7 | -29.1 | 178.9 | -171.4 | 172.8 | -172.3 | 175.3 | 0 | 112.7 | I23 S24 E30 L31 | I23-K27 HydrophobicContact CG2-CB 4.04Å; I23-K27 HydrophobicContact CG2-CG 4.38Å; S24-K27 WeakPolarHBondContact O-CA 3.49Å; S24-K27 PolarHBondContact O-N 3.49Å; S24-K27 VanDerWaalsContact OG-CB 3.29Å; S24-K27 WeakPolarHBondContact OG-CB 3.34Å; S24-K27 PolarHBondContact OG-N 2.86Å; K27-E30 PolarHBondContact O-N 3.2Å; K27-L31 PolarHBondContact O-N 3.22Å |
| 28 | A | 80.9 | Confident | 72.5 | Confident | 45 Ų | 45 | 115.4 Ų | 115.4 | 37% | 0.372 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -67.8 | -43.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | I23 S24 P25 E26 E30 L31 K32 | I23-A28 HydrophobicContact CG2-CB 3.25Å; S24-A28 PolarHBondContact O-N 3.03Å; P25-A28 PolarHBondContact O-N 3.29Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 3.26Å; A28-E30 VanDerWaalsContact C-N 3.34Å; A28-L31 PolarHBondContact O-N 3.35Å; A28-K32 PolarHBondContact O-N 2.9Å |
| 29 | E | 84.2 | Confident | 74.2 | Confident | 129 Ų | 129 | 114.2 Ų | 114.2 | 60% | 0.603 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.6 | -41.8 | 175.1 | -168.5 | 172.8 | -178 | 0 | 0 | 111 | P25 E26 L31 K32 L33 | P25-E29 PolarHBondContact O-N 2.68Å; E26-E29 PolarHBondContact O-N 3.31Å; E29-L31 PolarHBondContact O-N 3.4Å; E29-K32 WeakPolarHBondContact O-CB 3.4Å; E29-K32 PolarHBondContact O-N 3.22Å; E29-L33 HydrophobicContact CG-CD1 4.33Å; E29-L33 WeakPolarHBondContact O-CB 3.32Å; E29-L33 VanDerWaalsContact O-CG 3.31Å; E29-L33 WeakPolarHBondContact O-CG 3.45Å; E29-L33 PolarHBondContact O-N 3.01Å |
| 30 | E | 82.2 | Confident | 75.4 | Confident | 125 Ų | 125 | 109 Ų | 109 | 58% | 0.584 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.9 | -41.1 | 174.2 | -72.4 | -179.8 | 170.8 | 0 | 0 | 113 | E26 K27 A28 L33 L34 | E26-E30 WeakPolarHBondContact O-CG 3.46Å; E26-E30 PolarHBondContact O-N 3.43Å; K27-E30 PolarHBondContact O-N 3.2Å; A28-E30 VanDerWaalsContact C-N 3.34Å; E30-L33 PolarHBondContact O-N 3.47Å; E30-L34 WeakPolarHBondContact O-CB 3.25Å; E30-L34 PolarHBondContact O-N 2.87Å |
| 31 | L | 84.3 | Confident | 76.6 | Confident | 86 Ų | 86 | 103.1 Ų | 103.1 | 45% | 0.45 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 174.5 | -78.3 | 172.3 | 0 | 0 | 0 | 112.2 | I23 K27 A28 E29 L33 L34 A35 | I23-L31 HydrophobicContact CD1-CD1 4.05Å; K27-L31 PolarHBondContact O-N 3.22Å; A28-L31 PolarHBondContact O-N 3.35Å; E29-L31 PolarHBondContact O-N 3.4Å; L31-L33 VanDerWaalsContact C-N 3.31Å; L31-L34 HydrophobicContact CD2-CD2 4.45Å; L31-L34 PolarHBondContact O-N 3.33Å; L31-A35 WeakPolarHBondContact O-CB 3.35Å; L31-A35 PolarHBondContact O-N 3.15Å |
| 32 | K | 87.5 | Confident | 77.2 | Confident | 138 Ų | 138 | 105.9 Ų | 105.9 | 60% | 0.6 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.6 | -38.2 | 174.3 | -172.9 | 175.3 | -176.3 | 174.2 | 0 | 111.3 | A28 E29 K36 | A28-K32 PolarHBondContact O-N 2.9Å; E29-K32 WeakPolarHBondContact O-CB 3.4Å; E29-K32 PolarHBondContact O-N 3.22Å; K32-K36 WeakPolarHBondContact O-CG 3.43Å; K32-K36 PolarHBondContact O-N 3.2Å; K32-K36 VanDerWaalsContact O-N 3.11Å |
| 33 | L | 81.7 | Confident | 77.7 | Confident | 79 Ų | 79 | 101.3 Ų | 101.3 | 41% | 0.414 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -68.8 | -41.1 | 174.5 | -70.8 | 172 | 0 | 0 | 0 | 111.3 | E29 E30 L31 A35 K36 Y37 | E29-L33 HydrophobicContact CG-CD1 4.33Å; E29-L33 WeakPolarHBondContact O-CB 3.32Å; E29-L33 VanDerWaalsContact O-CG 3.31Å; E29-L33 WeakPolarHBondContact O-CG 3.45Å; E29-L33 PolarHBondContact O-N 3.01Å; E30-L33 PolarHBondContact O-N 3.47Å; L31-L33 VanDerWaalsContact C-N 3.31Å; L33-A35 PolarHBondContact O-N 2.88Å; L33-K36 PolarHBondContact O-N 2.73Å; L33-Y37 HydrophobicContact CD2-CD2 4.44Å; L33-Y37 HydrophobicContact CD2-CE2 4.09Å; L33-Y37 WeakPolarHBondContact O-CB 3.47Å; L33-Y37 VanDerWaalsContact O-CD2 3.24Å; L33-Y37 WeakPolarHBondContact O-CD2 3.39Å; L33-Y37 PolarHBondContact O-N 3.14Å |
| 34 | L | 82.3 | Confident | 78 | Confident | 79 Ų | 79 | 100 Ų | 100 | 41% | 0.414 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 175.1 | -169.5 | 83.8 | 0 | 0 | 0 | 111.6 | E30 L31 Y37 P38 A41 | E30-L34 WeakPolarHBondContact O-CB 3.25Å; E30-L34 PolarHBondContact O-N 2.87Å; L31-L34 HydrophobicContact CD2-CD2 4.45Å; L31-L34 PolarHBondContact O-N 3.33Å; L34-Y37 CarbonylContact O-C 3.5Å; L34-Y37 PolarHBondContact O-N 3.27Å; L34-P38 WeakPolarHBondContact O-CA 3.18Å; L34-A41 HydrophobicContact CD1-CB 3.48Å; L34-A41 VanDerWaalsContact CD1-CB 3.48Å |
| 35 | A | 83.7 | Confident | 78 | Confident | 82 Ų | 82 | 103.5 Ų | 103.5 | 68% | 0.678 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.7 | -38.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L31 L33 | L31-A35 WeakPolarHBondContact O-CB 3.35Å; L31-A35 PolarHBondContact O-N 3.15Å; L33-A35 PolarHBondContact O-N 2.88Å |
| 36 | K | 87.8 | Confident | 78.1 | Confident | 131 Ų | 131 | 105.1 Ų | 105.1 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -69.2 | -35.5 | 174.1 | -76.4 | -178.7 | 175.2 | -171.8 | 0 | 112.7 | K32 L33 P38 | K32-K36 WeakPolarHBondContact O-CG 3.43Å; K32-K36 PolarHBondContact O-N 3.2Å; K32-K36 VanDerWaalsContact O-N 3.11Å; L33-K36 PolarHBondContact O-N 2.73Å; K36-P38 VanDerWaalsContact C-CD 3.47Å; K36-P38 WeakPolarHBondContact O-CD 3.18Å |
| 37 | Y | 80.7 | Confident | 78.4 | Confident | 128 Ų | 128 | 101.4 Ų | 101.4 | 50% | 0.502 | 54% | 0.536 | S | S | . | . | trans | -123.1 | 69.4 | -175.1 | -54.8 | -73.7 | 0 | 0 | 0 | 110.5 | L33 L34 N39 I40 | L33-Y37 HydrophobicContact CD2-CD2 4.44Å; L33-Y37 HydrophobicContact CD2-CE2 4.09Å; L33-Y37 WeakPolarHBondContact O-CB 3.47Å; L33-Y37 VanDerWaalsContact O-CD2 3.24Å; L33-Y37 WeakPolarHBondContact O-CD2 3.39Å; L33-Y37 PolarHBondContact O-N 3.14Å; L34-Y37 CarbonylContact O-C 3.5Å; L34-Y37 PolarHBondContact O-N 3.27Å; Y37-N39 PolarHBondContact O-N 3.13Å; Y37-I40 HydrophobicContact CG-CD1 4.36Å; Y37-I40 PolarHBondContact O-N 3.1Å | ||
| 38 | P | 79.2 | Confident | 78.7 | Confident | 70 Ų | 70 | 102.6 Ų | 102.6 | 46% | 0.455 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -13.5 | -175.8 | 25.9 | -35.9 | 0 | 0 | 0 | 113.3 | L34 K36 K42 | L34-P38 WeakPolarHBondContact O-CA 3.18Å; K36-P38 VanDerWaalsContact C-CD 3.47Å; K36-P38 WeakPolarHBondContact O-CD 3.18Å; P38-K42 WeakPolarHBondContact O-CE 3.03Å; P38-K42 WeakPolarHBondContact O-CG 3.02Å |
