| 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 | 31.1 | Very low | 28.4 | Very low | 244 Ų | 244 | 145.5 Ų | 145.5 | 100% | 1.202 | 85% | 0.85 | S | S | * | * | 0 | 109.6 | 0 | -77.2 | 171.5 | 161 | 0 | 0 | 106.9 | |||||
| 2 | L | 33.5 | Very low | 28.3 | Very low | 164 Ų | 164 | 144.7 Ų | 144.7 | 86% | 0.859 | 85% | 0.849 | S | S | * | * | cis | -127.2 | 128.5 | 1.1 | -89.5 | 78.4 | 0 | 0 | 0 | 105.4 | ||||
| 3 | C | 23.4 | Very low | 28.5 | Very low | 130 Ų | 130 | 144.3 Ų | 144.3 | 88% | 0.878 | 85% | 0.849 | S | S | * | * | 41.8 | 109.2 | 86.6 | -88.4 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 4 | S | 26.7 | Very low | 28.5 | Very low | 121 Ų | 121 | 140.6 Ų | 140.6 | 85% | 0.846 | 84% | 0.842 | S | S | * | * | 154.9 | 105.4 | 126.2 | -162.9 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 5 | A | 29.5 | Very low | 28.7 | Very low | 86 Ų | 86 | 140.1 Ų | 140.1 | 71% | 0.711 | 84% | 0.84 | S | S | * | * | 91.7 | 121.5 | 62.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 6 | K | 27.6 | Very low | 28.7 | Very low | 197 Ų | 197 | 145.7 Ų | 145.7 | 86% | 0.857 | 84% | 0.842 | S | S | * | * | trans | 72.2 | 142.2 | 145.9 | -110.4 | 176.9 | 177 | 174.8 | 0 | 117.8 | ||||
| 7 | T | 28.2 | Very low | 28.8 | Very low | 123 Ų | 123 | 151.2 Ų | 151.2 | 76% | 0.755 | 85% | 0.846 | S | S | * | * | cis | -167.1 | 156.4 | 24 | -27.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 8 | S | 27.7 | Very low | 29.1 | Very low | 114 Ų | 114 | 155.3 Ų | 155.3 | 80% | 0.797 | 85% | 0.846 | S | S | * | * | trans | -35.9 | 152.2 | 160.7 | 179.4 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 9 | G | 27.6 | Very low | 29.5 | Very low | 69 Ų | 69 | 158.5 Ų | 158.5 | 71% | 0.711 | 85% | 0.851 | S | S | * | * | trans | -176.3 | 86.2 | 159.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 10 | Q | 28.8 | Very low | 29.8 | Very low | 191 Ų | 191 | 159.7 Ų | 159.7 | 89% | 0.893 | 85% | 0.853 | S | S | * | * | trans | -61.6 | 137.1 | 160.8 | -78.6 | -178.2 | -23.5 | 0 | 0 | 109.8 | ||||
| 11 | L | 28 | Very low | 30.2 | Very low | 161 Ų | 161 | 155.9 Ų | 155.9 | 84% | 0.843 | 84% | 0.839 | S | S | * | * | trans | -139 | 109.1 | 163.2 | -123.5 | 126.4 | 0 | 0 | 0 | 111.7 | ||||
| 12 | T | 27.8 | Very low | 30.9 | Very low | 136 Ų | 136 | 150.7 Ų | 150.7 | 83% | 0.834 | 82% | 0.821 | S | S | * | * | trans | -46.9 | 126.1 | 163.9 | 18.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 13 | V | 30.5 | Very low | 31.4 | Very low | 140 Ų | 140 | 148.3 Ų | 148.3 | 85% | 0.848 | 81% | 0.813 | S | S | * | * | trans | -101.9 | 113.7 | 169.1 | 178.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 14 | A | 28.6 | Very low | 32.3 | Very low | 92 Ų | 92 | 146.3 Ų | 146.3 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | trans | -67.5 | 128.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | R16 | A14-R16 PolarHBondContact O-N 2.95Å; A14-R16 VanDerWaalsContact O-N 3.17Å | ||
| 15 | V | 31.2 | Very low | 32.8 | Very low | 134 Ų | 134 | 144.2 Ų | 144.2 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -74.9 | 100.1 | 171.3 | 176 | 0 | 0 | 0 | 0 | 109.3 | R17 | V15-R17 PolarHBondContact O-N 3.43Š| ||
| 16 | R | 28.6 | Very low | 33.4 | Very low | 229 Ų | 229 | 150.7 Ų | 150.7 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | -86.4 | 94.6 | 172.1 | -159.3 | 174.2 | -169.3 | -179.9 | 3.8 | 109.3 | A14 R18 | A14-R16 PolarHBondContact O-N 2.95Å; A14-R16 VanDerWaalsContact O-N 3.17Å; R16-R18 PolarHBondContact O-N 3.19Å; R16-R18 VanDerWaalsContact O-N 3.08Å | ||
| 17 | R | 31.5 | Very low | 34.2 | Very low | 240 Ų | 240 | 146 Ų | 146 | 91% | 0.906 | 78% | 0.776 | S | S | * | * | trans | -60.7 | 106.1 | 170.8 | -83.8 | -176.7 | 175.8 | -178.3 | -0.9 | 110.2 | V15 | V15-R17 PolarHBondContact O-N 3.43Š| ||
| 18 | R | 33.2 | Very low | 34.8 | Very low | 225 Ų | 225 | 147 Ų | 147 | 85% | 0.849 | 77% | 0.774 | S | S | * | * | trans | -87.9 | 116.5 | 157.4 | -87.6 | -175.9 | 179.2 | 178.3 | 0.5 | 108.2 | R16 M20 | R16-R18 PolarHBondContact O-N 3.19Å; R16-R18 VanDerWaalsContact O-N 3.08Å; R18-M20 PolarHBondContact O-N 3.01Å | ||
| 19 | K | 36.6 | Very low | 35.5 | Very low | 215 Ų | 215 | 148.8 Ų | 148.8 | 94% | 0.935 | 77% | 0.767 | S | S | * | * | trans | -65.6 | 112.2 | 167.8 | -81.9 | 179.3 | 173.1 | 179.4 | 0 | 108.3 | ||||
| 20 | M | 35.1 | Very low | 36.4 | Very low | 182 Ų | 182 | 148.2 Ų | 148.2 | 90% | 0.897 | 76% | 0.756 | S | S | * | * | trans | -84.2 | 132.2 | 164 | -92.7 | -167.7 | -99.9 | 0 | 0 | 109.5 | R18 | R18-M20 PolarHBondContact O-N 3.01Š| ||
| 21 | S | 39.1 | Very low | 37.2 | Very low | 81 Ų | 81 | 141.3 Ų | 141.3 | 57% | 0.566 | 74% | 0.735 | S | S | * | * | trans | -66.6 | 137.9 | 178.7 | -178.9 | 0 | 0 | 0 | 0 | 111.5 | T23 | S21-T23 PolarHBondContact O-N 3.05Å; S21-T23 VanDerWaalsContact O-N 3.13Å; S21-T23 PolarHBondContact OG-OG1 3.07Å | ||
| 22 | V | 46.4 | Very low | 38.2 | Very low | 134 Ų | 134 | 141.2 Ų | 141.2 | 81% | 0.812 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | -13.5 | -173.8 | 173.1 | 0 | 0 | 0 | 0 | 113.2 | ||
| 23 | T | 43.1 | Very low | 39.4 | Very low | 114 Ų | 114 | 139.3 Ų | 139.3 | 70% | 0.699 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -24.4 | -176.2 | -23 | 0 | 0 | 0 | 0 | 113.7 | S21 | S21-T23 PolarHBondContact O-N 3.05Å; S21-T23 VanDerWaalsContact O-N 3.13Å; S21-T23 PolarHBondContact OG-OG1 3.07Å |
| 24 | T | 41.7 | Very low | 40.4 | Very low | 89 Ų | 89 | 140 Ų | 140 | 55% | 0.546 | 71% | 0.709 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.8 | -14.7 | -176.4 | -43.1 | 0 | 0 | 0 | 0 | 113.4 | T27 | T24-T27 PolarHBondContact O-OG1 3.13Š|
| 25 | C | 39 | Very low | 41.6 | Very low | 77 Ų | 77 | 138.5 Ų | 138.5 | 52% | 0.52 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -78.5 | -20.1 | -179.1 | -165.8 | 0 | 0 | 0 | 0 | 113 | ||
| 26 | R | 41.5 | Very low | 42.6 | Very low | 221 Ų | 221 | 138.9 Ų | 138.9 | 83% | 0.834 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -80.4 | -31.9 | -177.9 | -138.7 | 175.8 | -174.6 | 177.1 | 0.7 | 112.7 | ||
| 27 | T | 44.3 | Very low | 43.8 | Very low | 100 Ų | 100 | 130.3 Ų | 130.3 | 61% | 0.613 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -78.3 | -33.5 | 177.3 | 35.4 | 0 | 0 | 0 | 0 | 113.3 | T24 G31 | T24-T27 PolarHBondContact O-OG1 3.13Å; T27-G31 PolarHBondContact O-N 3.26Å |
| 28 | M | 41.6 | Very low | 44.5 | Very low | 144 Ų | 144 | 124.5 Ų | 124.5 | 71% | 0.709 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -70.4 | -33.1 | 175.5 | -78.5 | -177.3 | 78.3 | 0 | 0 | 113.3 | F32 | M28-F32 WeakPolarHBondContact O-CB 3.45Å; M28-F32 PolarHBondContact O-N 3.48Å |
| 29 | K | 42.3 | Very low | 45 | Very low | 150 Ų | 150 | 118 Ų | 118 | 65% | 0.652 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -69.1 | -36.3 | 175.6 | -79.5 | -178.6 | 175.6 | -178.5 | 0 | 112.7 | T33 | K29-T33 PolarHBondContact O-N 2.96Å; K29-T33 VanDerWaalsContact O-N 3.16Å; K29-T33 PolarHBondContact O-OG1 2.89Å |
| 30 | A | 45.6 | Very low | 45.4 | Very low | 58 Ų | 58 | 111.3 Ų | 111.3 | 48% | 0.479 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -69.5 | -41 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | T33 F34 | A30-T33 PolarHBondContact O-OG1 3.16Å; A30-F34 WeakPolarHBondContact O-CB 3.27Å; A30-F34 PolarHBondContact O-N 3.36Å |
| 31 | G | 45.8 | Very low | 45.7 | Very low | 45 Ų | 45 | 109.7 Ų | 109.7 | 46% | 0.464 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -65.7 | -38.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | T27 A35 | T27-G31 PolarHBondContact O-N 3.26Å; G31-A35 WeakPolarHBondContact O-CB 2.89Å; G31-A35 PolarHBondContact O-N 3.01Å |
| 32 | F | 49.3 | Very low | 45.6 | Very low | 160 Ų | 160 | 109.2 Ų | 109.2 | 70% | 0.702 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.2 | -35.6 | -179.5 | -152.9 | -93.9 | 0 | 0 | 0 | 112.8 | M28 F36 | M28-F32 WeakPolarHBondContact O-CB 3.45Å; M28-F32 PolarHBondContact O-N 3.48Å; F32-F36 WeakPolarHBondContact O-CB 3.48Å; F32-F36 PolarHBondContact O-N 3.32Å; F32-F36 VanDerWaalsContact O-N 3.08Å |
| 33 | T | 52.9 | Low | 45.4 | Very low | 96 Ų | 96 | 109.8 Ų | 109.8 | 59% | 0.589 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -72.3 | -35.9 | 174.4 | 34.6 | 0 | 0 | 0 | 0 | 112.2 | K29 A30 F36 A37 | K29-T33 PolarHBondContact O-N 2.96Å; K29-T33 VanDerWaalsContact O-N 3.16Å; K29-T33 PolarHBondContact O-OG1 2.89Å; A30-T33 PolarHBondContact O-OG1 3.16Å; T33-F36 PolarHBondContact O-N 3.05Å; T33-A37 WeakPolarHBondContact O-CB 3.42Å; T33-A37 PolarHBondContact O-N 3.48Å |
| 34 | F | 51.3 | Low | 45.2 | Very low | 155 Ų | 155 | 108 Ų | 108 | 68% | 0.68 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69.7 | -38.9 | 175.4 | -144 | -92.5 | 0 | 0 | 0 | 112 | A30 A37 L38 | A30-F34 WeakPolarHBondContact O-CB 3.27Å; A30-F34 PolarHBondContact O-N 3.36Å; F34-A37 PolarHBondContact O-N 3.22Å; F34-L38 VanDerWaalsContact O-CB 3.3Å; F34-L38 WeakPolarHBondContact O-CB 3.41Å; F34-L38 PolarHBondContact O-N 3.36Å |
| 35 | A | 53.7 | Low | 45 | Very low | 60 Ų | 60 | 106.6 Ų | 106.6 | 50% | 0.496 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66.1 | -38 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G31 C39 | G31-A35 WeakPolarHBondContact O-CB 2.89Å; G31-A35 PolarHBondContact O-N 3.01Å; A35-C39 VanDerWaalsContact O-CB 3.27Å; A35-C39 WeakPolarHBondContact O-CB 3.27Å; A35-C39 PolarHBondContact O-N 2.78Å |
| 36 | F | 52.8 | Low | 45.1 | Very low | 141 Ų | 141 | 109.3 Ų | 109.3 | 62% | 0.618 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70 | -39.7 | 176.1 | -152 | -92.6 | 0 | 0 | 0 | 111.8 | F32 T33 C39 C40 | F32-F36 WeakPolarHBondContact O-CB 3.48Å; F32-F36 PolarHBondContact O-N 3.32Å; F32-F36 VanDerWaalsContact O-N 3.08Å; T33-F36 PolarHBondContact O-N 3.05Å; F36-C39 PolarHBondContact O-N 3.47Å; F36-C40 PolarHBondContact O-N 3.38Å; F36-C40 PolarHBondContact O-SG 3.13Å |
| 37 | A | 52.4 | Low | 45.4 | Very low | 50 Ų | 50 | 107.2 Ų | 107.2 | 41% | 0.413 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.9 | -38.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T33 F34 C39 C40 L41 | T33-A37 WeakPolarHBondContact O-CB 3.42Å; T33-A37 PolarHBondContact O-N 3.48Å; F34-A37 PolarHBondContact O-N 3.22Å; A37-C39 VanDerWaalsContact C-N 3.34Å; A37-C40 PolarHBondContact O-N 3.13Å; A37-L41 PolarHBondContact O-N 3.32Å |
| 38 | L | 47.1 | Very low | 46.6 | Very low | 117 Ų | 117 | 103.7 Ų | 103.7 | 61% | 0.613 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.2 | -33.9 | 174.4 | -156.6 | 85.5 | 0 | 0 | 0 | 111.7 | F34 L41 A42 | F34-L38 VanDerWaalsContact O-CB 3.3Å; F34-L38 WeakPolarHBondContact O-CB 3.41Å; F34-L38 PolarHBondContact O-N 3.36Å; L38-L41 PolarHBondContact O-N 3.42Å; L38-A42 WeakPolarHBondContact O-CB 3.26Å; L38-A42 PolarHBondContact O-N 3.13Å; L38-A42 VanDerWaalsContact O-N 3.09Å |
| 39 | C | 44.5 | Very low | 48.9 | Very low | 88 Ų | 88 | 97.6 Ų | 97.6 | 60% | 0.595 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -72.4 | -33 | 174.5 | -158.2 | 0 | 0 | 0 | 0 | 112.3 | A35 F36 A37 A42 | A35-C39 VanDerWaalsContact O-CB 3.27Å; A35-C39 WeakPolarHBondContact O-CB 3.27Å; A35-C39 PolarHBondContact O-N 2.78Å; F36-C39 PolarHBondContact O-N 3.47Å; A37-C39 VanDerWaalsContact C-N 3.34Å; C39-A42 PolarHBondContact O-N 2.87Å |
| 40 | C | 44.3 | Very low | 51.2 | Low | 75 Ų | 75 | 90.9 Ų | 90.9 | 51% | 0.507 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -72.2 | -30.1 | 172.7 | -71.1 | 0 | 0 | 0 | 0 | 112.9 | F36 A37 A42 | F36-C40 PolarHBondContact O-N 3.38Å; F36-C40 PolarHBondContact O-SG 3.13Å; A37-C40 PolarHBondContact O-N 3.13Å; C40-A42 VanDerWaalsContact C-N 3.3Å |
| 41 | L | 41 | Very low | 53.5 | Low | 149 Ų | 149 | 88.1 Ų | 88.1 | 78% | 0.78 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -78.9 | -13.4 | 171.6 | -85.9 | 151.1 | 0 | 0 | 0 | 113.3 | A37 L38 L43 | A37-L41 PolarHBondContact O-N 3.32Å; L38-L41 PolarHBondContact O-N 3.42Å; L41-L43 VanDerWaalsContact C-N 3.34Å |
| 42 | A | 36.5 | Very low | 55.8 | Low | 70 Ų | 70 | 86.1 Ų | 86.1 | 58% | 0.579 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.8 | 13.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L38 C39 C40 A44 | L38-A42 WeakPolarHBondContact O-CB 3.26Å; L38-A42 PolarHBondContact O-N 3.13Å; L38-A42 VanDerWaalsContact O-N 3.09Å; C39-A42 PolarHBondContact O-N 2.87Å; C40-A42 VanDerWaalsContact C-N 3.3Å; A42-A44 PolarHBondContact O-N 3.38Å |
| 43 | L | 42.8 | Very low | 58 | Low | 146 Ų | 146 | 78.5 Ų | 78.5 | 76% | 0.764 | 47% | 0.474 | S | S | * | . | trans | -75 | 61.2 | 150.3 | -67.5 | 170.5 | 0 | 0 | 0 | 107.6 | L41 G45 | L41-L43 VanDerWaalsContact C-N 3.34Å; L43-G45 PolarHBondContact O-N 2.93Å | ||
| 44 | A | 39 | Very low | 60 | Low | 78 Ų | 78 | 74.1 Ų | 74.1 | 65% | 0.645 | 45% | 0.447 | S | S | * | . | trans | -53.1 | 127.9 | 160.4 | 0 | 0 | 0 | 0 | 0 | 106 | A42 V46 | A42-A44 PolarHBondContact O-N 3.38Å; A44-V46 PolarHBondContact O-N 3.38Å | ||
| 45 | G | 37.2 | Very low | 62 | Low | 59 Ų | 59 | 68.1 Ų | 68.1 | 61% | 0.608 | 42% | 0.421 | S | S | * | . | trans | -42.1 | 117 | -179.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | L43 H47 | L43-G45 PolarHBondContact O-N 2.93Å; G45-H47 VanDerWaalsContact C-N 3.33Å; G45-H47 PolarHBondContact O-N 3.29Å; G45-H47 PolarHBondContact O-ND1 3.44Å; G45-H47 VanDerWaalsContact O-ND1 3.14Å | ||
| 46 | V | 41 | Very low | 64 | Low | 133 Ų | 133 | 66 Ų | 66 | 81% | 0.806 | 40% | 0.403 | S | S | * | . | trans | -54.5 | 109.1 | 170.9 | 175.5 | 0 | 0 | 0 | 0 | 103.9 | A44 G48 | A44-V46 PolarHBondContact O-N 3.38Å; V46-G48 PolarHBondContact O-N 3.05Å | ||
| 47 | H | 47.5 | Very low | 65.9 | Low | 177 Ų | 177 | 59.3 Ų | 59.3 | 82% | 0.819 | 37% | 0.374 | S | S | * | . | trans | -67.7 | 81.1 | 167.1 | -78.9 | 34.5 | 0 | 0 | 0 | 105.1 | G45 | G45-H47 VanDerWaalsContact C-N 3.33Å; G45-H47 PolarHBondContact O-N 3.29Å; G45-H47 PolarHBondContact O-ND1 3.44Å; G45-H47 VanDerWaalsContact O-ND1 3.14Å | ||
| 48 | G | 70.1 | Confident | 67.6 | Low | 27 Ų | 27 | 66.3 Ų | 66.3 | 28% | 0.278 | 40% | 0.398 | S | S | . | . | trans | -94.1 | -174 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | V46 | V46-G48 PolarHBondContact O-N 3.05Š| ||
| 49 | D | 89.1 | Confident | 69.7 | Low | 15 Ų | 15 | 62.4 Ų | 62.4 | 8% | 0.08 | 38% | 0.376 | C | S | . | . | trans | -31.7 | 144.8 | 172.2 | -60 | -10.9 | 0 | 0 | 0 | 113.3 | D116 L129 P132 T296 K298 | D49-D116 WeakPolarHBondContact CA-O 3.33Å; D49-L129 HydrophobicContact CB-CB 3.91Å; D49-L129 HydrophobicContact CB-CD2 4.13Å; D49-L129 WeakPolarHBondContact O-CB 3.31Å; D49-L129 PolarHBondContact O-N 2.92Å; D49-P132 VanDerWaalsContact OD2-CB 3.26Å; D49-P132 WeakPolarHBondContact OD2-CB 3.45Å; D49-P132 VanDerWaalsContact OD2-CG 3.23Å; D49-P132 WeakPolarHBondContact OD2-CG 3.41Å; D49-T296 CarbonylContact C-O 3.46Å; D49-T296 VanDerWaalsContact CA-O 3.23Å; D49-T296 WeakPolarHBondContact CA-O 3.31Å; D49-T296 WeakPolarHBondContact CB-O 3.44Å; D49-K298 WeakPolarHBondContact OD1-CB 3.21Å; D49-K298 PolarHBondContact OD1-N 2.9Å | ||
| 50 | S | 92.3 | Very high | 71.9 | Confident | 9 Ų | 9 | 59 Ų | 59 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.5 | 144.9 | -171.8 | 78.1 | 0 | 0 | 0 | 0 | 112.7 | Y127 V295 T296 | S50-Y127 CarbonylContact C-O 3.6Å; S50-Y127 WeakPolarHBondContact CA-O 3.47Å; S50-V295 CarbonylContact O-C 3.57Å; S50-V295 WeakPolarHBondContact O-CA 3.28Å; S50-T296 PolarHBondContact N-O 3.42Å; S50-T296 PolarHBondContact N-OG1 2.86Å; S50-T296 PolarHBondContact O-N 3.26Å; S50-T296 PolarHBondContact O-OG1 3.25Å; S50-T296 PolarHBondContact OG-OG1 2.88Å |
| 51 | F | 93.7 | Very high | 74.1 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 113.5 | 167.1 | 175 | -105.3 | 0 | 0 | 0 | 108.5 | V53 V74 V77 W92 L109 S126 Y127 L129 E293 V295 | F51-V53 HydrophobicContact CE1-CG2 3.89Å; F51-V53 HydrophobicContact CZ-CG2 4.28Å; F51-V74 HydrophobicContact CE2-CG1 4.32Å; F51-V77 HydrophobicContact CE1-CG1 4.39Å; F51-V77 HydrophobicContact CZ-CG1 4.18Å; F51-W92 HydrophobicContact CE1-CH2 4.49Å; F51-L109 HydrophobicContact CE2-CD1 4.24Å; F51-S126 WeakPolarHBondContact O-CA 3.48Å; F51-Y127 AromaticContact CD1-CD2 3.83Å; F51-Y127 HydrophobicContact CD1-CD2 3.83Å; F51-Y127 HydrophobicContact CD1-CE2 4.48Å; F51-Y127 HydrophobicContact CE1-CD2 4.41Å; F51-Y127 PolarHBondContact N-O 2.91Å; F51-Y127 PolarHBondContact O-N 3.31Å; F51-L129 HydrophobicContact CB-CD1 4.35Å; F51-E293 HydrophobicContact CE2-CB 3.92Å; F51-E293 HydrophobicContact CE2-CG 4.13Å; F51-E293 HydrophobicContact CZ-CB 4.14Å; F51-E293 HydrophobicContact CZ-CG 3.83Å; F51-V295 HydrophobicContact CD2-CG2 3.73Å; F51-V295 HydrophobicContact CE2-CG2 4.27Å |
| 52 | T | 94.3 | Very high | 76.5 | Confident | 3 Ų | 3 | 50.9 Ų | 50.9 | 2% | 0.018 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 128.8 | -174.3 | -61 | 0 | 0 | 0 | 0 | 111.1 | L54 F120 T123 S126 E293 V294 | T52-L54 HydrophobicContact CG2-CD2 4.28Å; T52-F120 HydrophobicContact CG2-CD2 3.98Å; T52-F120 HydrophobicContact CG2-CE2 4.26Å; T52-T123 HydrophobicContact CG2-CG2 3.67Å; T52-S126 PolarHBondContact OG1-OG 3.37Å; T52-E293 CarbonylContact O-C 3.59Å; T52-E293 WeakPolarHBondContact O-CA 3.41Å; T52-V294 PolarHBondContact N-O 3.24Å; T52-V294 PolarHBondContact O-N 3.08Å |
| 53 | V | 95.1 | Very high | 79.1 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 114.5 | 174.1 | -173.6 | 0 | 0 | 0 | 0 | 108.5 | F51 A56 F62 V124 A125 E293 | F51-V53 HydrophobicContact CE1-CG2 3.89Å; F51-V53 HydrophobicContact CZ-CG2 4.28Å; V53-A56 HydrophobicContact CG1-CB 4.15Å; V53-F62 HydrophobicContact CB-CD2 4.44Å; V53-F62 HydrophobicContact CG1-CD2 3.88Å; V53-F62 HydrophobicContact CG1-CE2 3.74Å; V53-F62 HydrophobicContact CG1-CZ 4.3Å; V53-F62 HydrophobicContact CG2-CD1 3.98Å; V53-F62 HydrophobicContact CG2-CD2 4.18Å; V53-F62 HydrophobicContact CG2-CE1 3.91Å; V53-F62 HydrophobicContact CG2-CE2 4.13Å; V53-F62 HydrophobicContact CG2-CG 4.09Å; V53-F62 HydrophobicContact CG2-CZ 3.97Å; V53-V124 HydrophobicContact CB-CB 4.25Å; V53-V124 HydrophobicContact CG1-CB 4.1Å; V53-V124 HydrophobicContact CG1-CG1 4.49Å; V53-V124 WeakPolarHBondContact O-CB 3.33Å; V53-V124 PolarHBondContact O-N 3.34Å; V53-A125 PolarHBondContact N-O 3.02Å; V53-E293 HydrophobicContact CG2-CG 4.39Å |
| 54 | L | 94 | Very high | 81.2 | Confident | 4 Ų | 4 | 52.3 Ų | 52.3 | 2% | 0.021 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.4 | -46.3 | -180 | -66.4 | -175.6 | 0 | 0 | 0 | 112 | T52 F120 T123 V292 V294 | T52-L54 HydrophobicContact CG2-CD2 4.28Å; L54-F120 HydrophobicContact CD1-CE1 4.42Å; L54-F120 HydrophobicContact CD2-CB 3.99Å; L54-F120 HydrophobicContact CD2-CD1 3.73Å; L54-F120 HydrophobicContact CD2-CD2 3.75Å; L54-F120 HydrophobicContact CD2-CE1 4.11Å; L54-F120 HydrophobicContact CD2-CE2 4.11Å; L54-F120 HydrophobicContact CD2-CG 3.53Å; L54-F120 HydrophobicContact CD2-CZ 4.28Å; L54-T123 HydrophobicContact CD2-CG2 4.3Å; L54-V292 HydrophobicContact CB-CB 4.44Å; L54-V292 HydrophobicContact CB-CG1 4.35Å; L54-V292 HydrophobicContact CD1-CG1 4.3Å; L54-V292 PolarHBondContact N-O 3.5Å; L54-V294 HydrophobicContact CD1-CG2 3.48Å; L54-V294 VanDerWaalsContact CD1-CG2 3.48Å; L54-V294 HydrophobicContact CG-CG2 3.84Å |
| 55 | Q | 94.6 | Very high | 83.3 | Confident | 29 Ų | 29 | 49.6 Ų | 49.6 | 14% | 0.136 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 137.7 | -177.1 | -61.9 | -64.8 | -18.8 | 0 | 0 | 109.5 | Y283 V291 V292 | Q55-Y283 HydrophobicContact CB-CD2 3.9Å; Q55-Y283 HydrophobicContact CB-CG 4.03Å; Q55-Y283 HydrophobicContact CG-CG 4.32Å; Q55-V291 WeakPolarHBondContact O-CA 3.39Å; Q55-V292 HydrophobicContact CB-CB 4.15Å; Q55-V292 HydrophobicContact CB-CG2 4.16Å; Q55-V292 PolarHBondContact N-O 3.17Å; Q55-V292 PolarHBondContact O-N 3.36Å |
| 56 | A | 94.1 | Very high | 85.7 | Confident | 15 Ų | 15 | 53.8 Ų | 53.8 | 12% | 0.124 | 28% | 0.283 | C | S | . | . | trans | -146.5 | 143.4 | 175 | 0 | 0 | 0 | 0 | 0 | 110.1 | V53 F62 V124 Y283 | V53-A56 HydrophobicContact CG1-CB 4.15Å; A56-F62 HydrophobicContact CB-CD2 3.98Å; A56-F62 HydrophobicContact CB-CE2 3.94Å; A56-V124 HydrophobicContact CB-CG1 4.38Å; A56-V124 HydrophobicContact CB-CG2 4.37Å; A56-Y283 PolarHBondContact O-OH 3.45Å | ||
| 57 | P | 92.9 | Very high | 88 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 1% | 0.006 | 26% | 0.263 | C | S | . | . | trans | -65.6 | 155.3 | 173.1 | -18.5 | 33.1 | 0 | 0 | 0 | 111.6 | F59 V60 Y283 N288 A290 V291 | P57-F59 HydrophobicContact CB-CD1 3.84Å; P57-F59 HydrophobicContact CB-CD2 4.32Å; P57-F59 HydrophobicContact CB-CE1 3.43Å; P57-F59 VanDerWaalsContact CB-CE1 3.43Å; P57-F59 HydrophobicContact CB-CE2 3.93Å; P57-F59 HydrophobicContact CB-CG 4.27Å; P57-F59 HydrophobicContact CB-CZ 3.47Å; P57-F59 VanDerWaalsContact CB-CZ 3.47Å; P57-F59 HydrophobicContact CG-CE1 4.21Å; P57-F59 HydrophobicContact CG-CE2 4.16Å; P57-F59 HydrophobicContact CG-CZ 3.77Å; P57-F59 PolarHBondContact O-N 3.37Å; P57-V60 HydrophobicContact CG-CG2 4.49Å; P57-V60 PolarHBondContact O-N 2.99Å; P57-V60 VanDerWaalsContact O-O 3.1Å; P57-Y283 HydrophobicContact CG-CE2 4.44Å; P57-N288 WeakPolarHBondContact CB-O 3.43Å; P57-A290 WeakPolarHBondContact CD-O 3.26Å; P57-V291 HydrophobicContact CG-CG2 4.32Å | ||
| 58 | E | 89.5 | Confident | 90 | Very high | 198 Ų | 198 | 46.4 Ų | 46.4 | 93% | 0.925 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58 | -26.5 | -179.6 | -63.6 | -177.5 | 172.9 | 0 | 0 | 114.2 | V60 | E58-V60 VanDerWaalsContact C-N 3.35Š|
| 59 | F | 90.1 | Very high | 91 | Very high | 34 Ų | 34 | 45.2 Ų | 45.2 | 15% | 0.149 | 23% | 0.228 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -3.7 | 179 | 59.2 | -102 | 0 | 0 | 0 | 113.9 | P57 P99 Q102 P104 R289 | P57-F59 HydrophobicContact CB-CD1 3.84Å; P57-F59 HydrophobicContact CB-CD2 4.32Å; P57-F59 HydrophobicContact CB-CE1 3.43Å; P57-F59 VanDerWaalsContact CB-CE1 3.43Å; P57-F59 HydrophobicContact CB-CE2 3.93Å; P57-F59 HydrophobicContact CB-CG 4.27Å; P57-F59 HydrophobicContact CB-CZ 3.47Å; P57-F59 VanDerWaalsContact CB-CZ 3.47Å; P57-F59 HydrophobicContact CG-CE1 4.21Å; P57-F59 HydrophobicContact CG-CE2 4.16Å; P57-F59 HydrophobicContact CG-CZ 3.77Å; P57-F59 PolarHBondContact O-N 3.37Å; F59-P99 HydrophobicContact CB-CG 3.99Å; F59-P99 VanDerWaalsContact O-CD 3.26Å; F59-P99 WeakPolarHBondContact O-CD 3.07Å; F59-Q102 HydrophobicContact CB-CB 4.33Å; F59-Q102 HydrophobicContact CD1-CB 4.24Å; F59-Q102 HydrophobicContact CD2-CB 4.05Å; F59-Q102 WeakPolarHBondContact CD2-O 3.4Å; F59-Q102 HydrophobicContact CE2-CB 4.45Å; F59-Q102 HydrophobicContact CG-CB 3.94Å; F59-P104 HydrophobicContact CE2-CG 4.14Å; F59-R289 HydrophobicContact CE1-CG 4.28Å; F59-R289 HydrophobicContact CZ-CG 4.43Å |
