| 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 | 50.4 | Low | 57.3 | Low | 239 Ų | 239 | 110.9 Ų | 110.9 | 100% | 1.177 | 68% | 0.68 | S | S | * | * | 0 | 69.3 | 0 | -73 | 139.2 | 70.3 | 0 | 0 | 110.1 | |||||
| 2 | I | 53.8 | Low | 57.3 | Low | 138 Ų | 138 | 109.1 Ų | 109.1 | 71% | 0.708 | 67% | 0.673 | S | S | * | * | trans | -130.6 | -26.3 | 176.2 | -76 | 169.9 | 0 | 0 | 0 | 110.8 | S4 G5 | I2-S4 VanDerWaalsContact C-N 3.27Å; I2-S4 PolarHBondContact O-N 3.32Å; I2-G5 PolarHBondContact O-N 3.46Å | ||
| 3 | C | 54.4 | Low | 57 | Low | 119 Ų | 119 | 108.8 Ų | 108.8 | 80% | 0.804 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -66.4 | -19.4 | 176.8 | -68.7 | 0 | 0 | 0 | 0 | 115.4 | ||
| 4 | S | 59.6 | Low | 56.8 | Low | 93 Ų | 93 | 106.1 Ų | 106.1 | 65% | 0.65 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -78.2 | -23.5 | 179.9 | -122.5 | 0 | 0 | 0 | 0 | 113.4 | I2 L8 | I2-S4 VanDerWaalsContact C-N 3.27Å; I2-S4 PolarHBondContact O-N 3.32Å; S4-L8 WeakPolarHBondContact O-CD1 3.47Å |
| 5 | G | 60.2 | Low | 56.6 | Low | 41 Ų | 41 | 105.5 Ų | 105.5 | 42% | 0.423 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -77.7 | -34.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | I2 | I2-G5 PolarHBondContact O-N 3.46Å |
| 6 | M | 58.6 | Low | 56.4 | Low | 147 Ų | 147 | 108.3 Ų | 108.3 | 72% | 0.724 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -77.6 | -29.7 | 179.8 | -68 | 175.7 | -168.8 | 0 | 0 | 112.5 | L8 G10 | M6-L8 VanDerWaalsContact C-N 3.27Å; M6-L8 PolarHBondContact O-N 3.06Å; M6-G10 PolarHBondContact O-N 3.39Å |
| 7 | A | 58.5 | Low | 56.3 | Low | 71 Ų | 71 | 107.8 Ų | 107.8 | 59% | 0.587 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -68 | -26.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | G11 | A7-G11 PolarHBondContact O-N 3.27Å |
| 8 | L | 57.1 | Low | 55.9 | Low | 120 Ų | 120 | 110.8 Ų | 110.8 | 63% | 0.628 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -83.9 | -26.6 | -179.3 | -72.3 | 166.8 | 0 | 0 | 0 | 113.4 | S4 M6 C12 | S4-L8 WeakPolarHBondContact O-CD1 3.47Å; M6-L8 VanDerWaalsContact C-N 3.27Å; M6-L8 PolarHBondContact O-N 3.06Å; L8-C12 PolarHBondContact O-SG 3.43Å; L8-C12 VanDerWaalsContact O-SG 3.33Å |
| 9 | L | 58.2 | Low | 55.8 | Low | 162 Ų | 162 | 111.1 Ų | 111.1 | 85% | 0.848 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -88 | -24.2 | 179.7 | -70.8 | 164.4 | 0 | 0 | 0 | 113.2 | ||
| 10 | G | 60.8 | Low | 55.5 | Low | 67 Ų | 67 | 107.8 Ų | 107.8 | 69% | 0.691 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -98.3 | -6.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | M6 | M6-G10 PolarHBondContact O-N 3.39Š|
| 11 | G | 58.9 | Low | 55.1 | Low | 23 Ų | 23 | 106.4 Ų | 106.4 | 24% | 0.237 | 67% | 0.671 | C | S | . | * | S | Bend | trans | -110 | -6.9 | -167.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | A7 S14 | A7-G11 PolarHBondContact O-N 3.27Å; G11-S14 PolarHBondContact O-OG 3.43Å |
| 12 | C | 57.6 | Low | 55 | Low | 89 Ų | 89 | 104.5 Ų | 104.5 | 60% | 0.601 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -84.6 | -33 | -172.7 | -66.8 | 0 | 0 | 0 | 0 | 114.2 | L8 | L8-C12 PolarHBondContact O-SG 3.43Å; L8-C12 VanDerWaalsContact O-SG 3.33Å |
| 13 | S | 53 | Low | 54.9 | Low | 106 Ų | 106 | 107.4 Ų | 107.4 | 74% | 0.741 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -76.6 | -24.3 | 176.7 | -60.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 14 | S | 54.7 | Low | 54.8 | Low | 70 Ų | 70 | 104.2 Ų | 104.2 | 49% | 0.49 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -83.1 | -31.3 | -178.2 | 52.7 | 0 | 0 | 0 | 0 | 113.2 | G11 H18 | G11-S14 PolarHBondContact O-OG 3.43Å; S14-H18 WeakPolarHBondContact O-CB 3.5Å |
| 15 | V | 53.3 | Low | 54.5 | Low | 98 Ų | 98 | 105.3 Ų | 105.3 | 59% | 0.594 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -77.8 | -34.7 | 177.7 | 170.7 | 0 | 0 | 0 | 0 | 112.5 | H18 T19 | V15-H18 PolarHBondContact O-N 3.3Å; V15-T19 PolarHBondContact O-N 3.35Å; V15-T19 PolarHBondContact O-OG1 2.93Å |
| 16 | M | 53.2 | Low | 53.8 | Low | 149 Ų | 149 | 109.9 Ų | 109.9 | 73% | 0.734 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -76 | -28.9 | -177 | -174.1 | 162.6 | -80.7 | 0 | 0 | 113.5 | ||
| 17 | S | 54.4 | Low | 53.5 | Low | 101 Ų | 101 | 107.7 Ų | 107.7 | 71% | 0.706 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -81.8 | -16.7 | 171.4 | -61.2 | 0 | 0 | 0 | 0 | 113.1 | ||
| 18 | H | 49.3 | Very low | 53.2 | Low | 161 Ų | 161 | 106.6 Ų | 106.6 | 75% | 0.745 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -82.9 | -15.7 | 179 | -137.8 | -83 | 0 | 0 | 0 | 113.8 | S14 V15 | S14-H18 WeakPolarHBondContact O-CB 3.5Å; V15-H18 PolarHBondContact O-N 3.3Å |