| 39 | N | 77.4 | Confident | 79.1 | Confident | 108 Ų | 108 | 108.3 Ų | 108.3 | 58% | 0.578 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | -9.6 | -178.7 | -56.1 | -37.7 | 0 | 0 | 0 | 113.3 | Y37 A41 K42 | Y37-N39 PolarHBondContact O-N 3.13Å; N39-A41 VanDerWaalsContact C-N 3.35Å; N39-A41 PolarHBondContact O-N 2.71Å; N39-K42 PolarHBondContact OD1-NZ 3.42Å |
| 40 | I | 72.8 | Confident | 79.3 | Confident | 115 Ų | 115 | 105.7 Ų | 105.7 | 59% | 0.59 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -69.7 | -32.2 | -177.3 | -122.2 | 88.2 | 0 | 0 | 0 | 112.1 | Y37 | Y37-I40 HydrophobicContact CG-CD1 4.36Å; Y37-I40 PolarHBondContact O-N 3.1Å |
| 41 | A | 67.8 | Low | 79.6 | Confident | 57 Ų | 57 | 102.6 Ų | 102.6 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -97 | -20.6 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L34 N39 N43 G44 | L34-A41 HydrophobicContact CD1-CB 3.48Å; L34-A41 VanDerWaalsContact CD1-CB 3.48Å; N39-A41 VanDerWaalsContact C-N 3.35Å; N39-A41 PolarHBondContact O-N 2.71Å; A41-N43 PolarHBondContact O-N 2.84Å; A41-N43 VanDerWaalsContact O-N 3.14Å; A41-G44 PolarHBondContact O-N 3.45Å |
| 42 | K | 67.3 | Low | 80 | Confident | 158 Ų | 158 | 104.8 Ų | 104.8 | 69% | 0.687 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -25 | -167.3 | -72.6 | 176.8 | -177.8 | 164.9 | 0 | 114.4 | P38 N39 | P38-K42 WeakPolarHBondContact O-CE 3.03Å; P38-K42 WeakPolarHBondContact O-CG 3.02Å; N39-K42 PolarHBondContact OD1-NZ 3.42Å |
| 43 | N | 66.1 | Low | 80 | Confident | 98 Ų | 98 | 106 Ų | 106 | 52% | 0.524 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120.6 | 1.5 | -176.9 | 56.6 | 1.5 | 0 | 0 | 0 | 113.1 | A41 Q45 | A41-N43 PolarHBondContact O-N 2.84Å; A41-N43 VanDerWaalsContact O-N 3.14Å; N43-Q45 HydrophobicContact CB-CB 4.33Å; N43-Q45 HydrophobicContact CB-CG 4.06Å; N43-Q45 WeakPolarHBondContact O-CG 3.18Å; N43-Q45 PolarHBondContact O-N 3.33Å; N43-Q45 PolarHBondContact OD1-N 3.01Å |
| 44 | G | 67.6 | Low | 80.3 | Confident | 60 Ų | 60 | 107.1 Ų | 107.1 | 62% | 0.619 | 55% | 0.548 | S | S | * | . | trans | 53.9 | 10.7 | -174 | 0 | 0 | 0 | 0 | 0 | 113.7 | A41 F46 | A41-G44 PolarHBondContact O-N 3.45Å; G44-F46 PolarHBondContact O-N 3.08Å | ||
| 45 | Q | 70.8 | Confident | 80.5 | Confident | 126 Ų | 126 | 110.7 Ų | 110.7 | 59% | 0.589 | 56% | 0.562 | S | S | * | * | trans | -97.8 | 96.1 | -174 | -61.2 | -135.7 | -51.8 | 0 | 0 | 106.7 | N43 | N43-Q45 HydrophobicContact CB-CB 4.33Å; N43-Q45 HydrophobicContact CB-CG 4.06Å; N43-Q45 WeakPolarHBondContact O-CG 3.18Å; N43-Q45 PolarHBondContact O-N 3.33Å; N43-Q45 PolarHBondContact OD1-N 3.01Å | ||
| 46 | F | 76.3 | Confident | 80.6 | Confident | 142 Ų | 142 | 111.6 Ų | 111.6 | 62% | 0.623 | 55% | 0.552 | S | S | * | * | trans | -51.5 | 147.8 | 160.4 | -63.7 | -76.7 | 0 | 0 | 0 | 109.1 | G44 Q48 Q51 | G44-F46 PolarHBondContact O-N 3.08Å; F46-Q48 PolarHBondContact O-N 3.47Å; F46-Q51 HydrophobicContact CB-CG 3.96Å | ||
| 47 | S | 85.4 | Confident | 80.2 | Confident | 67 Ų | 67 | 113.8 Ų | 113.8 | 47% | 0.469 | 56% | 0.557 | S | S | . | * | trans | -55.1 | 130.4 | -178.7 | 74.1 | 0 | 0 | 0 | 0 | 109.8 | F49 L50 Q51 | S47-F49 PolarHBondContact O-N 3.06Å; S47-F49 VanDerWaalsContact O-N 3.1Å; S47-L50 WeakPolarHBondContact O-CA 3.27Å; S47-L50 WeakPolarHBondContact O-CB 3.33Å; S47-L50 PolarHBondContact O-N 2.76Å; S47-L50 WeakPolarHBondContact OG-CB 3.32Å; S47-L50 PolarHBondContact OG-N 3.47Å; S47-Q51 PolarHBondContact O-N 3.43Å | ||
| 48 | Q | 86.5 | Confident | 80.3 | Confident | 132 Ų | 132 | 116.3 Ų | 116.3 | 62% | 0.617 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -53.5 | -34.9 | -180 | -72.9 | -73.7 | 12.1 | 0 | 0 | 111.6 | F46 Q51 K52 | F46-Q48 PolarHBondContact O-N 3.47Å; Q48-Q51 PolarHBondContact O-N 3.42Å; Q48-Q51 VanDerWaalsContact OE1-OE1 3.14Å; Q48-K52 WeakPolarHBondContact O-CB 3.15Å; Q48-K52 PolarHBondContact O-N 2.54Å |
| 49 | F | 90.4 | Very high | 80.7 | Confident | 164 Ų | 164 | 123 Ų | 123 | 72% | 0.719 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -60.9 | -47.2 | 173.2 | -178.8 | -101.6 | 0 | 0 | 0 | 112.5 | S47 K52 R53 | S47-F49 PolarHBondContact O-N 3.06Å; S47-F49 VanDerWaalsContact O-N 3.1Å; F49-K52 PolarHBondContact O-N 3.09Å; F49-R53 PolarHBondContact O-N 2.82Å |
| 50 | L | 87.6 | Confident | 81 | Confident | 74 Ų | 74 | 121.8 Ų | 121.8 | 39% | 0.387 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.1 | -42.8 | 177.8 | -179.7 | 61.6 | 0 | 0 | 0 | 111.3 | S47 K52 R53 L54 | S47-L50 WeakPolarHBondContact O-CA 3.27Å; S47-L50 WeakPolarHBondContact O-CB 3.33Å; S47-L50 PolarHBondContact O-N 2.76Å; S47-L50 WeakPolarHBondContact OG-CB 3.32Å; S47-L50 PolarHBondContact OG-N 3.47Å; L50-K52 VanDerWaalsContact C-N 3.34Å; L50-K52 PolarHBondContact O-N 3.49Å; L50-R53 CarbonylContact O-C 3.1Å; L50-R53 WeakPolarHBondContact O-CB 3.35Å; L50-R53 PolarHBondContact O-N 2.82Å; L50-R53 VanDerWaalsContact O-N 3.1Å; L50-L54 HydrophobicContact CD1-CD1 4.38Å; L50-L54 HydrophobicContact CD1-CG 4.2Å; L50-L54 HydrophobicContact CG-CD1 4.07Å; L50-L54 HydrophobicContact CG-CG 4.32Å; L50-L54 WeakPolarHBondContact O-CB 3.42Å; L50-L54 WeakPolarHBondContact O-CG 3.49Å; L50-L54 PolarHBondContact O-N 2.86Å |
| 51 | Q | 88.9 | Confident | 81.7 | Confident | 61 Ų | 61 | 120.8 Ų | 120.8 | 29% | 0.285 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -57.4 | -48.8 | 175 | -70.7 | -177.9 | -31 | 0 | 0 | 110.5 | F46 S47 Q48 R53 L54 H55 | F46-Q51 HydrophobicContact CB-CG 3.96Å; S47-Q51 PolarHBondContact O-N 3.43Å; Q48-Q51 PolarHBondContact O-N 3.42Å; Q48-Q51 VanDerWaalsContact OE1-OE1 3.14Å; Q51-R53 VanDerWaalsContact C-N 3.27Å; Q51-R53 PolarHBondContact O-N 2.82Å; Q51-L54 PolarHBondContact O-N 2.83Å; Q51-H55 PolarHBondContact O-N 3.33Å; Q51-H55 PolarHBondContact O-ND1 2.91Å |
| 52 | K | 91.6 | Very high | 83 | Confident | 132 Ų | 132 | 122 Ų | 122 | 57% | 0.574 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -56.5 | -42.2 | 175.3 | -176.8 | 175.3 | 178 | 178.4 | 0 | 111.7 | Q48 F49 L50 H55 Q56 | Q48-K52 WeakPolarHBondContact O-CB 3.15Å; Q48-K52 PolarHBondContact O-N 2.54Å; F49-K52 PolarHBondContact O-N 3.09Å; L50-K52 VanDerWaalsContact C-N 3.34Å; L50-K52 PolarHBondContact O-N 3.49Å; K52-H55 PolarHBondContact O-N 2.85Å; K52-Q56 VanDerWaalsContact CE-NE2 3.27Å; K52-Q56 WeakPolarHBondContact O-CB 3.32Å; K52-Q56 WeakPolarHBondContact O-CG 3.5Å; K52-Q56 PolarHBondContact O-N 3.48Å |