| 60 | V | 91 | Very high | 91 | Very high | 16 Ų | 16 | 46 Ų | 46 | 10% | 0.097 | 24% | 0.235 | C | C | . | . | S | Bend | trans | -111.1 | 109.5 | 170.9 | -176.9 | 0 | 0 | 0 | 0 | 108.1 | P57 E58 F62 L95 P104 V291 | P57-V60 HydrophobicContact CG-CG2 4.49Å; P57-V60 PolarHBondContact O-N 2.99Å; P57-V60 VanDerWaalsContact O-O 3.1Å; E58-V60 VanDerWaalsContact C-N 3.35Å; V60-F62 HydrophobicContact CG1-CD2 4.13Å; V60-F62 HydrophobicContact CG1-CE2 3.56Å; V60-F62 HydrophobicContact CG1-CZ 4.1Å; V60-L95 HydrophobicContact CG1-CD1 4.18Å; V60-P104 HydrophobicContact CG2-CG 3.79Å; V60-V291 HydrophobicContact CG1-CG2 4.49Å; V60-V291 HydrophobicContact CG2-CG2 4.32Å |
| 61 | S | 90.1 | Very high | 90.8 | Very high | 36 Ų | 36 | 45.6 Ų | 45.6 | 25% | 0.252 | 23% | 0.232 | S | C | . | . | P | Polyproline II helix | trans | -102.4 | 120.1 | -176.6 | 16 | 0 | 0 | 0 | 0 | 110.8 | Q96 | S61-Q96 WeakPolarHBondContact O-CB 3.4Å; S61-Q96 PolarHBondContact O-N 3.25Å; S61-Q96 WeakPolarHBondContact OG-CB 3.49Å; S61-Q96 PolarHBondContact OG-OE1 3.31Å |
| 62 | F | 91.9 | Very high | 90.6 | Very high | 18 Ų | 18 | 50.9 Ų | 50.9 | 8% | 0.079 | 26% | 0.257 | C | S | . | . | B | Isolated β-bridge | trans | -102.1 | 120.3 | 169.7 | -71.5 | -81.3 | 0 | 0 | 0 | 109.1 | V53 A56 V60 T81 W92 G94 L95 V124 A125 Y127 V291 | V53-F62 HydrophobicContact CB-CD2 4.44Å; V53-F62 HydrophobicContact CG1-CD2 3.88Å; V53-F62 HydrophobicContact CG1-CE2 3.74Å; V53-F62 HydrophobicContact CG1-CZ 4.3Å; V53-F62 HydrophobicContact CG2-CD1 3.98Å; V53-F62 HydrophobicContact CG2-CD2 4.18Å; V53-F62 HydrophobicContact CG2-CE1 3.91Å; V53-F62 HydrophobicContact CG2-CE2 4.13Å; V53-F62 HydrophobicContact CG2-CG 4.09Å; V53-F62 HydrophobicContact CG2-CZ 3.97Å; A56-F62 HydrophobicContact CB-CD2 3.98Å; A56-F62 HydrophobicContact CB-CE2 3.94Å; V60-F62 HydrophobicContact CG1-CD2 4.13Å; V60-F62 HydrophobicContact CG1-CE2 3.56Å; V60-F62 HydrophobicContact CG1-CZ 4.1Å; F62-T81 HydrophobicContact CE1-CG2 4.38Å; F62-T81 HydrophobicContact CZ-CG2 3.82Å; F62-W92 HydrophobicContact CD1-CH2 4.47Å; F62-G94 CarbonylContact C-O 3.59Å; F62-G94 VanDerWaalsContact CA-O 3.28Å; F62-G94 WeakPolarHBondContact CA-O 3.27Å; F62-L95 HydrophobicContact CD1-CD1 4.13Å; F62-L95 HydrophobicContact CE1-CD1 3.73Å; F62-L95 HydrophobicContact CZ-CD1 4.05Å; F62-V124 HydrophobicContact CB-CG1 4.36Å; F62-A125 HydrophobicContact CB-CB 3.92Å; F62-Y127 WeakPolarHBondContact CB-OH 3.31Å; F62-Y127 HydrophobicContact CD1-CE2 4.43Å; F62-V291 HydrophobicContact CE2-CG1 4.29Å; F62-V291 HydrophobicContact CZ-CG1 4.37Å |
| 63 | H | 90.2 | Very high | 90.5 | Very high | 82 Ų | 82 | 53 Ų | 53 | 38% | 0.38 | 27% | 0.265 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 127.1 | 178.9 | -74.9 | -59.5 | 0 | 0 | 0 | 110.3 | G65 W67 P93 G94 Q96 Y127 | H63-G65 PolarHBondContact O-N 2.99Å; H63-W67 HydrophobicContact CB-CH2 4.18Å; H63-W67 HydrophobicContact CB-CZ3 3.89Å; H63-W67 WeakPolarHBondContact O-CZ3 3.21Å; H63-P93 PolarHBondContact CD2-O 3.43Å; H63-G94 PolarHBondContact N-O 3Å; H63-Q96 PolarHBondContact CE1-OE1 3.36Å; H63-Q96 PolarHBondContact NE2-OE1 2.93Å; H63-Y127 PolarHBondContact N-OH 3.47Å; H63-Y127 WeakPolarHBondContact O-CE1 3.38Å; H63-Y127 PolarHBondContact O-OH 3.28Å |
| 64 | K | 87.5 | Confident | 90.4 | Very high | 165 Ų | 165 | 53 Ų | 53 | 72% | 0.717 | 27% | 0.265 | S | S | * | . | P | Polyproline II helix | trans | -70.6 | 120.5 | 173.7 | -66.1 | -176.7 | 175.1 | -175.3 | 0 | 110 | V124 | K64-V124 WeakPolarHBondContact CE-O 3.5Š|
| 65 | G | 84.1 | Confident | 90.3 | Very high | 20 Ų | 20 | 53.4 Ų | 53.4 | 21% | 0.206 | 27% | 0.268 | C | S | . | . | S | Bend | trans | 178.4 | 164.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | H63 W67 Y127 | H63-G65 PolarHBondContact O-N 2.99Å; G65-W67 VanDerWaalsContact N-CZ3 3.33Å; G65-W67 PolarHBondContact O-N 3.32Å; G65-W67 VanDerWaalsContact O-N 3.07Å; G65-Y127 WeakPolarHBondContact O-CD1 3.46Å; G65-Y127 WeakPolarHBondContact O-CE1 2.98Å |
| 66 | D | 85.8 | Confident | 90.3 | Very high | 148 Ų | 148 | 53.4 Ų | 53.4 | 79% | 0.791 | 27% | 0.269 | S | S | * | . | trans | -88.8 | 45.1 | -171.1 | -56.7 | -40.6 | 0 | 0 | 0 | 111.9 | ||||
| 67 | W | 89.3 | Confident | 90.3 | Very high | 102 Ų | 102 | 52.7 Ų | 52.7 | 39% | 0.386 | 26% | 0.263 | S | S | . | . | trans | -87 | 120.5 | 178.6 | -53.8 | -76.6 | 0 | 0 | 0 | 110.5 | H63 G65 W92 P93 Y127 | H63-W67 HydrophobicContact CB-CH2 4.18Å; H63-W67 HydrophobicContact CB-CZ3 3.89Å; H63-W67 WeakPolarHBondContact O-CZ3 3.21Å; G65-W67 VanDerWaalsContact N-CZ3 3.33Å; G65-W67 PolarHBondContact O-N 3.32Å; G65-W67 VanDerWaalsContact O-N 3.07Å; W67-W92 PolarHBondContact O-NE1 2.97Å; W67-P93 HydrophobicContact CB-CG 4.15Å; W67-P93 HydrophobicContact CD2-CG 3.68Å; W67-P93 HydrophobicContact CE3-CG 4.27Å; W67-P93 HydrophobicContact CG-CG 3.57Å; W67-Y127 HydrophobicContact CE3-CE1 4.1Å; W67-Y127 HydrophobicContact CZ3-CE1 4.47Å | ||
| 68 | P | 90.1 | Very high | 90.3 | Very high | 53 Ų | 53 | 52.7 Ų | 52.7 | 34% | 0.344 | 26% | 0.263 | S | S | . | . | trans | -65.4 | 139.3 | -180 | 25.3 | -32.3 | 0 | 0 | 0 | 112 | P128 E130 | P68-P128 CarbonylContact C-O 3.48Å; P68-P128 VanDerWaalsContact CA-O 3.26Å; P68-P128 WeakPolarHBondContact CA-O 3.43Å; P68-P128 HydrophobicContact CB-CG 4.29Å; P68-E130 HydrophobicContact CB-CB 4.35Å; P68-E130 HydrophobicContact CB-CG 3.51Å; P68-E130 VanDerWaalsContact CB-OE1 3.23Å; P68-E130 WeakPolarHBondContact CB-OE1 2.96Å; P68-E130 HydrophobicContact CG-CG 4.38Å; P68-E130 WeakPolarHBondContact CG-OE1 3.47Å | ||
| 69 | V | 90.9 | Very high | 90.5 | Very high | 2 Ų | 2 | 43.6 Ų | 43.6 | 1% | 0.012 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 131.1 | 171.7 | 179.6 | 0 | 0 | 0 | 0 | 108.3 | V74 V77 W92 P128 L129 E130 | V69-V74 HydrophobicContact CG1-CG2 4.32Å; V69-V77 HydrophobicContact CG1-CG2 4.49Å; V69-W92 HydrophobicContact CG2-CD2 3.8Å; V69-W92 HydrophobicContact CG2-CE3 4.45Å; V69-W92 HydrophobicContact CG2-CG 4.19Å; V69-W92 HydrophobicContact CG2-CH2 4.02Å; V69-W92 HydrophobicContact CG2-CZ2 3.3Å; V69-W92 VanDerWaalsContact CG2-NE1 3.26Å; V69-P128 PolarHBondContact N-O 3.31Å; V69-L129 HydrophobicContact CB-CD1 4.41Å; V69-L129 CarbonylContact O-C 3.55Å; V69-L129 WeakPolarHBondContact O-CA 3.28Å; V69-L129 WeakPolarHBondContact O-CD1 3.37Å; V69-E130 PolarHBondContact O-N 2.98Å |
| 70 | S | 90.2 | Very high | 90.6 | Very high | 32 Ų | 32 | 44.9 Ų | 44.9 | 22% | 0.224 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -71.6 | 134.8 | 171.8 | -177 | 0 | 0 | 0 | 0 | 110.3 | E72 K73 V74 E130 | S70-E72 PolarHBondContact O-N 2.9Å; S70-K73 WeakPolarHBondContact O-CA 3.41Å; S70-K73 WeakPolarHBondContact O-CB 3.5Å; S70-K73 PolarHBondContact O-N 3.01Å; S70-V74 PolarHBondContact O-N 3.37Å; S70-E130 CarbonylContact C-O 3.54Å; S70-E130 WeakPolarHBondContact CA-O 3.09Å |
| 71 | G | 88.1 | Confident | 90.6 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.228 | C | C | . | . | G | 310 helix | trans | -53.1 | -37.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | K73 V74 E130 F135 | G71-K73 PolarHBondContact O-N 2.99Å; G71-V74 PolarHBondContact O-N 3.06Å; G71-E130 PolarHBondContact N-O 3.2Å; G71-F135 WeakPolarHBondContact O-CD1 3.25Å |
| 72 | E | 88.6 | Confident | 90.6 | Very high | 111 Ų | 111 | 43.1 Ų | 43.1 | 52% | 0.519 | 22% | 0.217 | S | C | . | . | G | 310 helix | trans | -61.5 | -24.3 | 175.4 | -69.9 | -179.3 | 177.3 | 0 | 0 | 113.6 | S70 V133 | S70-E72 PolarHBondContact O-N 2.9Å; E72-V133 HydrophobicContact CB-CG2 4.32Å; E72-V133 HydrophobicContact CG-CG2 3.31Å |
| 73 | K | 91.4 | Very high | 90.5 | Very high | 46 Ų | 46 | 43.8 Ų | 43.8 | 20% | 0.2 | 23% | 0.23 | C | C | . | . | G | 310 helix | trans | -98.3 | -1.3 | -174.8 | -63 | -59.5 | -175.3 | -175.3 | 0 | 113.3 | S70 G71 D76 V77 E88 L90 | S70-K73 WeakPolarHBondContact O-CA 3.41Å; S70-K73 WeakPolarHBondContact O-CB 3.5Å; S70-K73 PolarHBondContact O-N 3.01Å; G71-K73 PolarHBondContact O-N 2.99Å; K73-D76 WeakPolarHBondContact CD-OD2 3.36Å; K73-D76 IonicContact NZ-OD2 2.72Å; K73-D76 PolarHBondContact NZ-OD2 3.21Å; K73-D76 WeakPolarHBondContact O-CB 3.33Å; K73-D76 PolarHBondContact O-N 3.07Å; K73-D76 VanDerWaalsContact O-N 3.16Å; K73-V77 WeakPolarHBondContact O-CG2 3.3Å; K73-V77 PolarHBondContact O-N 3.27Å; K73-E88 IonicContact NZ-OE2 2.72Å; K73-E88 PolarHBondContact NZ-OE2 2.98Å; K73-L90 HydrophobicContact CB-CD1 3.83Å; K73-L90 HydrophobicContact CD-CD1 4.39Å; K73-L90 HydrophobicContact CG-CD1 4.17Å |
| 74 | V | 93.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.1 | -44.7 | 174.8 | 177 | 0 | 0 | 0 | 0 | 112 | F51 V69 S70 G71 D76 V77 V78 L109 L129 F135 V295 | F51-V74 HydrophobicContact CE2-CG1 4.32Å; V69-V74 HydrophobicContact CG1-CG2 4.32Å; S70-V74 PolarHBondContact O-N 3.37Å; G71-V74 PolarHBondContact O-N 3.06Å; V74-D76 VanDerWaalsContact C-N 3.27Å; V74-D76 PolarHBondContact O-N 3.2Å; V74-V77 WeakPolarHBondContact O-CB 3.34Å; V74-V77 PolarHBondContact O-N 3.21Å; V74-V78 WeakPolarHBondContact O-CG2 3.28Å; V74-V78 PolarHBondContact O-N 2.67Å; V74-L109 HydrophobicContact CG1-CD1 4.35Å; V74-L109 HydrophobicContact CG1-CD2 4Å; V74-L129 HydrophobicContact CG2-CD1 3.93Å; V74-F135 HydrophobicContact CB-CD1 4.43Å; V74-F135 HydrophobicContact CB-CE1 4.1Å; V74-F135 HydrophobicContact CB-CE2 4.24Å; V74-F135 HydrophobicContact CB-CZ 4.01Å; V74-F135 HydrophobicContact CG1-CE1 4.34Å; V74-F135 HydrophobicContact CG1-CE2 3.88Å; V74-F135 HydrophobicContact CG1-CZ 3.75Å; V74-F135 HydrophobicContact CG2-CE1 4.19Å; V74-F135 HydrophobicContact CG2-CZ 4.38Å; V74-V295 HydrophobicContact CG1-CG2 4.15Å |
| 75 | P | 93.5 | Very high | 90.6 | Very high | 13 Ų | 13 | 38.8 Ų | 38.8 | 8% | 0.084 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.1 | -36.1 | 174.3 | -24.3 | 35.4 | 0 | 0 | 0 | 113.5 | V78 A79 F135 L137 | P75-V78 PolarHBondContact O-N 3.45Å; P75-A79 WeakPolarHBondContact O-CB 3.03Å; P75-A79 PolarHBondContact O-N 3.48Å; P75-F135 HydrophobicContact CG-CB 3.9Å; P75-F135 HydrophobicContact CG-CD2 3.98Å; P75-F135 HydrophobicContact CG-CG 4.16Å; P75-L137 HydrophobicContact CB-CD2 3.78Å; P75-L137 HydrophobicContact CG-CD2 4.08Å |
| 76 | D | 93.5 | Very high | 90.8 | Very high | 30 Ų | 30 | 39.5 Ų | 39.5 | 16% | 0.16 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67 | -39.8 | 177.4 | -69 | -21.6 | 0 | 0 | 0 | 111.1 | K73 V74 A79 L80 I86 | K73-D76 WeakPolarHBondContact CD-OD2 3.36Å; K73-D76 IonicContact NZ-OD2 2.72Å; K73-D76 PolarHBondContact NZ-OD2 3.21Å; K73-D76 WeakPolarHBondContact O-CB 3.33Å; K73-D76 PolarHBondContact O-N 3.07Å; K73-D76 VanDerWaalsContact O-N 3.16Å; V74-D76 VanDerWaalsContact C-N 3.27Å; V74-D76 PolarHBondContact O-N 3.2Å; D76-A79 PolarHBondContact O-N 2.97Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 VanDerWaalsContact O-CG 3.31Å; D76-L80 WeakPolarHBondContact O-CG 3.13Å; D76-L80 PolarHBondContact O-N 3.16Å; D76-I86 HydrophobicContact CB-CB 4.46Å; D76-I86 HydrophobicContact CB-CD1 4.09Å; D76-I86 HydrophobicContact CB-CG2 3.97Å |
| 77 | V | 93.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.2 | -49.9 | 172.6 | 174.8 | 0 | 0 | 0 | 0 | 110 | F51 V69 K73 V74 A79 L80 T81 L90 W92 | F51-V77 HydrophobicContact CE1-CG1 4.39Å; F51-V77 HydrophobicContact CZ-CG1 4.18Å; V69-V77 HydrophobicContact CG1-CG2 4.49Å; K73-V77 WeakPolarHBondContact O-CG2 3.3Å; K73-V77 PolarHBondContact O-N 3.27Å; V74-V77 WeakPolarHBondContact O-CB 3.34Å; V74-V77 PolarHBondContact O-N 3.21Å; V77-A79 VanDerWaalsContact C-N 3.35Å; V77-A79 PolarHBondContact O-N 3.1Å; V77-L80 PolarHBondContact O-N 3.42Å; V77-T81 HydrophobicContact CG1-CG2 4.32Å; V77-T81 VanDerWaalsContact O-CG2 3.25Å; V77-T81 WeakPolarHBondContact O-CG2 3.37Å; V77-T81 PolarHBondContact O-N 3.07Å; V77-L90 HydrophobicContact CG2-CD2 3.57Å; V77-W92 HydrophobicContact CG1-CZ3 4.23Å; V77-W92 HydrophobicContact CG2-CE3 4.16Å; V77-W92 HydrophobicContact CG2-CZ3 4.11Å |
| 78 | V | 94.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -58.7 | -46.1 | 178.4 | 170.7 | 0 | 0 | 0 | 0 | 111 | V74 P75 L80 T81 M82 N107 L109 L137 V140 L242 E293 | V74-V78 WeakPolarHBondContact O-CG2 3.28Å; V74-V78 PolarHBondContact O-N 2.67Å; P75-V78 PolarHBondContact O-N 3.45Å; V78-L80 PolarHBondContact O-N 2.88Å; V78-T81 PolarHBondContact O-N 3.39Å; V78-T81 PolarHBondContact O-OG1 3.47Å; V78-M82 HydrophobicContact CG1-CE 3.55Å; V78-M82 PolarHBondContact O-N 3.02Å; V78-N107 HydrophobicContact CG1-CB 4.4Å; V78-L109 HydrophobicContact CG2-CD2 4.25Å; V78-L137 HydrophobicContact CB-CD2 4.25Å; V78-L137 HydrophobicContact CG1-CD1 4.21Å; V78-L137 HydrophobicContact CG1-CD2 4.31Å; V78-L137 HydrophobicContact CG2-CD2 4.3Å; V78-V140 HydrophobicContact CG1-CG1 4.34Å; V78-L242 HydrophobicContact CG1-CD1 4.2Å; V78-E293 WeakPolarHBondContact CG2-OE2 3Å |
| 79 | A | 93.6 | Very high | 90.1 | Very high | 8 Ų | 8 | 47.4 Ų | 47.4 | 7% | 0.066 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.9 | -47 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P75 D76 V77 M82 G83 F84 I86 V140 | P75-A79 WeakPolarHBondContact O-CB 3.03Å; P75-A79 PolarHBondContact O-N 3.48Å; D76-A79 PolarHBondContact O-N 2.97Å; V77-A79 VanDerWaalsContact C-N 3.35Å; V77-A79 PolarHBondContact O-N 3.1Å; A79-M82 PolarHBondContact O-N 2.96Å; A79-G83 PolarHBondContact O-N 2.8Å; A79-G83 VanDerWaalsContact O-N 3.14Å; A79-F84 HydrophobicContact CB-CB 4.26Å; A79-F84 WeakPolarHBondContact O-CB 3.39Å; A79-F84 PolarHBondContact O-N 3.13Å; A79-I86 HydrophobicContact CB-CG2 3.73Å; A79-V140 HydrophobicContact CB-CG2 4.11Å |
| 80 | L | 91.9 | Very high | 89.9 | Confident | 60 Ų | 60 | 49 Ų | 49 | 31% | 0.314 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.8 | -39 | 178.9 | -74.1 | 177 | 0 | 0 | 0 | 112.7 | D76 V77 V78 M82 G83 I86 L90 L95 | D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 VanDerWaalsContact O-CG 3.31Å; D76-L80 WeakPolarHBondContact O-CG 3.13Å; D76-L80 PolarHBondContact O-N 3.16Å; V77-L80 PolarHBondContact O-N 3.42Å; V78-L80 PolarHBondContact O-N 2.88Å; L80-M82 VanDerWaalsContact C-N 3.26Å; L80-M82 PolarHBondContact O-N 2.87Å; L80-G83 WeakPolarHBondContact O-CA 3.11Å; L80-G83 PolarHBondContact O-N 3.29Å; L80-I86 HydrophobicContact CD1-CD1 3.64Å; L80-I86 HydrophobicContact CD2-CD1 4.05Å; L80-I86 HydrophobicContact CD2-CG1 4.09Å; L80-I86 HydrophobicContact CD2-CG2 4.25Å; L80-I86 HydrophobicContact CG-CD1 3.87Å; L80-I86 HydrophobicContact CG-CG1 4.33Å; L80-I86 HydrophobicContact CG-CG2 4Å; L80-L90 HydrophobicContact CD1-CB 3.77Å; L80-L90 HydrophobicContact CD1-CD2 3.73Å; L80-L90 HydrophobicContact CD1-CG 4.39Å; L80-L95 HydrophobicContact CB-CD2 3.67Å; L80-L95 HydrophobicContact CD1-CD2 4.33Å |
| 81 | T | 91.4 | Very high | 89.7 | Confident | 7 Ų | 7 | 55.3 Ų | 55.3 | 4% | 0.043 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.7 | -36.3 | 177.6 | 64.4 | 0 | 0 | 0 | 0 | 111.8 | F62 V77 V78 G83 L95 P104 N107 | F62-T81 HydrophobicContact CE1-CG2 4.38Å; F62-T81 HydrophobicContact CZ-CG2 3.82Å; V77-T81 HydrophobicContact CG1-CG2 4.32Å; V77-T81 VanDerWaalsContact O-CG2 3.25Å; V77-T81 WeakPolarHBondContact O-CG2 3.37Å; V77-T81 PolarHBondContact O-N 3.07Å; V78-T81 PolarHBondContact O-N 3.39Å; V78-T81 PolarHBondContact O-OG1 3.47Å; T81-G83 VanDerWaalsContact C-N 3.26Å; T81-G83 PolarHBondContact O-N 3.26Å; T81-L95 HydrophobicContact CG2-CD1 3.92Å; T81-L95 HydrophobicContact CG2-CD2 4.03Å; T81-P104 WeakPolarHBondContact O-CD 3.2Å; T81-P104 WeakPolarHBondContact O-CG 3.23Å; T81-N107 PolarHBondContact OG1-ND2 3.35Å; T81-N107 VanDerWaalsContact OG1-ND2 3.08Å |
| 82 | M | 90.3 | Very high | 89.8 | Confident | 8 Ų | 8 | 56.5 Ų | 56.5 | 4% | 0.039 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -79.1 | -9.3 | 174.4 | -70.8 | -172.5 | -72.3 | 0 | 0 | 113.5 | V78 A79 L80 F84 N107 V140 L242 | V78-M82 HydrophobicContact CG1-CE 3.55Å; V78-M82 PolarHBondContact O-N 3.02Å; A79-M82 PolarHBondContact O-N 2.96Å; L80-M82 VanDerWaalsContact C-N 3.26Å; L80-M82 PolarHBondContact O-N 2.87Å; M82-F84 HydrophobicContact CB-CD2 3.87Å; M82-F84 HydrophobicContact CB-CE2 3.72Å; M82-F84 HydrophobicContact CB-CZ 4.33Å; M82-F84 HydrophobicContact CE-CD2 4.16Å; M82-F84 HydrophobicContact CE-CE2 3.88Å; M82-F84 HydrophobicContact SD-CE2 4.06Å; M82-N107 HydrophobicContact CE-CB 4.21Å; M82-N107 HydrophobicContact CG-CB 4Å; M82-N107 HydrophobicContact SD-CB 3.72Å; M82-V140 HydrophobicContact CE-CG1 3.15Å; M82-L242 HydrophobicContact CE-CD1 4Å; M82-L242 HydrophobicContact SD-CD1 4.48Å |
| 83 | G | 89.3 | Confident | 89.7 | Confident | 33 Ų | 33 | 54.3 Ų | 54.3 | 34% | 0.34 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.2 | 18.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | A79 L80 T81 | A79-G83 PolarHBondContact O-N 2.8Å; A79-G83 VanDerWaalsContact O-N 3.14Å; L80-G83 WeakPolarHBondContact O-CA 3.11Å; L80-G83 PolarHBondContact O-N 3.29Å; T81-G83 VanDerWaalsContact C-N 3.26Å; T81-G83 PolarHBondContact O-N 3.26Å |
| 84 | F | 90.1 | Very high | 89.5 | Confident | 23 Ų | 23 | 52.1 Ų | 52.1 | 10% | 0.101 | 29% | 0.287 | C | S | . | . | P | Polyproline II helix | trans | -82.1 | 154.1 | 172.4 | -56.8 | -44.9 | 0 | 0 | 0 | 111.4 | A79 M82 V140 T143 V144 L147 F148 P240 | A79-F84 HydrophobicContact CB-CB 4.26Å; A79-F84 WeakPolarHBondContact O-CB 3.39Å; A79-F84 PolarHBondContact O-N 3.13Å; M82-F84 HydrophobicContact CB-CD2 3.87Å; M82-F84 HydrophobicContact CB-CE2 3.72Å; M82-F84 HydrophobicContact CB-CZ 4.33Å; M82-F84 HydrophobicContact CE-CD2 4.16Å; M82-F84 HydrophobicContact CE-CE2 3.88Å; M82-F84 HydrophobicContact SD-CE2 4.06Å; F84-V140 HydrophobicContact CD2-CG1 4.22Å; F84-V140 HydrophobicContact CE2-CG1 4.3Å; F84-T143 HydrophobicContact CB-CG2 4.25Å; F84-T143 HydrophobicContact CD1-CG2 3.73Å; F84-T143 HydrophobicContact CD2-CG2 4.11Å; F84-T143 HydrophobicContact CE1-CG2 4.08Å; F84-T143 HydrophobicContact CE2-CG2 4.41Å; F84-T143 HydrophobicContact CG-CG2 3.76Å; F84-T143 HydrophobicContact CZ-CG2 4.4Å; F84-V144 HydrophobicContact CE2-CG2 3.65Å; F84-V144 HydrophobicContact CZ-CG2 3.75Å; F84-L147 HydrophobicContact CD1-CD1 3.95Å; F84-L147 HydrophobicContact CE1-CD1 3.81Å; F84-F148 HydrophobicContact CE1-CE2 4.03Å; F84-F148 HydrophobicContact CZ-CE2 4.18Å; F84-P240 HydrophobicContact CZ-CG 4.12Å |
| 85 | S | 88.8 | Confident | 89.3 | Confident | 119 Ų | 119 | 53.7 Ų | 53.7 | 83% | 0.832 | 30% | 0.295 | S | S | * | . | P | Polyproline II helix | trans | -80.3 | 137.5 | 173.8 | 54.7 | 0 | 0 | 0 | 0 | 110.9 | ||
| 86 | I | 89.6 | Confident | 89 | Confident | 35 Ų | 35 | 57.3 Ų | 57.3 | 18% | 0.179 | 31% | 0.311 | C | S | . | . | P | Polyproline II helix | trans | -103.2 | 160.3 | 175 | 60 | 176.6 | 0 | 0 | 0 | 111 | D76 A79 L80 E88 L90 | D76-I86 HydrophobicContact CB-CB 4.46Å; D76-I86 HydrophobicContact CB-CD1 4.09Å; D76-I86 HydrophobicContact CB-CG2 3.97Å; A79-I86 HydrophobicContact CB-CG2 3.73Å; L80-I86 HydrophobicContact CD1-CD1 3.64Å; L80-I86 HydrophobicContact CD2-CD1 4.05Å; L80-I86 HydrophobicContact CD2-CG1 4.09Å; L80-I86 HydrophobicContact CD2-CG2 4.25Å; L80-I86 HydrophobicContact CG-CD1 3.87Å; L80-I86 HydrophobicContact CG-CG1 4.33Å; L80-I86 HydrophobicContact CG-CG2 4Å; I86-E88 WeakPolarHBondContact CD1-O 3.27Å; I86-E88 VanDerWaalsContact CG1-O 3.28Å; I86-E88 WeakPolarHBondContact CG1-O 3.42Å; I86-L90 HydrophobicContact CD1-CB 3.71Å |
| 87 | Q | 82.1 | Confident | 88.1 | Confident | 199 Ų | 199 | 60.6 Ų | 60.6 | 93% | 0.93 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -75.7 | -34 | -176.7 | -66.1 | -178.5 | 1.8 | 0 | 0 | 112.9 | ||
| 88 | E | 85.1 | Confident | 87.4 | Confident | 123 Ų | 123 | 61.9 Ų | 61.9 | 58% | 0.575 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -124.2 | 134.8 | -179.4 | -65.2 | -176.7 | 166.1 | 0 | 0 | 109.5 | K73 I86 L90 | K73-E88 IonicContact NZ-OE2 2.72Å; K73-E88 PolarHBondContact NZ-OE2 2.98Å; I86-E88 WeakPolarHBondContact CD1-O 3.27Å; I86-E88 VanDerWaalsContact CG1-O 3.28Å; I86-E88 WeakPolarHBondContact CG1-O 3.42Å; E88-L90 PolarHBondContact O-N 2.9Å |
| 89 | D | 83.4 | Confident | 86.9 | Confident | 147 Ų | 147 | 64.8 Ų | 64.8 | 79% | 0.786 | 37% | 0.374 | S | S | * | . | trans | -59.9 | 125.2 | 179.7 | -69.6 | -30.3 | 0 | 0 | 0 | 111.4 | L91 | D89-L91 PolarHBondContact O-N 3.45Š| ||
| 90 | L | 85.9 | Confident | 86.2 | Confident | 35 Ų | 35 | 70.5 Ų | 70.5 | 18% | 0.183 | 40% | 0.403 | C | S | . | . | trans | -78.6 | 101.5 | 174.9 | -175.4 | 69.4 | 0 | 0 | 0 | 109.2 | K73 V77 L80 I86 E88 W92 | K73-L90 HydrophobicContact CB-CD1 3.83Å; K73-L90 HydrophobicContact CD-CD1 4.39Å; K73-L90 HydrophobicContact CG-CD1 4.17Å; V77-L90 HydrophobicContact CG2-CD2 3.57Å; L80-L90 HydrophobicContact CD1-CB 3.77Å; L80-L90 HydrophobicContact CD1-CD2 3.73Å; L80-L90 HydrophobicContact CD1-CG 4.39Å; I86-L90 HydrophobicContact CD1-CB 3.71Å; E88-L90 PolarHBondContact O-N 2.9Å; L90-W92 HydrophobicContact CD1-CB 4.04Å; L90-W92 HydrophobicContact CD2-CB 4.3Å; L90-W92 HydrophobicContact CD2-CE3 4.13Å; L90-W92 HydrophobicContact CG-CB 3.9Å; L90-W92 PolarHBondContact O-N 3.08Å; L90-W92 VanDerWaalsContact O-N 3.15Å | ||
| 91 | L | 85.4 | Confident | 85.8 | Confident | 165 Ų | 165 | 77.2 Ų | 77.2 | 86% | 0.864 | 43% | 0.43 | S | S | * | . | trans | -75.7 | 8.2 | 178.2 | -60.7 | 176.8 | 0 | 0 | 0 | 114 | D89 | D89-L91 PolarHBondContact O-N 3.45Š| ||