| 19 | T | 54.3 | Low | 53.1 | Low | 117 Ų | 117 | 104.8 Ų | 104.8 | 72% | 0.718 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -107.3 | 1.3 | 177.9 | 57.8 | 0 | 0 | 0 | 0 | 113 | V15 | V15-T19 PolarHBondContact O-N 3.35Å; V15-T19 PolarHBondContact O-OG1 2.93Å |
| 20 | G | 49.4 | Very low | 52.9 | Low | 45 Ų | 45 | 104.8 Ų | 104.8 | 46% | 0.464 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -97.6 | 17.8 | -170.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | K22 | G20-K22 PolarHBondContact O-N 3.22Å; G20-K22 VanDerWaalsContact O-N 3.13Å |
| 21 | G | 47.5 | Very low | 52.6 | Low | 79 Ų | 79 | 104.2 Ų | 104.2 | 81% | 0.814 | 63% | 0.626 | S | S | * | * | trans | 58.6 | 33.1 | 160.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 22 | K | 47.8 | Very low | 52.3 | Low | 199 Ų | 199 | 106.1 Ų | 106.1 | 87% | 0.865 | 64% | 0.636 | S | S | * | * | trans | -115.1 | 107.8 | 175.6 | -70.9 | 179.6 | 178.6 | 167.3 | 0 | 110.6 | G20 | G20-K22 PolarHBondContact O-N 3.22Å; G20-K22 VanDerWaalsContact O-N 3.13Å | ||
| 23 | E | 52.5 | Low | 52.2 | Low | 199 Ų | 199 | 105 Ų | 105 | 93% | 0.93 | 63% | 0.632 | S | S | * | * | trans | -57.1 | 126.3 | 176.3 | -64.2 | 168.9 | 151.7 | 0 | 0 | 110.9 | ||||
| 24 | G | 53.1 | Low | 52.5 | Low | 52 Ų | 52 | 105.6 Ų | 105.6 | 54% | 0.536 | 63% | 0.632 | S | S | . | * | trans | 169.3 | 118.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y26 P27 | G24-Y26 PolarHBondContact O-N 3.48Å; G24-P27 WeakPolarHBondContact O-CD 3.27Å | ||
| 25 | T | 51.4 | Low | 52.4 | Low | 115 Ų | 115 | 108.2 Ų | 108.2 | 71% | 0.706 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -60.2 | 126.3 | 168.5 | -51.9 | 0 | 0 | 0 | 0 | 110.1 | R30 | T25-R30 PolarHBondContact O-NE 3.28Å; T25-R30 PolarHBondContact O-NH2 2.93Å |
| 26 | Y | 46 | Very low | 52.3 | Low | 137 Ų | 137 | 108.6 Ų | 108.6 | 54% | 0.537 | 64% | 0.635 | S | S | . | * | trans | 68.2 | 58.9 | 179.4 | -104.4 | -81.5 | 0 | 0 | 0 | 115.9 | G24 G28 T29 R30 | G24-Y26 PolarHBondContact O-N 3.48Å; Y26-G28 VanDerWaalsContact C-N 3.29Å; Y26-G28 PolarHBondContact O-N 3.13Å; Y26-T29 VanDerWaalsContact CD1-CB 3.46Å; Y26-T29 HydrophobicContact CD1-CG2 4.49Å; Y26-T29 WeakPolarHBondContact CD1-OG1 3.48Å; Y26-T29 WeakPolarHBondContact CE1-OG1 3.37Å; Y26-R30 VanDerWaalsContact O-CG 3.32Å; Y26-R30 WeakPolarHBondContact O-CG 3.38Å; Y26-R30 PolarHBondContact O-N 2.87Å | ||
| 27 | P | 52.2 | Low | 52.2 | Low | 102 Ų | 102 | 104.5 Ų | 104.5 | 66% | 0.662 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -66.7 | -29.2 | 179 | 27.4 | -31.5 | 0 | 0 | 0 | 112.7 | G24 A31 | G24-P27 WeakPolarHBondContact O-CD 3.27Å; P27-A31 VanDerWaalsContact O-CB 3.29Å; P27-A31 WeakPolarHBondContact O-CB 3.49Å; P27-A31 PolarHBondContact O-N 2.68Å; P27-A31 VanDerWaalsContact O-N 3.11Å |
| 28 | G | 52.1 | Low | 51.9 | Low | 48 Ų | 48 | 104 Ų | 104 | 50% | 0.495 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -70.5 | -44.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y26 S32 | Y26-G28 VanDerWaalsContact C-N 3.29Å; Y26-G28 PolarHBondContact O-N 3.13Å; G28-S32 PolarHBondContact O-N 3.49Å |
| 29 | T | 55.3 | Low | 52.2 | Low | 81 Ų | 81 | 104.5 Ų | 104.5 | 50% | 0.497 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -75 | -29.1 | 179.6 | -59 | 0 | 0 | 0 | 0 | 112.5 | Y26 A33 | Y26-T29 VanDerWaalsContact CD1-CB 3.46Å; Y26-T29 HydrophobicContact CD1-CG2 4.49Å; Y26-T29 WeakPolarHBondContact CD1-OG1 3.48Å; Y26-T29 WeakPolarHBondContact CE1-OG1 3.37Å; T29-A33 WeakPolarHBondContact O-CB 3.48Å; T29-A33 PolarHBondContact O-N 3.35Å |
| 30 | R | 54.3 | Low | 52.2 | Low | 163 Ų | 163 | 107.3 Ų | 107.3 | 62% | 0.615 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.8 | -37.7 | 174.2 | -63.1 | 179.6 | -161.6 | -88.4 | 1.1 | 111.7 | T25 Y26 A33 T34 | T25-R30 PolarHBondContact O-NE 3.28Å; T25-R30 PolarHBondContact O-NH2 2.93Å; Y26-R30 VanDerWaalsContact O-CG 3.32Å; Y26-R30 WeakPolarHBondContact O-CG 3.38Å; Y26-R30 PolarHBondContact O-N 2.87Å; R30-A33 PolarHBondContact O-N 3.02Å; R30-T34 PolarHBondContact O-N 2.8Å; R30-T34 VanDerWaalsContact O-N 3.14Å; R30-T34 PolarHBondContact O-OG1 3.41Å |
| 31 | A | 54.9 | Low | 52 | Low | 55 Ų | 55 | 108.5 Ų | 108.5 | 46% | 0.455 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -65.1 | -39.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | P27 M35 | P27-A31 VanDerWaalsContact O-CB 3.29Å; P27-A31 WeakPolarHBondContact O-CB 3.49Å; P27-A31 PolarHBondContact O-N 2.68Å; P27-A31 VanDerWaalsContact O-N 3.11Å; A31-M35 WeakPolarHBondContact O-CB 3.35Å; A31-M35 PolarHBondContact O-N 3.33Å |