| 53 | R | 89.3 | Confident | 84.3 | Confident | 163 Ų | 163 | 115.7 Ų | 115.7 | 62% | 0.615 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68 | -37.9 | 178.8 | -171.3 | 60.6 | 172.6 | -176.7 | -0.9 | 112.9 | F49 L50 Q51 Q56 | F49-R53 PolarHBondContact O-N 2.82Å; L50-R53 CarbonylContact O-C 3.1Å; L50-R53 WeakPolarHBondContact O-CB 3.35Å; L50-R53 PolarHBondContact O-N 2.82Å; L50-R53 VanDerWaalsContact O-N 3.1Å; Q51-R53 VanDerWaalsContact C-N 3.27Å; Q51-R53 PolarHBondContact O-N 2.82Å; R53-Q56 CarbonylContact O-C 3.58Å; R53-Q56 PolarHBondContact O-N 3.4Å |
| 54 | L | 86.4 | Confident | 85.5 | Confident | 103 Ų | 103 | 113.9 Ų | 113.9 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69.4 | -41.4 | 175.8 | -73.6 | 175.5 | 0 | 0 | 0 | 111.4 | L50 Q51 Q56 R57 | L50-L54 HydrophobicContact CD1-CD1 4.38Å; L50-L54 HydrophobicContact CD1-CG 4.2Å; L50-L54 HydrophobicContact CG-CD1 4.07Å; L50-L54 HydrophobicContact CG-CG 4.32Å; L50-L54 WeakPolarHBondContact O-CB 3.42Å; L50-L54 WeakPolarHBondContact O-CG 3.49Å; L50-L54 PolarHBondContact O-N 2.86Å; Q51-L54 PolarHBondContact O-N 2.83Å; L54-Q56 VanDerWaalsContact C-N 3.26Å; L54-Q56 PolarHBondContact O-N 3.49Å; L54-R57 WeakPolarHBondContact O-CD 3.36Å; L54-R57 WeakPolarHBondContact O-CG 3.14Å; L54-R57 PolarHBondContact O-N 3.36Å |
| 55 | H | 86.3 | Confident | 86.7 | Confident | 154 Ų | 154 | 117.3 Ų | 117.3 | 71% | 0.713 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.4 | -30 | 173.3 | -64.3 | 108.4 | 0 | 0 | 0 | 112.1 | Q51 K52 R57 | Q51-H55 PolarHBondContact O-N 3.33Å; Q51-H55 PolarHBondContact O-ND1 2.91Å; K52-H55 PolarHBondContact O-N 2.85Å; H55-R57 PolarHBondContact O-N 3.19Å |
| 56 | Q | 85.9 | Confident | 87.7 | Confident | 101 Ų | 101 | 116.8 Ų | 116.8 | 47% | 0.472 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | 39.5 | 171.4 | -69.6 | 175.7 | 2.8 | 0 | 0 | 113 | K52 R53 L54 K58 | K52-Q56 VanDerWaalsContact CE-NE2 3.27Å; K52-Q56 WeakPolarHBondContact O-CB 3.32Å; K52-Q56 WeakPolarHBondContact O-CG 3.5Å; K52-Q56 PolarHBondContact O-N 3.48Å; R53-Q56 CarbonylContact O-C 3.58Å; R53-Q56 PolarHBondContact O-N 3.4Å; L54-Q56 VanDerWaalsContact C-N 3.26Å; L54-Q56 PolarHBondContact O-N 3.49Å; Q56-K58 PolarHBondContact O-N 3.42Å; Q56-K58 VanDerWaalsContact O-N 3.14Å |
| 57 | R | 79.7 | Confident | 88.4 | Confident | 176 Ų | 176 | 114.7 Ų | 114.7 | 66% | 0.664 | 54% | 0.539 | S | S | * | . | trans | -61.2 | 122.2 | 164.2 | -57.6 | -53.8 | -81.2 | 110 | 9.2 | 107 | L54 H55 Y59 | L54-R57 WeakPolarHBondContact O-CD 3.36Å; L54-R57 WeakPolarHBondContact O-CG 3.14Å; L54-R57 PolarHBondContact O-N 3.36Å; H55-R57 PolarHBondContact O-N 3.19Å; R57-Y59 PolarHBondContact O-N 3.35Å | ||
| 58 | K | 83.4 | Confident | 88.5 | Confident | 181 Ų | 181 | 112.4 Ų | 112.4 | 79% | 0.787 | 52% | 0.524 | S | S | * | . | trans | -63.9 | 109.3 | 168.5 | -63.1 | -165 | 71.6 | 178.2 | 0 | 106.7 | Q56 F60 | Q56-K58 PolarHBondContact O-N 3.42Å; Q56-K58 VanDerWaalsContact O-N 3.14Å; K58-F60 PolarHBondContact O-N 2.94Å | ||
| 59 | Y | 87.5 | Confident | 88.4 | Confident | 212 Ų | 212 | 114.2 Ų | 114.2 | 83% | 0.831 | 53% | 0.529 | S | S | * | . | P | Polyproline II helix | trans | -59.4 | 130.8 | 161.7 | -65.2 | -77.6 | 0 | 0 | 0 | 106.6 | R57 D61 | R57-Y59 PolarHBondContact O-N 3.35Å; Y59-D61 PolarHBondContact O-N 3.33Å |
| 60 | F | 84 | Confident | 88.2 | Confident | 81 Ų | 81 | 110.6 Ų | 110.6 | 36% | 0.355 | 53% | 0.53 | S | S | . | . | P | Polyproline II helix | trans | -77.8 | 116.9 | -177 | -175.9 | -71 | 0 | 0 | 0 | 107.1 | K58 D64 Y65 A68 | K58-F60 PolarHBondContact O-N 2.94Å; F60-D64 HydrophobicContact CD1-CB 4.06Å; F60-D64 HydrophobicContact CD2-CB 4.19Å; F60-D64 HydrophobicContact CE1-CB 3.55Å; F60-D64 HydrophobicContact CE2-CB 3.78Å; F60-D64 HydrophobicContact CG-CB 4.35Å; F60-D64 HydrophobicContact CZ-CB 3.46Å; F60-D64 VanDerWaalsContact CZ-CB 3.46Å; F60-D64 WeakPolarHBondContact CZ-O 3.48Å; F60-Y65 AromaticContact CD1-CD1 3.73Å; F60-Y65 HydrophobicContact CD1-CD1 3.73Å; F60-Y65 AromaticContact CD1-CD2 3.27Å; F60-Y65 HydrophobicContact CD1-CD2 3.27Å; F60-Y65 AromaticContact CD1-CE1 3.52Å; F60-Y65 HydrophobicContact CD1-CE1 3.52Å; F60-Y65 AromaticContact CD1-CE2 3.05Å; F60-Y65 HydrophobicContact CD1-CE2 3.05Å; F60-Y65 AromaticContact CD1-CG 3.59Å; F60-Y65 HydrophobicContact CD1-CG 3.59Å; F60-Y65 AromaticContact CD1-CZ 3.16Å; F60-Y65 VanDerWaalsContact CE1-CB 3.47Å; F60-Y65 AromaticContact CE1-CD1 3.08Å; F60-Y65 HydrophobicContact CE1-CD1 3.08Å; F60-Y65 AromaticContact CE1-CD2 3.13Å; F60-Y65 HydrophobicContact CE1-CD2 3.13Å; F60-Y65 AromaticContact CE1-CE1 3.35Å; F60-Y65 HydrophobicContact CE1-CE1 3.35Å; F60-Y65 AromaticContact CE1-CE2 3.42Å; F60-Y65 HydrophobicContact CE1-CE2 3.42Å; F60-Y65 VanDerWaalsContact CE1-CE2 3.42Å; F60-Y65 AromaticContact CE1-CG 2.93Å; F60-Y65 HydrophobicContact CE1-CG 2.93Å; F60-Y65 AromaticContact CE1-CZ 3.5Å; F60-Y65 VanDerWaalsContact CE1-CZ 3.5Å; F60-Y65 HydrophobicContact CE2-CE1 4.49Å; F60-Y65 HydrophobicContact CG-CE1 4.2Å; F60-Y65 HydrophobicContact CG-CE2 4.08Å; F60-Y65 AromaticContact CG-CZ 3.85Å; F60-Y65 AromaticContact CZ-CD1 3.51Å; F60-Y65 HydrophobicContact CZ-CD1 3.51Å; F60-Y65 HydrophobicContact CZ-CD2 4.32Å; F60-Y65 AromaticContact CZ-CE1 3.83Å; F60-Y65 HydrophobicContact CZ-CE1 3.83Å; F60-Y65 AromaticContact CZ-CG 3.76Å; F60-Y65 HydrophobicContact CZ-CG 3.76Å; F60-A68 HydrophobicContact CZ-CB 4.28Å |
| 61 | D | 88 | Confident | 88 | Confident | 95 Ų | 95 | 114 Ų | 114 | 51% | 0.508 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -71.8 | 149.2 | -179.8 | -177.5 | 14.8 | 0 | 0 | 0 | 110.4 | Y59 G63 D64 Y65 | Y59-D61 PolarHBondContact O-N 3.33Å; D61-G63 PolarHBondContact O-N 3.39Å; D61-G63 VanDerWaalsContact O-N 3.16Å; D61-G63 PolarHBondContact OD1-N 3.16Å; D61-D64 WeakPolarHBondContact O-CA 3.15Å; D61-D64 WeakPolarHBondContact O-CB 3.42Å; D61-D64 PolarHBondContact O-N 2.99Å; D61-Y65 PolarHBondContact O-N 2.72Å |