| 92 | W | 90.2 | Very high | 85.6 | Confident | 24 Ų | 24 | 82 Ų | 82 | 9% | 0.091 | 45% | 0.452 | C | S | . | . | trans | -80.9 | 124.8 | -177.5 | 175.1 | 73.3 | 0 | 0 | 0 | 111.2 | F51 F62 W67 V69 V77 L90 G94 L95 Y127 | F51-W92 HydrophobicContact CE1-CH2 4.49Å; F62-W92 HydrophobicContact CD1-CH2 4.47Å; W67-W92 PolarHBondContact O-NE1 2.97Å; V69-W92 HydrophobicContact CG2-CD2 3.8Å; V69-W92 HydrophobicContact CG2-CE3 4.45Å; V69-W92 HydrophobicContact CG2-CG 4.19Å; V69-W92 HydrophobicContact CG2-CH2 4.02Å; V69-W92 HydrophobicContact CG2-CZ2 3.3Å; V69-W92 VanDerWaalsContact CG2-NE1 3.26Å; V77-W92 HydrophobicContact CG1-CZ3 4.23Å; V77-W92 HydrophobicContact CG2-CE3 4.16Å; V77-W92 HydrophobicContact CG2-CZ3 4.11Å; L90-W92 HydrophobicContact CD1-CB 4.04Å; L90-W92 HydrophobicContact CD2-CB 4.3Å; L90-W92 HydrophobicContact CD2-CE3 4.13Å; L90-W92 HydrophobicContact CG-CB 3.9Å; L90-W92 PolarHBondContact O-N 3.08Å; L90-W92 VanDerWaalsContact O-N 3.15Å; W92-G94 VanDerWaalsContact C-N 3.29Å; W92-G94 PolarHBondContact O-N 2.83Å; W92-L95 HydrophobicContact CE3-CB 4.07Å; W92-L95 HydrophobicContact CZ3-CB 3.74Å; W92-Y127 AromaticContact CH2-CD2 4Å; W92-Y127 HydrophobicContact CH2-CD2 4Å; W92-Y127 HydrophobicContact CH2-CE1 4.25Å; W92-Y127 AromaticContact CH2-CE2 3.65Å; W92-Y127 HydrophobicContact CH2-CE2 3.65Å; W92-Y127 HydrophobicContact CH2-CG 4.38Å; W92-Y127 AromaticContact CH2-CZ 3.77Å; W92-Y127 AromaticContact CZ2-CD1 3.58Å; W92-Y127 HydrophobicContact CZ2-CD1 3.58Å; W92-Y127 AromaticContact CZ2-CD2 3.69Å; W92-Y127 HydrophobicContact CZ2-CD2 3.69Å; W92-Y127 AromaticContact CZ2-CE1 3.57Å; W92-Y127 HydrophobicContact CZ2-CE1 3.57Å; W92-Y127 AromaticContact CZ2-CE2 3.65Å; W92-Y127 HydrophobicContact CZ2-CE2 3.65Å; W92-Y127 AromaticContact CZ2-CG 3.61Å; W92-Y127 HydrophobicContact CZ2-CG 3.61Å; W92-Y127 AromaticContact CZ2-CZ 3.57Å | ||
| 93 | P | 87.1 | Confident | 85.5 | Confident | 66 Ų | 66 | 85.4 Ų | 85.4 | 43% | 0.429 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | -3.4 | -171.9 | 33.3 | -37.8 | 0 | 0 | 0 | 114.4 | H63 W67 L95 | H63-P93 PolarHBondContact CD2-O 3.43Å; W67-P93 HydrophobicContact CB-CG 4.15Å; W67-P93 HydrophobicContact CD2-CG 3.68Å; W67-P93 HydrophobicContact CE3-CG 4.27Å; W67-P93 HydrophobicContact CG-CG 3.57Å; P93-L95 VanDerWaalsContact C-N 3.34Å; P93-L95 PolarHBondContact O-N 3.48Å |
| 94 | G | 87.4 | Confident | 85.7 | Confident | 0 Ų | 0 | 84 Ų | 84 | 0% | 0 | 45% | 0.449 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -19.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | F62 H63 W92 Y127 | F62-G94 CarbonylContact C-O 3.59Å; F62-G94 VanDerWaalsContact CA-O 3.28Å; F62-G94 WeakPolarHBondContact CA-O 3.27Å; H63-G94 PolarHBondContact N-O 3Å; W92-G94 VanDerWaalsContact C-N 3.29Å; W92-G94 PolarHBondContact O-N 2.83Å; G94-Y127 PolarHBondContact O-OH 2.96Å; G94-Y127 VanDerWaalsContact O-OH 3.09Å |
| 95 | L | 89.7 | Confident | 85.8 | Confident | 33 Ų | 33 | 86 Ų | 86 | 17% | 0.173 | 46% | 0.456 | C | S | . | . | B | Isolated β-bridge | trans | -104.9 | 118.3 | 175.1 | -177.6 | 64.2 | 0 | 0 | 0 | 110.5 | V60 F62 L80 T81 W92 P93 | V60-L95 HydrophobicContact CG1-CD1 4.18Å; F62-L95 HydrophobicContact CD1-CD1 4.13Å; F62-L95 HydrophobicContact CE1-CD1 3.73Å; F62-L95 HydrophobicContact CZ-CD1 4.05Å; L80-L95 HydrophobicContact CB-CD2 3.67Å; L80-L95 HydrophobicContact CD1-CD2 4.33Å; T81-L95 HydrophobicContact CG2-CD1 3.92Å; T81-L95 HydrophobicContact CG2-CD2 4.03Å; W92-L95 HydrophobicContact CE3-CB 4.07Å; W92-L95 HydrophobicContact CZ3-CB 3.74Å; P93-L95 VanDerWaalsContact C-N 3.34Å; P93-L95 PolarHBondContact O-N 3.48Å |
| 96 | Q | 86.3 | Confident | 86 | Confident | 89 Ų | 89 | 80.4 Ų | 80.4 | 42% | 0.416 | 42% | 0.416 | S | S | . | . | trans | -86.1 | 142.3 | 175.7 | -171.3 | 176.7 | -6.8 | 0 | 0 | 111 | S61 H63 G98 | S61-Q96 WeakPolarHBondContact O-CB 3.4Å; S61-Q96 PolarHBondContact O-N 3.25Å; S61-Q96 WeakPolarHBondContact OG-CB 3.49Å; S61-Q96 PolarHBondContact OG-OE1 3.31Å; H63-Q96 PolarHBondContact CE1-OE1 3.36Å; H63-Q96 PolarHBondContact NE2-OE1 2.93Å; Q96-G98 PolarHBondContact O-N 3.29Å; Q96-G98 VanDerWaalsContact O-N 3.1Å | ||
| 97 | A | 75.6 | Confident | 86.3 | Confident | 99 Ų | 99 | 78.7 Ų | 78.7 | 82% | 0.818 | 41% | 0.408 | S | S | * | . | trans | -64.8 | 110.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 98 | G | 78.6 | Confident | 86.9 | Confident | 27 Ų | 27 | 69.2 Ų | 69.2 | 28% | 0.278 | 36% | 0.363 | S | S | . | . | trans | -87.9 | -179.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q96 L100 | Q96-G98 PolarHBondContact O-N 3.29Å; Q96-G98 VanDerWaalsContact O-N 3.1Å; G98-L100 PolarHBondContact O-N 3.39Å | ||
| 99 | P | 82.9 | Confident | 87.5 | Confident | 60 Ų | 60 | 63.4 Ų | 63.4 | 39% | 0.39 | 34% | 0.336 | S | S | . | . | trans | -62 | 130.7 | -178 | -16.2 | 28.4 | 0 | 0 | 0 | 112.5 | F59 F101 Q102 R103 | F59-P99 HydrophobicContact CB-CG 3.99Å; F59-P99 VanDerWaalsContact O-CD 3.26Å; F59-P99 WeakPolarHBondContact O-CD 3.07Å; P99-F101 PolarHBondContact O-N 3.47Å; P99-F101 VanDerWaalsContact O-N 3.09Å; P99-Q102 HydrophobicContact CB-CB 4.26Å; P99-Q102 PolarHBondContact O-N 2.84Å; P99-R103 PolarHBondContact O-NH1 3.4Å | ||
| 100 | L | 79.1 | Confident | 88 | Confident | 129 Ų | 129 | 56.4 Ų | 56.4 | 68% | 0.675 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -29 | -174 | -66.5 | 175.3 | 0 | 0 | 0 | 115.1 | G98 | G98-L100 PolarHBondContact O-N 3.39Š|
| 101 | F | 83.3 | Confident | 88.4 | Confident | 200 Ų | 200 | 55.1 Ų | 55.1 | 88% | 0.877 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.1 | -2.2 | -173.6 | -55.4 | -69.1 | 0 | 0 | 0 | 114 | P99 | P99-F101 PolarHBondContact O-N 3.47Å; P99-F101 VanDerWaalsContact O-N 3.09Å |
| 102 | Q | 86.6 | Confident | 88.8 | Confident | 108 Ų | 108 | 47.2 Ų | 47.2 | 51% | 0.505 | 25% | 0.251 | S | S | . | . | trans | -115.4 | 108.4 | 176.1 | -66.5 | -179 | -5 | 0 | 0 | 108.1 | F59 P99 | F59-Q102 HydrophobicContact CB-CB 4.33Å; F59-Q102 HydrophobicContact CD1-CB 4.24Å; F59-Q102 HydrophobicContact CD2-CB 4.05Å; F59-Q102 WeakPolarHBondContact CD2-O 3.4Å; F59-Q102 HydrophobicContact CE2-CB 4.45Å; F59-Q102 HydrophobicContact CG-CB 3.94Å; P99-Q102 HydrophobicContact CB-CB 4.26Å; P99-Q102 PolarHBondContact O-N 2.84Å | ||
| 103 | R | 90.1 | Very high | 88.8 | Confident | 80 Ų | 80 | 48.4 Ų | 48.4 | 30% | 0.302 | 26% | 0.255 | S | S | . | . | trans | -121 | 149.4 | 178.4 | -60.4 | -59.3 | -178.4 | -140.2 | 12.1 | 110.3 | P99 | P99-R103 PolarHBondContact O-NH1 3.4Š| ||
| 104 | P | 92.4 | Very high | 88.9 | Confident | 4 Ų | 4 | 45.4 Ų | 45.4 | 3% | 0.026 | 24% | 0.236 | C | C | . | . | trans | -55.7 | 144.5 | 169.9 | -22.8 | 35.1 | 0 | 0 | 0 | 110.8 | F59 V60 T81 R289 V291 | F59-P104 HydrophobicContact CE2-CG 4.14Å; V60-P104 HydrophobicContact CG2-CG 3.79Å; T81-P104 WeakPolarHBondContact O-CD 3.2Å; T81-P104 WeakPolarHBondContact O-CG 3.23Å; P104-R289 CarbonylContact C-O 3.56Å; P104-R289 WeakPolarHBondContact CA-O 3.38Å; P104-R289 WeakPolarHBondContact CB-O 3.22Å; P104-V291 HydrophobicContact CB-CG2 4Å; P104-V291 HydrophobicContact CG-CG2 3.62Å | ||
| 105 | R | 91.7 | Very high | 89 | Confident | 65 Ų | 65 | 45.7 Ų | 45.7 | 25% | 0.245 | 24% | 0.238 | C | C | . | . | S | Bend | trans | -88.8 | -17.2 | 173.3 | -66 | -66.2 | 179 | -175.2 | -1.6 | 112.6 | F238 P240 D241 Y286 R289 | R105-F238 VanDerWaalsContact NH1-C 3.27Å; R105-F238 PolarHBondContact NH1-O 3.38Å; R105-P240 CarbonylContact O-C 3.43Å; R105-P240 WeakPolarHBondContact O-CA 3.3Å; R105-D241 PolarHBondContact O-N 3.12Å; R105-Y286 HydrophobicContact CB-CD1 3.9Å; R105-R289 HydrophobicContact CB-CB 4.26Å; R105-R289 HydrophobicContact CG-CB 4.04Å; R105-R289 PolarHBondContact N-O 2.92Å |
| 106 | A | 93.8 | Very high | 88.8 | Confident | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.6 | 143.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | D241 Y243 Y286 A290 V291 | A106-D241 CarbonylContact C-O 3.58Å; A106-D241 VanDerWaalsContact CA-O 3.23Å; A106-D241 WeakPolarHBondContact CA-O 3.36Å; A106-D241 HydrophobicContact CB-CB 4.2Å; A106-Y243 HydrophobicContact CB-CE2 4.4Å; A106-Y286 HydrophobicContact CB-CD1 3.72Å; A106-Y286 HydrophobicContact CB-CD2 3.77Å; A106-Y286 HydrophobicContact CB-CE1 3.6Å; A106-Y286 HydrophobicContact CB-CE2 3.68Å; A106-Y286 HydrophobicContact CB-CG 3.8Å; A106-A290 HydrophobicContact CB-CB 4Å; A106-A290 CarbonylContact O-C 3.57Å; A106-A290 VanDerWaalsContact O-CA 3.28Å; A106-A290 WeakPolarHBondContact O-CA 3.33Å; A106-V291 PolarHBondContact O-N 3.29Å |
| 107 | N | 95.6 | Very high | 88.8 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 128.5 | 161.9 | -172.5 | -58.1 | 0 | 0 | 0 | 108.5 | V78 T81 M82 D241 L242 Y243 E293 | V78-N107 HydrophobicContact CG1-CB 4.4Å; T81-N107 PolarHBondContact OG1-ND2 3.35Å; T81-N107 VanDerWaalsContact OG1-ND2 3.08Å; M82-N107 HydrophobicContact CE-CB 4.21Å; M82-N107 HydrophobicContact CG-CB 4Å; M82-N107 HydrophobicContact SD-CB 3.72Å; N107-D241 PolarHBondContact N-O 2.97Å; N107-L242 HydrophobicContact CB-CD1 4.29Å; N107-Y243 PolarHBondContact O-N 3.32Å; N107-E293 PolarHBondContact ND2-OE1 3.16Å |
| 108 | V | 95.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 109 | 178.5 | -177.6 | 0 | 0 | 0 | 0 | 108.1 | V110 Y243 F278 M282 V291 V292 E293 | V108-V110 HydrophobicContact CG1-CG2 4.24Å; V108-Y243 HydrophobicContact CG2-CD2 3.74Å; V108-Y243 HydrophobicContact CG2-CG 4.21Å; V108-F278 HydrophobicContact CG1-CE1 3.64Å; V108-F278 HydrophobicContact CG1-CZ 4.21Å; V108-M282 HydrophobicContact CG2-CB 4.46Å; V108-M282 HydrophobicContact CG2-CE 3.61Å; V108-M282 HydrophobicContact CG2-CG 4.49Å; V108-V291 PolarHBondContact N-O 3.13Å; V108-V292 HydrophobicContact CB-CG1 4.28Å; V108-V292 HydrophobicContact CB-CG2 4.21Å; V108-V292 HydrophobicContact CG1-CG1 4.31Å; V108-V292 HydrophobicContact CG2-CG2 4.43Å; V108-V292 CarbonylContact O-C 3.55Å; V108-V292 WeakPolarHBondContact O-CA 3.2Å; V108-E293 PolarHBondContact O-N 3.22Å |
| 109 | L | 95.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 120.2 | 174.4 | -173.7 | 67.4 | 0 | 0 | 0 | 109.6 | F51 V74 V78 V111 F135 L137 Y243 S244 L245 E293 V295 | F51-L109 HydrophobicContact CE2-CD1 4.24Å; V74-L109 HydrophobicContact CG1-CD1 4.35Å; V74-L109 HydrophobicContact CG1-CD2 4Å; V78-L109 HydrophobicContact CG2-CD2 4.25Å; L109-V111 HydrophobicContact CD2-CG2 4.45Å; L109-V111 HydrophobicContact CG-CG2 4.42Å; L109-F135 HydrophobicContact CD2-CE2 3.7Å; L109-F135 HydrophobicContact CD2-CZ 4.32Å; L109-L137 HydrophobicContact CB-CD1 4.1Å; L109-L137 HydrophobicContact CD2-CD1 3.78Å; L109-L137 HydrophobicContact CD2-CD2 4.24Å; L109-L137 HydrophobicContact CD2-CG 4.22Å; L109-Y243 PolarHBondContact N-O 3.48Å; L109-S244 WeakPolarHBondContact O-CA 3.4Å; L109-L245 PolarHBondContact O-N 3.43Å; L109-E293 HydrophobicContact CD1-CB 3.61Å; L109-V295 HydrophobicContact CD1-CG2 3.69Å; L109-V295 HydrophobicContact CG-CG2 4.45Å |
| 110 | V | 95.2 | Very high | 90.1 | Very high | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.006 | 22% | 0.221 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.3 | 118.3 | 173.6 | -171.6 | 0 | 0 | 0 | 0 | 109.7 | V108 V112 L245 L247 L275 F278 E293 V294 V295 | V108-V110 HydrophobicContact CG1-CG2 4.24Å; V110-V112 HydrophobicContact CG1-CG2 4.19Å; V110-L245 CarbonylContact C-O 3.5Å; V110-L245 VanDerWaalsContact CA-O 3.27Å; V110-L245 WeakPolarHBondContact CA-O 3.28Å; V110-L245 HydrophobicContact CG1-CB 4.41Å; V110-L245 HydrophobicContact CG2-CB 4.37Å; V110-L245 HydrophobicContact CG2-CD1 4.37Å; V110-L247 HydrophobicContact CG1-CD1 3.73Å; V110-L247 HydrophobicContact CG1-CG 3.97Å; V110-L275 HydrophobicContact CB-CD2 4.4Å; V110-L275 HydrophobicContact CG1-CD2 3.86Å; V110-L275 HydrophobicContact CG2-CD2 4.35Å; V110-F278 HydrophobicContact CG2-CE1 4.21Å; V110-E293 PolarHBondContact N-O 3.44Å; V110-V294 HydrophobicContact CB-CG2 4.35Å; V110-V294 CarbonylContact O-C 3.55Å; V110-V294 VanDerWaalsContact O-CA 3.23Å; V110-V294 WeakPolarHBondContact O-CA 3.45Å; V110-V295 PolarHBondContact O-N 3.34Å |
| 111 | V | 93.8 | Very high | 90.4 | Very high | 7 Ų | 7 | 42 Ų | 42 | 4% | 0.042 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.1 | 118.1 | 175.5 | -176.4 | 0 | 0 | 0 | 0 | 108.4 | L109 F135 L245 E246 L247 V295 F300 | L109-V111 HydrophobicContact CD2-CG2 4.45Å; L109-V111 HydrophobicContact CG-CG2 4.42Å; V111-F135 HydrophobicContact CG2-CE2 4.04Å; V111-F135 HydrophobicContact CG2-CZ 3.83Å; V111-L245 PolarHBondContact N-O 3.22Å; V111-E246 HydrophobicContact CB-CB 4.45Å; V111-E246 HydrophobicContact CB-CG 4.4Å; V111-E246 CarbonylContact O-C 3.3Å; V111-E246 WeakPolarHBondContact O-CA 3.37Å; V111-L247 PolarHBondContact O-N 3.01Å; V111-V295 CarbonylContact C-O 3.52Å; V111-V295 WeakPolarHBondContact CA-O 3.18Å; V111-V295 HydrophobicContact CG1-CB 4.49Å; V111-V295 HydrophobicContact CG2-CB 4.32Å; V111-V295 HydrophobicContact CG2-CG2 4.45Å; V111-F300 HydrophobicContact CG1-CZ 3.92Å |
| 112 | V | 93.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 119.7 | 178.6 | -174.6 | 0 | 0 | 0 | 0 | 109.3 | V110 V115 L118 L247 L250 L271 L275 V294 V295 T296 V297 | V110-V112 HydrophobicContact CG1-CG2 4.19Å; V112-V115 HydrophobicContact CB-CG1 4.33Å; V112-V115 HydrophobicContact CG1-CG1 3.69Å; V112-L118 HydrophobicContact CB-CD1 4.34Å; V112-L118 HydrophobicContact CG1-CD1 4.22Å; V112-L118 HydrophobicContact CG2-CD1 4.1Å; V112-L247 HydrophobicContact CG2-CD1 4.4Å; V112-L250 HydrophobicContact CG1-CD1 3.87Å; V112-L271 HydrophobicContact CG1-CD2 3.54Å; V112-L271 HydrophobicContact CG2-CD2 4.16Å; V112-L275 HydrophobicContact CG2-CD1 3.87Å; V112-V294 HydrophobicContact CG2-CG1 3.96Å; V112-V295 PolarHBondContact N-O 3.12Å; V112-T296 WeakPolarHBondContact O-CA 3.39Å; V112-V297 PolarHBondContact O-N 3.45Å |
| 113 | R | 91.4 | Very high | 90.7 | Very high | 48 Ų | 48 | 36 Ų | 36 | 18% | 0.181 | 20% | 0.201 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 152.9 | 179.7 | -62.9 | 175.9 | 57.5 | 163 | -1.3 | 112.3 | E246 L247 L250 E251 V297 F300 | R113-E246 WeakPolarHBondContact CD-OE1 3.5Å; R113-E246 IonicContact CZ-OE1 3.61Å; R113-E246 IonicContact NE-OE1 3.09Å; R113-E246 IonicContact NH1-OE1 3.1Å; R113-E246 PolarHBondContact NH1-OE1 3.3Å; R113-L247 PolarHBondContact N-O 3.37Å; R113-L250 WeakPolarHBondContact O-CB 3.42Å; R113-E251 HydrophobicContact CB-CB 4.22Å; R113-E251 WeakPolarHBondContact CB-OE2 3.43Å; R113-E251 IonicContact CZ-OE2 3.77Å; R113-E251 IonicContact NE-OE2 2.89Å; R113-E251 PolarHBondContact NE-OE2 3.44Å; R113-E251 IonicContact NH2-OE1 3.81Å; R113-E251 PolarHBondContact NH2-OE1 3.37Å; R113-E251 IonicContact NH2-OE2 3.35Å; R113-E251 PolarHBondContact NH2-OE2 2.89Å; R113-E251 PolarHBondContact O-N 3.1Å; R113-V297 CarbonylContact C-O 3.53Å; R113-V297 VanDerWaalsContact CA-O 3.25Å; R113-V297 WeakPolarHBondContact CA-O 3.44Å; R113-F300 HydrophobicContact CG-CE2 4.13Å |
| 114 | G | 87.9 | Confident | 90.7 | Very high | 3 Ų | 3 | 34.2 Ų | 34.2 | 3% | 0.031 | 20% | 0.199 | C | C | . | . | S | Bend | trans | 85.3 | 10.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | Y264 V297 K298 | G114-Y264 PolarHBondContact O-OH 3.32Å; G114-V297 PolarHBondContact N-O 3.46Å; G114-K298 VanDerWaalsContact CA-O 3.31Å; G114-K298 WeakPolarHBondContact CA-O 3.35Å; G114-K298 PolarHBondContact N-O 3.28Å |
| 115 | V | 90.1 | Very high | 90.7 | Very high | 6 Ų | 6 | 34.2 Ų | 34.2 | 4% | 0.036 | 20% | 0.2 | C | C | . | . | trans | -139 | 135.6 | -180 | 68.3 | 0 | 0 | 0 | 0 | 111 | V112 S117 L118 L250 T268 T296 V297 | V112-V115 HydrophobicContact CB-CG1 4.33Å; V112-V115 HydrophobicContact CG1-CG1 3.69Å; V115-S117 WeakPolarHBondContact CG2-O 3.26Å; V115-L118 HydrophobicContact CG1-CD1 4.39Å; V115-L118 HydrophobicContact CG1-CD2 4.15Å; V115-L118 HydrophobicContact CG1-CG 3.96Å; V115-L118 HydrophobicContact CG2-CD2 4.02Å; V115-L118 HydrophobicContact CG2-CG 4.39Å; V115-L250 HydrophobicContact CB-CD1 4.27Å; V115-L250 HydrophobicContact CG1-CD1 4.2Å; V115-T268 HydrophobicContact CG2-CG2 4.34Å; V115-T296 HydrophobicContact CG1-CG2 4.09Å; V115-V297 PolarHBondContact N-O 2.93Å; V115-V297 CarbonylContact O-C 3.58Å; V115-V297 VanDerWaalsContact O-C 3.3Å; V115-V297 PolarHBondContact O-N 3.32Å | ||
| 116 | D | 85.9 | Confident | 90.7 | Very high | 51 Ų | 51 | 33.8 Ų | 33.8 | 27% | 0.273 | 21% | 0.207 | S | C | . | . | S | Bend | trans | -72.7 | -49.4 | -177.2 | -48.8 | -59.2 | 0 | 0 | 0 | 109.8 | D49 K259 T296 K298 | D49-D116 WeakPolarHBondContact CA-O 3.33Å; D116-K259 IonicContact OD1-NZ 2.88Å; D116-K259 PolarHBondContact OD1-NZ 3.01Å; D116-K259 IonicContact OD2-NZ 3.19Å; D116-K259 PolarHBondContact OD2-NZ 3.46Å; D116-T296 PolarHBondContact O-OG1 2.95Å; D116-K298 WeakPolarHBondContact OD1-CB 3.26Å; D116-K298 VanDerWaalsContact OD1-CD 3.27Å; D116-K298 WeakPolarHBondContact OD1-CD 3.17Å; D116-K298 WeakPolarHBondContact OD1-CG 3.49Å |
| 117 | S | 86.4 | Confident | 90.6 | Very high | 73 Ų | 73 | 33.9 Ų | 33.9 | 51% | 0.51 | 21% | 0.207 | S | C | . | . | trans | -148.7 | 151.3 | 173.2 | 61.1 | 0 | 0 | 0 | 0 | 111.6 | V115 | V115-S117 WeakPolarHBondContact CG2-O 3.26Š| ||
| 118 | L | 87.6 | Confident | 90.5 | Very high | 12 Ų | 12 | 36.3 Ų | 36.3 | 6% | 0.063 | 22% | 0.223 | C | C | . | . | trans | -108.8 | 131 | 174.4 | -72.9 | 173.8 | 0 | 0 | 0 | 109.9 | V112 V115 F120 T268 L271 L275 T296 | V112-L118 HydrophobicContact CB-CD1 4.34Å; V112-L118 HydrophobicContact CG1-CD1 4.22Å; V112-L118 HydrophobicContact CG2-CD1 4.1Å; V115-L118 HydrophobicContact CG1-CD1 4.39Å; V115-L118 HydrophobicContact CG1-CD2 4.15Å; V115-L118 HydrophobicContact CG1-CG 3.96Å; V115-L118 HydrophobicContact CG2-CD2 4.02Å; V115-L118 HydrophobicContact CG2-CG 4.39Å; L118-F120 HydrophobicContact CB-CD2 4.22Å; L118-F120 HydrophobicContact CB-CE1 4.18Å; L118-F120 HydrophobicContact CB-CE2 3.54Å; L118-F120 HydrophobicContact CB-CZ 3.5Å; L118-F120 VanDerWaalsContact CB-CZ 3.5Å; L118-F120 HydrophobicContact CD1-CE1 4.35Å; L118-F120 HydrophobicContact CD1-CE2 4.43Å; L118-F120 HydrophobicContact CD1-CZ 3.69Å; L118-F120 HydrophobicContact CG-CZ 4.26Å; L118-F120 VanDerWaalsContact O-CD2 3.32Å; L118-F120 WeakPolarHBondContact O-CD2 3.43Å; L118-F120 PolarHBondContact O-N 3.09Å; L118-T268 HydrophobicContact CD2-CG2 3.47Å; L118-T268 VanDerWaalsContact CD2-CG2 3.47Å; L118-L271 HydrophobicContact CD1-CD2 4.29Å; L118-L275 HydrophobicContact CD1-CD1 3.93Å; L118-T296 HydrophobicContact CB-CG2 4.1Å; L118-T296 HydrophobicContact CD1-CG2 3.84Å; L118-T296 HydrophobicContact CG-CG2 3.77Å | ||
| 119 | A | 87.3 | Confident | 90.3 | Very high | 92 Ų | 92 | 37 Ų | 37 | 76% | 0.76 | 23% | 0.226 | S | C | * | . | trans | -82.6 | 97 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 120 | F | 89.4 | Confident | 89.9 | Confident | 25 Ų | 25 | 41.8 Ų | 41.8 | 11% | 0.11 | 25% | 0.248 | C | C | . | . | trans | -88.9 | 138.5 | 176.6 | -62 | -71.7 | 0 | 0 | 0 | 111.7 | T52 L54 L118 Q122 T123 A272 L275 V294 | T52-F120 HydrophobicContact CG2-CD2 3.98Å; T52-F120 HydrophobicContact CG2-CE2 4.26Å; L54-F120 HydrophobicContact CD1-CE1 4.42Å; L54-F120 HydrophobicContact CD2-CB 3.99Å; L54-F120 HydrophobicContact CD2-CD1 3.73Å; L54-F120 HydrophobicContact CD2-CD2 3.75Å; L54-F120 HydrophobicContact CD2-CE1 4.11Å; L54-F120 HydrophobicContact CD2-CE2 4.11Å; L54-F120 HydrophobicContact CD2-CG 3.53Å; L54-F120 HydrophobicContact CD2-CZ 4.28Å; L118-F120 HydrophobicContact CB-CD2 4.22Å; L118-F120 HydrophobicContact CB-CE1 4.18Å; L118-F120 HydrophobicContact CB-CE2 3.54Å; L118-F120 HydrophobicContact CB-CZ 3.5Å; L118-F120 VanDerWaalsContact CB-CZ 3.5Å; L118-F120 HydrophobicContact CD1-CE1 4.35Å; L118-F120 HydrophobicContact CD1-CE2 4.43Å; L118-F120 HydrophobicContact CD1-CZ 3.69Å; L118-F120 HydrophobicContact CG-CZ 4.26Å; L118-F120 VanDerWaalsContact O-CD2 3.32Å; L118-F120 WeakPolarHBondContact O-CD2 3.43Å; L118-F120 PolarHBondContact O-N 3.09Å; F120-Q122 VanDerWaalsContact C-N 3.33Å; F120-Q122 PolarHBondContact O-N 3.48Å; F120-T123 HydrophobicContact CB-CG2 3.55Å; F120-T123 HydrophobicContact CD2-CG2 4.24Å; F120-T123 HydrophobicContact CG-CG2 4.3Å; F120-A272 HydrophobicContact CD1-CB 4.38Å; F120-A272 HydrophobicContact CE1-CB 4.39Å; F120-L275 HydrophobicContact CE1-CB 3.93Å; F120-L275 HydrophobicContact CE1-CD1 4.17Å; F120-L275 HydrophobicContact CZ-CD1 4.21Å; F120-V294 HydrophobicContact CE2-CB 4.43Å; F120-V294 HydrophobicContact CE2-CG1 4.41Å; F120-V294 HydrophobicContact CZ-CB 4.21Å; F120-V294 HydrophobicContact CZ-CG1 3.97Å; F120-V294 HydrophobicContact CZ-CG2 4.24Å | ||
| 121 | P | 84.4 | Confident | 89.4 | Confident | 106 Ų | 106 | 45.7 Ų | 45.7 | 69% | 0.688 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -64.5 | -33.5 | 176.7 | -23.2 | 33.7 | 0 | 0 | 0 | 114.1 | ||
| 122 | Q | 86.6 | Confident | 88.9 | Confident | 117 Ų | 117 | 45.8 Ų | 45.8 | 55% | 0.547 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -134.9 | 124.3 | -179.7 | -61 | -177.4 | -4 | 0 | 0 | 109.7 | F120 Q276 | F120-Q122 VanDerWaalsContact C-N 3.33Å; F120-Q122 PolarHBondContact O-N 3.48Å; Q122-Q276 PolarHBondContact O-OE1 2.82Å; Q122-Q276 VanDerWaalsContact O-OE1 3.09Å |
| 123 | T | 90 | Very high | 88.6 | Confident | 65 Ų | 65 | 46.4 Ų | 46.4 | 40% | 0.399 | 27% | 0.274 | S | S | . | . | trans | -135.8 | 146 | 176.8 | 58.2 | 0 | 0 | 0 | 0 | 110.5 | T52 L54 F120 | T52-T123 HydrophobicContact CG2-CG2 3.67Å; L54-T123 HydrophobicContact CD2-CG2 4.3Å; F120-T123 HydrophobicContact CB-CG2 3.55Å; F120-T123 HydrophobicContact CD2-CG2 4.24Å; F120-T123 HydrophobicContact CG-CG2 4.3Å | ||
| 124 | V | 89.8 | Confident | 88.3 | Confident | 44 Ų | 44 | 48.1 Ų | 48.1 | 27% | 0.267 | 29% | 0.291 | S | S | . | . | S | Bend | trans | -79.1 | -53 | 172.7 | 176 | 0 | 0 | 0 | 0 | 109.3 | V53 A56 F62 K64 | V53-V124 HydrophobicContact CB-CB 4.25Å; V53-V124 HydrophobicContact CG1-CB 4.1Å; V53-V124 HydrophobicContact CG1-CG1 4.49Å; V53-V124 WeakPolarHBondContact O-CB 3.33Å; V53-V124 PolarHBondContact O-N 3.34Å; A56-V124 HydrophobicContact CB-CG1 4.38Å; A56-V124 HydrophobicContact CB-CG2 4.37Å; F62-V124 HydrophobicContact CB-CG1 4.36Å; K64-V124 WeakPolarHBondContact CE-O 3.5Å |
| 125 | A | 91.7 | Very high | 88.3 | Confident | 4 Ų | 4 | 49.7 Ų | 49.7 | 3% | 0.033 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.5 | 155.5 | 178 | 0 | 0 | 0 | 0 | 0 | 109.9 | V53 F62 Y127 | V53-A125 PolarHBondContact N-O 3.02Å; F62-A125 HydrophobicContact CB-CB 3.92Å; A125-Y127 HydrophobicContact CB-CE2 3.61Å |
| 126 | S | 92.3 | Very high | 88.1 | Confident | 56 Ų | 56 | 53.5 Ų | 53.5 | 39% | 0.392 | 32% | 0.32 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 138.1 | 174.7 | -173 | 0 | 0 | 0 | 0 | 108.4 | F51 T52 | F51-S126 WeakPolarHBondContact O-CA 3.48Å; T52-S126 PolarHBondContact OG1-OG 3.37Å |