| 32 | S | 53 | Low | 52.1 | Low | 63 Ų | 63 | 110.6 Ų | 110.6 | 44% | 0.441 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -72.9 | -29.6 | 172.3 | -80.8 | 0 | 0 | 0 | 0 | 113.8 | G28 M35 I36 | G28-S32 PolarHBondContact O-N 3.49Å; S32-M35 PolarHBondContact O-N 3.33Å; S32-I36 WeakPolarHBondContact O-CB 3.42Å; S32-I36 WeakPolarHBondContact O-CG1 3.44Å; S32-I36 PolarHBondContact O-N 3.23Å |
| 33 | A | 54.8 | Low | 52.2 | Low | 65 Ų | 65 | 111.2 Ų | 111.2 | 54% | 0.537 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -72.9 | -31.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | T29 R30 | T29-A33 WeakPolarHBondContact O-CB 3.48Å; T29-A33 PolarHBondContact O-N 3.35Å; R30-A33 PolarHBondContact O-N 3.02Å |
| 34 | T | 58.4 | Low | 52.5 | Low | 119 Ų | 119 | 103.5 Ų | 103.5 | 73% | 0.73 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -75.9 | -28.1 | 171.1 | -52.3 | 0 | 0 | 0 | 0 | 111.9 | R30 | R30-T34 PolarHBondContact O-N 2.8Å; R30-T34 VanDerWaalsContact O-N 3.14Å; R30-T34 PolarHBondContact O-OG1 3.41Å |
| 35 | M | 52.5 | Low | 52.6 | Low | 125 Ų | 125 | 105.8 Ų | 105.8 | 62% | 0.616 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -90.2 | -19.1 | -179.8 | -147.8 | -176.1 | -64.4 | 0 | 0 | 114 | A31 S32 | A31-M35 WeakPolarHBondContact O-CB 3.35Å; A31-M35 PolarHBondContact O-N 3.33Å; S32-M35 PolarHBondContact O-N 3.33Å |
| 36 | I | 51.6 | Low | 52.6 | Low | 105 Ų | 105 | 105 Ų | 105 | 54% | 0.538 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -83.6 | -16.5 | 172.1 | -73.9 | 170.3 | 0 | 0 | 0 | 112 | S32 D38 | S32-I36 WeakPolarHBondContact O-CB 3.42Å; S32-I36 WeakPolarHBondContact O-CG1 3.44Å; S32-I36 PolarHBondContact O-N 3.23Å; I36-D38 VanDerWaalsContact C-N 3.26Å |
| 37 | G | 52.1 | Low | 53.2 | Low | 64 Ų | 64 | 101 Ų | 101 | 66% | 0.66 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | 2.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 38 | D | 47.9 | Very low | 53.7 | Low | 89 Ų | 89 | 102.5 Ų | 102.5 | 48% | 0.476 | 58% | 0.581 | S | S | . | * | trans | -103.1 | 115.3 | 179.1 | -153.6 | -87.9 | 0 | 0 | 0 | 109.1 | I36 E40 | I36-D38 VanDerWaalsContact C-N 3.26Å; D38-E40 PolarHBondContact O-N 3.16Å | ||
| 39 | D | 54.6 | Low | 54 | Low | 173 Ų | 173 | 102.9 Ų | 102.9 | 93% | 0.925 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | 5.7 | -170.5 | -85 | -37.6 | 0 | 0 | 0 | 114.4 | ||
| 40 | E | 55.3 | Low | 54.5 | Low | 175 Ų | 175 | 104.4 Ų | 104.4 | 82% | 0.818 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | 1.5 | -172.4 | -101.2 | -162.7 | 159.7 | 0 | 0 | 116.1 | D38 | D38-E40 PolarHBondContact O-N 3.16Š|
| 41 | T | 45 | Very low | 55.2 | Low | 70 Ų | 70 | 103.2 Ų | 103.2 | 43% | 0.429 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -99 | 110.4 | -172.4 | 47.1 | 0 | 0 | 0 | 0 | 115 | ||
| 42 | N | 48.4 | Very low | 55.8 | Low | 123 Ų | 123 | 104.8 Ų | 104.8 | 66% | 0.658 | 59% | 0.589 | S | S | * | * | trans | -21.6 | 125.3 | 171.3 | -115.9 | -88.4 | 0 | 0 | 0 | 115.7 | G44 T45 | N42-G44 PolarHBondContact O-N 3.24Å; N42-T45 PolarHBondContact O-N 3.41Å; N42-T45 VanDerWaalsContact O-N 3.11Å | ||
| 43 | W | 50.8 | Low | 56.4 | Low | 212 Ų | 212 | 108 Ų | 108 | 80% | 0.803 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -52.7 | -25.1 | 179.7 | 100.4 | -75.6 | 0 | 0 | 0 | 114.2 | S47 | W43-S47 PolarHBondContact O-N 3.27Å; W43-S47 PolarHBondContact O-OG 2.9Å |
| 44 | G | 58.3 | Low | 57 | Low | 38 Ų | 38 | 108.7 Ų | 108.7 | 39% | 0.392 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.5 | -35.7 | 180 | 0 | 0 | 0 | 0 | 0 | 114.6 | N42 L48 | N42-G44 PolarHBondContact O-N 3.24Å; G44-L48 PolarHBondContact O-N 3.39Å |
| 45 | T | 56.4 | Low | 57.7 | Low | 99 Ų | 99 | 109.7 Ų | 109.7 | 61% | 0.607 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -80.3 | -32.1 | -176.3 | -34.8 | 0 | 0 | 0 | 0 | 111.5 | N42 L48 A49 | N42-T45 PolarHBondContact O-N 3.41Å; N42-T45 VanDerWaalsContact O-N 3.11Å; T45-L48 PolarHBondContact O-N 3.24Å; T45-A49 WeakPolarHBondContact O-CB 3.48Å; T45-A49 PolarHBondContact O-N 3.28Å |
| 46 | K | 50.8 | Low | 58.4 | Low | 100 Ų | 100 | 106.7 Ų | 106.7 | 44% | 0.435 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.7 | -41.1 | 171.6 | -92.7 | 179.7 | 176.4 | 173.5 | 0 | 111.9 | A49 I50 | K46-A49 PolarHBondContact O-N 3.4Å; K46-I50 WeakPolarHBondContact O-CD1 3.39Å; K46-I50 VanDerWaalsContact O-CG1 3.23Å; K46-I50 WeakPolarHBondContact O-CG1 3.48Å; K46-I50 PolarHBondContact O-N 3.05Å |