| 62 | S | 94.5 | Very high | 87 | Confident | 82 Ų | 82 | 113.7 Ų | 113.7 | 57% | 0.573 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -49.2 | -34.6 | 166.2 | 63.4 | 0 | 0 | 0 | 0 | 112.7 | Y65 N66 | S62-Y65 PolarHBondContact O-N 3.19Å; S62-N66 PolarHBondContact O-N 3.26Å |
| 63 | G | 94 | Very high | 85.3 | Confident | 26 Ų | 26 | 112.9 Ų | 112.9 | 27% | 0.268 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.3 | -40.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | D61 Y65 N66 M67 | D61-G63 PolarHBondContact O-N 3.39Å; D61-G63 VanDerWaalsContact O-N 3.16Å; D61-G63 PolarHBondContact OD1-N 3.16Å; G63-Y65 PolarHBondContact O-N 3.45Å; G63-N66 PolarHBondContact O-N 2.71Å; G63-M67 PolarHBondContact O-N 3.39Å |
| 64 | D | 92.1 | Very high | 83.6 | Confident | 59 Ų | 59 | 114.2 Ų | 114.2 | 32% | 0.316 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.7 | -30.5 | 175.1 | -72.5 | -28.5 | 0 | 0 | 0 | 111 | F60 D61 M67 A68 | F60-D64 HydrophobicContact CD1-CB 4.06Å; F60-D64 HydrophobicContact CD2-CB 4.19Å; F60-D64 HydrophobicContact CE1-CB 3.55Å; F60-D64 HydrophobicContact CE2-CB 3.78Å; F60-D64 HydrophobicContact CG-CB 4.35Å; F60-D64 HydrophobicContact CZ-CB 3.46Å; F60-D64 VanDerWaalsContact CZ-CB 3.46Å; F60-D64 WeakPolarHBondContact CZ-O 3.48Å; D61-D64 WeakPolarHBondContact O-CA 3.15Å; D61-D64 WeakPolarHBondContact O-CB 3.42Å; D61-D64 PolarHBondContact O-N 2.99Å; D64-M67 PolarHBondContact O-N 3.34Å; D64-M67 WeakPolarHBondContact OD1-CE 3.07Å; D64-A68 WeakPolarHBondContact O-CB 3.44Å; D64-A68 PolarHBondContact O-N 3.01Å |
| 65 | Y | 92.4 | Very high | 82 | Confident | 132 Ų | 132 | 116.8 Ų | 116.8 | 52% | 0.518 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -70.3 | -44.6 | -175.1 | -89.4 | -55 | 0 | 0 | 0 | 107.7 | F60 D61 S62 G63 M67 A68 K69 | F60-Y65 AromaticContact CD1-CD1 3.73Å; F60-Y65 HydrophobicContact CD1-CD1 3.73Å; F60-Y65 AromaticContact CD1-CD2 3.27Å; F60-Y65 HydrophobicContact CD1-CD2 3.27Å; F60-Y65 AromaticContact CD1-CE1 3.52Å; F60-Y65 HydrophobicContact CD1-CE1 3.52Å; F60-Y65 AromaticContact CD1-CE2 3.05Å; F60-Y65 HydrophobicContact CD1-CE2 3.05Å; F60-Y65 AromaticContact CD1-CG 3.59Å; F60-Y65 HydrophobicContact CD1-CG 3.59Å; F60-Y65 AromaticContact CD1-CZ 3.16Å; F60-Y65 VanDerWaalsContact CE1-CB 3.47Å; F60-Y65 AromaticContact CE1-CD1 3.08Å; F60-Y65 HydrophobicContact CE1-CD1 3.08Å; F60-Y65 AromaticContact CE1-CD2 3.13Å; F60-Y65 HydrophobicContact CE1-CD2 3.13Å; F60-Y65 AromaticContact CE1-CE1 3.35Å; F60-Y65 HydrophobicContact CE1-CE1 3.35Å; F60-Y65 AromaticContact CE1-CE2 3.42Å; F60-Y65 HydrophobicContact CE1-CE2 3.42Å; F60-Y65 VanDerWaalsContact CE1-CE2 3.42Å; F60-Y65 AromaticContact CE1-CG 2.93Å; F60-Y65 HydrophobicContact CE1-CG 2.93Å; F60-Y65 AromaticContact CE1-CZ 3.5Å; F60-Y65 VanDerWaalsContact CE1-CZ 3.5Å; F60-Y65 HydrophobicContact CE2-CE1 4.49Å; F60-Y65 HydrophobicContact CG-CE1 4.2Å; F60-Y65 HydrophobicContact CG-CE2 4.08Å; F60-Y65 AromaticContact CG-CZ 3.85Å; F60-Y65 AromaticContact CZ-CD1 3.51Å; F60-Y65 HydrophobicContact CZ-CD1 3.51Å; F60-Y65 HydrophobicContact CZ-CD2 4.32Å; F60-Y65 AromaticContact CZ-CE1 3.83Å; F60-Y65 HydrophobicContact CZ-CE1 3.83Å; F60-Y65 AromaticContact CZ-CG 3.76Å; F60-Y65 HydrophobicContact CZ-CG 3.76Å; D61-Y65 PolarHBondContact O-N 2.72Å; S62-Y65 PolarHBondContact O-N 3.19Å; G63-Y65 PolarHBondContact O-N 3.45Å; Y65-M67 VanDerWaalsContact C-N 3.34Å; Y65-M67 PolarHBondContact O-N 3.14Å; Y65-A68 PolarHBondContact O-N 3.35Å; Y65-K69 VanDerWaalsContact O-CB 3.27Å; Y65-K69 WeakPolarHBondContact O-CB 3.44Å; Y65-K69 WeakPolarHBondContact O-CG 3.43Å; Y65-K69 PolarHBondContact O-N 3.05Å |
| 66 | N | 91.3 | Very high | 80.1 | Confident | 116 Ų | 116 | 113.9 Ų | 113.9 | 62% | 0.62 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62 | -44.1 | 177.8 | -65 | -18.8 | 0 | 0 | 0 | 111 | S62 G63 K69 A70 | S62-N66 PolarHBondContact O-N 3.26Å; G63-N66 PolarHBondContact O-N 2.71Å; N66-K69 PolarHBondContact O-N 3.39Å; N66-A70 VanDerWaalsContact O-CB 3.25Å; N66-A70 WeakPolarHBondContact O-CB 3.24Å; N66-A70 PolarHBondContact O-N 3.49Å |
| 67 | M | 90.7 | Very high | 78.1 | Confident | 98 Ų | 98 | 114.2 Ų | 114.2 | 48% | 0.483 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.4 | -43.9 | 176 | -71.7 | -170.1 | -69.8 | 0 | 0 | 112.6 | G63 D64 Y65 K69 A70 K71 | G63-M67 PolarHBondContact O-N 3.39Å; D64-M67 PolarHBondContact O-N 3.34Å; D64-M67 WeakPolarHBondContact OD1-CE 3.07Å; Y65-M67 VanDerWaalsContact C-N 3.34Å; Y65-M67 PolarHBondContact O-N 3.14Å; M67-K69 VanDerWaalsContact C-N 3.35Å; M67-A70 PolarHBondContact O-N 2.86Å; M67-K71 WeakPolarHBondContact O-CB 3.48Å; M67-K71 WeakPolarHBondContact O-CG 3.37Å; M67-K71 PolarHBondContact O-N 3.41Å |
| 68 | A | 88.2 | Confident | 76.1 | Confident | 18 Ų | 18 | 110.4 Ų | 110.4 | 15% | 0.149 | 59% | 0.585 | C | S | . | * | H | α-helix | trans | -65 | -40.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | F60 D64 Y65 K71 G72 F75 | F60-A68 HydrophobicContact CZ-CB 4.28Å; D64-A68 WeakPolarHBondContact O-CB 3.44Å; D64-A68 PolarHBondContact O-N 3.01Å; Y65-A68 PolarHBondContact O-N 3.35Å; A68-K71 PolarHBondContact O-N 3.19Å; A68-G72 PolarHBondContact O-N 2.93Å; A68-F75 HydrophobicContact CB-CE2 4.01Å; A68-F75 HydrophobicContact CB-CZ 4.12Å |
| 69 | K | 85.2 | Confident | 74 | Confident | 170 Ų | 170 | 106 Ų | 106 | 74% | 0.739 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.9 | -47.3 | 173.6 | -73.9 | -72.2 | -173.2 | 177.4 | 0 | 111.5 | Y65 N66 M67 K71 G72 | Y65-K69 VanDerWaalsContact O-CB 3.27Å; Y65-K69 WeakPolarHBondContact O-CB 3.44Å; Y65-K69 WeakPolarHBondContact O-CG 3.43Å; Y65-K69 PolarHBondContact O-N 3.05Å; N66-K69 PolarHBondContact O-N 3.39Å; M67-K69 VanDerWaalsContact C-N 3.35Å; K69-K71 VanDerWaalsContact C-N 3.32Å; K69-K71 PolarHBondContact O-N 2.8Å; K69-G72 PolarHBondContact O-N 3.48Å; K69-G72 VanDerWaalsContact O-N 3.08Å |
| 70 | A | 86.5 | Confident | 72.1 | Confident | 89 Ų | 89 | 101.6 Ų | 101.6 | 74% | 0.736 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.2 | -38 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | N66 M67 G72 | N66-A70 VanDerWaalsContact O-CB 3.25Å; N66-A70 WeakPolarHBondContact O-CB 3.24Å; N66-A70 PolarHBondContact O-N 3.49Å; M67-A70 PolarHBondContact O-N 2.86Å; A70-G72 PolarHBondContact O-N 3.1Å |