| 127 | Y | 92.9 | Very high | 88.3 | Confident | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.008 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 142.8 | -173.5 | -53.1 | -85 | 0 | 0 | 0 | 109.7 | S50 F51 F62 H63 G65 W67 W92 G94 A125 | S50-Y127 CarbonylContact C-O 3.6Å; S50-Y127 WeakPolarHBondContact CA-O 3.47Å; F51-Y127 AromaticContact CD1-CD2 3.83Å; F51-Y127 HydrophobicContact CD1-CD2 3.83Å; F51-Y127 HydrophobicContact CD1-CE2 4.48Å; F51-Y127 HydrophobicContact CE1-CD2 4.41Å; F51-Y127 PolarHBondContact N-O 2.91Å; F51-Y127 PolarHBondContact O-N 3.31Å; F62-Y127 WeakPolarHBondContact CB-OH 3.31Å; F62-Y127 HydrophobicContact CD1-CE2 4.43Å; H63-Y127 PolarHBondContact N-OH 3.47Å; H63-Y127 WeakPolarHBondContact O-CE1 3.38Å; H63-Y127 PolarHBondContact O-OH 3.28Å; G65-Y127 WeakPolarHBondContact O-CD1 3.46Å; G65-Y127 WeakPolarHBondContact O-CE1 2.98Å; W67-Y127 HydrophobicContact CE3-CE1 4.1Å; W67-Y127 HydrophobicContact CZ3-CE1 4.47Å; W92-Y127 AromaticContact CH2-CD2 4Å; W92-Y127 HydrophobicContact CH2-CD2 4Å; W92-Y127 HydrophobicContact CH2-CE1 4.25Å; W92-Y127 AromaticContact CH2-CE2 3.65Å; W92-Y127 HydrophobicContact CH2-CE2 3.65Å; W92-Y127 HydrophobicContact CH2-CG 4.38Å; W92-Y127 AromaticContact CH2-CZ 3.77Å; W92-Y127 AromaticContact CZ2-CD1 3.58Å; W92-Y127 HydrophobicContact CZ2-CD1 3.58Å; W92-Y127 AromaticContact CZ2-CD2 3.69Å; W92-Y127 HydrophobicContact CZ2-CD2 3.69Å; W92-Y127 AromaticContact CZ2-CE1 3.57Å; W92-Y127 HydrophobicContact CZ2-CE1 3.57Å; W92-Y127 AromaticContact CZ2-CE2 3.65Å; W92-Y127 HydrophobicContact CZ2-CE2 3.65Å; W92-Y127 AromaticContact CZ2-CG 3.61Å; W92-Y127 HydrophobicContact CZ2-CG 3.61Å; W92-Y127 AromaticContact CZ2-CZ 3.57Å; G94-Y127 PolarHBondContact O-OH 2.96Å; G94-Y127 VanDerWaalsContact O-OH 3.09Å; A125-Y127 HydrophobicContact CB-CE2 3.61Å |
| 128 | P | 92.5 | Very high | 88.4 | Confident | 51 Ų | 51 | 51 Ų | 51 | 33% | 0.331 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 142.2 | 173.1 | 25.3 | -27.8 | 0 | 0 | 0 | 110.4 | P68 V69 | P68-P128 CarbonylContact C-O 3.48Å; P68-P128 VanDerWaalsContact CA-O 3.26Å; P68-P128 WeakPolarHBondContact CA-O 3.43Å; P68-P128 HydrophobicContact CB-CG 4.29Å; V69-P128 PolarHBondContact N-O 3.31Å |
| 129 | L | 90.9 | Very high | 88.5 | Confident | 14 Ų | 14 | 53.7 Ų | 53.7 | 7% | 0.073 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 128.2 | 176.6 | -165.4 | 75.8 | 0 | 0 | 0 | 109.5 | D49 F51 V69 V74 P132 V295 V297 | D49-L129 HydrophobicContact CB-CB 3.91Å; D49-L129 HydrophobicContact CB-CD2 4.13Å; D49-L129 WeakPolarHBondContact O-CB 3.31Å; D49-L129 PolarHBondContact O-N 2.92Å; F51-L129 HydrophobicContact CB-CD1 4.35Å; V69-L129 HydrophobicContact CB-CD1 4.41Å; V69-L129 CarbonylContact O-C 3.55Å; V69-L129 WeakPolarHBondContact O-CA 3.28Å; V69-L129 WeakPolarHBondContact O-CD1 3.37Å; V74-L129 HydrophobicContact CG2-CD1 3.93Å; L129-P132 HydrophobicContact CD2-CB 4.11Å; L129-V295 HydrophobicContact CD2-CG1 3.78Å; L129-V297 HydrophobicContact CD2-CG2 3.93Å |
| 130 | E | 88.4 | Confident | 88.7 | Confident | 100 Ų | 100 | 49.5 Ų | 49.5 | 47% | 0.467 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 145.4 | 173.9 | -78 | -177.1 | -179.7 | 0 | 0 | 110.4 | P68 V69 S70 G71 | P68-E130 HydrophobicContact CB-CB 4.35Å; P68-E130 HydrophobicContact CB-CG 3.51Å; P68-E130 VanDerWaalsContact CB-OE1 3.23Å; P68-E130 WeakPolarHBondContact CB-OE1 2.96Å; P68-E130 HydrophobicContact CG-CG 4.38Å; P68-E130 WeakPolarHBondContact CG-OE1 3.47Å; V69-E130 PolarHBondContact O-N 2.98Å; S70-E130 CarbonylContact C-O 3.54Å; S70-E130 WeakPolarHBondContact CA-O 3.09Å; G71-E130 PolarHBondContact N-O 3.2Å |
| 131 | N | 84.9 | Confident | 88.7 | Confident | 84 Ų | 84 | 48.3 Ų | 48.3 | 45% | 0.449 | 28% | 0.281 | S | S | . | . | S | Bend | trans | 49.7 | 67.9 | 179.4 | -52.4 | -57.1 | 0 | 0 | 0 | 111.9 | V133 | N131-V133 VanDerWaalsContact C-N 3.26Å; N131-V133 PolarHBondContact O-N 3.02Å |
| 132 | P | 84 | Confident | 89 | Confident | 9 Ų | 9 | 50.2 Ų | 50.2 | 6% | 0.058 | 28% | 0.281 | C | S | . | . | trans | -69.5 | 83.6 | -178.9 | 32.3 | -37.3 | 0 | 0 | 0 | 109.6 | D49 L129 V297 F300 E301 | D49-P132 VanDerWaalsContact OD2-CB 3.26Å; D49-P132 WeakPolarHBondContact OD2-CB 3.45Å; D49-P132 VanDerWaalsContact OD2-CG 3.23Å; D49-P132 WeakPolarHBondContact OD2-CG 3.41Å; L129-P132 HydrophobicContact CD2-CB 4.11Å; P132-V297 HydrophobicContact CB-CG1 3.83Å; P132-V297 HydrophobicContact CB-CG2 4.37Å; P132-F300 CarbonylContact O-C 3.51Å; P132-F300 WeakPolarHBondContact O-CA 3.46Å; P132-E301 HydrophobicContact CG-CB 4.45Å; P132-E301 HydrophobicContact CG-CG 4.03Å; P132-E301 PolarHBondContact O-N 3.5Å | ||
| 133 | V | 85.6 | Confident | 89.2 | Confident | 12 Ų | 12 | 46.8 Ų | 46.8 | 7% | 0.073 | 27% | 0.268 | C | S | . | . | trans | -93 | 152.2 | 173.2 | -60.3 | 0 | 0 | 0 | 0 | 110.2 | E72 N131 F135 F300 P303 | E72-V133 HydrophobicContact CB-CG2 4.32Å; E72-V133 HydrophobicContact CG-CG2 3.31Å; N131-V133 VanDerWaalsContact C-N 3.26Å; N131-V133 PolarHBondContact O-N 3.02Å; V133-F135 WeakPolarHBondContact O-CD1 3.4Å; V133-F135 PolarHBondContact O-N 3.06Å; V133-F300 VanDerWaalsContact C-CD1 3.43Å; V133-F300 WeakPolarHBondContact O-CE1 3.47Å; V133-P303 HydrophobicContact CG1-CB 4.22Å | ||
| 134 | P | 85.7 | Confident | 89.2 | Confident | 84 Ų | 84 | 43.7 Ų | 43.7 | 55% | 0.545 | 25% | 0.249 | S | C | . | . | trans | -60.4 | 132.1 | 170.5 | -17.8 | 30.9 | 0 | 0 | 0 | 110 | F300 | P134-F300 HydrophobicContact CB-CD1 4.49Å; P134-F300 HydrophobicContact CB-CD2 4.41Å; P134-F300 HydrophobicContact CB-CG 4.33Å; P134-F300 HydrophobicContact CG-CB 3.71Å; P134-F300 HydrophobicContact CG-CD1 4.23Å; P134-F300 HydrophobicContact CG-CD2 4.17Å; P134-F300 HydrophobicContact CG-CG 3.81Å | ||
| 135 | F | 87.8 | Confident | 89 | Confident | 37 Ų | 37 | 45.9 Ų | 45.9 | 16% | 0.162 | 26% | 0.256 | C | S | . | . | trans | -133 | 155.2 | 176.5 | 58.9 | -99.2 | 0 | 0 | 0 | 109.9 | G71 V74 P75 L109 V111 V133 V295 | G71-F135 WeakPolarHBondContact O-CD1 3.25Å; V74-F135 HydrophobicContact CB-CD1 4.43Å; V74-F135 HydrophobicContact CB-CE1 4.1Å; V74-F135 HydrophobicContact CB-CE2 4.24Å; V74-F135 HydrophobicContact CB-CZ 4.01Å; V74-F135 HydrophobicContact CG1-CE1 4.34Å; V74-F135 HydrophobicContact CG1-CE2 3.88Å; V74-F135 HydrophobicContact CG1-CZ 3.75Å; V74-F135 HydrophobicContact CG2-CE1 4.19Å; V74-F135 HydrophobicContact CG2-CZ 4.38Å; P75-F135 HydrophobicContact CG-CB 3.9Å; P75-F135 HydrophobicContact CG-CD2 3.98Å; P75-F135 HydrophobicContact CG-CG 4.16Å; L109-F135 HydrophobicContact CD2-CE2 3.7Å; L109-F135 HydrophobicContact CD2-CZ 4.32Å; V111-F135 HydrophobicContact CG2-CE2 4.04Å; V111-F135 HydrophobicContact CG2-CZ 3.83Å; V133-F135 WeakPolarHBondContact O-CD1 3.4Å; V133-F135 PolarHBondContact O-N 3.06Å; F135-V295 HydrophobicContact CZ-CG1 4.45Å; F135-V295 HydrophobicContact CZ-CG2 4.09Å | ||
| 136 | T | 86.8 | Confident | 88.9 | Confident | 85 Ų | 85 | 49.2 Ų | 49.2 | 52% | 0.521 | 28% | 0.279 | S | S | . | . | trans | -124.3 | 159.1 | 173 | 66 | 0 | 0 | 0 | 0 | 109.7 | D138 | T136-D138 VanDerWaalsContact C-N 3.33Å; T136-D138 VanDerWaalsContact CB-OD2 3.28Å; T136-D138 WeakPolarHBondContact CB-OD2 3.41Å; T136-D138 VanDerWaalsContact OG1-CG 3.25Å; T136-D138 PolarHBondContact OG1-OD2 3.31Å | ||
| 137 | L | 90 | Very high | 88.8 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 29% | 0.288 | C | S | . | . | trans | -98.2 | 25.6 | 175.9 | -62.4 | -175.7 | 0 | 0 | 0 | 112.1 | P75 V78 L109 S139 V140 A141 L242 | P75-L137 HydrophobicContact CB-CD2 3.78Å; P75-L137 HydrophobicContact CG-CD2 4.08Å; V78-L137 HydrophobicContact CB-CD2 4.25Å; V78-L137 HydrophobicContact CG1-CD1 4.21Å; V78-L137 HydrophobicContact CG1-CD2 4.31Å; V78-L137 HydrophobicContact CG2-CD2 4.3Å; L109-L137 HydrophobicContact CB-CD1 4.1Å; L109-L137 HydrophobicContact CD2-CD1 3.78Å; L109-L137 HydrophobicContact CD2-CD2 4.24Å; L109-L137 HydrophobicContact CD2-CG 4.22Å; L137-S139 PolarHBondContact O-N 3.04Å; L137-V140 HydrophobicContact CB-CB 4.43Å; L137-V140 HydrophobicContact CD2-CG2 4.38Å; L137-V140 WeakPolarHBondContact O-CB 3.38Å; L137-V140 PolarHBondContact O-N 3.33Å; L137-V140 VanDerWaalsContact O-N 3.15Å; L137-A141 WeakPolarHBondContact O-CB 3.23Å; L137-A141 PolarHBondContact O-N 3.05Å; L137-L242 HydrophobicContact CB-CD2 4.18Å; L137-L242 HydrophobicContact CD1-CD1 3.95Å | ||
| 138 | D | 88.5 | Confident | 88.5 | Confident | 73 Ų | 73 | 54.2 Ų | 54.2 | 39% | 0.39 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | -172 | -58.2 | -27 | 0 | 0 | 0 | 112.3 | T136 V140 A141 E142 Q157 | T136-D138 VanDerWaalsContact C-N 3.33Å; T136-D138 VanDerWaalsContact CB-OD2 3.28Å; T136-D138 WeakPolarHBondContact CB-OD2 3.41Å; T136-D138 VanDerWaalsContact OG1-CG 3.25Å; T136-D138 PolarHBondContact OG1-OD2 3.31Å; D138-V140 VanDerWaalsContact C-N 3.26Å; D138-V140 PolarHBondContact O-N 3.45Å; D138-A141 WeakPolarHBondContact O-CB 3.41Å; D138-A141 PolarHBondContact O-N 3.31Å; D138-E142 WeakPolarHBondContact O-CB 3.45Å; D138-E142 PolarHBondContact O-N 3.48Å; D138-Q157 PolarHBondContact OD1-NE2 2.85Å; D138-Q157 PolarHBondContact OD1-OE1 2.98Å |
| 139 | S | 88.9 | Confident | 88 | Confident | 68 Ų | 68 | 54.7 Ų | 54.7 | 48% | 0.476 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.3 | -37.9 | 174.9 | 57.9 | 0 | 0 | 0 | 0 | 111.9 | L137 T143 | L137-S139 PolarHBondContact O-N 3.04Å; S139-T143 WeakPolarHBondContact O-CB 3.46Å; S139-T143 PolarHBondContact O-N 3.3Å; S139-T143 PolarHBondContact O-OG1 3.19Å |
| 140 | V | 91.3 | Very high | 87.6 | Confident | 3 Ų | 3 | 62 Ų | 62 | 2% | 0.018 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -72.5 | -44.3 | 178.5 | -172.2 | 0 | 0 | 0 | 0 | 110.2 | V78 A79 M82 F84 L137 D138 E142 T143 V144 L242 | V78-V140 HydrophobicContact CG1-CG1 4.34Å; A79-V140 HydrophobicContact CB-CG2 4.11Å; M82-V140 HydrophobicContact CE-CG1 3.15Å; F84-V140 HydrophobicContact CD2-CG1 4.22Å; F84-V140 HydrophobicContact CE2-CG1 4.3Å; L137-V140 HydrophobicContact CB-CB 4.43Å; L137-V140 HydrophobicContact CD2-CG2 4.38Å; L137-V140 WeakPolarHBondContact O-CB 3.38Å; L137-V140 PolarHBondContact O-N 3.33Å; L137-V140 VanDerWaalsContact O-N 3.15Å; D138-V140 VanDerWaalsContact C-N 3.26Å; D138-V140 PolarHBondContact O-N 3.45Å; V140-E142 VanDerWaalsContact C-N 3.35Å; V140-E142 PolarHBondContact O-N 2.95Å; V140-T143 WeakPolarHBondContact O-CB 3.23Å; V140-T143 PolarHBondContact O-N 3.07Å; V140-V144 WeakPolarHBondContact O-CG2 3.39Å; V140-V144 PolarHBondContact O-N 3.09Å; V140-L242 HydrophobicContact CB-CD2 4.16Å; V140-L242 HydrophobicContact CG1-CD2 4.02Å |
| 141 | A | 90.3 | Very high | 87.4 | Confident | 1 Ų | 1 | 61.7 Ų | 61.7 | 1% | 0.008 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -57.9 | -45.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L137 D138 T143 V144 H145 V155 L168 L242 | L137-A141 WeakPolarHBondContact O-CB 3.23Å; L137-A141 PolarHBondContact O-N 3.05Å; D138-A141 WeakPolarHBondContact O-CB 3.41Å; D138-A141 PolarHBondContact O-N 3.31Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.32Å; A141-V144 PolarHBondContact O-N 3.24Å; A141-H145 WeakPolarHBondContact O-CB 3.43Å; A141-H145 PolarHBondContact O-N 3.2Å; A141-V155 HydrophobicContact CB-CG1 3.71Å; A141-L168 HydrophobicContact CB-CD1 4.14Å; A141-L242 HydrophobicContact CB-CD2 4.05Å |
| 142 | E | 89.3 | Confident | 87.2 | Confident | 145 Ų | 145 | 60.3 Ų | 60.3 | 68% | 0.678 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -64.9 | -37.8 | 176.6 | -173.4 | 172.4 | -163.5 | 0 | 0 | 111.6 | D138 V140 H145 S146 | D138-E142 WeakPolarHBondContact O-CB 3.45Å; D138-E142 PolarHBondContact O-N 3.48Å; V140-E142 VanDerWaalsContact C-N 3.35Å; V140-E142 PolarHBondContact O-N 2.95Å; E142-H145 PolarHBondContact O-N 3.07Å; E142-S146 VanDerWaalsContact O-CB 3.29Å; E142-S146 WeakPolarHBondContact O-CB 3.38Å; E142-S146 PolarHBondContact O-N 3.26Å; E142-S146 PolarHBondContact O-OG 3.42Å |
| 143 | T | 90.9 | Very high | 87.3 | Confident | 46 Ų | 46 | 60 Ų | 60 | 28% | 0.282 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 174.4 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | F84 S139 V140 A141 S146 L147 | F84-T143 HydrophobicContact CB-CG2 4.25Å; F84-T143 HydrophobicContact CD1-CG2 3.73Å; F84-T143 HydrophobicContact CD2-CG2 4.11Å; F84-T143 HydrophobicContact CE1-CG2 4.08Å; F84-T143 HydrophobicContact CE2-CG2 4.41Å; F84-T143 HydrophobicContact CG-CG2 3.76Å; F84-T143 HydrophobicContact CZ-CG2 4.4Å; S139-T143 WeakPolarHBondContact O-CB 3.46Å; S139-T143 PolarHBondContact O-N 3.3Å; S139-T143 PolarHBondContact O-OG1 3.19Å; V140-T143 WeakPolarHBondContact O-CB 3.23Å; V140-T143 PolarHBondContact O-N 3.07Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.32Å; T143-S146 WeakPolarHBondContact CA-OG 3.25Å; T143-S146 PolarHBondContact O-OG 3.45Å; T143-S146 VanDerWaalsContact O-OG 3.07Å; T143-L147 HydrophobicContact CG2-CD1 3.65Å; T143-L147 HydrophobicContact CG2-CG 4.26Å; T143-L147 WeakPolarHBondContact O-CB 3.26Å; T143-L147 WeakPolarHBondContact O-CG 3.47Å; T143-L147 PolarHBondContact O-N 3.15Å |
| 144 | V | 90.4 | Very high | 87.3 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 174.7 | 171.4 | 0 | 0 | 0 | 0 | 110.5 | F84 V140 A141 S146 F148 P153 V155 P240 | F84-V144 HydrophobicContact CE2-CG2 3.65Å; F84-V144 HydrophobicContact CZ-CG2 3.75Å; V140-V144 WeakPolarHBondContact O-CG2 3.39Å; V140-V144 PolarHBondContact O-N 3.09Å; A141-V144 PolarHBondContact O-N 3.24Å; V144-S146 PolarHBondContact O-N 2.73Å; V144-F148 WeakPolarHBondContact O-CB 3.45Å; V144-F148 PolarHBondContact O-N 2.72Å; V144-P153 HydrophobicContact CG1-CB 3.54Å; V144-P153 HydrophobicContact CG1-CG 4.14Å; V144-V155 HydrophobicContact CG1-CG2 4.16Å; V144-P240 HydrophobicContact CG1-CG 4.37Å; V144-P240 VanDerWaalsContact CG1-O 3.32Å; V144-P240 WeakPolarHBondContact CG1-O 3.34Å; V144-P240 HydrophobicContact CG2-CG 4.35Å |
| 145 | H | 87 | Confident | 87.4 | Confident | 90 Ų | 90 | 56 Ų | 56 | 42% | 0.417 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.5 | -42.1 | -178.1 | -170.9 | 70.8 | 0 | 0 | 0 | 112.6 | A141 E142 S149 | A141-H145 WeakPolarHBondContact O-CB 3.43Å; A141-H145 PolarHBondContact O-N 3.2Å; E142-H145 PolarHBondContact O-N 3.07Å; H145-S149 WeakPolarHBondContact O-CA 3.49Å; H145-S149 VanDerWaalsContact O-CB 3.31Å; H145-S149 WeakPolarHBondContact O-CB 3.33Å; H145-S149 PolarHBondContact O-N 3.09Å; H145-S149 VanDerWaalsContact O-N 3.17Å |
| 146 | S | 89.3 | Confident | 87.4 | Confident | 73 Ų | 73 | 54.2 Ų | 54.2 | 51% | 0.51 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -70.6 | -46 | -179.5 | 56.9 | 0 | 0 | 0 | 0 | 112.5 | E142 T143 V144 | E142-S146 VanDerWaalsContact O-CB 3.29Å; E142-S146 WeakPolarHBondContact O-CB 3.38Å; E142-S146 PolarHBondContact O-N 3.26Å; E142-S146 PolarHBondContact O-OG 3.42Å; T143-S146 WeakPolarHBondContact CA-OG 3.25Å; T143-S146 PolarHBondContact O-OG 3.45Å; T143-S146 VanDerWaalsContact O-OG 3.07Å; V144-S146 PolarHBondContact O-N 2.73Å |
| 147 | L | 89.6 | Confident | 87.3 | Confident | 111 Ų | 111 | 51 Ų | 51 | 58% | 0.581 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -75.2 | -29.8 | -177.3 | -66.1 | 179.5 | 0 | 0 | 0 | 113.4 | F84 T143 | F84-L147 HydrophobicContact CD1-CD1 3.95Å; F84-L147 HydrophobicContact CE1-CD1 3.81Å; T143-L147 HydrophobicContact CG2-CD1 3.65Å; T143-L147 HydrophobicContact CG2-CG 4.26Å; T143-L147 WeakPolarHBondContact O-CB 3.26Å; T143-L147 WeakPolarHBondContact O-CG 3.47Å; T143-L147 PolarHBondContact O-N 3.15Å |
| 148 | F | 87.4 | Confident | 86.8 | Confident | 52 Ų | 52 | 52.4 Ų | 52.4 | 23% | 0.228 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -117.8 | 27.8 | -175.2 | -60.1 | -88.3 | 0 | 0 | 0 | 113.2 | F84 V144 E150 Y151 P240 | F84-F148 HydrophobicContact CE1-CE2 4.03Å; F84-F148 HydrophobicContact CZ-CE2 4.18Å; V144-F148 WeakPolarHBondContact O-CB 3.45Å; V144-F148 PolarHBondContact O-N 2.72Å; F148-E150 PolarHBondContact O-N 2.9Å; F148-E150 VanDerWaalsContact O-N 3.12Å; F148-Y151 HydrophobicContact CB-CD2 4.44Å; F148-Y151 HydrophobicContact CD1-CD2 4.13Å; F148-Y151 PolarHBondContact O-N 3.21Å; F148-P240 VanDerWaalsContact CD2-CD 3.45Å; F148-P240 HydrophobicContact CD2-CG 3.75Å; F148-P240 VanDerWaalsContact CE2-CD 3.46Å; F148-P240 HydrophobicContact CE2-CG 3.49Å; F148-P240 VanDerWaalsContact CE2-CG 3.49Å; F148-P240 HydrophobicContact CG-CG 4.37Å; F148-P240 HydrophobicContact CZ-CG 3.92Å |
| 149 | S | 81.6 | Confident | 86 | Confident | 61 Ų | 61 | 49.9 Ų | 49.9 | 43% | 0.427 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -25.9 | -179.6 | 57.9 | 0 | 0 | 0 | 0 | 114.5 | H145 Y151 K170 | H145-S149 WeakPolarHBondContact O-CA 3.49Å; H145-S149 VanDerWaalsContact O-CB 3.31Å; H145-S149 WeakPolarHBondContact O-CB 3.33Å; H145-S149 PolarHBondContact O-N 3.09Å; H145-S149 VanDerWaalsContact O-N 3.17Å; S149-Y151 VanDerWaalsContact C-N 3.31Å; S149-K170 PolarHBondContact O-NZ 3.22Å |
| 150 | E | 82.1 | Confident | 84.7 | Confident | 168 Ų | 168 | 48.1 Ų | 48.1 | 79% | 0.785 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -28.3 | 176.3 | -63.9 | -172.9 | 177.3 | 0 | 0 | 112.8 | F148 | F148-E150 PolarHBondContact O-N 2.9Å; F148-E150 VanDerWaalsContact O-N 3.12Å |
| 151 | Y | 83.3 | Confident | 83.1 | Confident | 94 Ų | 94 | 52.2 Ų | 52.2 | 37% | 0.369 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -95.2 | -170.1 | -178.2 | -66 | -75.3 | 0 | 0 | 0 | 111.6 | F148 S149 P153 D237 F238 | F148-Y151 HydrophobicContact CB-CD2 4.44Å; F148-Y151 HydrophobicContact CD1-CD2 4.13Å; F148-Y151 PolarHBondContact O-N 3.21Å; S149-Y151 VanDerWaalsContact C-N 3.31Å; Y151-P153 WeakPolarHBondContact O-CD 3.36Å; Y151-D237 WeakPolarHBondContact CB-OD2 3.44Å; Y151-D237 WeakPolarHBondContact CD1-OD1 3.24Å; Y151-F238 HydrophobicContact CD1-CB 4.22Å; Y151-F238 HydrophobicContact CE1-CB 3.85Å; Y151-F238 HydrophobicContact CE1-CD2 4.14Å; Y151-F238 HydrophobicContact CE1-CG 4.41Å |
| 152 | T | 81.9 | Confident | 81.3 | Confident | 55 Ų | 55 | 57.2 Ų | 57.2 | 34% | 0.337 | 31% | 0.306 | S | S | . | . | trans | -117.4 | 67.7 | 176.7 | 54.6 | 0 | 0 | 0 | 0 | 111.3 | K170 D237 | T152-K170 HydrophobicContact CG2-CB 4.06Å; T152-K170 HydrophobicContact CG2-CD 4.26Å; T152-D237 PolarHBondContact N-OD2 2.85Å; T152-D237 VanDerWaalsContact N-OD2 3.14Å; T152-D237 PolarHBondContact OG1-OD2 3.17Å | ||
| 153 | P | 85.5 | Confident | 79.7 | Confident | 3 Ų | 3 | 57 Ų | 57 | 2% | 0.019 | 30% | 0.304 | C | S | . | . | trans | -62.3 | 140.2 | 174.6 | 25.7 | -32.5 | 0 | 0 | 0 | 110.4 | V144 Y151 S239 | V144-P153 HydrophobicContact CG1-CB 3.54Å; V144-P153 HydrophobicContact CG1-CG 4.14Å; Y151-P153 WeakPolarHBondContact O-CD 3.36Å; P153-S239 WeakPolarHBondContact CA-OG 3.36Å | ||
| 154 | V | 86.6 | Confident | 78 | Confident | 5 Ų | 5 | 62.2 Ų | 62.2 | 3% | 0.03 | 32% | 0.319 | C | S | . | . | trans | -95.7 | 110.7 | 170.9 | -175.7 | 0 | 0 | 0 | 0 | 108.1 | A171 F175 L234 D241 L242 Y243 | V154-A171 HydrophobicContact CG2-CB 3.9Å; V154-F175 HydrophobicContact CG1-CE2 3.75Å; V154-F175 HydrophobicContact CG1-CZ 3.97Å; V154-F175 HydrophobicContact CG2-CE2 4.46Å; V154-L234 HydrophobicContact CG2-CB 4.14Å; V154-L234 HydrophobicContact CG2-CD1 4.34Å; V154-L234 HydrophobicContact CG2-CD2 4.49Å; V154-D241 HydrophobicContact CB-CB 4.2Å; V154-D241 PolarHBondContact N-OD1 3.12Å; V154-D241 CarbonylContact O-C 3.19Å; V154-D241 WeakPolarHBondContact O-CA 3.3Å; V154-L242 PolarHBondContact O-N 3.15Å; V154-Y243 HydrophobicContact CG1-CE1 3.99Å | ||
| 155 | V | 88 | Confident | 76.5 | Confident | 5 Ų | 5 | 63.5 Ų | 63.5 | 3% | 0.03 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 113.2 | 168.6 | -176.4 | 0 | 0 | 0 | 0 | 108.7 | A141 V144 Q157 M167 L168 L242 | A141-V155 HydrophobicContact CB-CG1 3.71Å; V144-V155 HydrophobicContact CG1-CG2 4.16Å; V155-Q157 HydrophobicContact CG1-CG 4.42Å; V155-M167 WeakPolarHBondContact O-CA 3.5Å; V155-L168 HydrophobicContact CB-CB 4.01Å; V155-L168 VanDerWaalsContact CB-O 3.3Å; V155-L168 WeakPolarHBondContact CB-O 3.48Å; V155-L168 HydrophobicContact CG1-CB 4.2Å; V155-L168 PolarHBondContact O-N 2.84Å; V155-L242 CarbonylContact C-O 3.51Å; V155-L242 VanDerWaalsContact CA-O 3.31Å; V155-L242 WeakPolarHBondContact CA-O 3.23Å; V155-L242 HydrophobicContact CG1-CB 4.29Å; V155-L242 HydrophobicContact CG1-CD2 4.23Å; V155-L242 HydrophobicContact CG2-CB 4.33Å |
| 156 | L | 86.4 | Confident | 75.2 | Confident | 1 Ų | 1 | 63.2 Ų | 63.2 | 1% | 0.005 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 115.7 | -179.6 | -170.4 | 70 | 0 | 0 | 0 | 109.4 | L165 M167 I224 L242 Y243 S244 L245 | L156-L165 HydrophobicContact CD1-CD1 3.58Å; L156-L165 HydrophobicContact CD1-CD2 3.74Å; L156-L165 HydrophobicContact CD1-CG 3.78Å; L156-L165 HydrophobicContact CG-CD1 4.09Å; L156-M167 HydrophobicContact CD1-CG 3.75Å; L156-M167 HydrophobicContact CD1-SD 3.77Å; L156-I224 HydrophobicContact CD2-CD1 3.66Å; L156-I224 HydrophobicContact CD2-CG1 3.95Å; L156-I224 HydrophobicContact CD2-CG2 4.34Å; L156-L242 PolarHBondContact N-O 3.36Å; L156-Y243 HydrophobicContact CB-CD1 3.67Å; L156-Y243 HydrophobicContact CB-CE1 4.08Å; L156-Y243 HydrophobicContact CD2-CD1 3.82Å; L156-Y243 HydrophobicContact CD2-CE1 4.19Å; L156-Y243 HydrophobicContact CG-CD1 4.37Å; L156-Y243 CarbonylContact O-C 3.57Å; L156-Y243 WeakPolarHBondContact O-CA 3.28Å; L156-S244 PolarHBondContact O-N 3.08Å; L156-L245 HydrophobicContact CD2-CD2 4.22Å |
| 157 | Q | 84.9 | Confident | 74 | Confident | 17 Ų | 17 | 61.8 Ų | 61.8 | 8% | 0.079 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 121.2 | 173.9 | -63.8 | 179 | -36.8 | 0 | 0 | 109.6 | D138 V155 Y166 S244 | D138-Q157 PolarHBondContact OD1-NE2 2.85Å; D138-Q157 PolarHBondContact OD1-OE1 2.98Å; V155-Q157 HydrophobicContact CG1-CG 4.42Å; Q157-Y166 PolarHBondContact N-O 2.94Å; Q157-Y166 PolarHBondContact O-N 3.14Å; Q157-S244 CarbonylContact C-O 3.54Å; Q157-S244 VanDerWaalsContact CA-O 3.26Å; Q157-S244 WeakPolarHBondContact CA-O 3.28Å |
| 158 | L | 80 | Confident | 72.5 | Confident | 29 Ų | 29 | 60.1 Ų | 60.1 | 15% | 0.152 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 115.1 | 174.2 | -177.4 | 73.5 | 0 | 0 | 0 | 108.4 | L165 V220 S244 L245 E246 | L158-L165 HydrophobicContact CB-CD1 4.05Å; L158-L165 HydrophobicContact CD1-CD1 3.75Å; L158-V220 HydrophobicContact CD2-CG1 3.99Å; L158-S244 PolarHBondContact N-O 3.15Å; L158-L245 HydrophobicContact CB-CD2 3.72Å; L158-L245 HydrophobicContact CD2-CD2 4.42Å; L158-E246 WeakPolarHBondContact O-CB 3.22Å; L158-E246 PolarHBondContact O-N 3.44Å |
| 159 | A | 71.8 | Confident | 71.1 | Confident | 20 Ų | 20 | 58.7 Ų | 58.7 | 17% | 0.165 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 106.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | S161 E162 | A159-S161 PolarHBondContact O-N 2.95Å; A159-E162 PolarHBondContact O-N 3.1Å |