| 47 | S | 59.1 | Low | 59.3 | Low | 52 Ų | 52 | 104.2 Ų | 104.2 | 36% | 0.364 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -66.8 | -40 | 178.6 | -65.5 | 0 | 0 | 0 | 0 | 112.9 | W43 A49 I50 L51 | W43-S47 PolarHBondContact O-N 3.27Å; W43-S47 PolarHBondContact O-OG 2.9Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-I50 PolarHBondContact O-N 3.02Å; S47-L51 PolarHBondContact O-N 3.5Å; S47-L51 VanDerWaalsContact O-N 3.12Å |
| 48 | L | 61.5 | Low | 60.3 | Low | 134 Ų | 134 | 105.1 Ų | 105.1 | 70% | 0.702 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.5 | -38 | 177.3 | -144.7 | 102.9 | 0 | 0 | 0 | 111.4 | G44 T45 L51 D52 | G44-L48 PolarHBondContact O-N 3.39Å; T45-L48 PolarHBondContact O-N 3.24Å; L48-L51 PolarHBondContact O-N 3.39Å; L48-D52 PolarHBondContact O-N 3.02Å; L48-D52 VanDerWaalsContact O-N 3.12Å |
| 49 | A | 59.1 | Low | 61.2 | Low | 55 Ų | 55 | 105.7 Ų | 105.7 | 46% | 0.455 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -69.2 | -34.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | T45 K46 S47 D52 M53 | T45-A49 WeakPolarHBondContact O-CB 3.48Å; T45-A49 PolarHBondContact O-N 3.28Å; K46-A49 PolarHBondContact O-N 3.4Å; S47-A49 VanDerWaalsContact C-N 3.35Å; A49-D52 PolarHBondContact O-N 3.26Å; A49-M53 WeakPolarHBondContact O-CG 3.4Å; A49-M53 PolarHBondContact O-N 3.41Å |
| 50 | I | 65.3 | Low | 61.7 | Low | 113 Ų | 113 | 101.1 Ų | 101.1 | 58% | 0.579 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.2 | -37.3 | 173.9 | -70.6 | 163.8 | 0 | 0 | 0 | 111.1 | K46 S47 D52 P54 | K46-I50 WeakPolarHBondContact O-CD1 3.39Å; K46-I50 VanDerWaalsContact O-CG1 3.23Å; K46-I50 WeakPolarHBondContact O-CG1 3.48Å; K46-I50 PolarHBondContact O-N 3.05Å; S47-I50 PolarHBondContact O-N 3.02Å; I50-D52 VanDerWaalsContact C-N 3.31Å; I50-P54 WeakPolarHBondContact O-CD 3.37Å |
| 51 | L | 68.5 | Low | 62.3 | Low | 139 Ų | 139 | 97.1 Ų | 97.1 | 73% | 0.728 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.5 | -32.4 | 175.6 | -111.1 | 162.1 | 0 | 0 | 0 | 112.5 | S47 L48 P54 | S47-L51 PolarHBondContact O-N 3.5Å; S47-L51 VanDerWaalsContact O-N 3.12Å; L48-L51 PolarHBondContact O-N 3.39Å; L51-P54 WeakPolarHBondContact O-CD 3.36Å; L51-P54 WeakPolarHBondContact O-CG 3.28Å |
| 52 | D | 67.6 | Low | 63.4 | Low | 88 Ų | 88 | 99.5 Ų | 99.5 | 47% | 0.471 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -86.9 | -20.1 | -180 | -165.5 | 44.9 | 0 | 0 | 0 | 113.7 | L48 A49 I50 F55 T56 | L48-D52 PolarHBondContact O-N 3.02Å; L48-D52 VanDerWaalsContact O-N 3.12Å; A49-D52 PolarHBondContact O-N 3.26Å; I50-D52 VanDerWaalsContact C-N 3.31Å; D52-F55 PolarHBondContact O-N 3.45Å; D52-F55 VanDerWaalsContact O-N 3.16Å; D52-T56 WeakPolarHBondContact O-CB 3.35Å; D52-T56 PolarHBondContact O-N 3.39Å; D52-T56 PolarHBondContact O-OG1 3.36Å; D52-T56 PolarHBondContact OD2-OG1 2.94Å |
| 53 | M | 66.5 | Low | 64 | Low | 131 Ų | 131 | 98.4 Ų | 98.4 | 65% | 0.645 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -53.5 | -46.4 | 175.9 | -94.2 | -129.7 | -92.9 | 0 | 0 | 115 | A49 F55 A57 | A49-M53 WeakPolarHBondContact O-CG 3.4Å; A49-M53 PolarHBondContact O-N 3.41Å; M53-F55 VanDerWaalsContact C-N 3.31Å; M53-F55 PolarHBondContact O-N 2.88Å; M53-A57 WeakPolarHBondContact O-CB 3.29Å; M53-A57 PolarHBondContact O-N 3.26Å |
| 54 | P | 68.4 | Low | 64.6 | Low | 79 Ų | 79 | 94.1 Ų | 94.1 | 51% | 0.513 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68 | -31.4 | 178.3 | 25.5 | -33.9 | 0 | 0 | 0 | 112.5 | I50 L51 V58 | I50-P54 WeakPolarHBondContact O-CD 3.37Å; L51-P54 WeakPolarHBondContact O-CD 3.36Å; L51-P54 WeakPolarHBondContact O-CG 3.28Å; P54-V58 WeakPolarHBondContact O-CB 3.19Å; P54-V58 VanDerWaalsContact O-CG2 3.23Å; P54-V58 WeakPolarHBondContact O-CG2 3.45Å; P54-V58 PolarHBondContact O-N 3.14Å |
| 55 | F | 71.9 | Confident | 64.6 | Low | 140 Ų | 140 | 96.2 Ų | 96.2 | 61% | 0.614 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -75.7 | -41.3 | 179.4 | -151.6 | -92.6 | 0 | 0 | 0 | 111.4 | D52 M53 V58 M59 | D52-F55 PolarHBondContact O-N 3.45Å; D52-F55 VanDerWaalsContact O-N 3.16Å; M53-F55 VanDerWaalsContact C-N 3.31Å; M53-F55 PolarHBondContact O-N 2.88Å; F55-V58 PolarHBondContact O-N 2.92Å; F55-M59 HydrophobicContact CD1-SD 4.35Å; F55-M59 HydrophobicContact CE1-SD 4.23Å; F55-M59 PolarHBondContact O-N 3.47Å |