| 71 | K | 82 | Confident | 70.1 | Confident | 145 Ų | 145 | 101.2 Ų | 101.2 | 63% | 0.63 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -19.7 | 174 | -85.7 | 176.1 | -174.9 | -179.7 | 0 | 112.3 | M67 A68 K69 L73 | M67-K71 WeakPolarHBondContact O-CB 3.48Å; M67-K71 WeakPolarHBondContact O-CG 3.37Å; M67-K71 PolarHBondContact O-N 3.41Å; A68-K71 PolarHBondContact O-N 3.19Å; K69-K71 VanDerWaalsContact C-N 3.32Å; K69-K71 PolarHBondContact O-N 2.8Å; K71-L73 HydrophobicContact CB-CD1 3.67Å; K71-L73 HydrophobicContact CD-CD1 4.37Å; K71-L73 HydrophobicContact CG-CD1 4.23Å; K71-L73 PolarHBondContact O-N 2.96Å |
| 72 | G | 67.8 | Low | 67.9 | Low | 55 Ų | 55 | 103.9 Ų | 103.9 | 57% | 0.567 | 60% | 0.6 | S | S | * | * | trans | 59.6 | 3.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | A68 K69 A70 K74 | A68-G72 PolarHBondContact O-N 2.93Å; K69-G72 PolarHBondContact O-N 3.48Å; K69-G72 VanDerWaalsContact O-N 3.08Å; A70-G72 PolarHBondContact O-N 3.1Å; G72-K74 PolarHBondContact O-N 3.18Å | ||
| 73 | L | 55.7 | Low | 65.7 | Low | 115 Ų | 115 | 109.1 Ų | 109.1 | 60% | 0.602 | 61% | 0.613 | S | S | * | * | trans | -66.6 | 93.7 | 171.7 | -82.8 | 113.6 | 0 | 0 | 0 | 105 | K71 F75 | K71-L73 HydrophobicContact CB-CD1 3.67Å; K71-L73 HydrophobicContact CD-CD1 4.37Å; K71-L73 HydrophobicContact CG-CD1 4.23Å; K71-L73 PolarHBondContact O-N 2.96Å; L73-F75 PolarHBondContact O-N 3.44Å | ||
| 74 | K | 53.3 | Low | 63 | Low | 190 Ų | 190 | 112.5 Ų | 112.5 | 83% | 0.826 | 64% | 0.639 | S | S | * | * | trans | -46.2 | 102.2 | 150.2 | -63.8 | 168.3 | -175.2 | 161.5 | 0 | 103.6 | G72 P76 | G72-K74 PolarHBondContact O-N 3.18Å; K74-P76 WeakPolarHBondContact O-CD 3.46Å | ||
| 75 | F | 53.7 | Low | 60.6 | Low | 157 Ų | 157 | 114.3 Ų | 114.3 | 69% | 0.689 | 66% | 0.662 | S | S | * | * | trans | -56 | 112.4 | 167.6 | -70.1 | -80.8 | 0 | 0 | 0 | 103.7 | A68 L73 A77 | A68-F75 HydrophobicContact CB-CE2 4.01Å; A68-F75 HydrophobicContact CB-CZ 4.12Å; L73-F75 PolarHBondContact O-N 3.44Å; F75-A77 PolarHBondContact O-N 2.86Å | ||
| 76 | P | 47.4 | Very low | 58.3 | Low | 94 Ų | 94 | 115.1 Ų | 115.1 | 61% | 0.61 | 67% | 0.67 | S | S | * | * | trans | -59.3 | 119.9 | 169.2 | 28.5 | -32.1 | 0 | 0 | 0 | 103.6 | K74 T78 | K74-P76 WeakPolarHBondContact O-CD 3.46Å; P76-T78 WeakPolarHBondContact CB-OG1 3.4Å; P76-T78 PolarHBondContact O-N 3.3Å | ||
| 77 | A | 42.2 | Very low | 56.2 | Low | 108 Ų | 108 | 114.9 Ų | 114.9 | 89% | 0.893 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -66.1 | 72.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 105.7 | F75 | F75-A77 PolarHBondContact O-N 2.86Š|
| 78 | T | 37.7 | Very low | 54 | Low | 96 Ų | 96 | 117.2 Ų | 117.2 | 59% | 0.589 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -159.4 | 124.4 | -174.1 | -17.4 | 0 | 0 | 0 | 0 | 106 | P76 | P76-T78 WeakPolarHBondContact CB-OG1 3.4Å; P76-T78 PolarHBondContact O-N 3.3Å |
| 79 | S | 39.7 | Very low | 52.2 | Low | 89 Ų | 89 | 120.7 Ų | 120.7 | 62% | 0.622 | 72% | 0.721 | S | S | * | * | trans | -36.4 | 149.4 | -177.1 | 45.9 | 0 | 0 | 0 | 0 | 114.8 | A81 | S79-A81 PolarHBondContact O-N 2.99Š| ||
| 80 | P | 48.8 | Very low | 50.7 | Low | 119 Ų | 119 | 120 Ų | 120 | 77% | 0.773 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 68.7 | -174.6 | 31.2 | -37.9 | 0 | 0 | 0 | 113.5 | F83 | P80-F83 HydrophobicContact CB-CE2 4.36Š|
| 81 | A | 40.7 | Very low | 49 | Very low | 73 Ų | 73 | 120 Ų | 120 | 60% | 0.603 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121 | -17.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | S79 F83 | S79-A81 PolarHBondContact O-N 2.99Å; A81-F83 PolarHBondContact O-N 3.4Å |
| 82 | D | 42.8 | Very low | 48.2 | Very low | 150 Ų | 150 | 117.9 Ų | 117.9 | 80% | 0.802 | 73% | 0.728 | S | S | * | * | trans | -107.3 | 63.4 | -174.5 | -59.6 | -29.8 | 0 | 0 | 0 | 112.4 | A84 | D82-A84 PolarHBondContact O-N 2.95Š| ||
| 83 | F | 47.4 | Very low | 47.8 | Very low | 192 Ų | 192 | 118.9 Ų | 118.9 | 84% | 0.842 | 73% | 0.725 | S | S | * | * | trans | -89.3 | 78.6 | 166.1 | -76.7 | -87.3 | 0 | 0 | 0 | 109.6 | P80 A81 | P80-F83 HydrophobicContact CB-CE2 4.36Å; A81-F83 PolarHBondContact O-N 3.4Å | ||
| 84 | A | 37.2 | Very low | 48.3 | Very low | 98 Ų | 98 | 119.9 Ų | 119.9 | 81% | 0.81 | 73% | 0.729 | S | S | * | * | trans | -156.6 | 67.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | D82 | D82-A84 PolarHBondContact O-N 2.95Š| ||
| 85 | A | 42.8 | Very low | 49 | Very low | 96 Ų | 96 | 115.2 Ų | 115.2 | 79% | 0.793 | 72% | 0.72 | S | S | * | * | trans | 168.2 | 132.4 | 152 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 86 | Q | 44.3 | Very low | 49.7 | Very low | 149 Ų | 149 | 112.6 Ų | 112.6 | 70% | 0.696 | 71% | 0.71 | S | S | * | * | cis | -175.9 | 103.3 | 3.7 | -176.8 | 167.6 | 23.7 | 0 | 0 | 101.9 | D88 | Q86-D88 PolarHBondContact O-N 2.71Š| ||
| 87 | S | 45.3 | Very low | 50.6 | Low | 111 Ų | 111 | 112.4 Ų | 112.4 | 78% | 0.776 | 70% | 0.703 | S | S | * | * | 45.1 | 46.8 | 96.5 | 78.4 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 88 | D | 45.9 | Very low | 52.1 | Low | 148 Ų | 148 | 111.7 Ų | 111.7 | 79% | 0.791 | 69% | 0.688 | S | S | * | * | trans | -121.1 | 51.3 | 169.6 | -75.7 | -21.9 | 0 | 0 | 0 | 112.8 | Q86 | Q86-D88 PolarHBondContact O-N 2.71Š| ||
| 89 | A | 50.4 | Low | 53.8 | Low | 91 Ų | 91 | 113.8 Ų | 113.8 | 75% | 0.752 | 69% | 0.689 | S | S | * | * | trans | -121.6 | 0.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 90 | L | 53.4 | Low | 55.1 | Low | 156 Ų | 156 | 113.8 Ų | 113.8 | 82% | 0.817 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -115.7 | 76.7 | 176.9 | -55.3 | -172.3 | 0 | 0 | 0 | 109.8 | L92 | L90-L92 VanDerWaalsContact C-N 3.31Å; L90-L92 PolarHBondContact O-N 3.1Å |
| 91 | G | 50.3 | Low | 56 | Low | 89 Ų | 89 | 114.8 Ų | 114.8 | 92% | 0.918 | 67% | 0.674 | S | S | * | * | trans | -56.1 | 79.3 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 92 | L | 65.6 | Low | 56.9 | Low | 100 Ų | 100 | 119.1 Ų | 119.1 | 52% | 0.524 | 68% | 0.679 | S | S | . | * | trans | -90.2 | 146.5 | 174.8 | -68.6 | 175.5 | 0 | 0 | 0 | 111.4 | L90 | L90-L92 VanDerWaalsContact C-N 3.31Å; L90-L92 PolarHBondContact O-N 3.1Å | ||