| 160 | P | 61.2 | Low | 70.1 | Confident | 32 Ų | 32 | 62.2 Ų | 62.2 | 21% | 0.208 | 31% | 0.306 | C | S | . | . | G | 310 helix | trans | -59.6 | -31 | -178.4 | -25.6 | 34 | 0 | 0 | 0 | 113.6 | E162 E163 E246 S248 | P160-E162 PolarHBondContact O-N 3.45Å; P160-E162 VanDerWaalsContact O-N 3.17Å; P160-E163 PolarHBondContact O-N 3.09Å; P160-E246 WeakPolarHBondContact CD-O 3.43Å; P160-E246 WeakPolarHBondContact CG-O 3.33Å; P160-S248 VanDerWaalsContact CB-OG 3.25Å; P160-S248 WeakPolarHBondContact CB-OG 3.38Å |
| 161 | S | 57.3 | Low | 69 | Low | 89 Ų | 89 | 54.6 Ų | 54.6 | 62% | 0.622 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -62 | -22.6 | 179.3 | 55.4 | 0 | 0 | 0 | 0 | 114 | A159 | A159-S161 PolarHBondContact O-N 2.95Š|
| 162 | E | 53.3 | Low | 67.9 | Low | 105 Ų | 105 | 53 Ų | 53 | 49% | 0.491 | 27% | 0.27 | S | S | . | . | G | 310 helix | trans | -107.6 | 0.7 | -178.4 | -58.7 | -166 | -178.7 | 0 | 0 | 112.8 | A159 P160 R164 Y166 | A159-E162 PolarHBondContact O-N 3.1Å; P160-E162 PolarHBondContact O-N 3.45Å; P160-E162 VanDerWaalsContact O-N 3.17Å; E162-R164 VanDerWaalsContact O-CG 3.23Å; E162-R164 WeakPolarHBondContact O-CG 3.34Å; E162-R164 PolarHBondContact O-N 2.75Å; E162-Y166 HydrophobicContact CB-CE2 4.12Å; E162-Y166 WeakPolarHBondContact OE2-CE2 3.37Å; E162-Y166 PolarHBondContact OE2-OH 3.21Å |
| 163 | E | 55.4 | Low | 67 | Low | 140 Ų | 140 | 53.7 Ų | 53.7 | 65% | 0.654 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.3 | 28.1 | -175.3 | -61.9 | -173.1 | 165.4 | 0 | 0 | 113.8 | P160 | P160-E163 PolarHBondContact O-N 3.09Š|
| 164 | R | 54.4 | Low | 65.9 | Low | 157 Ų | 157 | 55 Ų | 55 | 59% | 0.592 | 29% | 0.289 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 134.6 | -171.9 | -69.7 | 176.1 | 96.9 | 178.3 | 4.8 | 111.5 | E162 Y166 | E162-R164 VanDerWaalsContact O-CG 3.23Å; E162-R164 WeakPolarHBondContact O-CG 3.34Å; E162-R164 PolarHBondContact O-N 2.75Å; R164-Y166 HydrophobicContact CB-CD2 4.49Å; R164-Y166 HydrophobicContact CB-CE2 3.94Å |
| 165 | L | 58.6 | Low | 64.9 | Low | 27 Ų | 27 | 54.9 Ų | 54.9 | 14% | 0.141 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 114.2 | 166.2 | -171.4 | 79.7 | 0 | 0 | 0 | 107.6 | L156 L158 M167 L178 V180 | L156-L165 HydrophobicContact CD1-CD1 3.58Å; L156-L165 HydrophobicContact CD1-CD2 3.74Å; L156-L165 HydrophobicContact CD1-CG 3.78Å; L156-L165 HydrophobicContact CG-CD1 4.09Å; L158-L165 HydrophobicContact CB-CD1 4.05Å; L158-L165 HydrophobicContact CD1-CD1 3.75Å; L165-M167 HydrophobicContact CD2-CE 4.29Å; L165-M167 HydrophobicContact CD2-CG 3.9Å; L165-M167 HydrophobicContact CD2-SD 3.8Å; L165-M167 HydrophobicContact CG-CG 4.04Å; L165-L178 HydrophobicContact CD2-CB 4.47Å; L165-L178 HydrophobicContact CD2-CD1 4.2Å; L165-V180 HydrophobicContact CB-CG1 3.76Å; L165-V180 HydrophobicContact CB-CG2 4.06Å; L165-V180 HydrophobicContact CD2-CG2 4.46Å; L165-V180 VanDerWaalsContact N-CG1 3.28Å |
| 166 | Y | 60 | Low | 63.7 | Low | 83 Ų | 83 | 61.3 Ų | 61.3 | 33% | 0.325 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 120.5 | 172.5 | -68.7 | -82.8 | 0 | 0 | 0 | 108.8 | Q157 E162 R164 | Q157-Y166 PolarHBondContact N-O 2.94Å; Q157-Y166 PolarHBondContact O-N 3.14Å; E162-Y166 HydrophobicContact CB-CE2 4.12Å; E162-Y166 WeakPolarHBondContact OE2-CE2 3.37Å; E162-Y166 PolarHBondContact OE2-OH 3.21Å; R164-Y166 HydrophobicContact CB-CD2 4.49Å; R164-Y166 HydrophobicContact CB-CE2 3.94Å |
| 167 | M | 65.5 | Low | 62.6 | Low | 44 Ų | 44 | 68.4 Ų | 68.4 | 22% | 0.217 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 125.4 | 174.9 | -62.7 | -161.7 | -67.2 | 0 | 0 | 109.8 | V155 L156 L165 N172 F175 | V155-M167 WeakPolarHBondContact O-CA 3.5Å; L156-M167 HydrophobicContact CD1-CG 3.75Å; L156-M167 HydrophobicContact CD1-SD 3.77Å; L165-M167 HydrophobicContact CD2-CE 4.29Å; L165-M167 HydrophobicContact CD2-CG 3.9Å; L165-M167 HydrophobicContact CD2-SD 3.8Å; L165-M167 HydrophobicContact CG-CG 4.04Å; M167-N172 WeakPolarHBondContact CB-OD1 3.18Å; M167-N172 HydrophobicContact CE-CB 4.28Å; M167-N172 WeakPolarHBondContact CE-O 3.32Å; M167-F175 HydrophobicContact CE-CB 3.68Å; M167-F175 HydrophobicContact SD-CB 3.26Å; M167-F175 WeakPolarHBondContact SD-CB 3.47Å; M167-F175 HydrophobicContact SD-CD2 4.35Å; M167-F175 HydrophobicContact SD-CG 4Å |
| 168 | L | 56.9 | Low | 61.8 | Low | 76 Ų | 76 | 68.1 Ų | 68.1 | 40% | 0.398 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 107.8 | 180 | -77.6 | 151.2 | 0 | 0 | 0 | 107.8 | A141 V155 | A141-L168 HydrophobicContact CB-CD1 4.14Å; V155-L168 HydrophobicContact CB-CB 4.01Å; V155-L168 VanDerWaalsContact CB-O 3.3Å; V155-L168 WeakPolarHBondContact CB-O 3.48Å; V155-L168 HydrophobicContact CG1-CB 4.2Å; V155-L168 PolarHBondContact O-N 2.84Å |
| 169 | G | 59.2 | Low | 61.1 | Low | 21 Ų | 21 | 67.4 Ų | 67.4 | 22% | 0.216 | 35% | 0.352 | C | S | . | . | S | Bend | trans | 145.3 | -175.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115 | A171 N172 | G169-A171 VanDerWaalsContact C-N 3.32Å; G169-N172 VanDerWaalsContact O-CG 3.23Å; G169-N172 PolarHBondContact O-ND2 2.82Å; G169-N172 PolarHBondContact O-OD1 3.19Å; G169-N172 VanDerWaalsContact O-OD1 3.08Å |
| 170 | K | 59.3 | Low | 60.6 | Low | 135 Ų | 135 | 69 Ų | 69 | 59% | 0.587 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.9 | -9.6 | -179.2 | -67.4 | 175.2 | -176.5 | 159 | 0 | 113.2 | S149 T152 N172 | S149-K170 PolarHBondContact O-NZ 3.22Å; T152-K170 HydrophobicContact CG2-CB 4.06Å; T152-K170 HydrophobicContact CG2-CD 4.26Å; K170-N172 VanDerWaalsContact C-N 3.29Å; K170-N172 PolarHBondContact O-N 2.87Å |
| 171 | A | 59.1 | Low | 60.7 | Low | 9 Ų | 9 | 70.2 Ų | 70.2 | 7% | 0.074 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.3 | 2.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | V154 G169 A173 V174 L234 | V154-A171 HydrophobicContact CG2-CB 3.9Å; G169-A171 VanDerWaalsContact C-N 3.32Å; A171-A173 VanDerWaalsContact C-N 3.27Å; A171-A173 PolarHBondContact O-N 3.49Å; A171-A173 VanDerWaalsContact O-N 3.14Å; A171-V174 PolarHBondContact O-N 3.19Å; A171-L234 HydrophobicContact CB-CD2 4.38Å |
| 172 | N | 61.4 | Low | 60.9 | Low | 60 Ų | 60 | 68.9 Ų | 68.9 | 32% | 0.321 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -51.2 | -42.4 | -173.9 | -70 | 1.7 | 0 | 0 | 0 | 113.3 | M167 G169 K170 V174 F175 E176 | M167-N172 WeakPolarHBondContact CB-OD1 3.18Å; M167-N172 HydrophobicContact CE-CB 4.28Å; M167-N172 WeakPolarHBondContact CE-O 3.32Å; G169-N172 VanDerWaalsContact O-CG 3.23Å; G169-N172 PolarHBondContact O-ND2 2.82Å; G169-N172 PolarHBondContact O-OD1 3.19Å; G169-N172 VanDerWaalsContact O-OD1 3.08Å; K170-N172 VanDerWaalsContact C-N 3.29Å; K170-N172 PolarHBondContact O-N 2.87Å; N172-V174 PolarHBondContact O-N 3.02Å; N172-V174 VanDerWaalsContact O-N 3.13Å; N172-F175 PolarHBondContact O-N 2.94Å; N172-F175 VanDerWaalsContact O-N 3.1Å; N172-E176 PolarHBondContact O-N 2.94Å; N172-E176 VanDerWaalsContact O-N 3.16Å |
| 173 | A | 62 | Low | 61.4 | Low | 69 Ų | 69 | 71.7 Ų | 71.7 | 57% | 0.57 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -61.4 | -24.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | A171 F175 | A171-A173 VanDerWaalsContact C-N 3.27Å; A171-A173 PolarHBondContact O-N 3.49Å; A171-A173 VanDerWaalsContact O-N 3.14Å; A173-F175 VanDerWaalsContact C-N 3.35Å |
| 174 | V | 62.3 | Low | 62 | Low | 31 Ų | 31 | 69.8 Ų | 69.8 | 19% | 0.188 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -78.1 | -26.6 | -179 | -172.3 | 0 | 0 | 0 | 0 | 111.4 | A171 N172 L227 H231 L234 | A171-V174 PolarHBondContact O-N 3.19Å; N172-V174 PolarHBondContact O-N 3.02Å; N172-V174 VanDerWaalsContact O-N 3.13Å; V174-L227 HydrophobicContact CG1-CD2 3.65Å; V174-L227 HydrophobicContact CG1-CG 4.35Å; V174-L227 VanDerWaalsContact O-CD1 3.31Å; V174-L227 WeakPolarHBondContact O-CD1 3.25Å; V174-H231 HydrophobicContact CG1-CB 3.99Å; V174-H231 WeakPolarHBondContact CG1-CD2 3.44Å; V174-L234 HydrophobicContact CB-CD1 4.34Å; V174-L234 HydrophobicContact CG1-CD1 4.07Å; V174-L234 HydrophobicContact CG2-CD1 4.3Å |
| 175 | F | 64.9 | Low | 62.7 | Low | 2 Ų | 2 | 63 Ų | 63 | 1% | 0.009 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -110.6 | 4.7 | -173.8 | -66.2 | -87.8 | 0 | 0 | 0 | 113 | V154 M167 N172 A173 D177 L178 L227 L228 L234 | V154-F175 HydrophobicContact CG1-CE2 3.75Å; V154-F175 HydrophobicContact CG1-CZ 3.97Å; V154-F175 HydrophobicContact CG2-CE2 4.46Å; M167-F175 HydrophobicContact CE-CB 3.68Å; M167-F175 HydrophobicContact SD-CB 3.26Å; M167-F175 WeakPolarHBondContact SD-CB 3.47Å; M167-F175 HydrophobicContact SD-CD2 4.35Å; M167-F175 HydrophobicContact SD-CG 4Å; N172-F175 PolarHBondContact O-N 2.94Å; N172-F175 VanDerWaalsContact O-N 3.1Å; A173-F175 VanDerWaalsContact C-N 3.35Å; F175-D177 PolarHBondContact O-N 2.82Å; F175-L178 HydrophobicContact CB-CD1 4.29Å; F175-L178 HydrophobicContact CD1-CD1 3.7Å; F175-L178 HydrophobicContact CD1-CG 4.34Å; F175-L178 HydrophobicContact CG-CD1 4.48Å; F175-L178 WeakPolarHBondContact O-CB 3.12Å; F175-L178 PolarHBondContact O-N 3.06Å; F175-L178 VanDerWaalsContact O-N 3.1Å; F175-L227 HydrophobicContact CB-CD1 4.46Å; F175-L227 HydrophobicContact CD1-CD1 3.42Å; F175-L227 VanDerWaalsContact CD1-CD1 3.42Å; F175-L227 HydrophobicContact CD1-CD2 3.62Å; F175-L227 HydrophobicContact CD1-CG 4.13Å; F175-L227 HydrophobicContact CD2-CD2 4.41Å; F175-L227 HydrophobicContact CE1-CD1 3.88Å; F175-L227 HydrophobicContact CE1-CD2 3.23Å; F175-L227 HydrophobicContact CE1-CG 4.1Å; F175-L227 HydrophobicContact CE2-CD2 4.07Å; F175-L227 HydrophobicContact CG-CD1 4.05Å; F175-L227 HydrophobicContact CG-CD2 4.21Å; F175-L227 HydrophobicContact CZ-CD2 3.47Å; F175-L227 VanDerWaalsContact CZ-CD2 3.47Å; F175-L228 HydrophobicContact CE1-CD2 4.38Å; F175-L228 HydrophobicContact CE1-CG 4.48Å; F175-L228 HydrophobicContact CZ-CD2 3.72Å; F175-L228 HydrophobicContact CZ-CG 4.29Å; F175-L234 HydrophobicContact CE2-CD1 3.99Å; F175-L234 HydrophobicContact CZ-CD1 4.42Å |
| 176 | E | 63.8 | Low | 63.1 | Low | 140 Ų | 140 | 67 Ų | 67 | 65% | 0.654 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -30 | 170.6 | -80.5 | 176.2 | -162.8 | 0 | 0 | 112.5 | N172 L178 | N172-E176 PolarHBondContact O-N 2.94Å; N172-E176 VanDerWaalsContact O-N 3.16Å; E176-L178 VanDerWaalsContact C-N 3.25Å; E176-L178 PolarHBondContact O-N 2.82Å |
| 177 | D | 63.8 | Low | 63.7 | Low | 151 Ų | 151 | 65.2 Ų | 65.2 | 81% | 0.807 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -7.4 | 179.1 | -69.6 | -26.4 | 0 | 0 | 0 | 113.5 | F175 | F175-D177 PolarHBondContact O-N 2.82Š|
| 178 | L | 67.9 | Low | 64.1 | Low | 11 Ų | 11 | 65.5 Ų | 65.5 | 6% | 0.058 | 35% | 0.346 | C | S | . | . | S | Bend | trans | -69.2 | 129.9 | 175.1 | -75.6 | -179.2 | 0 | 0 | 0 | 109.5 | L165 F175 E176 V180 D223 I224 L227 | L165-L178 HydrophobicContact CD2-CB 4.47Å; L165-L178 HydrophobicContact CD2-CD1 4.2Å; F175-L178 HydrophobicContact CB-CD1 4.29Å; F175-L178 HydrophobicContact CD1-CD1 3.7Å; F175-L178 HydrophobicContact CD1-CG 4.34Å; F175-L178 HydrophobicContact CG-CD1 4.48Å; F175-L178 WeakPolarHBondContact O-CB 3.12Å; F175-L178 PolarHBondContact O-N 3.06Å; F175-L178 VanDerWaalsContact O-N 3.1Å; E176-L178 VanDerWaalsContact C-N 3.25Å; E176-L178 PolarHBondContact O-N 2.82Å; L178-V180 VanDerWaalsContact O-CG2 3.26Å; L178-V180 WeakPolarHBondContact O-CG2 3.48Å; L178-V180 PolarHBondContact O-N 2.87Å; L178-V180 VanDerWaalsContact O-N 3.11Å; L178-D223 HydrophobicContact CD2-CB 3.84Å; L178-I224 HydrophobicContact CD1-CG1 3.97Å; L178-L227 HydrophobicContact CD2-CD1 4.19Å; L178-L227 HydrophobicContact CG-CD1 4.05Å |
| 179 | P | 64.3 | Low | 64.9 | Low | 14 Ų | 14 | 62.4 Ų | 62.4 | 9% | 0.091 | 33% | 0.329 | C | S | . | . | trans | -68.4 | 114 | 177.2 | 29.6 | -34.8 | 0 | 0 | 0 | 109.3 | Q184 I185 R188 | P179-Q184 HydrophobicContact CB-CB 3.64Å; P179-I185 HydrophobicContact CB-CB 4.36Å; P179-I185 HydrophobicContact CB-CG1 3.63Å; P179-I185 HydrophobicContact CG-CG1 3.84Å; P179-I185 WeakPolarHBondContact O-CG1 3.39Å; P179-R188 HydrophobicContact CB-CB 4.46Å; P179-R188 HydrophobicContact CG-CB 4.13Å; P179-R188 HydrophobicContact CG-CG 4.15Å | ||
| 180 | V | 62.9 | Low | 65.5 | Low | 52 Ų | 52 | 66.2 Ų | 66.2 | 32% | 0.315 | 35% | 0.353 | S | S | . | . | trans | -94.9 | -26 | -174.5 | -171.7 | 0 | 0 | 0 | 0 | 111.8 | L165 L178 | L165-V180 HydrophobicContact CB-CG1 3.76Å; L165-V180 HydrophobicContact CB-CG2 4.06Å; L165-V180 HydrophobicContact CD2-CG2 4.46Å; L165-V180 VanDerWaalsContact N-CG1 3.28Å; L178-V180 VanDerWaalsContact O-CG2 3.26Å; L178-V180 WeakPolarHBondContact O-CG2 3.48Å; L178-V180 PolarHBondContact O-N 2.87Å; L178-V180 VanDerWaalsContact O-N 3.11Å | ||
| 181 | T | 62 | Low | 66.2 | Low | 58 Ų | 58 | 64.8 Ų | 64.8 | 36% | 0.356 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -103.2 | 149.5 | -178.6 | 60.7 | 0 | 0 | 0 | 0 | 111.7 | Q183 Q184 I185 | T181-Q183 PolarHBondContact O-N 2.83Å; T181-Q184 PolarHBondContact O-N 2.72Å; T181-Q184 WeakPolarHBondContact OG1-CB 3.49Å; T181-Q184 VanDerWaalsContact OG1-CD 3.31Å; T181-Q184 VanDerWaalsContact OG1-CG 3.23Å; T181-Q184 WeakPolarHBondContact OG1-CG 3.27Å; T181-Q184 PolarHBondContact OG1-N 2.79Å; T181-Q184 PolarHBondContact OG1-OE1 3.25Å; T181-Q184 VanDerWaalsContact OG1-OE1 3.14Å; T181-I185 WeakPolarHBondContact O-CG1 3.39Å; T181-I185 PolarHBondContact O-N 3.22Å |
| 182 | L | 61.5 | Low | 66.2 | Low | 61 Ų | 61 | 72 Ų | 72 | 32% | 0.319 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -50.3 | -34.8 | 173.3 | -77.9 | 171.6 | 0 | 0 | 0 | 112.8 | I185 R186 L213 | L182-I185 PolarHBondContact O-N 3.09Å; L182-R186 WeakPolarHBondContact O-CB 3.21Å; L182-R186 WeakPolarHBondContact O-CG 3.46Å; L182-R186 PolarHBondContact O-N 3.08Å; L182-L213 HydrophobicContact CD2-CD1 3.86Å |
| 183 | Q | 63.9 | Low | 66.3 | Low | 164 Ų | 164 | 71.3 Ų | 71.3 | 77% | 0.766 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -69.9 | -43.6 | 178.4 | -169.7 | 174 | -5.6 | 0 | 0 | 112.6 | T181 I185 R186 A187 | T181-Q183 PolarHBondContact O-N 2.83Å; Q183-I185 VanDerWaalsContact C-N 3.33Å; Q183-R186 PolarHBondContact O-N 3.46Å; Q183-A187 PolarHBondContact O-N 3.34Å; Q183-A187 VanDerWaalsContact O-N 3.16Å |
| 184 | Q | 69.1 | Low | 66.8 | Low | 101 Ų | 101 | 68.3 Ų | 68.3 | 47% | 0.472 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -65.6 | -37.6 | 174.2 | -72.4 | 167 | -25.2 | 0 | 0 | 111.2 | P179 T181 A187 R188 | P179-Q184 HydrophobicContact CB-CB 3.64Å; T181-Q184 PolarHBondContact O-N 2.72Å; T181-Q184 WeakPolarHBondContact OG1-CB 3.49Å; T181-Q184 VanDerWaalsContact OG1-CD 3.31Å; T181-Q184 VanDerWaalsContact OG1-CG 3.23Å; T181-Q184 WeakPolarHBondContact OG1-CG 3.27Å; T181-Q184 PolarHBondContact OG1-N 2.79Å; T181-Q184 PolarHBondContact OG1-OE1 3.25Å; T181-Q184 VanDerWaalsContact OG1-OE1 3.14Å; Q184-A187 WeakPolarHBondContact O-CB 3.22Å; Q184-A187 PolarHBondContact O-N 3.42Å; Q184-R188 WeakPolarHBondContact O-CB 3.4Å; Q184-R188 PolarHBondContact O-N 3.23Å |
| 185 | I | 67.4 | Low | 67.3 | Low | 13 Ų | 13 | 67.3 Ų | 67.3 | 7% | 0.067 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -71.9 | -36.9 | 179.1 | -52.4 | 163.6 | 0 | 0 | 0 | 111.1 | P179 T181 L182 Q183 A187 R188 L189 V220 | P179-I185 HydrophobicContact CB-CB 4.36Å; P179-I185 HydrophobicContact CB-CG1 3.63Å; P179-I185 HydrophobicContact CG-CG1 3.84Å; P179-I185 WeakPolarHBondContact O-CG1 3.39Å; T181-I185 WeakPolarHBondContact O-CG1 3.39Å; T181-I185 PolarHBondContact O-N 3.22Å; L182-I185 PolarHBondContact O-N 3.09Å; Q183-I185 VanDerWaalsContact C-N 3.33Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 2.98Å; I185-R188 CarbonylContact O-C 3.56Å; I185-R188 WeakPolarHBondContact O-CB 3.34Å; I185-R188 PolarHBondContact O-N 2.75Å; I185-R188 VanDerWaalsContact O-N 3.08Å; I185-L189 HydrophobicContact CG2-CD1 4.31Å; I185-L189 HydrophobicContact CG2-CG 4.15Å; I185-L189 WeakPolarHBondContact O-CB 3.48Å; I185-L189 VanDerWaalsContact O-CG 3.3Å; I185-L189 WeakPolarHBondContact O-CG 3.25Å; I185-L189 PolarHBondContact O-N 2.91Å; I185-V220 HydrophobicContact CD1-CG2 4.19Å |
| 186 | R | 67.4 | Low | 67.5 | Low | 112 Ų | 112 | 68.2 Ų | 68.2 | 42% | 0.423 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -57.6 | -43.6 | 170.6 | -80 | 179.9 | -172.5 | 163.2 | 7.3 | 111.6 | L182 Q183 L189 S190 E209 | L182-R186 WeakPolarHBondContact O-CB 3.21Å; L182-R186 WeakPolarHBondContact O-CG 3.46Å; L182-R186 PolarHBondContact O-N 3.08Å; Q183-R186 PolarHBondContact O-N 3.46Å; R186-L189 PolarHBondContact O-N 3.49Å; R186-S190 PolarHBondContact O-N 3.14Å; R186-E209 IonicContact NH2-OE1 3.15Å; R186-E209 PolarHBondContact NH2-OE1 3.25Å |
| 187 | A | 73 | Confident | 67.5 | Low | 45 Ų | 45 | 67.5 Ų | 67.5 | 37% | 0.372 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q183 Q184 I185 L189 S190 Q191 | Q183-A187 PolarHBondContact O-N 3.34Å; Q183-A187 VanDerWaalsContact O-N 3.16Å; Q184-A187 WeakPolarHBondContact O-CB 3.22Å; Q184-A187 PolarHBondContact O-N 3.42Å; I185-A187 VanDerWaalsContact C-N 3.29Å; I185-A187 PolarHBondContact O-N 2.98Å; A187-L189 PolarHBondContact O-N 2.96Å; A187-S190 PolarHBondContact O-N 3.36Å; A187-S190 VanDerWaalsContact O-N 3.16Å; A187-S190 PolarHBondContact O-OG 3.03Å; A187-Q191 WeakPolarHBondContact O-CG 3.44Å; A187-Q191 PolarHBondContact O-N 3.19Å |
| 188 | R | 74.2 | Confident | 67.8 | Low | 51 Ų | 51 | 64.6 Ų | 64.6 | 19% | 0.192 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.5 | -39.7 | 178.2 | -172.6 | 68.3 | -172.4 | 109.1 | 10.9 | 113.3 | P179 Q184 I185 S190 Q191 D192 Q219 D223 | P179-R188 HydrophobicContact CB-CB 4.46Å; P179-R188 HydrophobicContact CG-CB 4.13Å; P179-R188 HydrophobicContact CG-CG 4.15Å; Q184-R188 WeakPolarHBondContact O-CB 3.4Å; Q184-R188 PolarHBondContact O-N 3.23Å; I185-R188 CarbonylContact O-C 3.56Å; I185-R188 WeakPolarHBondContact O-CB 3.34Å; I185-R188 PolarHBondContact O-N 2.75Å; I185-R188 VanDerWaalsContact O-N 3.08Å; R188-S190 PolarHBondContact O-N 3.31Å; R188-Q191 WeakPolarHBondContact O-CB 3.38Å; R188-Q191 PolarHBondContact O-N 3.33Å; R188-Q191 VanDerWaalsContact O-N 3.12Å; R188-D192 PolarHBondContact NH1-O 3.3Å; R188-Q219 HydrophobicContact CG-CG 4.28Å; R188-D223 IonicContact CZ-OD1 3.05Å; R188-D223 IonicContact NE-OD1 3.21Å; R188-D223 IonicContact NE-OD2 3.78Å; R188-D223 PolarHBondContact NE-OD2 2.62Å; R188-D223 IonicContact NH2-OD1 3.59Å; R188-D223 PolarHBondContact NH2-OD1 2.73Å |
| 189 | L | 73.1 | Confident | 68 | Low | 11 Ų | 11 | 65.2 Ų | 65.2 | 6% | 0.058 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.3 | -25.3 | 176 | -72.9 | 172.4 | 0 | 0 | 0 | 112.4 | I185 R186 A187 S194 L196 L212 Q219 | I185-L189 HydrophobicContact CG2-CD1 4.31Å; I185-L189 HydrophobicContact CG2-CG 4.15Å; I185-L189 WeakPolarHBondContact O-CB 3.48Å; I185-L189 VanDerWaalsContact O-CG 3.3Å; I185-L189 WeakPolarHBondContact O-CG 3.25Å; I185-L189 PolarHBondContact O-N 2.91Å; R186-L189 PolarHBondContact O-N 3.49Å; A187-L189 PolarHBondContact O-N 2.96Å; L189-S194 VanDerWaalsContact O-CB 3.23Å; L189-S194 WeakPolarHBondContact O-CB 3.43Å; L189-S194 PolarHBondContact O-OG 3.16Å; L189-S194 VanDerWaalsContact O-OG 3.05Å; L189-L196 HydrophobicContact CB-CD1 4.11Å; L189-L196 HydrophobicContact CD2-CD1 4.46Å; L189-L196 HydrophobicContact CD2-CD2 4.45Å; L189-L196 HydrophobicContact CD2-CG 4.16Å; L189-L196 WeakPolarHBondContact O-CD1 3.33Å; L189-L212 HydrophobicContact CD1-CD2 4.2Å; L189-Q219 HydrophobicContact CD2-CB 3.85Å; L189-Q219 HydrophobicContact CD2-CG 4.09Å |
| 190 | S | 71.6 | Confident | 68.3 | Low | 101 Ų | 101 | 68.2 Ų | 68.2 | 71% | 0.706 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | -8.5 | 176.5 | 71.7 | 0 | 0 | 0 | 0 | 114.5 | R186 A187 R188 | R186-S190 PolarHBondContact O-N 3.14Å; A187-S190 PolarHBondContact O-N 3.36Å; A187-S190 VanDerWaalsContact O-N 3.16Å; A187-S190 PolarHBondContact O-OG 3.03Å; R188-S190 PolarHBondContact O-N 3.31Å |
| 191 | Q | 74.5 | Confident | 68.5 | Low | 104 Ų | 104 | 67.7 Ų | 67.7 | 49% | 0.486 | 38% | 0.381 | S | S | . | . | S | Bend | trans | -92.5 | 166.4 | -177.7 | -70.7 | 170.3 | 0.3 | 0 | 0 | 112.7 | A187 R188 S194 | A187-Q191 WeakPolarHBondContact O-CG 3.44Å; A187-Q191 PolarHBondContact O-N 3.19Å; R188-Q191 WeakPolarHBondContact O-CB 3.38Å; R188-Q191 PolarHBondContact O-N 3.33Å; R188-Q191 VanDerWaalsContact O-N 3.12Å; Q191-S194 WeakPolarHBondContact O-CB 3.44Å; Q191-S194 PolarHBondContact O-N 2.99Å |
| 192 | D | 59 | Low | 69 | Low | 161 Ų | 161 | 71.5 Ų | 71.5 | 86% | 0.861 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | 139.5 | 174 | -64.3 | -40.4 | 0 | 0 | 0 | 111.6 | R188 | R188-D192 PolarHBondContact NH1-O 3.3Š|
| 193 | G | 64.2 | Low | 69.8 | Low | 46 Ų | 46 | 70 Ų | 70 | 47% | 0.474 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85 | 12.8 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 194 | S | 72.7 | Confident | 70.7 | Confident | 5 Ų | 5 | 62.7 Ų | 62.7 | 4% | 0.035 | 36% | 0.36 | C | S | . | . | trans | -68.8 | 137.9 | 172.7 | 178.9 | 0 | 0 | 0 | 0 | 112.2 | L189 Q191 L196 T197 | L189-S194 VanDerWaalsContact O-CB 3.23Å; L189-S194 WeakPolarHBondContact O-CB 3.43Å; L189-S194 PolarHBondContact O-OG 3.16Å; L189-S194 VanDerWaalsContact O-OG 3.05Å; Q191-S194 WeakPolarHBondContact O-CB 3.44Å; Q191-S194 PolarHBondContact O-N 2.99Å; S194-L196 PolarHBondContact O-N 3.39Å; S194-L196 VanDerWaalsContact O-N 3.12Å; S194-L196 WeakPolarHBondContact OG-CB 3.44Å; S194-L196 VanDerWaalsContact OG-CG 3.31Å; S194-L196 WeakPolarHBondContact OG-CG 3.33Å; S194-L196 PolarHBondContact OG-N 2.87Å; S194-L196 VanDerWaalsContact OG-N 3.15Å; S194-T197 PolarHBondContact O-N 3.36Å; S194-T197 VanDerWaalsContact O-N 3.17Å; S194-T197 PolarHBondContact O-OG1 2.89Å | ||
| 195 | V | 71.5 | Confident | 71.3 | Confident | 11 Ų | 11 | 60 Ų | 60 | 7% | 0.067 | 35% | 0.352 | C | S | . | . | G | 310 helix | trans | -60.1 | -18 | 172.8 | 177.2 | 0 | 0 | 0 | 0 | 112.2 | T197 S198 L199 V218 Q219 H222 | V195-T197 PolarHBondContact O-N 2.94Å; V195-T197 VanDerWaalsContact O-N 3.12Å; V195-S198 PolarHBondContact O-N 3.38Å; V195-S198 VanDerWaalsContact O-N 3.1Å; V195-S198 PolarHBondContact O-OG 2.8Å; V195-L199 HydrophobicContact CG1-CD1 3.3Å; V195-L199 HydrophobicContact CG1-CD2 4.25Å; V195-L199 HydrophobicContact CG1-CG 3.41Å; V195-L199 VanDerWaalsContact CG1-CG 3.41Å; V195-L199 PolarHBondContact O-N 2.78Å; V195-V218 HydrophobicContact CG1-CG1 3.92Å; V195-Q219 VanDerWaalsContact CG2-OE1 3.26Å; V195-H222 HydrophobicContact CG2-CB 3.57Å |