| 56 | T | 67.4 | Low | 64.9 | Low | 62 Ų | 62 | 100.3 Ų | 100.3 | 38% | 0.38 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 171 | -66 | 0 | 0 | 0 | 0 | 111.3 | D52 V58 M59 D60 | D52-T56 WeakPolarHBondContact O-CB 3.35Å; D52-T56 PolarHBondContact O-N 3.39Å; D52-T56 PolarHBondContact O-OG1 3.36Å; D52-T56 PolarHBondContact OD2-OG1 2.94Å; T56-V58 VanDerWaalsContact C-N 3.35Å; T56-V58 PolarHBondContact O-N 3.44Å; T56-M59 PolarHBondContact O-N 3.47Å; T56-D60 WeakPolarHBondContact O-CB 3.1Å; T56-D60 PolarHBondContact O-N 2.88Å |
| 57 | A | 71.2 | Confident | 65.2 | Low | 52 Ų | 52 | 99.1 Ų | 99.1 | 43% | 0.43 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.7 | -38.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | M53 T61 | M53-A57 WeakPolarHBondContact O-CB 3.29Å; M53-A57 PolarHBondContact O-N 3.26Å; A57-T61 VanDerWaalsContact O-CB 3.29Å; A57-T61 WeakPolarHBondContact O-CB 3.49Å; A57-T61 PolarHBondContact O-N 3.11Å; A57-T61 PolarHBondContact O-OG1 3.37Å |
| 58 | V | 72.7 | Confident | 65.1 | Low | 83 Ų | 83 | 101.3 Ų | 101.3 | 50% | 0.503 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -67.6 | -42.9 | 174.5 | 169.1 | 0 | 0 | 0 | 0 | 111 | P54 F55 T56 T61 L62 | P54-V58 WeakPolarHBondContact O-CB 3.19Å; P54-V58 VanDerWaalsContact O-CG2 3.23Å; P54-V58 WeakPolarHBondContact O-CG2 3.45Å; P54-V58 PolarHBondContact O-N 3.14Å; F55-V58 PolarHBondContact O-N 2.92Å; T56-V58 VanDerWaalsContact C-N 3.35Å; T56-V58 PolarHBondContact O-N 3.44Å; V58-T61 PolarHBondContact O-N 3Å; V58-L62 HydrophobicContact CG1-CD1 3.9Å; V58-L62 HydrophobicContact CG1-CG 4.35Å; V58-L62 WeakPolarHBondContact O-CB 3.15Å; V58-L62 WeakPolarHBondContact O-CG 3.17Å; V58-L62 PolarHBondContact O-N 3.42Å |
| 59 | M | 67.7 | Low | 64.8 | Low | 101 Ų | 101 | 104 Ų | 104 | 50% | 0.498 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63 | -43.6 | 175.5 | -82.8 | -169.3 | 56.8 | 0 | 0 | 112.4 | F55 T56 T61 L62 L63 | F55-M59 HydrophobicContact CD1-SD 4.35Å; F55-M59 HydrophobicContact CE1-SD 4.23Å; F55-M59 PolarHBondContact O-N 3.47Å; T56-M59 PolarHBondContact O-N 3.47Å; M59-T61 VanDerWaalsContact C-N 3.29Å; M59-T61 PolarHBondContact O-N 2.81Å; M59-L62 PolarHBondContact O-N 2.97Å; M59-L63 WeakPolarHBondContact O-CB 3.32Å; M59-L63 PolarHBondContact O-N 3.2Å |
| 60 | D | 65.2 | Low | 64.7 | Low | 78 Ų | 78 | 109.8 Ų | 109.8 | 42% | 0.417 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.6 | -34.3 | 174.9 | -82.6 | -10 | 0 | 0 | 0 | 111.6 | T56 L64 | T56-D60 WeakPolarHBondContact O-CB 3.1Å; T56-D60 PolarHBondContact O-N 2.88Å; D60-L64 VanDerWaalsContact O-CG 3.31Å; D60-L64 WeakPolarHBondContact O-CG 3.42Å; D60-L64 PolarHBondContact O-N 3.42Å |
| 61 | T | 67.9 | Low | 63.9 | Low | 90 Ų | 90 | 110.1 Ų | 110.1 | 55% | 0.552 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -74.2 | -33.3 | 176.5 | -53.5 | 0 | 0 | 0 | 0 | 112.5 | A57 V58 M59 P65 | A57-T61 VanDerWaalsContact O-CB 3.29Å; A57-T61 WeakPolarHBondContact O-CB 3.49Å; A57-T61 PolarHBondContact O-N 3.11Å; A57-T61 PolarHBondContact O-OG1 3.37Å; V58-T61 PolarHBondContact O-N 3Å; M59-T61 VanDerWaalsContact C-N 3.29Å; M59-T61 PolarHBondContact O-N 2.81Å; T61-P65 WeakPolarHBondContact O-CD 3.43Å |
| 62 | L | 66.6 | Low | 62.9 | Low | 120 Ų | 120 | 111.3 Ų | 111.3 | 63% | 0.628 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -76.9 | -30.1 | 175.2 | -71.7 | 173.4 | 0 | 0 | 0 | 112.1 | V58 M59 W66 | V58-L62 HydrophobicContact CG1-CD1 3.9Å; V58-L62 HydrophobicContact CG1-CG 4.35Å; V58-L62 WeakPolarHBondContact O-CB 3.15Å; V58-L62 WeakPolarHBondContact O-CG 3.17Å; V58-L62 PolarHBondContact O-N 3.42Å; M59-L62 PolarHBondContact O-N 2.97Å; L62-W66 WeakPolarHBondContact O-CB 3.2Å |
| 63 | L | 61.1 | Low | 61.9 | Low | 101 Ų | 101 | 112.2 Ų | 112.2 | 53% | 0.529 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -72.7 | -29 | 176.5 | -112.2 | 91.3 | 0 | 0 | 0 | 113 | M59 W66 D67 | M59-L63 WeakPolarHBondContact O-CB 3.32Å; M59-L63 PolarHBondContact O-N 3.2Å; L63-W66 PolarHBondContact O-N 3.43Å; L63-D67 WeakPolarHBondContact O-CB 3.01Å; L63-D67 PolarHBondContact O-N 3.26Å |
| 64 | L | 63.4 | Low | 61.1 | Low | 121 Ų | 121 | 108.5 Ų | 108.5 | 63% | 0.634 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.2 | -50.4 | -178.9 | -77.2 | 167.7 | 0 | 0 | 0 | 113.1 | D60 V68 | D60-L64 VanDerWaalsContact O-CG 3.31Å; D60-L64 WeakPolarHBondContact O-CG 3.42Å; D60-L64 PolarHBondContact O-N 3.42Å; L64-V68 WeakPolarHBondContact O-CG2 3.4Å; L64-V68 PolarHBondContact O-N 3.34Å |
| 65 | P | 58.6 | Low | 60.4 | Low | 82 Ų | 82 | 110 Ų | 110 | 53% | 0.532 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -71.8 | -33.8 | 176.7 | -18.1 | 30.9 | 0 | 0 | 0 | 113.2 | T61 F69 | T61-P65 WeakPolarHBondContact O-CD 3.43Å; P65-F69 PolarHBondContact O-N 3.04Å |