| 93 | P | 58.8 | Low | 57.8 | Low | 75 Ų | 75 | 117.2 Ų | 117.2 | 49% | 0.487 | 67% | 0.667 | S | S | . | * | trans | -67.8 | 142.8 | -175.2 | 28 | -34.9 | 0 | 0 | 0 | 112.5 | S95 E96 | P93-S95 PolarHBondContact O-N 3.18Å; P93-E96 PolarHBondContact O-N 3.46Å | ||
| 94 | I | 67.2 | Low | 58.5 | Low | 136 Ų | 136 | 114.7 Ų | 114.7 | 70% | 0.697 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -53.2 | -30.9 | -169.5 | -64.1 | 168 | 0 | 0 | 0 | 113.7 | E96 I97 V98 | I94-E96 PolarHBondContact O-N 3.27Å; I94-I97 PolarHBondContact O-N 2.86Å; I94-V98 HydrophobicContact CG2-CG2 4.41Å; I94-V98 WeakPolarHBondContact O-CG2 3.31Å; I94-V98 PolarHBondContact O-N 3.29Å; I94-V98 VanDerWaalsContact O-N 3.11Å |
| 95 | S | 68.3 | Low | 59.3 | Low | 92 Ų | 92 | 114.4 Ų | 114.4 | 64% | 0.643 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -62.4 | -38.5 | 178.7 | 47.7 | 0 | 0 | 0 | 0 | 113.1 | P93 F99 | P93-S95 PolarHBondContact O-N 3.18Å; S95-F99 PolarHBondContact O-N 3.31Å |
| 96 | E | 68.5 | Low | 59.3 | Low | 102 Ų | 102 | 112.7 Ų | 112.7 | 48% | 0.477 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73 | -35.5 | 176.5 | -71.8 | -172.2 | -173.2 | 0 | 0 | 111.5 | P93 I94 V98 F99 L100 | P93-E96 PolarHBondContact O-N 3.46Å; I94-E96 PolarHBondContact O-N 3.27Å; E96-V98 VanDerWaalsContact C-N 3.33Å; E96-V98 PolarHBondContact O-N 3.33Å; E96-F99 PolarHBondContact O-N 2.93Å; E96-L100 WeakPolarHBondContact O-CB 3.5Å; E96-L100 WeakPolarHBondContact O-CG 3.38Å; E96-L100 PolarHBondContact O-N 3.25Å |
| 97 | I | 66 | Low | 59.1 | Low | 90 Ų | 90 | 109.5 Ų | 109.5 | 46% | 0.462 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -61.6 | -42.5 | 176.9 | -61.3 | 176.9 | 0 | 0 | 0 | 110.7 | I94 L100 K101 | I94-I97 PolarHBondContact O-N 2.86Å; I97-L100 PolarHBondContact O-N 3.42Å; I97-K101 WeakPolarHBondContact O-CB 3.45Å; I97-K101 PolarHBondContact O-N 3.41Å |
| 98 | V | 72.4 | Confident | 58.8 | Low | 93 Ų | 93 | 114.7 Ų | 114.7 | 56% | 0.564 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -67.8 | -39.4 | 178.5 | 177.3 | 0 | 0 | 0 | 0 | 111.4 | I94 E96 K101 K102 | I94-V98 HydrophobicContact CG2-CG2 4.41Å; I94-V98 WeakPolarHBondContact O-CG2 3.31Å; I94-V98 PolarHBondContact O-N 3.29Å; I94-V98 VanDerWaalsContact O-N 3.11Å; E96-V98 VanDerWaalsContact C-N 3.33Å; E96-V98 PolarHBondContact O-N 3.33Å; V98-K101 PolarHBondContact O-N 2.96Å; V98-K102 PolarHBondContact O-N 2.83Å |
| 99 | F | 74.3 | Confident | 59 | Low | 140 Ų | 140 | 115.3 Ų | 115.3 | 61% | 0.614 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -64.2 | -44.7 | 176 | -173 | -100.9 | 0 | 0 | 0 | 111.8 | S95 E96 K101 K102 I103 | S95-F99 PolarHBondContact O-N 3.31Å; E96-F99 PolarHBondContact O-N 2.93Å; F99-K101 VanDerWaalsContact C-N 3.34Å; F99-K101 PolarHBondContact O-N 3.03Å; F99-K102 WeakPolarHBondContact O-CB 3.42Å; F99-K102 PolarHBondContact O-N 3.02Å; F99-I103 HydrophobicContact CD1-CD1 4.05Å; F99-I103 HydrophobicContact CE1-CD1 3.76Å; F99-I103 PolarHBondContact O-N 3.35Å |
| 100 | L | 66.8 | Low | 58.7 | Low | 89 Ų | 89 | 114.5 Ų | 114.5 | 47% | 0.466 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -64.8 | -36.2 | 174.2 | -71.5 | 168.6 | 0 | 0 | 0 | 111.9 | E96 I97 K102 I103 I104 | E96-L100 WeakPolarHBondContact O-CB 3.5Å; E96-L100 WeakPolarHBondContact O-CG 3.38Å; E96-L100 PolarHBondContact O-N 3.25Å; I97-L100 PolarHBondContact O-N 3.42Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.04Å; L100-I103 HydrophobicContact CD2-CD1 4.39Å; L100-I103 WeakPolarHBondContact O-CB 3.47Å; L100-I103 PolarHBondContact O-N 3.45Å; L100-I104 VanDerWaalsContact O-CG1 3.32Å; L100-I104 WeakPolarHBondContact O-CG1 3.37Å; L100-I104 PolarHBondContact O-N 3.01Å |
| 101 | K | 66.8 | Low | 58.2 | Low | 141 Ų | 141 | 112 Ų | 112 | 61% | 0.613 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.9 | -36 | 173.8 | -124.4 | 179.3 | -177.7 | -178.7 | 0 | 112.3 | I97 V98 F99 I103 I104 S105 | I97-K101 WeakPolarHBondContact O-CB 3.45Å; I97-K101 PolarHBondContact O-N 3.41Å; V98-K101 PolarHBondContact O-N 2.96Å; F99-K101 VanDerWaalsContact C-N 3.34Å; F99-K101 PolarHBondContact O-N 3.03Å; K101-I103 VanDerWaalsContact C-N 3.34Å; K101-I104 PolarHBondContact O-N 3.48Å; K101-S105 WeakPolarHBondContact O-CB 3.07Å; K101-S105 PolarHBondContact O-N 2.86Å; K101-S105 PolarHBondContact O-OG 2.92Å |
| 102 | K | 60.5 | Low | 58 | Low | 163 Ų | 163 | 114.6 Ų | 114.6 | 71% | 0.709 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67.1 | -35.9 | 175.5 | -171.8 | 168.5 | -177.8 | 175.3 | 0 | 112.1 | V98 F99 L100 I104 S105 G106 | V98-K102 PolarHBondContact O-N 2.83Å; F99-K102 WeakPolarHBondContact O-CB 3.42Å; F99-K102 PolarHBondContact O-N 3.02Å; L100-K102 VanDerWaalsContact C-N 3.3Å; L100-K102 PolarHBondContact O-N 3.04Å; K102-I104 VanDerWaalsContact C-N 3.31Å; K102-S105 PolarHBondContact O-N 3.2Å; K102-G106 PolarHBondContact O-N 3.33Å |
| 103 | I | 61.3 | Low | 57.3 | Low | 110 Ų | 110 | 112.1 Ų | 112.1 | 56% | 0.564 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64 | -38.5 | 171.7 | -68.5 | 168.3 | 0 | 0 | 0 | 110.7 | F99 L100 K101 | F99-I103 HydrophobicContact CD1-CD1 4.05Å; F99-I103 HydrophobicContact CE1-CD1 3.76Å; F99-I103 PolarHBondContact O-N 3.35Å; L100-I103 HydrophobicContact CD2-CD1 4.39Å; L100-I103 WeakPolarHBondContact O-CB 3.47Å; L100-I103 PolarHBondContact O-N 3.45Å; K101-I103 VanDerWaalsContact C-N 3.34Å |
| 104 | I | 62.1 | Low | 57.3 | Low | 140 Ų | 140 | 113.2 Ų | 113.2 | 72% | 0.718 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -74.4 | -27.3 | 178.3 | -63.5 | 163.6 | 0 | 0 | 0 | 112.3 | L100 K101 K102 | L100-I104 VanDerWaalsContact O-CG1 3.32Å; L100-I104 WeakPolarHBondContact O-CG1 3.37Å; L100-I104 PolarHBondContact O-N 3.01Å; K101-I104 PolarHBondContact O-N 3.48Å; K102-I104 VanDerWaalsContact C-N 3.31Å |
| 105 | S | 54.8 | Low | 57 | Low | 92 Ų | 92 | 114.1 Ų | 114.1 | 64% | 0.643 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -96.8 | -8.3 | -171.7 | -49.2 | 0 | 0 | 0 | 0 | 114.9 | K101 K102 A107 | K101-S105 WeakPolarHBondContact O-CB 3.07Å; K101-S105 PolarHBondContact O-N 2.86Å; K101-S105 PolarHBondContact O-OG 2.92Å; K102-S105 PolarHBondContact O-N 3.2Å; S105-A107 PolarHBondContact O-N 2.78Å |