| 196 | L | 69.6 | Low | 71.8 | Confident | 21 Ų | 21 | 66 Ų | 66 | 11% | 0.11 | 37% | 0.374 | C | S | . | . | G | 310 helix | trans | -61 | -20 | 174 | -62.2 | -177.6 | 0 | 0 | 0 | 114.4 | L189 S194 L201 L215 | L189-L196 HydrophobicContact CB-CD1 4.11Å; L189-L196 HydrophobicContact CD2-CD1 4.46Å; L189-L196 HydrophobicContact CD2-CD2 4.45Å; L189-L196 HydrophobicContact CD2-CG 4.16Å; L189-L196 WeakPolarHBondContact O-CD1 3.33Å; S194-L196 PolarHBondContact O-N 3.39Å; S194-L196 VanDerWaalsContact O-N 3.12Å; S194-L196 WeakPolarHBondContact OG-CB 3.44Å; S194-L196 VanDerWaalsContact OG-CG 3.31Å; S194-L196 WeakPolarHBondContact OG-CG 3.33Å; S194-L196 PolarHBondContact OG-N 2.87Å; S194-L196 VanDerWaalsContact OG-N 3.15Å; L196-L201 HydrophobicContact CB-CD1 4.15Å; L196-L201 HydrophobicContact CD2-CD1 3.84Å; L196-L201 HydrophobicContact CD2-CD2 4.29Å; L196-L215 HydrophobicContact CD2-CB 4.36Å; L196-L215 HydrophobicContact CD2-CD1 3.78Å; L196-L215 HydrophobicContact CD2-CD2 4.07Å; L196-L215 HydrophobicContact CD2-CG 4.28Å |
| 197 | T | 64.6 | Low | 72.4 | Confident | 124 Ų | 124 | 68.2 Ų | 68.2 | 76% | 0.761 | 39% | 0.394 | S | S | * | . | G | 310 helix | trans | -88.9 | -20.8 | 177.7 | 57.4 | 0 | 0 | 0 | 0 | 113.2 | S194 V195 | S194-T197 PolarHBondContact O-N 3.36Å; S194-T197 VanDerWaalsContact O-N 3.17Å; S194-T197 PolarHBondContact O-OG1 2.89Å; V195-T197 PolarHBondContact O-N 2.94Å; V195-T197 VanDerWaalsContact O-N 3.12Å |
| 198 | S | 68.6 | Low | 72.9 | Confident | 90 Ų | 90 | 67 Ų | 67 | 63% | 0.629 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.2 | -19.7 | -175.4 | 59.5 | 0 | 0 | 0 | 0 | 113.6 | V195 | V195-S198 PolarHBondContact O-N 3.38Å; V195-S198 VanDerWaalsContact O-N 3.1Å; V195-S198 PolarHBondContact O-OG 2.8Å |
| 199 | L | 73.6 | Confident | 73.4 | Confident | 25 Ų | 25 | 70.7 Ų | 70.7 | 13% | 0.131 | 40% | 0.402 | C | S | . | . | S | Bend | trans | -89 | 143 | 178.1 | -69.8 | 179.8 | 0 | 0 | 0 | 113.2 | V195 L201 L215 V218 I270 V274 | V195-L199 HydrophobicContact CG1-CD1 3.3Å; V195-L199 HydrophobicContact CG1-CD2 4.25Å; V195-L199 HydrophobicContact CG1-CG 3.41Å; V195-L199 VanDerWaalsContact CG1-CG 3.41Å; V195-L199 PolarHBondContact O-N 2.78Å; L199-L201 VanDerWaalsContact C-N 3.34Å; L199-L201 PolarHBondContact O-N 3.37Å; L199-L215 HydrophobicContact CD1-CD2 4.28Å; L199-V218 HydrophobicContact CD1-CG1 4.12Å; L199-I270 HydrophobicContact CD1-CG2 3.91Å; L199-I270 HydrophobicContact CD2-CG2 3.71Å; L199-I270 HydrophobicContact CG-CG2 4.42Å; L199-V274 HydrophobicContact CD2-CG2 4.2Å |
| 200 | P | 70.8 | Confident | 73.9 | Confident | 76 Ų | 76 | 70.4 Ų | 70.4 | 49% | 0.494 | 40% | 0.401 | S | S | . | . | trans | -72.7 | 88.3 | 169 | 31.1 | -32.9 | 0 | 0 | 0 | 109.9 | N202 | P200-N202 PolarHBondContact O-N 2.87Š| ||
| 201 | L | 66.5 | Low | 74.7 | Confident | 41 Ų | 41 | 65.6 Ų | 65.6 | 22% | 0.215 | 37% | 0.368 | C | S | . | . | trans | -77.1 | 66.8 | 174 | -61.1 | 170.2 | 0 | 0 | 0 | 110.1 | L196 L199 L204 L215 | L196-L201 HydrophobicContact CB-CD1 4.15Å; L196-L201 HydrophobicContact CD2-CD1 3.84Å; L196-L201 HydrophobicContact CD2-CD2 4.29Å; L199-L201 VanDerWaalsContact C-N 3.34Å; L199-L201 PolarHBondContact O-N 3.37Å; L201-L204 HydrophobicContact CD2-CB 4.39Å; L201-L215 HydrophobicContact CD2-CD1 4.24Å; L201-L215 HydrophobicContact CD2-CD2 3.66Å | ||
| 202 | N | 72.7 | Confident | 75.2 | Confident | 139 Ų | 139 | 61.9 Ų | 61.9 | 74% | 0.743 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -76.1 | -53.1 | -179.1 | -69.6 | -19.2 | 0 | 0 | 0 | 111.4 | P200 | P200-N202 PolarHBondContact O-N 2.87Š|
| 203 | S | 78.6 | Confident | 76.4 | Confident | 28 Ų | 28 | 56 Ų | 56 | 20% | 0.196 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -107.9 | -19.2 | -173.6 | 57.7 | 0 | 0 | 0 | 0 | 114.5 | Q263 D266 | S203-Q263 WeakPolarHBondContact O-CG 3.44Å; S203-D266 VanDerWaalsContact CB-OD2 3.27Å; S203-D266 WeakPolarHBondContact CB-OD2 3.34Å; S203-D266 WeakPolarHBondContact OG-CB 3.27Å; S203-D266 PolarHBondContact OG-OD2 2.56Å |
| 204 | L | 82.1 | Confident | 77.6 | Confident | 12 Ų | 12 | 53.9 Ų | 53.9 | 6% | 0.063 | 30% | 0.297 | C | S | . | . | trans | -81.2 | 134.7 | -178.5 | -63.2 | 174.4 | 0 | 0 | 0 | 111.4 | L201 F214 L215 L253 Q263 A267 I270 | L201-L204 HydrophobicContact CD2-CB 4.39Å; L204-F214 HydrophobicContact CD1-CD1 3.9Å; L204-F214 HydrophobicContact CD1-CE1 3.81Å; L204-L215 HydrophobicContact CD1-CD2 4.37Å; L204-L253 HydrophobicContact CD2-CD1 4.39Å; L204-Q263 HydrophobicContact CD2-CB 4.26Å; L204-A267 HydrophobicContact CD1-CB 4.45Å; L204-A267 HydrophobicContact CD2-CB 4.37Å; L204-I270 HydrophobicContact CD1-CD1 4.21Å | ||
| 205 | S | 81.1 | Confident | 78.2 | Confident | 43 Ų | 43 | 53.8 Ų | 53.8 | 30% | 0.301 | 30% | 0.296 | S | S | . | . | trans | -99.7 | 148 | -178.9 | 77.4 | 0 | 0 | 0 | 0 | 112.2 | N207 S208 D211 | S205-N207 VanDerWaalsContact C-N 3.29Å; S205-S208 WeakPolarHBondContact OG-CB 3.28Å; S205-S208 PolarHBondContact OG-N 3.34Å; S205-D211 WeakPolarHBondContact CA-OD2 3.44Å; S205-D211 WeakPolarHBondContact CB-OD2 3.24Å; S205-D211 PolarHBondContact N-OD2 2.79Å; S205-D211 WeakPolarHBondContact O-CB 3.47Å; S205-D211 PolarHBondContact OG-OD2 2.85Å | ||
| 206 | R | 78.6 | Confident | 78.8 | Confident | 140 Ų | 140 | 53.5 Ų | 53.5 | 53% | 0.528 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -85 | -4 | 175.7 | -61.8 | -179.2 | -176.4 | -176.9 | -1.1 | 113.6 | L212 | R206-L212 WeakPolarHBondContact O-CD1 3.41Å; R206-L212 WeakPolarHBondContact O-CD2 3.28Å; R206-L212 WeakPolarHBondContact O-CG 3.37Å |
| 207 | N | 78.9 | Confident | 79.6 | Confident | 158 Ų | 158 | 53.1 Ų | 53.1 | 85% | 0.845 | 29% | 0.292 | S | S | * | . | S | Bend | trans | -105.5 | -20.4 | -173.8 | -62.9 | -17.7 | 0 | 0 | 0 | 112.4 | S205 | S205-N207 VanDerWaalsContact C-N 3.29Š|
| 208 | S | 84.8 | Confident | 80.7 | Confident | 21 Ų | 21 | 47.3 Ų | 47.3 | 15% | 0.147 | 26% | 0.257 | C | S | . | . | trans | -77.9 | 134.1 | 175.9 | -179.2 | 0 | 0 | 0 | 0 | 110.2 | S205 A210 D211 L212 L256 Y257 | S205-S208 WeakPolarHBondContact OG-CB 3.28Å; S205-S208 PolarHBondContact OG-N 3.34Å; S208-A210 VanDerWaalsContact C-N 3.34Å; S208-A210 PolarHBondContact O-N 3.38Å; S208-D211 WeakPolarHBondContact CB-OD2 3.21Å; S208-D211 PolarHBondContact O-N 2.76Å; S208-L212 WeakPolarHBondContact O-CB 3.46Å; S208-L212 VanDerWaalsContact O-CG 3.3Å; S208-L212 WeakPolarHBondContact O-CG 3.35Å; S208-L212 PolarHBondContact O-N 2.88Å; S208-L256 WeakPolarHBondContact OG-CD2 3.35Å; S208-Y257 WeakPolarHBondContact CB-OH 3.28Å; S208-Y257 PolarHBondContact OG-OH 2.9Å; S208-Y257 VanDerWaalsContact OG-OH 3.11Å | ||
| 209 | E | 83.7 | Confident | 81.6 | Confident | 128 Ų | 128 | 43 Ų | 43 | 60% | 0.598 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -64.9 | -38.5 | 178.8 | -177.8 | 157.1 | -128.7 | 0 | 0 | 112.2 | R186 L212 L213 | R186-E209 IonicContact NH2-OE1 3.15Å; R186-E209 PolarHBondContact NH2-OE1 3.25Å; E209-L212 PolarHBondContact O-N 3.26Å; E209-L213 PolarHBondContact O-N 2.84Å |
| 210 | A | 85.2 | Confident | 82.1 | Confident | 5 Ų | 5 | 42.2 Ų | 42.2 | 4% | 0.041 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.5 | -43.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S208 L212 L213 F214 E252 L253 L256 | S208-A210 VanDerWaalsContact C-N 3.34Å; S208-A210 PolarHBondContact O-N 3.38Å; A210-L212 VanDerWaalsContact C-N 3.34Å; A210-L213 PolarHBondContact O-N 2.71Å; A210-F214 PolarHBondContact O-N 2.8Å; A210-F214 VanDerWaalsContact O-N 3.13Å; A210-E252 HydrophobicContact CB-CG 3.78Å; A210-L253 HydrophobicContact CB-CD2 3.99Å; A210-L256 HydrophobicContact CB-CB 4.44Å; A210-L256 HydrophobicContact CB-CD2 3.7Å |
| 211 | D | 87.2 | Confident | 83 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.5 | -41.2 | 176.1 | -66.5 | -16.3 | 0 | 0 | 0 | 110.8 | S205 S208 F214 L215 L253 Y257 | S205-D211 WeakPolarHBondContact CA-OD2 3.44Å; S205-D211 WeakPolarHBondContact CB-OD2 3.24Å; S205-D211 PolarHBondContact N-OD2 2.79Å; S205-D211 WeakPolarHBondContact O-CB 3.47Å; S205-D211 PolarHBondContact OG-OD2 2.85Å; S208-D211 WeakPolarHBondContact CB-OD2 3.21Å; S208-D211 PolarHBondContact O-N 2.76Å; D211-F214 PolarHBondContact O-N 2.83Å; D211-L215 WeakPolarHBondContact O-CB 3.14Å; D211-L215 WeakPolarHBondContact O-CD1 3.27Å; D211-L215 WeakPolarHBondContact O-CG 3.23Å; D211-L215 PolarHBondContact O-N 2.89Å; D211-L253 WeakPolarHBondContact OD1-CD2 3.29Å; D211-Y257 WeakPolarHBondContact OD1-CE2 3.39Å; D211-Y257 PolarHBondContact OD2-OH 2.89Å |
| 212 | L | 84.7 | Confident | 84.1 | Confident | 26 Ų | 26 | 41 Ų | 41 | 14% | 0.136 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.2 | -39.4 | 176.7 | -76.8 | 175.7 | 0 | 0 | 0 | 112.3 | L189 R206 S208 E209 A210 L215 S216 | L189-L212 HydrophobicContact CD1-CD2 4.2Å; R206-L212 WeakPolarHBondContact O-CD1 3.41Å; R206-L212 WeakPolarHBondContact O-CD2 3.28Å; R206-L212 WeakPolarHBondContact O-CG 3.37Å; S208-L212 WeakPolarHBondContact O-CB 3.46Å; S208-L212 VanDerWaalsContact O-CG 3.3Å; S208-L212 WeakPolarHBondContact O-CG 3.35Å; S208-L212 PolarHBondContact O-N 2.88Å; E209-L212 PolarHBondContact O-N 3.26Å; A210-L212 VanDerWaalsContact C-N 3.34Å; L212-L215 PolarHBondContact O-N 3.44Å; L212-S216 WeakPolarHBondContact O-CB 3.23Å; L212-S216 PolarHBondContact O-N 2.75Å; L212-S216 PolarHBondContact O-OG 3.2Å |
| 213 | L | 85 | Confident | 84.6 | Confident | 37 Ų | 37 | 35 Ų | 35 | 19% | 0.194 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.9 | -50.1 | 174.7 | 176.6 | 66.3 | 0 | 0 | 0 | 110.5 | L182 E209 A210 L215 S216 E217 E252 | L182-L213 HydrophobicContact CD2-CD1 3.86Å; E209-L213 PolarHBondContact O-N 2.84Å; A210-L213 PolarHBondContact O-N 2.71Å; L213-L215 PolarHBondContact O-N 2.83Å; L213-S216 WeakPolarHBondContact CA-OG 3.36Å; L213-S216 WeakPolarHBondContact O-CB 3.36Å; L213-S216 PolarHBondContact O-N 3.4Å; L213-S216 VanDerWaalsContact O-N 3.13Å; L213-S216 PolarHBondContact O-OG 3.44Å; L213-E217 PolarHBondContact O-N 3.03Å; L213-E252 HydrophobicContact CD2-CB 4.24Å |
| 214 | F | 88.6 | Confident | 85 | Confident | 1 Ų | 1 | 33.7 Ų | 33.7 | 0% | 0.004 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.5 | -46.6 | 176.6 | 172.8 | -102.7 | 0 | 0 | 0 | 112.2 | L204 A210 D211 S216 E217 V218 L250 L253 A267 I270 L271 | L204-F214 HydrophobicContact CD1-CD1 3.9Å; L204-F214 HydrophobicContact CD1-CE1 3.81Å; A210-F214 PolarHBondContact O-N 2.8Å; A210-F214 VanDerWaalsContact O-N 3.13Å; D211-F214 PolarHBondContact O-N 2.83Å; F214-S216 VanDerWaalsContact C-N 3.26Å; F214-S216 PolarHBondContact O-N 3.47Å; F214-E217 PolarHBondContact O-N 2.78Å; F214-V218 HydrophobicContact CE1-CG2 4.14Å; F214-V218 HydrophobicContact CE2-CG2 4.12Å; F214-V218 HydrophobicContact CZ-CG2 3.89Å; F214-V218 WeakPolarHBondContact O-CG2 3.31Å; F214-V218 PolarHBondContact O-N 2.79Å; F214-V218 VanDerWaalsContact O-N 3.13Å; F214-L250 HydrophobicContact CD2-CD2 3.98Å; F214-L250 HydrophobicContact CD2-CG 4.31Å; F214-L250 HydrophobicContact CE2-CD2 3.73Å; F214-L250 HydrophobicContact CE2-CG 4.13Å; F214-L253 HydrophobicContact CB-CD1 3.68Å; F214-L253 HydrophobicContact CB-CG 4.33Å; F214-L253 HydrophobicContact CD1-CD1 4.18Å; F214-L253 HydrophobicContact CD2-CD1 4.13Å; F214-L253 HydrophobicContact CG-CD1 3.72Å; F214-A267 HydrophobicContact CD1-CB 4.27Å; F214-A267 HydrophobicContact CE1-CB 3.86Å; F214-A267 HydrophobicContact CE2-CB 4.18Å; F214-A267 HydrophobicContact CZ-CB 3.81Å; F214-A267 VanDerWaalsContact CZ-O 3.3Å; F214-A267 WeakPolarHBondContact CZ-O 3.23Å; F214-I270 HydrophobicContact CE1-CG2 4.34Å; F214-I270 HydrophobicContact CZ-CG2 4.26Å; F214-L271 HydrophobicContact CE2-CB 4.04Å; F214-L271 HydrophobicContact CE2-CD1 4.31Å; F214-L271 HydrophobicContact CE2-CD2 4.47Å; F214-L271 HydrophobicContact CE2-CG 4.5Å; F214-L271 HydrophobicContact CZ-CB 4.14Å |
| 215 | L | 86.8 | Confident | 85.4 | Confident | 3 Ų | 3 | 33.5 Ų | 33.5 | 2% | 0.016 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65.1 | -32 | 178.3 | -67.1 | 166.7 | 0 | 0 | 0 | 112.2 | L196 L199 L201 L204 D211 L212 L213 Q219 | L196-L215 HydrophobicContact CD2-CB 4.36Å; L196-L215 HydrophobicContact CD2-CD1 3.78Å; L196-L215 HydrophobicContact CD2-CD2 4.07Å; L196-L215 HydrophobicContact CD2-CG 4.28Å; L199-L215 HydrophobicContact CD1-CD2 4.28Å; L201-L215 HydrophobicContact CD2-CD1 4.24Å; L201-L215 HydrophobicContact CD2-CD2 3.66Å; L204-L215 HydrophobicContact CD1-CD2 4.37Å; D211-L215 WeakPolarHBondContact O-CB 3.14Å; D211-L215 WeakPolarHBondContact O-CD1 3.27Å; D211-L215 WeakPolarHBondContact O-CG 3.23Å; D211-L215 PolarHBondContact O-N 2.89Å; L212-L215 PolarHBondContact O-N 3.44Å; L213-L215 PolarHBondContact O-N 2.83Å; L215-Q219 WeakPolarHBondContact O-CB 3.46Å; L215-Q219 PolarHBondContact O-N 3.15Å |
| 216 | S | 82.8 | Confident | 85.7 | Confident | 6 Ų | 6 | 32.6 Ų | 32.6 | 4% | 0.042 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.7 | -43.6 | 175.9 | 79.5 | 0 | 0 | 0 | 0 | 111.7 | L212 L213 F214 V218 Q219 V220 | L212-S216 WeakPolarHBondContact O-CB 3.23Å; L212-S216 PolarHBondContact O-N 2.75Å; L212-S216 PolarHBondContact O-OG 3.2Å; L213-S216 WeakPolarHBondContact CA-OG 3.36Å; L213-S216 WeakPolarHBondContact O-CB 3.36Å; L213-S216 PolarHBondContact O-N 3.4Å; L213-S216 VanDerWaalsContact O-N 3.13Å; L213-S216 PolarHBondContact O-OG 3.44Å; F214-S216 VanDerWaalsContact C-N 3.26Å; F214-S216 PolarHBondContact O-N 3.47Å; S216-V218 PolarHBondContact O-N 2.9Å; S216-Q219 WeakPolarHBondContact O-CB 3.42Å; S216-Q219 PolarHBondContact O-N 3.38Å; S216-V220 WeakPolarHBondContact O-CG2 3.47Å; S216-V220 PolarHBondContact O-N 2.7Å |
| 217 | E | 86.2 | Confident | 86 | Confident | 12 Ų | 12 | 26.7 Ų | 26.7 | 6% | 0.056 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.4 | -44.9 | 176.7 | -76.3 | 177.1 | 173.8 | 0 | 0 | 111.4 | L213 F214 Q219 V220 L221 L247 S248 G249 | L213-E217 PolarHBondContact O-N 3.03Å; F214-E217 PolarHBondContact O-N 2.78Å; E217-Q219 VanDerWaalsContact C-N 3.32Å; E217-Q219 PolarHBondContact O-N 3.49Å; E217-V220 PolarHBondContact O-N 3.47Å; E217-L221 PolarHBondContact O-N 2.84Å; E217-L221 VanDerWaalsContact O-N 3.16Å; E217-L247 HydrophobicContact CB-CD2 4.04Å; E217-L247 HydrophobicContact CG-CD2 4.2Å; E217-S248 PolarHBondContact OE1-N 3.01Å; E217-S248 PolarHBondContact OE1-OG 3.31Å; E217-S248 VanDerWaalsContact OE1-OG 3.04Å; E217-S248 PolarHBondContact OE2-N 3.5Å; E217-G249 VanDerWaalsContact CD-N 3.26Å; E217-G249 PolarHBondContact OE1-N 3.49Å; E217-G249 VanDerWaalsContact OE2-CA 3.32Å; E217-G249 WeakPolarHBondContact OE2-CA 3.46Å; E217-G249 PolarHBondContact OE2-N 2.89Å |
| 218 | V | 89.1 | Confident | 86.4 | Confident | 2 Ų | 2 | 19.2 Ų | 19.2 | 1% | 0.012 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64.2 | -38 | 176.8 | -179.2 | 0 | 0 | 0 | 0 | 111.5 | V195 L199 F214 S216 L221 H222 L271 V274 | V195-V218 HydrophobicContact CG1-CG1 3.92Å; L199-V218 HydrophobicContact CD1-CG1 4.12Å; F214-V218 HydrophobicContact CE1-CG2 4.14Å; F214-V218 HydrophobicContact CE2-CG2 4.12Å; F214-V218 HydrophobicContact CZ-CG2 3.89Å; F214-V218 WeakPolarHBondContact O-CG2 3.31Å; F214-V218 PolarHBondContact O-N 2.79Å; F214-V218 VanDerWaalsContact O-N 3.13Å; S216-V218 PolarHBondContact O-N 2.9Å; V218-L221 PolarHBondContact O-N 3.22Å; V218-H222 PolarHBondContact O-N 2.88Å; V218-L271 HydrophobicContact CG2-CD1 4.36Å; V218-V274 HydrophobicContact CG1-CB 4.37Å; V218-V274 HydrophobicContact CG1-CG1 4.01Å; V218-V274 HydrophobicContact CG1-CG2 3.88Å |
| 219 | Q | 86.2 | Confident | 86.6 | Confident | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -63.4 | -42 | 174.3 | 179.4 | 68.2 | 40.1 | 0 | 0 | 111.7 | R188 L189 V195 L215 S216 E217 L221 H222 D223 | R188-Q219 HydrophobicContact CG-CG 4.28Å; L189-Q219 HydrophobicContact CD2-CB 3.85Å; L189-Q219 HydrophobicContact CD2-CG 4.09Å; V195-Q219 VanDerWaalsContact CG2-OE1 3.26Å; L215-Q219 WeakPolarHBondContact O-CB 3.46Å; L215-Q219 PolarHBondContact O-N 3.15Å; S216-Q219 WeakPolarHBondContact O-CB 3.42Å; S216-Q219 PolarHBondContact O-N 3.38Å; E217-Q219 VanDerWaalsContact C-N 3.32Å; E217-Q219 PolarHBondContact O-N 3.49Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 3.09Å; Q219-H222 WeakPolarHBondContact O-CB 3.38Å; Q219-H222 PolarHBondContact O-N 3.47Å; Q219-H222 VanDerWaalsContact O-N 3.12Å; Q219-D223 VanDerWaalsContact NE2-CG 3.31Å; Q219-D223 PolarHBondContact NE2-OD1 3.07Å; Q219-D223 VanDerWaalsContact NE2-OD1 3.11Å; Q219-D223 PolarHBondContact NE2-OD2 3Å; Q219-D223 PolarHBondContact O-N 3.32Å |
| 220 | V | 85.4 | Confident | 86.8 | Confident | 9 Ų | 9 | 25.9 Ų | 25.9 | 6% | 0.055 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.6 | -43.4 | 178.2 | 169.4 | 0 | 0 | 0 | 0 | 111 | L158 I185 S216 E217 H222 D223 I224 | L158-V220 HydrophobicContact CD2-CG1 3.99Å; I185-V220 HydrophobicContact CD1-CG2 4.19Å; S216-V220 WeakPolarHBondContact O-CG2 3.47Å; S216-V220 PolarHBondContact O-N 2.7Å; E217-V220 PolarHBondContact O-N 3.47Å; V220-H222 VanDerWaalsContact C-N 3.28Å; V220-H222 PolarHBondContact O-N 2.81Å; V220-D223 PolarHBondContact O-N 2.82Å; V220-I224 HydrophobicContact CG1-CD1 3.7Å; V220-I224 HydrophobicContact CG1-CG1 4.27Å; V220-I224 WeakPolarHBondContact O-CB 3.44Å; V220-I224 VanDerWaalsContact O-CG1 3.24Å; V220-I224 WeakPolarHBondContact O-CG1 3.45Å; V220-I224 PolarHBondContact O-N 3.45Å |
| 221 | L | 89.2 | Confident | 86.7 | Confident | 2 Ų | 2 | 28.7 Ų | 28.7 | 1% | 0.01 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -56.9 | -43.5 | 174.3 | -64.7 | 178.5 | 0 | 0 | 0 | 111.8 | E217 V218 Q219 T225 L245 L247 V274 L275 F278 | E217-L221 PolarHBondContact O-N 2.84Å; E217-L221 VanDerWaalsContact O-N 3.16Å; V218-L221 PolarHBondContact O-N 3.22Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 3.09Å; L221-T225 PolarHBondContact O-N 3.34Å; L221-T225 PolarHBondContact O-OG1 2.84Å; L221-L245 HydrophobicContact CD2-CD1 3.64Å; L221-L247 HydrophobicContact CD1-CD1 4.1Å; L221-V274 HydrophobicContact CD1-CG1 4.17Å; L221-L275 HydrophobicContact CD1-CD2 3.79Å; L221-F278 HydrophobicContact CB-CD2 4.14Å; L221-F278 HydrophobicContact CB-CE2 4.43Å; L221-F278 HydrophobicContact CD2-CD2 4.45Å; L221-F278 HydrophobicContact CD2-CE1 4.28Å; L221-F278 HydrophobicContact CD2-CE2 4.24Å; L221-F278 HydrophobicContact CD2-CZ 4.15Å |
| 222 | H | 88.5 | Confident | 86.6 | Confident | 88 Ų | 88 | 36.2 Ų | 36.2 | 41% | 0.407 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -66.7 | -45 | 178.2 | -173.9 | 62.2 | 0 | 0 | 0 | 112.6 | V195 V218 Q219 V220 T225 A226 | V195-H222 HydrophobicContact CG2-CB 3.57Å; V218-H222 PolarHBondContact O-N 2.88Å; Q219-H222 WeakPolarHBondContact O-CB 3.38Å; Q219-H222 PolarHBondContact O-N 3.47Å; Q219-H222 VanDerWaalsContact O-N 3.12Å; V220-H222 VanDerWaalsContact C-N 3.28Å; V220-H222 PolarHBondContact O-N 2.81Å; H222-T225 PolarHBondContact O-N 2.85Å; H222-A226 WeakPolarHBondContact O-CB 3.32Å; H222-A226 PolarHBondContact O-N 2.94Å |
| 223 | D | 85 | Confident | 86.6 | Confident | 15 Ų | 15 | 40.8 Ų | 40.8 | 8% | 0.08 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.3 | -37.7 | -179.5 | -76.5 | -31.1 | 0 | 0 | 0 | 111.3 | L178 R188 Q219 V220 T225 A226 L227 | L178-D223 HydrophobicContact CD2-CB 3.84Å; R188-D223 IonicContact CZ-OD1 3.05Å; R188-D223 IonicContact NE-OD1 3.21Å; R188-D223 IonicContact NE-OD2 3.78Å; R188-D223 PolarHBondContact NE-OD2 2.62Å; R188-D223 IonicContact NH2-OD1 3.59Å; R188-D223 PolarHBondContact NH2-OD1 2.73Å; Q219-D223 VanDerWaalsContact NE2-CG 3.31Å; Q219-D223 PolarHBondContact NE2-OD1 3.07Å; Q219-D223 VanDerWaalsContact NE2-OD1 3.11Å; Q219-D223 PolarHBondContact NE2-OD2 3Å; Q219-D223 PolarHBondContact O-N 3.32Å; V220-D223 PolarHBondContact O-N 2.82Å; D223-T225 PolarHBondContact O-N 2.86Å; D223-A226 PolarHBondContact O-N 2.71Å; D223-L227 WeakPolarHBondContact O-CB 3.36Å; D223-L227 PolarHBondContact O-N 2.77Å |
| 224 | I | 86.9 | Confident | 86.4 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -57.5 | -50.6 | 172.6 | -71 | 164.2 | 0 | 0 | 0 | 110.2 | L156 L178 V220 A226 L227 L228 L245 F278 | L156-I224 HydrophobicContact CD2-CD1 3.66Å; L156-I224 HydrophobicContact CD2-CG1 3.95Å; L156-I224 HydrophobicContact CD2-CG2 4.34Å; L178-I224 HydrophobicContact CD1-CG1 3.97Å; V220-I224 HydrophobicContact CG1-CD1 3.7Å; V220-I224 HydrophobicContact CG1-CG1 4.27Å; V220-I224 WeakPolarHBondContact O-CB 3.44Å; V220-I224 VanDerWaalsContact O-CG1 3.24Å; V220-I224 WeakPolarHBondContact O-CG1 3.45Å; V220-I224 PolarHBondContact O-N 3.45Å; I224-A226 PolarHBondContact O-N 3.24Å; I224-L227 PolarHBondContact O-N 3.41Å; I224-L228 HydrophobicContact CG2-CD1 3.93Å; I224-L228 WeakPolarHBondContact O-CB 3.4Å; I224-L228 WeakPolarHBondContact O-CG 3.03Å; I224-L228 PolarHBondContact O-N 2.75Å; I224-L245 HydrophobicContact CD1-CD1 4.2Å; I224-L245 HydrophobicContact CD1-CD2 4.01Å; I224-F278 HydrophobicContact CG2-CE2 4.38Å |
| 225 | T | 89 | Confident | 86 | Confident | 7 Ų | 7 | 39.6 Ų | 39.6 | 4% | 0.043 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63 | -42.8 | 178.9 | -56.5 | 0 | 0 | 0 | 0 | 111.7 | L221 H222 D223 L227 L228 Q229 F278 D281 | L221-T225 PolarHBondContact O-N 3.34Å; L221-T225 PolarHBondContact O-OG1 2.84Å; H222-T225 PolarHBondContact O-N 2.85Å; D223-T225 PolarHBondContact O-N 2.86Å; T225-L227 PolarHBondContact O-N 2.79Å; T225-L228 PolarHBondContact O-N 2.88Å; T225-Q229 HydrophobicContact CG2-CG 4.5Å; T225-Q229 WeakPolarHBondContact O-CB 3.41Å; T225-Q229 VanDerWaalsContact O-CG 3.23Å; T225-Q229 WeakPolarHBondContact O-CG 3.46Å; T225-Q229 PolarHBondContact O-N 2.94Å; T225-F278 WeakPolarHBondContact OG1-CD2 3.5Å; T225-F278 WeakPolarHBondContact OG1-CE2 3.5Å; T225-D281 HydrophobicContact CG2-CB 3.69Å |
| 226 | A | 88.2 | Confident | 85.7 | Confident | 24 Ų | 24 | 47 Ų | 47 | 20% | 0.198 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -40.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | H222 D223 I224 Q229 R230 | H222-A226 WeakPolarHBondContact O-CB 3.32Å; H222-A226 PolarHBondContact O-N 2.94Å; D223-A226 PolarHBondContact O-N 2.71Å; I224-A226 PolarHBondContact O-N 3.24Å; A226-Q229 PolarHBondContact O-N 3.32Å; A226-R230 WeakPolarHBondContact O-CG 3.31Å; A226-R230 PolarHBondContact O-N 2.89Å; A226-R230 VanDerWaalsContact O-N 3.09Å |