| 66 | W | 63.6 | Low | 59.6 | Low | 185 Ų | 185 | 111.4 Ų | 111.4 | 70% | 0.701 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.2 | -38.7 | -179.4 | -174.9 | -98.7 | 0 | 0 | 0 | 112.4 | L62 L63 R70 | L62-W66 WeakPolarHBondContact O-CB 3.2Å; L63-W66 PolarHBondContact O-N 3.43Å; W66-R70 WeakPolarHBondContact O-CB 3.46Å; W66-R70 PolarHBondContact O-N 3.14Å |
| 67 | D | 56 | Low | 58.8 | Low | 75 Ų | 75 | 112.2 Ų | 112.2 | 40% | 0.401 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -70.5 | -36.7 | 175 | -163.1 | 44.2 | 0 | 0 | 0 | 110.9 | L63 R70 K71 | L63-D67 WeakPolarHBondContact O-CB 3.01Å; L63-D67 PolarHBondContact O-N 3.26Å; D67-R70 PolarHBondContact O-N 3.24Å; D67-K71 WeakPolarHBondContact O-CB 3.18Å; D67-K71 PolarHBondContact O-N 2.8Å; D67-K71 IonicContact OD2-NZ 2.81Å; D67-K71 PolarHBondContact OD2-NZ 3.28Å |
| 68 | V | 56.7 | Low | 58.2 | Low | 99 Ų | 99 | 118.6 Ų | 118.6 | 60% | 0.6 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.5 | -40 | 175 | 170.6 | 0 | 0 | 0 | 0 | 112.2 | L64 R70 | L64-V68 WeakPolarHBondContact O-CG2 3.4Å; L64-V68 PolarHBondContact O-N 3.34Å; V68-R70 PolarHBondContact O-N 2.81Å |
| 69 | F | 55.6 | Low | 57.6 | Low | 190 Ų | 190 | 118.3 Ų | 118.3 | 83% | 0.833 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | -11.4 | 176.8 | -119.7 | -88.3 | 0 | 0 | 0 | 114 | P65 | P65-F69 PolarHBondContact O-N 3.04Š|
| 70 | R | 57.4 | Low | 57.3 | Low | 177 Ų | 177 | 118.9 Ų | 118.9 | 67% | 0.668 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | -13.1 | -177 | -162 | 172.7 | 162.6 | 119.9 | -1.4 | 113.7 | W66 D67 V68 D72 S73 | W66-R70 WeakPolarHBondContact O-CB 3.46Å; W66-R70 PolarHBondContact O-N 3.14Å; D67-R70 PolarHBondContact O-N 3.24Å; V68-R70 PolarHBondContact O-N 2.81Å; R70-D72 PolarHBondContact O-N 2.96Å; R70-S73 PolarHBondContact O-OG 3.11Å |
| 71 | K | 48.4 | Very low | 57 | Low | 120 Ų | 120 | 123 Ų | 123 | 52% | 0.522 | 61% | 0.612 | S | S | . | * | G | 310 helix | trans | -74 | -16.7 | -174.4 | -142.2 | 140.1 | -175.7 | 156.1 | 0 | 115.8 | D67 S73 | D67-K71 WeakPolarHBondContact O-CB 3.18Å; D67-K71 PolarHBondContact O-N 2.8Å; D67-K71 IonicContact OD2-NZ 2.81Å; D67-K71 PolarHBondContact OD2-NZ 3.28Å; K71-S73 PolarHBondContact O-N 3.34Å |
| 72 | D | 47.3 | Very low | 56.6 | Low | 163 Ų | 163 | 122.5 Ų | 122.5 | 87% | 0.872 | 61% | 0.613 | S | S | * | * | G | 310 helix | trans | -69.2 | 1.7 | -177.4 | -81.8 | -31.3 | 0 | 0 | 0 | 114.8 | R70 | R70-D72 PolarHBondContact O-N 2.96Š|
| 73 | S | 46.8 | Very low | 56.3 | Low | 107 Ų | 107 | 122.3 Ų | 122.3 | 75% | 0.748 | 61% | 0.609 | S | S | * | * | G | 310 helix | trans | -117.9 | 17.2 | -176.7 | 63.8 | 0 | 0 | 0 | 0 | 116 | R70 K71 | R70-S73 PolarHBondContact O-OG 3.11Å; K71-S73 PolarHBondContact O-N 3.34Å |
| 74 | S | 49.7 | Very low | 56.3 | Low | 53 Ų | 53 | 120.2 Ų | 120.2 | 37% | 0.371 | 61% | 0.606 | S | S | . | * | trans | -119.6 | 130.4 | -177.3 | 84 | 0 | 0 | 0 | 0 | 114.8 | R76 S77 | S74-R76 PolarHBondContact O-N 3Å; S74-S77 PolarHBondContact O-N 3.29Å | ||
| 75 | V | 52.4 | Low | 56.2 | Low | 111 Ų | 111 | 119.7 Ų | 119.7 | 67% | 0.673 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.6 | -15.8 | 173.5 | -114.2 | 0 | 0 | 0 | 0 | 115 | R78 V79 | V75-R78 WeakPolarHBondContact O-CB 3.23Å; V75-R78 PolarHBondContact O-N 2.93Å; V75-V79 WeakPolarHBondContact O-CG2 3.19Å; V75-V79 PolarHBondContact O-N 3.45Å; V75-V79 VanDerWaalsContact O-N 3.16Å |
| 76 | R | 55.3 | Low | 56.3 | Low | 170 Ų | 170 | 118.5 Ų | 118.5 | 64% | 0.642 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67.9 | -35 | -174.8 | -167.9 | 173.6 | 176.6 | 165.8 | 1.7 | 113.7 | S74 R78 V79 E80 | S74-R76 PolarHBondContact O-N 3Å; R76-R78 VanDerWaalsContact C-N 3.29Å; R76-R78 PolarHBondContact O-N 3.06Å; R76-V79 PolarHBondContact O-N 3.41Å; R76-E80 PolarHBondContact O-N 2.9Å |
| 77 | S | 51.2 | Low | 56.1 | Low | 78 Ų | 78 | 116.3 Ų | 116.3 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.8 | -27.6 | 175.8 | 64.9 | 0 | 0 | 0 | 0 | 112.5 | S74 K81 | S74-S77 PolarHBondContact O-N 3.29Å; S77-K81 VanDerWaalsContact O-CB 3.28Å; S77-K81 WeakPolarHBondContact O-CB 3.38Å; S77-K81 PolarHBondContact O-N 3.27Å; S77-K81 VanDerWaalsContact O-N 3.14Å |
| 78 | R | 58.8 | Low | 56.3 | Low | 187 Ų | 187 | 115.5 Ų | 115.5 | 71% | 0.706 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -71.7 | -41.4 | 171.5 | -67.4 | 178.4 | 63.2 | -176.5 | -1.1 | 110.8 | V75 R76 K81 S82 | V75-R78 WeakPolarHBondContact O-CB 3.23Å; V75-R78 PolarHBondContact O-N 2.93Å; R76-R78 VanDerWaalsContact C-N 3.29Å; R76-R78 PolarHBondContact O-N 3.06Å; R78-K81 PolarHBondContact O-N 2.87Å; R78-S82 WeakPolarHBondContact O-CB 3.29Å; R78-S82 PolarHBondContact O-N 3.5Å; R78-S82 PolarHBondContact O-OG 3.24Å |