| 106 | G | 42.1 | Very low | 56.9 | Low | 59 Ų | 59 | 113.2 Ų | 113.2 | 61% | 0.608 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -85 | 90.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | K102 | K102-G106 PolarHBondContact O-N 3.33Š|
| 107 | A | 39.5 | Very low | 56.8 | Low | 83 Ų | 83 | 115.8 Ų | 115.8 | 69% | 0.686 | 68% | 0.676 | S | S | * | * | trans | -40.1 | 135.2 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | S105 | S105-A107 PolarHBondContact O-N 2.78Š| ||
| 108 | R | 40.7 | Very low | 57.6 | Low | 220 Ų | 220 | 117.2 Ų | 117.2 | 83% | 0.83 | 68% | 0.681 | S | S | * | * | -179.4 | 145 | 80.3 | -79.2 | 162.3 | -179.4 | -169.4 | -5.7 | 109.5 | |||||
| 109 | D | 48.4 | Very low | 57.7 | Low | 161 Ų | 161 | 119.7 Ų | 119.7 | 86% | 0.861 | 69% | 0.689 | S | S | * | * | trans | 59.9 | 88.2 | 152.4 | -49.5 | -22.9 | 0 | 0 | 0 | 117.9 | ||||
| 110 | G | 45.3 | Very low | 57.8 | Low | 73 Ų | 73 | 117.2 Ų | 117.2 | 75% | 0.753 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -175.4 | 59.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 111 | S | 42.3 | Very low | 58.4 | Low | 104 Ų | 104 | 116.6 Ų | 116.6 | 73% | 0.727 | 69% | 0.687 | S | S | * | * | trans | 48.1 | 77.1 | 164 | -161.5 | 0 | 0 | 0 | 0 | 116.6 | S113 | S111-S113 PolarHBondContact O-N 3.27Š| ||
| 112 | T | 46.2 | Very low | 59.2 | Low | 144 Ų | 144 | 114.9 Ų | 114.9 | 88% | 0.883 | 69% | 0.691 | S | S | * | * | trans | -88 | 78.7 | 155 | 55.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 113 | S | 50.7 | Low | 60.3 | Low | 47 Ų | 47 | 115.1 Ų | 115.1 | 33% | 0.329 | 69% | 0.694 | S | S | . | * | trans | -77.2 | 139.2 | 154.8 | 60.7 | 0 | 0 | 0 | 0 | 108.2 | S111 T115 E118 | S111-S113 PolarHBondContact O-N 3.27Å; S113-T115 PolarHBondContact O-N 3.11Å; S113-T115 VanDerWaalsContact O-N 3.13Å; S113-E118 WeakPolarHBondContact CB-OE2 3.16Å; S113-E118 PolarHBondContact OG-OE2 3Å | ||
| 114 | P | 59.6 | Low | 61.3 | Low | 98 Ų | 98 | 113.9 Ų | 113.9 | 64% | 0.636 | 69% | 0.692 | S | S | * | * | trans | -57.7 | 120.1 | -177.2 | 23.6 | -33.7 | 0 | 0 | 0 | 110.1 | G116 L117 | P114-G116 PolarHBondContact O-N 2.9Å; P114-L117 PolarHBondContact O-N 3.37Å | ||
| 115 | T | 61.1 | Low | 62.2 | Low | 155 Ų | 155 | 111 Ų | 111 | 95% | 0.951 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -35.7 | 98.9 | 175.9 | -50.1 | 0 | 0 | 0 | 0 | 111.9 | S113 | S113-T115 PolarHBondContact O-N 3.11Å; S113-T115 VanDerWaalsContact O-N 3.13Å |
| 116 | G | 66 | Low | 63.4 | Low | 74 Ų | 74 | 112.2 Ų | 112.2 | 76% | 0.763 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 125 | -6.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 118 | P114 | P114-G116 PolarHBondContact O-N 2.9Š|
| 117 | L | 66.6 | Low | 65.3 | Low | 156 Ų | 156 | 117.5 Ų | 117.5 | 82% | 0.817 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -103.7 | -16.5 | 175.9 | -64 | -171.5 | 0 | 0 | 0 | 115.1 | P114 | P114-L117 PolarHBondContact O-N 3.37Š|
| 118 | E | 81.1 | Confident | 67.3 | Low | 119 Ų | 119 | 125.5 Ų | 125.5 | 56% | 0.556 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -95.3 | 111.1 | -179.9 | -166 | 159.4 | -169.1 | 0 | 0 | 110.4 | S113 | S113-E118 WeakPolarHBondContact CB-OE2 3.16Å; S113-E118 PolarHBondContact OG-OE2 3Å |
| 119 | I | 76.3 | Confident | 69.1 | Low | 145 Ų | 145 | 124.6 Ų | 124.6 | 74% | 0.744 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -65 | 124.4 | 173.5 | -60.2 | 172.4 | 0 | 0 | 0 | 107 | T121 | I119-T121 PolarHBondContact O-N 3.49Å; I119-T121 VanDerWaalsContact O-N 3.09Å |
| 120 | P | 74.8 | Confident | 70.3 | Confident | 89 Ų | 89 | 122.4 Ų | 122.4 | 58% | 0.578 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 120.2 | 179.7 | 23.9 | -32.5 | 0 | 0 | 0 | 109.5 | T124 | P120-T124 WeakPolarHBondContact CA-OG1 3.29Š|
| 121 | T | 80.3 | Confident | 71.7 | Confident | 76 Ų | 76 | 124 Ų | 124 | 47% | 0.466 | 71% | 0.707 | S | S | . | * | P | Polyproline II helix | trans | -77.2 | 153.6 | 169.2 | 57.3 | 0 | 0 | 0 | 0 | 108.6 | I119 E123 T124 | I119-T121 PolarHBondContact O-N 3.49Å; I119-T121 VanDerWaalsContact O-N 3.09Å; T121-E123 PolarHBondContact O-N 2.82Å; T121-T124 PolarHBondContact N-OG1 3.03Å; T121-T124 VanDerWaalsContact N-OG1 3.1Å; T121-T124 PolarHBondContact O-N 3.18Å; T121-T124 PolarHBondContact O-OG1 3.14Å |
| 122 | P | 83.4 | Confident | 73.2 | Confident | 105 Ų | 105 | 126.6 Ų | 126.6 | 68% | 0.682 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -54 | -30.4 | -171.2 | 18.2 | -32.3 | 0 | 0 | 0 | 114.3 | T124 | P122-T124 VanDerWaalsContact C-N 3.3Å; P122-T124 PolarHBondContact O-N 2.95Å |
| 123 | E | 83.7 | Confident | 74 | Confident | 167 Ų | 167 | 125.5 Ų | 125.5 | 78% | 0.78 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -72.6 | -20.3 | 177.9 | -51.4 | -52.2 | 139.6 | 0 | 0 | 113.7 | T121 | T121-E123 PolarHBondContact O-N 2.82Š|
| 124 | T | 83.2 | Confident | 74.2 | Confident | 85 Ų | 85 | 128.5 Ų | 128.5 | 52% | 0.521 | 72% | 0.722 | S | S | . | * | G | 310 helix | trans | -94 | -3.6 | -179.2 | 62.6 | 0 | 0 | 0 | 0 | 113.3 | P120 T121 P122 P126 | P120-T124 WeakPolarHBondContact CA-OG1 3.29Å; T121-T124 PolarHBondContact N-OG1 3.03Å; T121-T124 VanDerWaalsContact N-OG1 3.1Å; T121-T124 PolarHBondContact O-N 3.18Å; T121-T124 PolarHBondContact O-OG1 3.14Å; P122-T124 VanDerWaalsContact C-N 3.3Å; P122-T124 PolarHBondContact O-N 2.95Å; T124-P126 WeakPolarHBondContact O-CD 3.46Å |
| 125 | V | 80 | Confident | 74 | Confident | 78 Ų | 78 | 131.7 Ų | 131.7 | 47% | 0.473 | 73% | 0.733 | S | S | . | * | S | Bend | trans | -73.3 | 123.3 | 178.4 | -179.6 | 0 | 0 | 0 | 0 | 109.3 | H127 | V125-H127 PolarHBondContact O-N 3.23Å; V125-H127 VanDerWaalsContact O-N 3.15Å |
| 126 | P | 81.2 | Confident | 73.7 | Confident | 118 Ų | 118 | 130.9 Ų | 130.9 | 77% | 0.766 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 121.6 | -179.2 | -25.7 | 34.7 | 0 | 0 | 0 | 112.3 | T124 R128 | T124-P126 WeakPolarHBondContact O-CD 3.46Å; P126-R128 PolarHBondContact O-N 3.37Å |
| 127 | H | 80.6 | Confident | 73.1 | Confident | 170 Ų | 170 | 131.2 Ų | 131.2 | 79% | 0.787 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 123.6 | 171.1 | -70.2 | -79.5 | 0 | 0 | 0 | 110.2 | V125 K129 | V125-H127 PolarHBondContact O-N 3.23Å; V125-H127 VanDerWaalsContact O-N 3.15Å; H127-K129 PolarHBondContact O-N 3.27Å |