| 227 | L | 85.6 | Confident | 85.5 | Confident | 17 Ų | 17 | 48.3 Ų | 48.3 | 9% | 0.089 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.5 | -46.9 | 177.2 | -177.9 | 166.4 | 0 | 0 | 0 | 111.1 | V174 F175 L178 D223 I224 T225 Q229 R230 H231 | V174-L227 HydrophobicContact CG1-CD2 3.65Å; V174-L227 HydrophobicContact CG1-CG 4.35Å; V174-L227 VanDerWaalsContact O-CD1 3.31Å; V174-L227 WeakPolarHBondContact O-CD1 3.25Å; F175-L227 HydrophobicContact CB-CD1 4.46Å; F175-L227 HydrophobicContact CD1-CD1 3.42Å; F175-L227 VanDerWaalsContact CD1-CD1 3.42Å; F175-L227 HydrophobicContact CD1-CD2 3.62Å; F175-L227 HydrophobicContact CD1-CG 4.13Å; F175-L227 HydrophobicContact CD2-CD2 4.41Å; F175-L227 HydrophobicContact CE1-CD1 3.88Å; F175-L227 HydrophobicContact CE1-CD2 3.23Å; F175-L227 HydrophobicContact CE1-CG 4.1Å; F175-L227 HydrophobicContact CE2-CD2 4.07Å; F175-L227 HydrophobicContact CG-CD1 4.05Å; F175-L227 HydrophobicContact CG-CD2 4.21Å; F175-L227 HydrophobicContact CZ-CD2 3.47Å; F175-L227 VanDerWaalsContact CZ-CD2 3.47Å; L178-L227 HydrophobicContact CD2-CD1 4.19Å; L178-L227 HydrophobicContact CG-CD1 4.05Å; D223-L227 WeakPolarHBondContact O-CB 3.36Å; D223-L227 PolarHBondContact O-N 2.77Å; I224-L227 PolarHBondContact O-N 3.41Å; T225-L227 PolarHBondContact O-N 2.79Å; L227-Q229 VanDerWaalsContact C-N 3.25Å; L227-Q229 PolarHBondContact O-N 2.78Å; L227-R230 WeakPolarHBondContact O-CB 3.45Å; L227-R230 PolarHBondContact O-N 2.84Å; L227-H231 PolarHBondContact O-CD2 3.35Å; L227-H231 PolarHBondContact O-N 2.72Å |
| 228 | L | 86.7 | Confident | 85.2 | Confident | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.6 | -35.8 | 175.9 | -73.2 | 173.5 | 0 | 0 | 0 | 112.1 | F175 I224 T225 R230 H231 R232 Y243 M282 L285 | F175-L228 HydrophobicContact CE1-CD2 4.38Å; F175-L228 HydrophobicContact CE1-CG 4.48Å; F175-L228 HydrophobicContact CZ-CD2 3.72Å; F175-L228 HydrophobicContact CZ-CG 4.29Å; I224-L228 HydrophobicContact CG2-CD1 3.93Å; I224-L228 WeakPolarHBondContact O-CB 3.4Å; I224-L228 WeakPolarHBondContact O-CG 3.03Å; I224-L228 PolarHBondContact O-N 2.75Å; T225-L228 PolarHBondContact O-N 2.88Å; L228-R230 VanDerWaalsContact C-N 3.32Å; L228-R230 PolarHBondContact O-N 2.89Å; L228-H231 CarbonylContact O-C 3.35Å; L228-H231 PolarHBondContact O-N 2.75Å; L228-R232 PolarHBondContact O-N 2.84Å; L228-Y243 HydrophobicContact CD1-CE1 4.11Å; L228-Y243 WeakPolarHBondContact CD2-OH 3.41Å; L228-M282 HydrophobicContact CD1-CE 3.69Å; L228-M282 HydrophobicContact CD1-SD 3.57Å; L228-M282 VanDerWaalsContact CD1-SD 3.57Å; L228-L285 HydrophobicContact CB-CD1 3.66Å; L228-L285 HydrophobicContact CB-CD2 4.07Å; L228-L285 HydrophobicContact CD1-CD2 4.47Å |
| 229 | Q | 88.2 | Confident | 85.1 | Confident | 87 Ų | 87 | 54 Ų | 54 | 41% | 0.407 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.4 | -32.3 | 174.5 | -76.4 | 177.9 | 6.9 | 0 | 0 | 113 | T225 A226 L227 R232 L285 | T225-Q229 HydrophobicContact CG2-CG 4.5Å; T225-Q229 WeakPolarHBondContact O-CB 3.41Å; T225-Q229 VanDerWaalsContact O-CG 3.23Å; T225-Q229 WeakPolarHBondContact O-CG 3.46Å; T225-Q229 PolarHBondContact O-N 2.94Å; A226-Q229 PolarHBondContact O-N 3.32Å; L227-Q229 VanDerWaalsContact C-N 3.25Å; L227-Q229 PolarHBondContact O-N 2.78Å; Q229-R232 WeakPolarHBondContact O-CG 3.36Å; Q229-L285 HydrophobicContact CG-CD1 3.88Å |
| 230 | R | 87.4 | Confident | 85.3 | Confident | 201 Ų | 201 | 54.5 Ų | 54.5 | 76% | 0.758 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -72.3 | -40.4 | 172.1 | -69 | 169.8 | -176.9 | -178.2 | 2.1 | 111 | A226 L227 L228 | A226-R230 WeakPolarHBondContact O-CG 3.31Å; A226-R230 PolarHBondContact O-N 2.89Å; A226-R230 VanDerWaalsContact O-N 3.09Å; L227-R230 WeakPolarHBondContact O-CB 3.45Å; L227-R230 PolarHBondContact O-N 2.84Å; L228-R230 VanDerWaalsContact C-N 3.32Å; L228-R230 PolarHBondContact O-N 2.89Å |
| 231 | H | 85.1 | Confident | 85.6 | Confident | 64 Ų | 64 | 54.1 Ų | 54.1 | 30% | 0.296 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -103.9 | 51.9 | -177.3 | -63.1 | -89.7 | 0 | 0 | 0 | 112.5 | V174 L227 L228 H233 L234 | V174-H231 HydrophobicContact CG1-CB 3.99Å; V174-H231 WeakPolarHBondContact CG1-CD2 3.44Å; L227-H231 PolarHBondContact O-CD2 3.35Å; L227-H231 PolarHBondContact O-N 2.72Å; L228-H231 CarbonylContact O-C 3.35Å; L228-H231 PolarHBondContact O-N 2.75Å; H231-H233 AromaticContact ND1-CE1 3.51Å; H231-H233 PolarHBondContact O-N 2.89Å; H231-L234 HydrophobicContact CB-CD1 3.8Å; H231-L234 HydrophobicContact CB-CG 4.17Å; H231-L234 WeakPolarHBondContact O-CB 3.43Å; H231-L234 PolarHBondContact O-N 3.39Å |
| 232 | R | 84.6 | Confident | 85.8 | Confident | 159 Ų | 159 | 54 Ų | 54 | 60% | 0.6 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58 | -16.4 | -177.7 | -62.1 | -161.1 | -178.7 | -159.2 | 0 | 115.4 | L228 Q229 L234 | L228-R232 PolarHBondContact O-N 2.84Å; Q229-R232 WeakPolarHBondContact O-CG 3.36Å; R232-L234 VanDerWaalsContact C-N 3.28Å |
| 233 | H | 83.2 | Confident | 86 | Confident | 122 Ų | 122 | 49.8 Ų | 49.8 | 57% | 0.565 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68 | -29.9 | 177.4 | 58.2 | -89.2 | 0 | 0 | 0 | 112 | H231 K236 | H231-H233 AromaticContact ND1-CE1 3.51Å; H231-H233 PolarHBondContact O-N 2.89Å; H233-K236 PolarHBondContact O-N 2.89Å |
| 234 | L | 81.9 | Confident | 86.3 | Confident | 8 Ų | 8 | 50 Ų | 50 | 4% | 0.042 | 22% | 0.224 | C | C | . | . | G | 310 helix | trans | -61.8 | -47.9 | 177.2 | -62.4 | 176.1 | 0 | 0 | 0 | 110.8 | V154 A171 V174 F175 H231 R232 K236 D237 | V154-L234 HydrophobicContact CG2-CB 4.14Å; V154-L234 HydrophobicContact CG2-CD1 4.34Å; V154-L234 HydrophobicContact CG2-CD2 4.49Å; A171-L234 HydrophobicContact CB-CD2 4.38Å; V174-L234 HydrophobicContact CB-CD1 4.34Å; V174-L234 HydrophobicContact CG1-CD1 4.07Å; V174-L234 HydrophobicContact CG2-CD1 4.3Å; F175-L234 HydrophobicContact CE2-CD1 3.99Å; F175-L234 HydrophobicContact CZ-CD1 4.42Å; H231-L234 HydrophobicContact CB-CD1 3.8Å; H231-L234 HydrophobicContact CB-CG 4.17Å; H231-L234 WeakPolarHBondContact O-CB 3.43Å; H231-L234 PolarHBondContact O-N 3.39Å; R232-L234 VanDerWaalsContact C-N 3.28Å; L234-K236 PolarHBondContact O-N 3.49Å; L234-K236 VanDerWaalsContact O-N 3.13Å; L234-D237 PolarHBondContact O-N 2.87Å |
| 235 | A | 81.1 | Confident | 86.5 | Confident | 4 Ų | 4 | 50 Ų | 50 | 3% | 0.033 | 22% | 0.224 | C | C | . | . | G | 310 helix | trans | -74.1 | -2.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | L285 Y286 | A235-L285 HydrophobicContact CB-CD2 3.24Å; A235-L285 HydrophobicContact CB-CG 4.21Å; A235-Y286 HydrophobicContact CB-CD1 3.89Å; A235-Y286 HydrophobicContact CB-CD2 4.4Å; A235-Y286 HydrophobicContact CB-CE1 3.52Å; A235-Y286 HydrophobicContact CB-CE2 4.05Å; A235-Y286 HydrophobicContact CB-CG 4.31Å |
| 236 | K | 79.9 | Confident | 86.6 | Confident | 158 Ų | 158 | 51.3 Ų | 51.3 | 69% | 0.687 | 23% | 0.229 | S | C | * | . | G | 310 helix | trans | -106 | -1.1 | 179.4 | -74.5 | -173.9 | 177.1 | -173.5 | 0 | 113.2 | H233 L234 | H233-K236 PolarHBondContact O-N 2.89Å; L234-K236 PolarHBondContact O-N 3.49Å; L234-K236 VanDerWaalsContact O-N 3.13Å |
| 237 | D | 78.6 | Confident | 86.7 | Confident | 34 Ų | 34 | 50.2 Ų | 50.2 | 18% | 0.182 | 22% | 0.22 | C | C | . | . | S | Bend | trans | -68.5 | 167.6 | 178.7 | -165.7 | 17.2 | 0 | 0 | 0 | 111.9 | Y151 T152 L234 S239 | Y151-D237 WeakPolarHBondContact CB-OD2 3.44Å; Y151-D237 WeakPolarHBondContact CD1-OD1 3.24Å; T152-D237 PolarHBondContact N-OD2 2.85Å; T152-D237 VanDerWaalsContact N-OD2 3.14Å; T152-D237 PolarHBondContact OG1-OD2 3.17Å; L234-D237 PolarHBondContact O-N 2.87Å; D237-S239 VanDerWaalsContact C-N 3.28Å; D237-S239 PolarHBondContact OD2-OG 3Å |
| 238 | F | 80.3 | Confident | 86.9 | Confident | 133 Ų | 133 | 50.4 Ų | 50.4 | 58% | 0.583 | 22% | 0.223 | S | C | * | . | S | Bend | trans | -81.4 | -7.7 | 176.1 | -68.2 | -80.8 | 0 | 0 | 0 | 113.2 | R105 Y151 | R105-F238 VanDerWaalsContact NH1-C 3.27Å; R105-F238 PolarHBondContact NH1-O 3.38Å; Y151-F238 HydrophobicContact CD1-CB 4.22Å; Y151-F238 HydrophobicContact CE1-CB 3.85Å; Y151-F238 HydrophobicContact CE1-CD2 4.14Å; Y151-F238 HydrophobicContact CE1-CG 4.41Å |
| 239 | S | 86.4 | Confident | 86.9 | Confident | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.014 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -80.7 | 146.1 | 174.8 | 50.9 | 0 | 0 | 0 | 0 | 111.7 | P153 D237 | P153-S239 WeakPolarHBondContact CA-OG 3.36Å; D237-S239 VanDerWaalsContact C-N 3.28Å; D237-S239 PolarHBondContact OD2-OG 3Å |
| 240 | P | 90.7 | Very high | 87.1 | Confident | 9 Ų | 9 | 46.3 Ų | 46.3 | 6% | 0.058 | 20% | 0.204 | C | C | . | . | P | Polyproline II helix | trans | -79.4 | 135.6 | 168.2 | 31 | -30.4 | 0 | 0 | 0 | 110.4 | F84 R105 V144 F148 | F84-P240 HydrophobicContact CZ-CG 4.12Å; R105-P240 CarbonylContact O-C 3.43Å; R105-P240 WeakPolarHBondContact O-CA 3.3Å; V144-P240 HydrophobicContact CG1-CG 4.37Å; V144-P240 VanDerWaalsContact CG1-O 3.32Å; V144-P240 WeakPolarHBondContact CG1-O 3.34Å; V144-P240 HydrophobicContact CG2-CG 4.35Å; F148-P240 VanDerWaalsContact CD2-CD 3.45Å; F148-P240 HydrophobicContact CD2-CG 3.75Å; F148-P240 VanDerWaalsContact CE2-CD 3.46Å; F148-P240 HydrophobicContact CE2-CG 3.49Å; F148-P240 VanDerWaalsContact CE2-CG 3.49Å; F148-P240 HydrophobicContact CG-CG 4.37Å; F148-P240 HydrophobicContact CZ-CG 3.92Å |
| 241 | D | 92.1 | Very high | 87.2 | Confident | 1 Ų | 1 | 39.3 Ų | 39.3 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 146.4 | 176.9 | -65.1 | -28.5 | 0 | 0 | 0 | 111.4 | R105 A106 N107 V154 Y243 Y286 | R105-D241 PolarHBondContact O-N 3.12Å; A106-D241 CarbonylContact C-O 3.58Å; A106-D241 VanDerWaalsContact CA-O 3.23Å; A106-D241 WeakPolarHBondContact CA-O 3.36Å; A106-D241 HydrophobicContact CB-CB 4.2Å; N107-D241 PolarHBondContact N-O 2.97Å; V154-D241 HydrophobicContact CB-CB 4.2Å; V154-D241 PolarHBondContact N-OD1 3.12Å; V154-D241 CarbonylContact O-C 3.19Å; V154-D241 WeakPolarHBondContact O-CA 3.3Å; D241-Y243 HydrophobicContact CB-CE2 3.74Å; D241-Y286 HydrophobicContact CB-CE1 4.25Å; D241-Y286 WeakPolarHBondContact OD2-CE1 3.23Å; D241-Y286 VanDerWaalsContact OD2-CZ 3.28Å; D241-Y286 PolarHBondContact OD2-OH 3.22Å |
| 242 | L | 92.6 | Very high | 87.4 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 123.3 | -177.8 | -177 | 63.5 | 0 | 0 | 0 | 110.5 | V78 M82 N107 L137 V140 A141 V154 V155 L156 | V78-L242 HydrophobicContact CG1-CD1 4.2Å; M82-L242 HydrophobicContact CE-CD1 4Å; M82-L242 HydrophobicContact SD-CD1 4.48Å; N107-L242 HydrophobicContact CB-CD1 4.29Å; L137-L242 HydrophobicContact CB-CD2 4.18Å; L137-L242 HydrophobicContact CD1-CD1 3.95Å; V140-L242 HydrophobicContact CB-CD2 4.16Å; V140-L242 HydrophobicContact CG1-CD2 4.02Å; A141-L242 HydrophobicContact CB-CD2 4.05Å; V154-L242 PolarHBondContact O-N 3.15Å; V155-L242 CarbonylContact C-O 3.51Å; V155-L242 VanDerWaalsContact CA-O 3.31Å; V155-L242 WeakPolarHBondContact CA-O 3.23Å; V155-L242 HydrophobicContact CG1-CB 4.29Å; V155-L242 HydrophobicContact CG1-CD2 4.23Å; V155-L242 HydrophobicContact CG2-CB 4.33Å; L156-L242 PolarHBondContact N-O 3.36Å |
| 243 | Y | 92.3 | Very high | 87.7 | Confident | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 15% | 0.149 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 117.3 | 175.7 | -58 | -90.7 | 0 | 0 | 0 | 109.2 | A106 N107 V108 L109 V154 L156 L228 D241 M282 Y286 | A106-Y243 HydrophobicContact CB-CE2 4.4Å; N107-Y243 PolarHBondContact O-N 3.32Å; V108-Y243 HydrophobicContact CG2-CD2 3.74Å; V108-Y243 HydrophobicContact CG2-CG 4.21Å; L109-Y243 PolarHBondContact N-O 3.48Å; V154-Y243 HydrophobicContact CG1-CE1 3.99Å; L156-Y243 HydrophobicContact CB-CD1 3.67Å; L156-Y243 HydrophobicContact CB-CE1 4.08Å; L156-Y243 HydrophobicContact CD2-CD1 3.82Å; L156-Y243 HydrophobicContact CD2-CE1 4.19Å; L156-Y243 HydrophobicContact CG-CD1 4.37Å; L156-Y243 CarbonylContact O-C 3.57Å; L156-Y243 WeakPolarHBondContact O-CA 3.28Å; L228-Y243 HydrophobicContact CD1-CE1 4.11Å; L228-Y243 WeakPolarHBondContact CD2-OH 3.41Å; D241-Y243 HydrophobicContact CB-CE2 3.74Å; Y243-M282 HydrophobicContact CD2-CE 3.85Å; Y243-M282 HydrophobicContact CE1-CE 4.42Å; Y243-M282 HydrophobicContact CE2-CE 3.67Å; Y243-M282 HydrophobicContact CG-CE 4.29Å; Y243-Y286 HydrophobicContact CE2-CE2 4.3Å; Y243-Y286 WeakPolarHBondContact CE2-OH 3.35Å; Y243-Y286 PolarHBondContact OH-OH 2.59Å |
| 244 | S | 92.4 | Very high | 88.1 | Confident | 19 Ų | 19 | 26.8 Ų | 26.8 | 13% | 0.133 | 13% | 0.132 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 105.2 | 176.1 | -169 | 0 | 0 | 0 | 0 | 108.6 | L109 L156 Q157 L158 | L109-S244 WeakPolarHBondContact O-CA 3.4Å; L156-S244 PolarHBondContact O-N 3.08Å; Q157-S244 CarbonylContact C-O 3.54Å; Q157-S244 VanDerWaalsContact CA-O 3.26Å; Q157-S244 WeakPolarHBondContact CA-O 3.28Å; L158-S244 PolarHBondContact N-O 3.15Å |
| 245 | L | 91.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 16% | 0.164 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 109.9 | -173.2 | -56.2 | 175.2 | 0 | 0 | 0 | 109.6 | L109 V110 V111 L156 L158 L221 I224 F278 | L109-L245 PolarHBondContact O-N 3.43Å; V110-L245 CarbonylContact C-O 3.5Å; V110-L245 VanDerWaalsContact CA-O 3.27Å; V110-L245 WeakPolarHBondContact CA-O 3.28Å; V110-L245 HydrophobicContact CG1-CB 4.41Å; V110-L245 HydrophobicContact CG2-CB 4.37Å; V110-L245 HydrophobicContact CG2-CD1 4.37Å; V111-L245 PolarHBondContact N-O 3.22Å; L156-L245 HydrophobicContact CD2-CD2 4.22Å; L158-L245 HydrophobicContact CB-CD2 3.72Å; L158-L245 HydrophobicContact CD2-CD2 4.42Å; L221-L245 HydrophobicContact CD2-CD1 3.64Å; I224-L245 HydrophobicContact CD1-CD1 4.2Å; I224-L245 HydrophobicContact CD1-CD2 4.01Å; L245-F278 HydrophobicContact CD1-CE1 4.17Å; L245-F278 HydrophobicContact CD1-CZ 3.85Å |
| 246 | E | 90.1 | Very high | 88.9 | Confident | 34 Ų | 34 | 39.8 Ų | 39.8 | 16% | 0.159 | 19% | 0.186 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 128.8 | 172 | -175.5 | -176.5 | 166.4 | 0 | 0 | 109.9 | V111 R113 L158 P160 | V111-E246 HydrophobicContact CB-CB 4.45Å; V111-E246 HydrophobicContact CB-CG 4.4Å; V111-E246 CarbonylContact O-C 3.3Å; V111-E246 WeakPolarHBondContact O-CA 3.37Å; R113-E246 WeakPolarHBondContact CD-OE1 3.5Å; R113-E246 IonicContact CZ-OE1 3.61Å; R113-E246 IonicContact NE-OE1 3.09Å; R113-E246 IonicContact NH1-OE1 3.1Å; R113-E246 PolarHBondContact NH1-OE1 3.3Å; L158-E246 WeakPolarHBondContact O-CB 3.22Å; L158-E246 PolarHBondContact O-N 3.44Å; P160-E246 WeakPolarHBondContact CD-O 3.43Å; P160-E246 WeakPolarHBondContact CG-O 3.33Å |
| 247 | L | 90.2 | Very high | 89.4 | Confident | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.01 | 17% | 0.167 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 121.2 | 179.9 | -52.3 | -175.5 | 0 | 0 | 0 | 108.8 | V110 V111 V112 R113 E217 L221 L271 L275 | V110-L247 HydrophobicContact CG1-CD1 3.73Å; V110-L247 HydrophobicContact CG1-CG 3.97Å; V111-L247 PolarHBondContact O-N 3.01Å; V112-L247 HydrophobicContact CG2-CD1 4.4Å; R113-L247 PolarHBondContact N-O 3.37Å; E217-L247 HydrophobicContact CB-CD2 4.04Å; E217-L247 HydrophobicContact CG-CD2 4.2Å; L221-L247 HydrophobicContact CD1-CD1 4.1Å; L247-L271 HydrophobicContact CD1-CD1 4.03Å; L247-L275 HydrophobicContact CD1-CD2 4.36Å |
| 248 | S | 89.1 | Confident | 89.9 | Confident | 21 Ų | 21 | 35.5 Ų | 35.5 | 15% | 0.147 | 17% | 0.171 | C | C | . | . | trans | -112.7 | -8.2 | -174.5 | 65.2 | 0 | 0 | 0 | 0 | 113.5 | P160 E217 L250 E251 E252 | P160-S248 VanDerWaalsContact CB-OG 3.25Å; P160-S248 WeakPolarHBondContact CB-OG 3.38Å; E217-S248 PolarHBondContact OE1-N 3.01Å; E217-S248 PolarHBondContact OE1-OG 3.31Å; E217-S248 VanDerWaalsContact OE1-OG 3.04Å; E217-S248 PolarHBondContact OE2-N 3.5Å; S248-L250 VanDerWaalsContact C-N 3.32Å; S248-L250 PolarHBondContact O-N 3.34Å; S248-E251 WeakPolarHBondContact O-CB 3.45Å; S248-E251 PolarHBondContact O-N 3.44Å; S248-E252 PolarHBondContact O-N 2.92Å | ||
| 249 | G | 88.3 | Confident | 90.2 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.1 | -36.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | E217 E251 E252 L253 | E217-G249 VanDerWaalsContact CD-N 3.26Å; E217-G249 PolarHBondContact OE1-N 3.49Å; E217-G249 VanDerWaalsContact OE2-CA 3.32Å; E217-G249 WeakPolarHBondContact OE2-CA 3.46Å; E217-G249 PolarHBondContact OE2-N 2.89Å; G249-E251 VanDerWaalsContact C-N 3.35Å; G249-E251 PolarHBondContact O-N 2.98Å; G249-E252 PolarHBondContact O-N 3.33Å; G249-L253 VanDerWaalsContact O-CG 3.28Å; G249-L253 WeakPolarHBondContact O-CG 3.2Å; G249-L253 PolarHBondContact O-N 3.49Å |
| 250 | L | 91.2 | Very high | 90.3 | Very high | 2 Ų | 2 | 39.8 Ų | 39.8 | 1% | 0.01 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.1 | -32.1 | 176.3 | -74.2 | -172.1 | 0 | 0 | 0 | 113 | V112 R113 V115 F214 S248 L253 S254 Y264 A267 L271 | V112-L250 HydrophobicContact CG1-CD1 3.87Å; R113-L250 WeakPolarHBondContact O-CB 3.42Å; V115-L250 HydrophobicContact CB-CD1 4.27Å; V115-L250 HydrophobicContact CG1-CD1 4.2Å; F214-L250 HydrophobicContact CD2-CD2 3.98Å; F214-L250 HydrophobicContact CD2-CG 4.31Å; F214-L250 HydrophobicContact CE2-CD2 3.73Å; F214-L250 HydrophobicContact CE2-CG 4.13Å; S248-L250 VanDerWaalsContact C-N 3.32Å; S248-L250 PolarHBondContact O-N 3.34Å; L250-L253 HydrophobicContact CD2-CD1 4.28Å; L250-S254 WeakPolarHBondContact O-CB 3.5Å; L250-S254 PolarHBondContact O-N 3.4Å; L250-Y264 HydrophobicContact CB-CE2 4.47Å; L250-A267 HydrophobicContact CD2-CB 3.66Å; L250-L271 HydrophobicContact CD1-CD2 3.41Å; L250-L271 VanDerWaalsContact CD1-CD2 3.41Å; L250-L271 HydrophobicContact CG-CD2 3.94Å |
| 251 | E | 91 | Very high | 90.3 | Very high | 54 Ų | 54 | 40 Ų | 40 | 25% | 0.252 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.3 | -46.1 | 174.7 | -172.3 | 177.1 | 174.2 | 0 | 0 | 110.5 | R113 S248 G249 S254 R255 | R113-E251 HydrophobicContact CB-CB 4.22Å; R113-E251 WeakPolarHBondContact CB-OE2 3.43Å; R113-E251 IonicContact CZ-OE2 3.77Å; R113-E251 IonicContact NE-OE2 2.89Å; R113-E251 PolarHBondContact NE-OE2 3.44Å; R113-E251 IonicContact NH2-OE1 3.81Å; R113-E251 PolarHBondContact NH2-OE1 3.37Å; R113-E251 IonicContact NH2-OE2 3.35Å; R113-E251 PolarHBondContact NH2-OE2 2.89Å; R113-E251 PolarHBondContact O-N 3.1Å; S248-E251 WeakPolarHBondContact O-CB 3.45Å; S248-E251 PolarHBondContact O-N 3.44Å; G249-E251 VanDerWaalsContact C-N 3.35Å; G249-E251 PolarHBondContact O-N 2.98Å; E251-S254 PolarHBondContact O-N 3.34Å; E251-R255 WeakPolarHBondContact O-CB 3.2Å; E251-R255 PolarHBondContact O-N 3.32Å |
| 252 | E | 88.2 | Confident | 90.3 | Very high | 55 Ų | 55 | 43.6 Ų | 43.6 | 26% | 0.257 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -67.9 | -37.9 | 179.1 | -168.5 | 56.7 | -150.3 | 0 | 0 | 112.1 | A210 L213 S248 G249 R255 L256 | A210-E252 HydrophobicContact CB-CG 3.78Å; L213-E252 HydrophobicContact CD2-CB 4.24Å; S248-E252 PolarHBondContact O-N 2.92Å; G249-E252 PolarHBondContact O-N 3.33Å; E252-R255 WeakPolarHBondContact O-CB 3.33Å; E252-R255 PolarHBondContact O-N 3.13Å; E252-R255 IonicContact OE1-CZ 3.39Å; E252-R255 VanDerWaalsContact OE1-CZ 3.26Å; E252-R255 IonicContact OE1-NE 2.89Å; E252-R255 PolarHBondContact OE1-NE 3.44Å; E252-R255 VanDerWaalsContact OE1-NE 3.09Å; E252-R255 IonicContact OE1-NH2 3.26Å; E252-R255 PolarHBondContact OE1-NH2 3.08Å; E252-R255 IonicContact OE2-CZ 2.69Å; E252-R255 VanDerWaalsContact OE2-CZ 3.3Å; E252-R255 IonicContact OE2-NE 3.26Å; E252-R255 PolarHBondContact OE2-NE 3.43Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.3Å; E252-R255 PolarHBondContact OE2-NH2 3.48Å; E252-L256 PolarHBondContact O-N 3.45Å |
| 253 | L | 90.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.3 | -42.5 | 172.5 | -71.9 | 178.1 | 0 | 0 | 0 | 112.3 | L204 A210 D211 F214 G249 L250 R255 L256 Y257 A267 | L204-L253 HydrophobicContact CD2-CD1 4.39Å; A210-L253 HydrophobicContact CB-CD2 3.99Å; D211-L253 WeakPolarHBondContact OD1-CD2 3.29Å; F214-L253 HydrophobicContact CB-CD1 3.68Å; F214-L253 HydrophobicContact CB-CG 4.33Å; F214-L253 HydrophobicContact CD1-CD1 4.18Å; F214-L253 HydrophobicContact CD2-CD1 4.13Å; F214-L253 HydrophobicContact CG-CD1 3.72Å; G249-L253 VanDerWaalsContact O-CG 3.28Å; G249-L253 WeakPolarHBondContact O-CG 3.2Å; G249-L253 PolarHBondContact O-N 3.49Å; L250-L253 HydrophobicContact CD2-CD1 4.28Å; L253-R255 PolarHBondContact O-N 3.08Å; L253-L256 PolarHBondContact O-N 2.71Å; L253-Y257 HydrophobicContact CD2-CD2 3.9Å; L253-Y257 HydrophobicContact CD2-CE2 3.73Å; L253-Y257 PolarHBondContact O-N 3.18Å; L253-A267 HydrophobicContact CD1-CB 3.67Å |
| 254 | S | 91.2 | Very high | 90.1 | Very high | 27 Ų | 27 | 46.5 Ų | 46.5 | 19% | 0.189 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.3 | -33.7 | 174.4 | -178 | 0 | 0 | 0 | 0 | 111.4 | L250 E251 G258 K259 | L250-S254 WeakPolarHBondContact O-CB 3.5Å; L250-S254 PolarHBondContact O-N 3.4Å; E251-S254 PolarHBondContact O-N 3.34Å; S254-G258 WeakPolarHBondContact O-CA 3.1Å; S254-G258 PolarHBondContact O-N 3.27Å; S254-G258 VanDerWaalsContact O-N 3.14Å; S254-K259 WeakPolarHBondContact OG-CG 3.4Å |
| 255 | R | 90.3 | Very high | 90 | Very high | 191 Ų | 191 | 53.9 Ų | 53.9 | 72% | 0.721 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -71.2 | -40.9 | 177.6 | -168.9 | 176.6 | 79.3 | 153.2 | 2.4 | 112.1 | E251 E252 L253 | E251-R255 WeakPolarHBondContact O-CB 3.2Å; E251-R255 PolarHBondContact O-N 3.32Å; E252-R255 WeakPolarHBondContact O-CB 3.33Å; E252-R255 PolarHBondContact O-N 3.13Å; E252-R255 IonicContact OE1-CZ 3.39Å; E252-R255 VanDerWaalsContact OE1-CZ 3.26Å; E252-R255 IonicContact OE1-NE 2.89Å; E252-R255 PolarHBondContact OE1-NE 3.44Å; E252-R255 VanDerWaalsContact OE1-NE 3.09Å; E252-R255 IonicContact OE1-NH2 3.26Å; E252-R255 PolarHBondContact OE1-NH2 3.08Å; E252-R255 IonicContact OE2-CZ 2.69Å; E252-R255 VanDerWaalsContact OE2-CZ 3.3Å; E252-R255 IonicContact OE2-NE 3.26Å; E252-R255 PolarHBondContact OE2-NE 3.43Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.3Å; E252-R255 PolarHBondContact OE2-NH2 3.48Å; L253-R255 PolarHBondContact O-N 3.08Å |
| 256 | L | 91.1 | Very high | 90 | Very high | 94 Ų | 94 | 56.5 Ų | 56.5 | 49% | 0.492 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -79.8 | -50.9 | -176.1 | -176.2 | 62.8 | 0 | 0 | 0 | 113.2 | S208 A210 E252 L253 | S208-L256 WeakPolarHBondContact OG-CD2 3.35Å; A210-L256 HydrophobicContact CB-CB 4.44Å; A210-L256 HydrophobicContact CB-CD2 3.7Å; E252-L256 PolarHBondContact O-N 3.45Å; L253-L256 PolarHBondContact O-N 2.71Å |