| 79 | V | 60.1 | Low | 56.4 | Low | 77 Ų | 77 | 114.7 Ų | 114.7 | 47% | 0.467 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.8 | -46.1 | 177.6 | 177 | 0 | 0 | 0 | 0 | 111.2 | V75 R76 K81 S82 E83 | V75-V79 WeakPolarHBondContact O-CG2 3.19Å; V75-V79 PolarHBondContact O-N 3.45Å; V75-V79 VanDerWaalsContact O-N 3.16Å; R76-V79 PolarHBondContact O-N 3.41Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 3.23Å; V79-S82 CarbonylContact O-C 3.53Å; V79-S82 WeakPolarHBondContact O-CA 3.36Å; V79-S82 WeakPolarHBondContact O-CB 3.46Å; V79-S82 PolarHBondContact O-N 3.44Å; V79-E83 HydrophobicContact CG1-CG 4.39Å; V79-E83 WeakPolarHBondContact O-CG 3.31Å; V79-E83 PolarHBondContact O-N 3.31Å |
| 80 | E | 60.3 | Low | 56.5 | Low | 112 Ų | 112 | 111.4 Ų | 111.4 | 52% | 0.523 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -61.8 | -38 | 175.7 | -88.7 | 173.1 | -177.8 | 0 | 0 | 112.1 | R76 S82 E83 A84 | R76-E80 PolarHBondContact O-N 2.9Å; E80-S82 VanDerWaalsContact C-N 3.32Å; E80-E83 PolarHBondContact O-N 3.06Å; E80-A84 WeakPolarHBondContact O-CB 3.5Å; E80-A84 PolarHBondContact O-N 3.4Å |
| 81 | K | 60.1 | Low | 56.6 | Low | 164 Ų | 164 | 107.2 Ų | 107.2 | 71% | 0.713 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.5 | -32.2 | 174 | -167.1 | 165.9 | -176.1 | 169.9 | 0 | 112.2 | S77 R78 V79 N85 | S77-K81 VanDerWaalsContact O-CB 3.28Å; S77-K81 WeakPolarHBondContact O-CB 3.38Å; S77-K81 PolarHBondContact O-N 3.27Å; S77-K81 VanDerWaalsContact O-N 3.14Å; R78-K81 PolarHBondContact O-N 2.87Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 3.23Å; K81-N85 WeakPolarHBondContact O-CB 3.42Å; K81-N85 PolarHBondContact O-N 3.45Å |
| 82 | S | 58.6 | Low | 57.2 | Low | 80 Ų | 80 | 107.2 Ų | 107.2 | 56% | 0.559 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -70.5 | -41.2 | 173 | -62.3 | 0 | 0 | 0 | 0 | 112.2 | R78 V79 E80 N85 A86 | R78-S82 WeakPolarHBondContact O-CB 3.29Å; R78-S82 PolarHBondContact O-N 3.5Å; R78-S82 PolarHBondContact O-OG 3.24Å; V79-S82 CarbonylContact O-C 3.53Å; V79-S82 WeakPolarHBondContact O-CA 3.36Å; V79-S82 WeakPolarHBondContact O-CB 3.46Å; V79-S82 PolarHBondContact O-N 3.44Å; E80-S82 VanDerWaalsContact C-N 3.32Å; S82-N85 PolarHBondContact O-N 3.4Å; S82-A86 WeakPolarHBondContact O-CB 3.32Å; S82-A86 PolarHBondContact O-N 3.12Å |
| 83 | E | 59.9 | Low | 57.7 | Low | 117 Ų | 117 | 104.7 Ų | 104.7 | 55% | 0.547 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.3 | -42.1 | 178.2 | -72.9 | -176.6 | 119.3 | 0 | 0 | 111.8 | V79 E80 N85 A86 Q87 | V79-E83 HydrophobicContact CG1-CG 4.39Å; V79-E83 WeakPolarHBondContact O-CG 3.31Å; V79-E83 PolarHBondContact O-N 3.31Å; E80-E83 PolarHBondContact O-N 3.06Å; E83-N85 VanDerWaalsContact C-N 3.31Å; E83-N85 PolarHBondContact O-N 3.41Å; E83-A86 PolarHBondContact O-N 3.39Å; E83-Q87 WeakPolarHBondContact O-CB 3.45Å; E83-Q87 PolarHBondContact O-N 2.96Å |
| 84 | A | 62.3 | Low | 58.2 | Low | 56 Ų | 56 | 104.5 Ų | 104.5 | 46% | 0.463 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.5 | -39.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | E80 A88 | E80-A84 WeakPolarHBondContact O-CB 3.5Å; E80-A84 PolarHBondContact O-N 3.4Å; A84-A88 WeakPolarHBondContact O-CB 3.23Å; A84-A88 PolarHBondContact O-N 3.4Å |
| 85 | N | 60.4 | Low | 58.9 | Low | 111 Ų | 111 | 108 Ų | 108 | 59% | 0.594 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -72.5 | -36.9 | 178.4 | -149.1 | -1 | 0 | 0 | 0 | 111.5 | K81 S82 E83 A88 T89 | K81-N85 WeakPolarHBondContact O-CB 3.42Å; K81-N85 PolarHBondContact O-N 3.45Å; S82-N85 PolarHBondContact O-N 3.4Å; E83-N85 VanDerWaalsContact C-N 3.31Å; E83-N85 PolarHBondContact O-N 3.41Å; N85-A88 PolarHBondContact O-N 2.85Å; N85-T89 PolarHBondContact O-N 2.87Å; N85-T89 PolarHBondContact O-OG1 3.16Å |
| 86 | A | 60.5 | Low | 59.5 | Low | 57 Ų | 57 | 107 Ų | 107 | 47% | 0.471 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -66.1 | -41.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | S82 E83 T89 N90 | S82-A86 WeakPolarHBondContact O-CB 3.32Å; S82-A86 PolarHBondContact O-N 3.12Å; E83-A86 PolarHBondContact O-N 3.39Å; A86-T89 PolarHBondContact O-N 3.12Å; A86-N90 WeakPolarHBondContact O-CB 2.94Å; A86-N90 PolarHBondContact O-N 3.42Å |