| 128 | R | 82.1 | Confident | 72.4 | Confident | 252 Ų | 252 | 129.9 Ų | 129.9 | 95% | 0.951 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 122.8 | 172.4 | -100.7 | 176.8 | 136.2 | -161.9 | -3.7 | 109.9 | P126 | P126-R128 PolarHBondContact O-N 3.37Š|
| 129 | K | 77.7 | Confident | 71.1 | Confident | 200 Ų | 200 | 133.2 Ų | 133.2 | 87% | 0.87 | 74% | 0.74 | S | S | * | * | trans | -88.3 | 105.1 | 166.8 | -54.5 | -176.2 | 84.8 | 175.1 | 0 | 107.5 | H127 S131 | H127-K129 PolarHBondContact O-N 3.27Å; K129-S131 PolarHBondContact O-N 3.14Å; K129-S131 VanDerWaalsContact O-N 3.14Å | ||
| 130 | S | 74.5 | Confident | 69.9 | Low | 116 Ų | 116 | 134.9 Ų | 134.9 | 81% | 0.811 | 75% | 0.75 | S | S | * | * | trans | -69.1 | 108.6 | 173.5 | 57.2 | 0 | 0 | 0 | 0 | 109.1 | I132 | S130-I132 VanDerWaalsContact C-N 3.31Š| ||
| 131 | S | 74 | Confident | 68.7 | Low | 107 Ų | 107 | 136.8 Ų | 136.8 | 75% | 0.748 | 76% | 0.759 | S | S | * | * | trans | -95.3 | 31.9 | 174.5 | -178.1 | 0 | 0 | 0 | 0 | 111.8 | K129 V133 | K129-S131 PolarHBondContact O-N 3.14Å; K129-S131 VanDerWaalsContact O-N 3.14Å; S131-V133 PolarHBondContact O-N 3.3Å | ||
| 132 | I | 74.8 | Confident | 67.3 | Low | 157 Ų | 157 | 138 Ų | 138 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | trans | -68.6 | 101.2 | 178.8 | -135.6 | 165.4 | 0 | 0 | 0 | 107.6 | S130 | S130-I132 VanDerWaalsContact C-N 3.31Š| ||
| 133 | V | 61.6 | Low | 65.4 | Low | 121 Ų | 121 | 140.9 Ų | 140.9 | 73% | 0.733 | 78% | 0.781 | S | S | * | * | trans | -89.3 | 116.5 | 161.7 | -164.7 | 0 | 0 | 0 | 0 | 103.7 | S131 | S131-V133 PolarHBondContact O-N 3.3Š| ||
| 134 | P | 54.8 | Low | 63.7 | Low | 110 Ų | 110 | 142 Ų | 142 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | trans | -60.5 | 144.4 | -176.2 | 22.7 | -31.4 | 0 | 0 | 0 | 111.4 | ||||
| 135 | D | 56.2 | Low | 62.1 | Low | 165 Ų | 165 | 146.5 Ų | 146.5 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | trans | -39.7 | 132.3 | -174 | -73.9 | -50.7 | 0 | 0 | 0 | 115.7 | ||||
| 136 | V | 55.1 | Low | 61.2 | Low | 138 Ų | 138 | 148.1 Ų | 148.1 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | -137.2 | 116.1 | 142.4 | -161.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 137 | A | 52.6 | Low | 60.5 | Low | 82 Ų | 82 | 148.2 Ų | 148.2 | 68% | 0.678 | 81% | 0.809 | S | S | * | * | trans | -33.9 | 132.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 138 | S | 53.3 | Low | 59.9 | Low | 127 Ų | 127 | 148.5 Ų | 148.5 | 89% | 0.888 | 81% | 0.81 | S | S | * | * | trans | -138.9 | 110.9 | 154.5 | -80.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 139 | K | 53.3 | Low | 59.5 | Low | 189 Ų | 189 | 145.1 Ų | 145.1 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -76.6 | 125.2 | 179.7 | -60.6 | 156.6 | 177.6 | -80.1 | 0 | 108.6 | ||||
| 140 | L | 50.6 | Low | 59.2 | Low | 181 Ų | 181 | 143 Ų | 143 | 95% | 0.948 | 80% | 0.803 | S | S | * | * | trans | -132 | 108 | 152.4 | -73.6 | 179.5 | 0 | 0 | 0 | 108.5 | ||||
| 141 | V | 49 | Very low | 58.7 | Low | 129 Ų | 129 | 142.3 Ų | 142.3 | 78% | 0.782 | 80% | 0.796 | S | S | * | * | trans | -76.9 | 139.2 | -176.5 | 81.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 142 | A | 52.3 | Low | 58.1 | Low | 100 Ų | 100 | 143 Ų | 143 | 83% | 0.826 | 80% | 0.797 | S | S | * | * | trans | -112.4 | 99.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 143 | Q | 42.2 | Very low | 57.6 | Low | 167 Ų | 167 | 141.4 Ų | 141.4 | 78% | 0.78 | 80% | 0.798 | S | S | * | * | trans | -147.9 | 127.1 | 169.6 | -85 | -168.3 | -33.6 | 0 | 0 | 110.3 | ||||
| 144 | Q | 48.5 | Very low | 57.7 | Low | 191 Ų | 191 | 139.4 Ų | 139.4 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | 178 | 113.5 | 118.7 | -92.8 | 176.8 | 4.7 | 0 | 0 | 109.6 | |||||
| 145 | H | 49.5 | Very low | 58.3 | Low | 179 Ų | 179 | 142.6 Ų | 142.6 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 116.9 | 171.7 | -177.2 | -106.2 | 0 | 0 | 0 | 107.7 | ||
| 146 | V | 60.7 | Low | 59 | Low | 111 Ų | 111 | 146.3 Ų | 146.3 | 67% | 0.673 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 120.8 | -173.7 | -176.9 | 0 | 0 | 0 | 0 | 109.6 | ||
| 147 | V | 67.7 | Low | 59.2 | Low | 121 Ų | 121 | 146.8 Ų | 146.8 | 73% | 0.733 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 118.2 | 178.1 | -179.9 | 0 | 0 | 0 | 0 | 109.1 | ||
| 148 | H | 67.2 | Low | 59.5 | Low | 176 Ų | 176 | 150.2 Ų | 150.2 | 82% | 0.815 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -73 | 126.1 | 176.7 | -68.8 | -88.6 | 0 | 0 | 0 | 111.2 | ||
| 149 | H | 74.6 | Confident | 59.9 | Low | 180 Ų | 180 | 151.4 Ų | 151.4 | 83% | 0.833 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 132.8 | 176.8 | 52.8 | 66.3 | 0 | 0 | 0 | 111.7 | ||
| 150 | N | 70.8 | Confident | 60.3 | Low | 157 Ų | 157 | 149.2 Ų | 149.2 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 133.9 | 175.4 | -151.5 | 12.9 | 0 | 0 | 0 | 109.3 | ||
| 151 | P | 63.4 | Low | 60.9 | Low | 100 Ų | 100 | 147.3 Ų | 147.3 | 65% | 0.649 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 155.3 | -171.5 | 31.1 | -32.6 | 0 | 0 | 0 | 113.2 | ||
| 152 | P | 62.6 | Low | 61.7 | Low | 121 Ų | 121 | 148.5 Ų | 148.5 | 79% | 0.786 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -80 | 150.5 | -172.9 | 32.3 | -34.1 | 0 | 0 | 0 | 113.1 | ||
| 153 | P | 62.9 | Low | 62.3 | Low | 125 Ų | 125 | 151.9 Ų | 151.9 | 81% | 0.812 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -75 | 141.8 | 178.8 | 29.6 | -32.4 | 0 | 0 | 0 | 112.3 | ||
| 154 | G | 65.4 | Low | 63.9 | Low | 79 Ų | 79 | 150.8 Ų | 150.8 | 81% | 0.814 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 152.8 | -173 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 155 | L | 65.7 | Low | 65.2 | Low | 176 Ų | 176 | 147.4 Ų | 147.4 | 92% | 0.921 | 83% | 0.83 | S | S | * | * | trans | -122.6 | 120.2 | 163.3 | -78.7 | 168.6 | 0 | 0 | 0 | 107.7 | ||||
| 156 | I | 71.7 | Confident | 66.6 | Low | 244 Ų | 244 | 144.5 Ų | 144.5 | 100% | 1.251 | 83% | 0.83 | S | S | * | * | trans | -116.6 | 0 | 156.2 | 31 | 169.1 | 0 | 0 | 0 | 107 |
Retrieved 156 of 156 residues in 59.5 ms
(Link to these results)