| 87 | Q | 60.1 | Low | 59.8 | Low | 138 Ų | 138 | 110.4 Ų | 110.4 | 65% | 0.645 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.5 | -41.8 | 175.1 | -81.7 | 179.7 | -38.1 | 0 | 0 | 112.4 | E83 T89 N90 A91 | E83-Q87 WeakPolarHBondContact O-CB 3.45Å; E83-Q87 PolarHBondContact O-N 2.96Å; Q87-T89 VanDerWaalsContact C-N 3.26Å; Q87-T89 PolarHBondContact O-N 2.96Å; Q87-N90 PolarHBondContact O-N 2.63Å; Q87-A91 PolarHBondContact O-N 3.25Å |
| 88 | A | 59.6 | Low | 60.6 | Low | 59 Ų | 59 | 114.3 Ų | 114.3 | 49% | 0.488 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -61.7 | -36.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A84 N85 | A84-A88 WeakPolarHBondContact O-CB 3.23Å; A84-A88 PolarHBondContact O-N 3.4Å; N85-A88 PolarHBondContact O-N 2.85Å |
| 89 | T | 59.2 | Low | 60.8 | Low | 81 Ų | 81 | 110.9 Ų | 110.9 | 50% | 0.497 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -70.9 | -38.3 | 176.3 | -46 | 0 | 0 | 0 | 0 | 111.4 | N85 A86 Q87 A91 V92 I93 | N85-T89 PolarHBondContact O-N 2.87Å; N85-T89 PolarHBondContact O-OG1 3.16Å; A86-T89 PolarHBondContact O-N 3.12Å; Q87-T89 VanDerWaalsContact C-N 3.26Å; Q87-T89 PolarHBondContact O-N 2.96Å; T89-A91 VanDerWaalsContact C-N 3.35Å; T89-A91 PolarHBondContact O-N 3.45Å; T89-V92 PolarHBondContact O-N 3.43Å; T89-I93 WeakPolarHBondContact O-CG1 3.46Å |
| 90 | N | 57.8 | Low | 60.9 | Low | 122 Ų | 122 | 115 Ų | 115 | 65% | 0.652 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -69.5 | -31 | 180 | -134.7 | -33.9 | 0 | 0 | 0 | 112.6 | A86 Q87 V92 I93 | A86-N90 WeakPolarHBondContact O-CB 2.94Å; A86-N90 PolarHBondContact O-N 3.42Å; Q87-N90 PolarHBondContact O-N 2.63Å; N90-V92 PolarHBondContact O-N 2.91Å; N90-I93 PolarHBondContact O-N 2.82Å |
| 91 | A | 59.8 | Low | 60.8 | Low | 89 Ų | 89 | 120.5 Ų | 120.5 | 74% | 0.736 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | -19.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q87 T89 | Q87-A91 PolarHBondContact O-N 3.25Å; T89-A91 VanDerWaalsContact C-N 3.35Å; T89-A91 PolarHBondContact O-N 3.45Å |
| 92 | V | 60.2 | Low | 60.8 | Low | 120 Ų | 120 | 118.3 Ų | 118.3 | 73% | 0.727 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | -14.1 | -179.4 | 174.6 | 0 | 0 | 0 | 0 | 112.2 | T89 N90 P94 | T89-V92 PolarHBondContact O-N 3.43Å; N90-V92 PolarHBondContact O-N 2.91Å; V92-P94 VanDerWaalsContact O-CD 3.27Å; V92-P94 WeakPolarHBondContact O-CD 3.2Å |
| 93 | I | 57.6 | Low | 61 | Low | 109 Ų | 109 | 120.3 Ų | 120.3 | 56% | 0.559 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -84.5 | 113.3 | -178.3 | -59.9 | 171.5 | 0 | 0 | 0 | 108.9 | T89 N90 | T89-I93 WeakPolarHBondContact O-CG1 3.46Å; N90-I93 PolarHBondContact O-N 2.82Å |
| 94 | P | 58.9 | Low | 61 | Low | 103 Ų | 103 | 120.5 Ų | 120.5 | 67% | 0.669 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 143 | 177.5 | 26 | -33.1 | 0 | 0 | 0 | 110.2 | V92 A96 | V92-P94 VanDerWaalsContact O-CD 3.27Å; V92-P94 WeakPolarHBondContact O-CD 3.2Å; P94-A96 PolarHBondContact O-N 2.95Å |
| 95 | P | 62.9 | Low | 60.9 | Low | 127 Ų | 127 | 124.3 Ų | 124.3 | 83% | 0.825 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 129.2 | -176.4 | 22.6 | -33 | 0 | 0 | 0 | 110.7 | R97 | P95-R97 PolarHBondContact O-N 3.37Š|
| 96 | A | 66.8 | Low | 61 | Low | 91 Ų | 91 | 125.1 Ų | 125.1 | 75% | 0.752 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 131.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | P94 M98 | P94-A96 PolarHBondContact O-N 2.95Å; A96-M98 PolarHBondContact O-N 3.04Å |
| 97 | R | 60.5 | Low | 61 | Low | 240 Ų | 240 | 129.7 Ų | 129.7 | 91% | 0.906 | 74% | 0.739 | S | S | * | * | trans | -65.1 | 106.1 | 174.2 | -166.9 | 176 | -172.7 | 173.9 | 1.8 | 108 | P95 | P95-R97 PolarHBondContact O-N 3.37Š| ||
| 98 | M | 67.6 | Low | 61.1 | Low | 160 Ų | 160 | 129.1 Ų | 129.1 | 79% | 0.788 | 75% | 0.745 | S | S | * | * | trans | -67.1 | 139.4 | 171.8 | -73.2 | -168.6 | -95.7 | 0 | 0 | 109.1 | A96 D100 | A96-M98 PolarHBondContact O-N 3.04Å; M98-D100 PolarHBondContact O-N 3.25Å | ||
| 99 | P | 64.6 | Low | 61.2 | Low | 115 Ų | 115 | 134.5 Ų | 134.5 | 75% | 0.747 | 77% | 0.765 | S | S | * | * | trans | -69.4 | 126.9 | 172.1 | 27.6 | -30.6 | 0 | 0 | 0 | 109.2 | N101 | P99-N101 PolarHBondContact O-N 2.85Š| ||
| 100 | D | 61.9 | Low | 61.3 | Low | 164 Ų | 164 | 138.9 Ų | 138.9 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | trans | -69.4 | 115.4 | 170 | -54.4 | -53.1 | 0 | 0 | 0 | 107.9 | M98 | M98-D100 PolarHBondContact O-N 3.25Š| ||
| 101 | N | 57.6 | Low | 61.7 | Low | 227 Ų | 227 | 140.5 Ų | 140.5 | 100% | 1.214 | 80% | 0.8 | S | S | * | * | trans | -117.2 | 0 | 169.6 | 65.9 | -45.2 | 0 | 0 | 0 | 111.3 | P99 | P99-N101 PolarHBondContact O-N 2.85Š|
Retrieved 101 of 101 residues in 38.5 ms
(Link to these results)