| 257 | Y | 89.4 | Confident | 90.1 | Very high | 76 Ų | 76 | 54.9 Ų | 54.9 | 30% | 0.298 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.8 | -21.7 | -173.1 | -59.8 | -71.7 | 0 | 0 | 0 | 113.4 | S208 D211 L253 S261 Q263 | S208-Y257 WeakPolarHBondContact CB-OH 3.28Å; S208-Y257 PolarHBondContact OG-OH 2.9Å; S208-Y257 VanDerWaalsContact OG-OH 3.11Å; D211-Y257 WeakPolarHBondContact OD1-CE2 3.39Å; D211-Y257 PolarHBondContact OD2-OH 2.89Å; L253-Y257 HydrophobicContact CD2-CD2 3.9Å; L253-Y257 HydrophobicContact CD2-CE2 3.73Å; L253-Y257 PolarHBondContact O-N 3.18Å; Y257-S261 VanDerWaalsContact CB-OG 3.28Å; Y257-S261 WeakPolarHBondContact CB-OG 3.45Å; Y257-S261 WeakPolarHBondContact O-CB 3.31Å; Y257-Q263 HydrophobicContact CD1-CG 4.27Å; Y257-Q263 HydrophobicContact CD2-CB 3.98Å; Y257-Q263 HydrophobicContact CD2-CG 4.27Å; Y257-Q263 HydrophobicContact CE1-CG 4.38Å; Y257-Q263 HydrophobicContact CE2-CB 4.43Å; Y257-Q263 HydrophobicContact CE2-CG 4.39Å; Y257-Q263 HydrophobicContact CG-CB 4.11Å; Y257-Q263 HydrophobicContact CG-CG 4.23Å |
| 258 | G | 89.2 | Confident | 90.2 | Very high | 26 Ų | 26 | 56 Ų | 56 | 27% | 0.268 | 27% | 0.273 | S | S | . | . | trans | 87.8 | 156.6 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S254 D260 S261 Y264 | S254-G258 WeakPolarHBondContact O-CA 3.1Å; S254-G258 PolarHBondContact O-N 3.27Å; S254-G258 VanDerWaalsContact O-N 3.14Å; G258-D260 VanDerWaalsContact C-N 3.29Å; G258-D260 PolarHBondContact O-N 3.43Å; G258-S261 WeakPolarHBondContact O-CB 3.46Å; G258-S261 PolarHBondContact O-N 3.4Å; G258-S261 PolarHBondContact O-OG 2.86Å; G258-Y264 WeakPolarHBondContact O-CB 3.04Å | ||
| 259 | K | 87 | Confident | 90.3 | Very high | 67 Ų | 67 | 58.1 Ų | 58.1 | 29% | 0.291 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | -29.1 | -176 | -68.6 | -168 | 168.9 | -154.4 | 0 | 114.4 | D116 S254 S261 Y264 | D116-K259 IonicContact OD1-NZ 2.88Å; D116-K259 PolarHBondContact OD1-NZ 3.01Å; D116-K259 IonicContact OD2-NZ 3.19Å; D116-K259 PolarHBondContact OD2-NZ 3.46Å; S254-K259 WeakPolarHBondContact OG-CG 3.4Å; K259-S261 VanDerWaalsContact C-N 3.32Å; K259-Y264 HydrophobicContact CB-CD1 4.5Å; K259-Y264 HydrophobicContact CB-CE1 4.38Å; K259-Y264 HydrophobicContact CG-CE1 4.48Å; K259-Y264 WeakPolarHBondContact O-CD1 3.26Å |
| 260 | D | 88.4 | Confident | 90.4 | Very high | 157 Ų | 157 | 58.6 Ų | 58.6 | 84% | 0.84 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88 | -2 | -178.2 | -62 | -46.5 | 0 | 0 | 0 | 113.4 | G258 | G258-D260 VanDerWaalsContact C-N 3.29Å; G258-D260 PolarHBondContact O-N 3.43Å |
| 261 | S | 90.9 | Very high | 90.5 | Very high | 13 Ų | 13 | 58.7 Ų | 58.7 | 9% | 0.091 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -69.2 | 147.9 | -177.7 | 66.9 | 0 | 0 | 0 | 0 | 112.4 | Y257 G258 K259 Q263 Y264 R265 | Y257-S261 VanDerWaalsContact CB-OG 3.28Å; Y257-S261 WeakPolarHBondContact CB-OG 3.45Å; Y257-S261 WeakPolarHBondContact O-CB 3.31Å; G258-S261 WeakPolarHBondContact O-CB 3.46Å; G258-S261 PolarHBondContact O-N 3.4Å; G258-S261 PolarHBondContact O-OG 2.86Å; K259-S261 VanDerWaalsContact C-N 3.32Å; S261-Q263 PolarHBondContact O-N 2.84Å; S261-Y264 PolarHBondContact O-N 3.42Å; S261-Y264 VanDerWaalsContact OG-CB 3.22Å; S261-Y264 WeakPolarHBondContact OG-CB 3.25Å; S261-Y264 PolarHBondContact OG-N 3.46Å; S261-Y264 VanDerWaalsContact OG-N 3.16Å; S261-R265 WeakPolarHBondContact O-CG 3.33Å; S261-R265 PolarHBondContact O-N 2.84Å; S261-R265 VanDerWaalsContact O-N 3.13Å |
| 262 | P | 90.7 | Very high | 90.6 | Very high | 78 Ų | 78 | 56.5 Ų | 56.5 | 51% | 0.506 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62 | -32.7 | 174.3 | 24.5 | -31.4 | 0 | 0 | 0 | 111.7 | R265 D266 | P262-R265 PolarHBondContact O-N 2.71Å; P262-D266 VanDerWaalsContact O-CB 3.32Å; P262-D266 WeakPolarHBondContact O-CB 3.32Å; P262-D266 VanDerWaalsContact O-CG 3.24Å; P262-D266 PolarHBondContact O-N 3.3Å |
| 263 | Q | 90.1 | Very high | 90.8 | Very high | 45 Ų | 45 | 56.9 Ų | 56.9 | 21% | 0.21 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.3 | -50.4 | 175.5 | -68.1 | 79.1 | 5.4 | 0 | 0 | 111.7 | S203 L204 Y257 S261 D266 A267 | S203-Q263 WeakPolarHBondContact O-CG 3.44Å; L204-Q263 HydrophobicContact CD2-CB 4.26Å; Y257-Q263 HydrophobicContact CD1-CG 4.27Å; Y257-Q263 HydrophobicContact CD2-CB 3.98Å; Y257-Q263 HydrophobicContact CD2-CG 4.27Å; Y257-Q263 HydrophobicContact CE1-CG 4.38Å; Y257-Q263 HydrophobicContact CE2-CB 4.43Å; Y257-Q263 HydrophobicContact CE2-CG 4.39Å; Y257-Q263 HydrophobicContact CG-CB 4.11Å; Y257-Q263 HydrophobicContact CG-CG 4.23Å; S261-Q263 PolarHBondContact O-N 2.84Å; Q263-D266 PolarHBondContact O-N 2.84Å; Q263-A267 VanDerWaalsContact O-CB 3.23Å; Q263-A267 WeakPolarHBondContact O-CB 3.3Å; Q263-A267 PolarHBondContact O-N 2.77Å |
| 264 | Y | 91.3 | Very high | 90.9 | Very high | 16 Ų | 16 | 58.1 Ų | 58.1 | 6% | 0.063 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.6 | -40.8 | -179.5 | -179.6 | -95 | 0 | 0 | 0 | 111.7 | G114 L250 G258 K259 S261 A267 T268 | G114-Y264 PolarHBondContact O-OH 3.32Å; L250-Y264 HydrophobicContact CB-CE2 4.47Å; G258-Y264 WeakPolarHBondContact O-CB 3.04Å; K259-Y264 HydrophobicContact CB-CD1 4.5Å; K259-Y264 HydrophobicContact CB-CE1 4.38Å; K259-Y264 HydrophobicContact CG-CE1 4.48Å; K259-Y264 WeakPolarHBondContact O-CD1 3.26Å; S261-Y264 PolarHBondContact O-N 3.42Å; S261-Y264 VanDerWaalsContact OG-CB 3.22Å; S261-Y264 WeakPolarHBondContact OG-CB 3.25Å; S261-Y264 PolarHBondContact OG-N 3.46Å; S261-Y264 VanDerWaalsContact OG-N 3.16Å; Y264-A267 PolarHBondContact O-N 2.9Å; Y264-T268 WeakPolarHBondContact O-CB 2.96Å; Y264-T268 PolarHBondContact O-N 3.2Å; Y264-T268 PolarHBondContact O-OG1 3.13Å |
| 265 | R | 91.1 | Very high | 91 | Very high | 173 Ų | 173 | 56.9 Ų | 56.9 | 65% | 0.653 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -65.1 | -44.4 | 178 | -69.5 | -177.7 | 66.7 | 175.4 | 1.3 | 112.4 | S261 P262 T268 A269 | S261-R265 WeakPolarHBondContact O-CG 3.33Å; S261-R265 PolarHBondContact O-N 2.84Å; S261-R265 VanDerWaalsContact O-N 3.13Å; P262-R265 PolarHBondContact O-N 2.71Å; R265-T268 PolarHBondContact O-N 3.16Å; R265-A269 PolarHBondContact O-N 3.22Å; R265-A269 VanDerWaalsContact O-N 3.08Å |
| 266 | D | 90.6 | Very high | 91.2 | Very high | 56 Ų | 56 | 48.3 Ų | 48.3 | 30% | 0.299 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.4 | -44.1 | 176.6 | -72.8 | -7.5 | 0 | 0 | 0 | 110.8 | S203 P262 Q263 T268 A269 I270 | S203-D266 VanDerWaalsContact CB-OD2 3.27Å; S203-D266 WeakPolarHBondContact CB-OD2 3.34Å; S203-D266 WeakPolarHBondContact OG-CB 3.27Å; S203-D266 PolarHBondContact OG-OD2 2.56Å; P262-D266 VanDerWaalsContact O-CB 3.32Å; P262-D266 WeakPolarHBondContact O-CB 3.32Å; P262-D266 VanDerWaalsContact O-CG 3.24Å; P262-D266 PolarHBondContact O-N 3.3Å; Q263-D266 PolarHBondContact O-N 2.84Å; D266-T268 VanDerWaalsContact C-N 3.34Å; D266-T268 PolarHBondContact O-N 2.96Å; D266-A269 PolarHBondContact O-N 2.93Å; D266-I270 WeakPolarHBondContact O-CB 3.41Å; D266-I270 VanDerWaalsContact O-CG1 3.26Å; D266-I270 WeakPolarHBondContact O-CG1 3.39Å; D266-I270 PolarHBondContact O-N 3.21Å |
| 267 | A | 91.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.2 | -42.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L204 F214 L250 L253 Q263 Y264 I270 L271 | L204-A267 HydrophobicContact CD1-CB 4.45Å; L204-A267 HydrophobicContact CD2-CB 4.37Å; F214-A267 HydrophobicContact CD1-CB 4.27Å; F214-A267 HydrophobicContact CE1-CB 3.86Å; F214-A267 HydrophobicContact CE2-CB 4.18Å; F214-A267 HydrophobicContact CZ-CB 3.81Å; F214-A267 VanDerWaalsContact CZ-O 3.3Å; F214-A267 WeakPolarHBondContact CZ-O 3.23Å; L250-A267 HydrophobicContact CD2-CB 3.66Å; L253-A267 HydrophobicContact CD1-CB 3.67Å; Q263-A267 VanDerWaalsContact O-CB 3.23Å; Q263-A267 WeakPolarHBondContact O-CB 3.3Å; Q263-A267 PolarHBondContact O-N 2.77Å; Y264-A267 PolarHBondContact O-N 2.9Å; A267-I270 PolarHBondContact O-N 3.34Å; A267-L271 WeakPolarHBondContact O-CB 3.26Å; A267-L271 PolarHBondContact O-N 3.14Å |
| 268 | T | 92.4 | Very high | 91.6 | Very high | 25 Ų | 25 | 46.6 Ų | 46.6 | 15% | 0.153 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.2 | -44.8 | 176.8 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | V115 L118 Y264 R265 D266 L271 A272 | V115-T268 HydrophobicContact CG2-CG2 4.34Å; L118-T268 HydrophobicContact CD2-CG2 3.47Å; L118-T268 VanDerWaalsContact CD2-CG2 3.47Å; Y264-T268 WeakPolarHBondContact O-CB 2.96Å; Y264-T268 PolarHBondContact O-N 3.2Å; Y264-T268 PolarHBondContact O-OG1 3.13Å; R265-T268 PolarHBondContact O-N 3.16Å; D266-T268 VanDerWaalsContact C-N 3.34Å; D266-T268 PolarHBondContact O-N 2.96Å; T268-L271 PolarHBondContact O-N 3.34Å; T268-A272 WeakPolarHBondContact O-CB 3.46Å; T268-A272 PolarHBondContact O-N 3.38Å |
| 269 | A | 91.3 | Very high | 91.8 | Very high | 66 Ų | 66 | 45.4 Ų | 45.4 | 55% | 0.545 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.3 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | R265 D266 S273 | R265-A269 PolarHBondContact O-N 3.22Å; R265-A269 VanDerWaalsContact O-N 3.08Å; D266-A269 PolarHBondContact O-N 2.93Å; A269-S273 PolarHBondContact O-N 2.98Å; A269-S273 VanDerWaalsContact O-N 3.12Å |
| 270 | I | 91 | Very high | 92.2 | Very high | 9 Ų | 9 | 44.4 Ų | 44.4 | 5% | 0.046 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.2 | -50.3 | 174.9 | -73.3 | 167 | 0 | 0 | 0 | 109.9 | L199 L204 F214 D266 A267 A272 S273 V274 | L199-I270 HydrophobicContact CD1-CG2 3.91Å; L199-I270 HydrophobicContact CD2-CG2 3.71Å; L199-I270 HydrophobicContact CG-CG2 4.42Å; L204-I270 HydrophobicContact CD1-CD1 4.21Å; F214-I270 HydrophobicContact CE1-CG2 4.34Å; F214-I270 HydrophobicContact CZ-CG2 4.26Å; D266-I270 WeakPolarHBondContact O-CB 3.41Å; D266-I270 VanDerWaalsContact O-CG1 3.26Å; D266-I270 WeakPolarHBondContact O-CG1 3.39Å; D266-I270 PolarHBondContact O-N 3.21Å; A267-I270 PolarHBondContact O-N 3.34Å; I270-A272 PolarHBondContact O-N 2.89Å; I270-S273 PolarHBondContact O-N 3.39Å; I270-S273 VanDerWaalsContact O-N 3.15Å; I270-S273 PolarHBondContact O-OG 3.49Å; I270-V274 HydrophobicContact CG2-CG2 4.28Å; I270-V274 WeakPolarHBondContact O-CG2 3.49Å; I270-V274 PolarHBondContact O-N 3.05Å |
| 271 | L | 92.5 | Very high | 92.4 | Very high | 4 Ų | 4 | 38.6 Ų | 38.6 | 2% | 0.021 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.7 | -44 | -177.9 | -173.2 | 65.1 | 0 | 0 | 0 | 111.6 | V112 L118 F214 V218 L247 L250 A267 T268 S273 V274 L275 | V112-L271 HydrophobicContact CG1-CD2 3.54Å; V112-L271 HydrophobicContact CG2-CD2 4.16Å; L118-L271 HydrophobicContact CD1-CD2 4.29Å; F214-L271 HydrophobicContact CE2-CB 4.04Å; F214-L271 HydrophobicContact CE2-CD1 4.31Å; F214-L271 HydrophobicContact CE2-CD2 4.47Å; F214-L271 HydrophobicContact CE2-CG 4.5Å; F214-L271 HydrophobicContact CZ-CB 4.14Å; V218-L271 HydrophobicContact CG2-CD1 4.36Å; L247-L271 HydrophobicContact CD1-CD1 4.03Å; L250-L271 HydrophobicContact CD1-CD2 3.41Å; L250-L271 VanDerWaalsContact CD1-CD2 3.41Å; L250-L271 HydrophobicContact CG-CD2 3.94Å; A267-L271 WeakPolarHBondContact O-CB 3.26Å; A267-L271 PolarHBondContact O-N 3.14Å; T268-L271 PolarHBondContact O-N 3.34Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 3.27Å; L271-V274 PolarHBondContact O-N 3.27Å; L271-L275 HydrophobicContact CD1-CD1 4.15Å; L271-L275 HydrophobicContact CD1-CD2 4.49Å; L271-L275 HydrophobicContact CD1-CG 4.02Å; L271-L275 HydrophobicContact CD2-CD1 4.25Å; L271-L275 HydrophobicContact CG-CD1 3.78Å; L271-L275 HydrophobicContact CG-CG 4.09Å; L271-L275 WeakPolarHBondContact O-CB 3.19Å; L271-L275 VanDerWaalsContact O-CG 3.3Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.29Å |
| 272 | A | 93.3 | Very high | 92.5 | Very high | 8 Ų | 8 | 38 Ų | 38 | 7% | 0.066 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.7 | -43.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | F120 T268 I270 Q276 | F120-A272 HydrophobicContact CD1-CB 4.38Å; F120-A272 HydrophobicContact CE1-CB 4.39Å; T268-A272 WeakPolarHBondContact O-CB 3.46Å; T268-A272 PolarHBondContact O-N 3.38Å; I270-A272 PolarHBondContact O-N 2.89Å; A272-Q276 WeakPolarHBondContact O-CB 3.35Å; A272-Q276 PolarHBondContact O-N 2.92Å; A272-Q276 VanDerWaalsContact O-N 3.08Å |
| 273 | S | 92.1 | Very high | 92.7 | Very high | 64 Ų | 64 | 36 Ų | 36 | 45% | 0.448 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -67.6 | -38.4 | 177.7 | 75.9 | 0 | 0 | 0 | 0 | 113.1 | A269 I270 L271 K277 | A269-S273 PolarHBondContact O-N 2.98Å; A269-S273 VanDerWaalsContact O-N 3.12Å; I270-S273 PolarHBondContact O-N 3.39Å; I270-S273 VanDerWaalsContact O-N 3.15Å; I270-S273 PolarHBondContact O-OG 3.49Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 3.27Å; S273-K277 PolarHBondContact O-N 2.86Å; S273-K277 VanDerWaalsContact O-N 3.15Å |
| 274 | V | 92.8 | Very high | 92.9 | Very high | 25 Ų | 25 | 41.3 Ų | 41.3 | 15% | 0.152 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -71.3 | -44.9 | 179 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | L199 V218 L221 I270 L271 Q276 K277 F278 | L199-V274 HydrophobicContact CD2-CG2 4.2Å; V218-V274 HydrophobicContact CG1-CB 4.37Å; V218-V274 HydrophobicContact CG1-CG1 4.01Å; V218-V274 HydrophobicContact CG1-CG2 3.88Å; L221-V274 HydrophobicContact CD1-CG1 4.17Å; I270-V274 HydrophobicContact CG2-CG2 4.28Å; I270-V274 WeakPolarHBondContact O-CG2 3.49Å; I270-V274 PolarHBondContact O-N 3.05Å; L271-V274 PolarHBondContact O-N 3.27Å; V274-Q276 VanDerWaalsContact C-N 3.31Å; V274-Q276 PolarHBondContact O-N 2.76Å; V274-K277 PolarHBondContact O-N 2.79Å; V274-F278 VanDerWaalsContact O-CB 3.23Å; V274-F278 WeakPolarHBondContact O-CB 3.24Å; V274-F278 PolarHBondContact O-N 2.83Å |
| 275 | L | 94.6 | Very high | 92.9 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.1 | -38.7 | 178.3 | -72 | 177.1 | 0 | 0 | 0 | 111.9 | V110 V112 L118 F120 L221 L247 L271 F278 G279 V294 | V110-L275 HydrophobicContact CB-CD2 4.4Å; V110-L275 HydrophobicContact CG1-CD2 3.86Å; V110-L275 HydrophobicContact CG2-CD2 4.35Å; V112-L275 HydrophobicContact CG2-CD1 3.87Å; L118-L275 HydrophobicContact CD1-CD1 3.93Å; F120-L275 HydrophobicContact CE1-CB 3.93Å; F120-L275 HydrophobicContact CE1-CD1 4.17Å; F120-L275 HydrophobicContact CZ-CD1 4.21Å; L221-L275 HydrophobicContact CD1-CD2 3.79Å; L247-L275 HydrophobicContact CD1-CD2 4.36Å; L271-L275 HydrophobicContact CD1-CD1 4.15Å; L271-L275 HydrophobicContact CD1-CD2 4.49Å; L271-L275 HydrophobicContact CD1-CG 4.02Å; L271-L275 HydrophobicContact CD2-CD1 4.25Å; L271-L275 HydrophobicContact CG-CD1 3.78Å; L271-L275 HydrophobicContact CG-CG 4.09Å; L271-L275 WeakPolarHBondContact O-CB 3.19Å; L271-L275 VanDerWaalsContact O-CG 3.3Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.29Å; L275-F278 PolarHBondContact O-N 2.97Å; L275-G279 PolarHBondContact O-N 3.41Å; L275-V294 HydrophobicContact CD1-CG1 4.25Å |
| 276 | Q | 94 | Very high | 93 | Very high | 12 Ų | 12 | 34 Ų | 34 | 6% | 0.056 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.4 | -51.7 | 172.7 | -178 | 64.7 | 42.3 | 0 | 0 | 111 | Q122 A272 V274 G279 E280 | Q122-Q276 PolarHBondContact O-OE1 2.82Å; Q122-Q276 VanDerWaalsContact O-OE1 3.09Å; A272-Q276 WeakPolarHBondContact O-CB 3.35Å; A272-Q276 PolarHBondContact O-N 2.92Å; A272-Q276 VanDerWaalsContact O-N 3.08Å; V274-Q276 VanDerWaalsContact C-N 3.31Å; V274-Q276 PolarHBondContact O-N 2.76Å; Q276-G279 PolarHBondContact O-N 2.85Å; Q276-E280 PolarHBondContact NE2-OE1 3.28Å; Q276-E280 WeakPolarHBondContact O-CG 3.44Å; Q276-E280 PolarHBondContact O-N 2.98Å |
| 277 | K | 93.6 | Very high | 93 | Very high | 128 Ų | 128 | 33.6 Ų | 33.6 | 56% | 0.557 | 19% | 0.185 | S | C | * | . | H | α-helix | trans | -63.3 | -43.4 | 179.4 | -176 | 178.4 | 177.4 | -176.9 | 0 | 112.1 | S273 V274 G279 E280 D281 | S273-K277 PolarHBondContact O-N 2.86Å; S273-K277 VanDerWaalsContact O-N 3.15Å; V274-K277 PolarHBondContact O-N 2.79Å; K277-G279 VanDerWaalsContact C-N 3.34Å; K277-G279 PolarHBondContact O-N 2.87Å; K277-E280 PolarHBondContact O-N 3.1Å; K277-D281 WeakPolarHBondContact O-CB 3.36Å; K277-D281 PolarHBondContact O-N 3.14Å |
| 278 | F | 94.4 | Very high | 93 | Very high | 6 Ų | 6 | 37.7 Ų | 37.7 | 3% | 0.026 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.9 | -46.1 | 176.4 | 174.9 | -102.9 | 0 | 0 | 0 | 111.1 | V108 V110 L221 I224 T225 L245 V274 L275 E280 D281 M282 | V108-F278 HydrophobicContact CG1-CE1 3.64Å; V108-F278 HydrophobicContact CG1-CZ 4.21Å; V110-F278 HydrophobicContact CG2-CE1 4.21Å; L221-F278 HydrophobicContact CB-CD2 4.14Å; L221-F278 HydrophobicContact CB-CE2 4.43Å; L221-F278 HydrophobicContact CD2-CD2 4.45Å; L221-F278 HydrophobicContact CD2-CE1 4.28Å; L221-F278 HydrophobicContact CD2-CE2 4.24Å; L221-F278 HydrophobicContact CD2-CZ 4.15Å; I224-F278 HydrophobicContact CG2-CE2 4.38Å; T225-F278 WeakPolarHBondContact OG1-CD2 3.5Å; T225-F278 WeakPolarHBondContact OG1-CE2 3.5Å; L245-F278 HydrophobicContact CD1-CE1 4.17Å; L245-F278 HydrophobicContact CD1-CZ 3.85Å; V274-F278 VanDerWaalsContact O-CB 3.23Å; V274-F278 WeakPolarHBondContact O-CB 3.24Å; V274-F278 PolarHBondContact O-N 2.83Å; L275-F278 PolarHBondContact O-N 2.97Å; F278-E280 PolarHBondContact O-N 3.09Å; F278-D281 PolarHBondContact O-N 2.83Å; F278-M282 HydrophobicContact CD1-CG 4.46Å; F278-M282 HydrophobicContact CD2-CG 4.34Å; F278-M282 HydrophobicContact CE1-CG 4.14Å; F278-M282 HydrophobicContact CE2-CG 3.99Å; F278-M282 HydrophobicContact CE2-SD 4.36Å; F278-M282 HydrophobicContact CZ-CG 3.88Å; F278-M282 HydrophobicContact CZ-SD 4.4Å; F278-M282 WeakPolarHBondContact O-CB 3.47Å; F278-M282 VanDerWaalsContact O-CG 3.28Å; F278-M282 WeakPolarHBondContact O-CG 3.49Å; F278-M282 PolarHBondContact O-N 3.3Å |
| 279 | G | 93.9 | Very high | 93 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L275 Q276 K277 Y283 | L275-G279 PolarHBondContact O-N 3.41Å; Q276-G279 PolarHBondContact O-N 2.85Å; K277-G279 VanDerWaalsContact C-N 3.34Å; K277-G279 PolarHBondContact O-N 2.87Å; G279-Y283 WeakPolarHBondContact O-CB 3.41Å; G279-Y283 PolarHBondContact O-N 2.77Å |
| 280 | E | 94.6 | Very high | 93.1 | Very high | 47 Ų | 47 | 37.8 Ų | 37.8 | 22% | 0.22 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.4 | -43 | 175 | -73.9 | 175 | -152.2 | 0 | 0 | 112.8 | Q276 K277 F278 Y283 R284 | Q276-E280 PolarHBondContact NE2-OE1 3.28Å; Q276-E280 WeakPolarHBondContact O-CG 3.44Å; Q276-E280 PolarHBondContact O-N 2.98Å; K277-E280 PolarHBondContact O-N 3.1Å; F278-E280 PolarHBondContact O-N 3.09Å; E280-Y283 PolarHBondContact O-N 3.18Å; E280-R284 WeakPolarHBondContact O-CB 3.43Å; E280-R284 VanDerWaalsContact O-CG 3.25Å; E280-R284 WeakPolarHBondContact O-CG 3.45Å; E280-R284 PolarHBondContact O-N 3.17Å; E280-R284 IonicContact OE2-NH2 3.28Å |
| 281 | D | 93.9 | Very high | 93.3 | Very high | 35 Ų | 35 | 37.3 Ų | 37.3 | 19% | 0.187 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -67.3 | -42.6 | 180 | -74.5 | -22 | 0 | 0 | 0 | 111.2 | T225 K277 F278 R284 L285 | T225-D281 HydrophobicContact CG2-CB 3.69Å; K277-D281 WeakPolarHBondContact O-CB 3.36Å; K277-D281 PolarHBondContact O-N 3.14Å; F278-D281 PolarHBondContact O-N 2.83Å; D281-R284 PolarHBondContact O-N 3.24Å; D281-L285 VanDerWaalsContact O-CB 3.24Å; D281-L285 WeakPolarHBondContact O-CB 3.32Å; D281-L285 PolarHBondContact O-N 2.86Å |
| 282 | M | 93.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.3 | -45.5 | 173.7 | -71.4 | -62 | -74.5 | 0 | 0 | 111.4 | V108 L228 Y243 F278 R284 L285 Y286 V292 | V108-M282 HydrophobicContact CG2-CB 4.46Å; V108-M282 HydrophobicContact CG2-CE 3.61Å; V108-M282 HydrophobicContact CG2-CG 4.49Å; L228-M282 HydrophobicContact CD1-CE 3.69Å; L228-M282 HydrophobicContact CD1-SD 3.57Å; L228-M282 VanDerWaalsContact CD1-SD 3.57Å; Y243-M282 HydrophobicContact CD2-CE 3.85Å; Y243-M282 HydrophobicContact CE1-CE 4.42Å; Y243-M282 HydrophobicContact CE2-CE 3.67Å; Y243-M282 HydrophobicContact CG-CE 4.29Å; F278-M282 HydrophobicContact CD1-CG 4.46Å; F278-M282 HydrophobicContact CD2-CG 4.34Å; F278-M282 HydrophobicContact CE1-CG 4.14Å; F278-M282 HydrophobicContact CE2-CG 3.99Å; F278-M282 HydrophobicContact CE2-SD 4.36Å; F278-M282 HydrophobicContact CZ-CG 3.88Å; F278-M282 HydrophobicContact CZ-SD 4.4Å; F278-M282 WeakPolarHBondContact O-CB 3.47Å; F278-M282 VanDerWaalsContact O-CG 3.28Å; F278-M282 WeakPolarHBondContact O-CG 3.49Å; F278-M282 PolarHBondContact O-N 3.3Å; M282-R284 VanDerWaalsContact C-N 3.32Å; M282-R284 PolarHBondContact O-N 2.53Å; M282-L285 PolarHBondContact O-N 2.91Å; M282-Y286 HydrophobicContact CE-CE2 3.88Å; M282-Y286 WeakPolarHBondContact O-CD2 3.39Å; M282-Y286 PolarHBondContact O-N 3.22Å; M282-V292 HydrophobicContact CB-CG2 4.4Å |
| 283 | Y | 93.9 | Very high | 93.6 | Very high | 36 Ų | 36 | 36.8 Ų | 36.8 | 14% | 0.141 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.5 | -43.6 | 177.7 | -172.9 | -112.2 | 0 | 0 | 0 | 112.3 | Q55 A56 P57 G279 E280 G287 N288 A290 | Q55-Y283 HydrophobicContact CB-CD2 3.9Å; Q55-Y283 HydrophobicContact CB-CG 4.03Å; Q55-Y283 HydrophobicContact CG-CG 4.32Å; A56-Y283 PolarHBondContact O-OH 3.45Å; P57-Y283 HydrophobicContact CG-CE2 4.44Å; G279-Y283 WeakPolarHBondContact O-CB 3.41Å; G279-Y283 PolarHBondContact O-N 2.77Å; E280-Y283 PolarHBondContact O-N 3.18Å; Y283-G287 PolarHBondContact O-N 3.49Å; Y283-N288 HydrophobicContact CD1-CB 4.42Å; Y283-N288 HydrophobicContact CE1-CB 3.68Å; Y283-N288 WeakPolarHBondContact CE1-OD1 3.18Å; Y283-N288 HydrophobicContact CE2-CB 4.15Å; Y283-N288 WeakPolarHBondContact O-CA 3.4Å; Y283-N288 PolarHBondContact O-N 2.88Å; Y283-A290 VanDerWaalsContact CD2-O 3.24Å; Y283-A290 WeakPolarHBondContact CD2-O 3.34Å; Y283-A290 WeakPolarHBondContact CE2-O 3.23Å |
| 284 | R | 93.4 | Very high | 93.8 | Very high | 156 Ų | 156 | 33.8 Ų | 33.8 | 59% | 0.589 | 16% | 0.163 | S | C | * | . | H | α-helix | trans | -67.4 | -39.2 | 175.8 | -72.7 | 172.5 | -175.5 | 158 | 9.3 | 112.6 | E280 D281 M282 Y286 G287 | E280-R284 WeakPolarHBondContact O-CB 3.43Å; E280-R284 VanDerWaalsContact O-CG 3.25Å; E280-R284 WeakPolarHBondContact O-CG 3.45Å; E280-R284 PolarHBondContact O-N 3.17Å; E280-R284 IonicContact OE2-NH2 3.28Å; D281-R284 PolarHBondContact O-N 3.24Å; M282-R284 VanDerWaalsContact C-N 3.32Å; M282-R284 PolarHBondContact O-N 2.53Å; R284-Y286 VanDerWaalsContact C-N 3.3Å; R284-Y286 PolarHBondContact O-N 2.71Å; R284-G287 PolarHBondContact O-N 2.91Å; R284-G287 VanDerWaalsContact O-N 3.08Å |
| 285 | L | 92.4 | Very high | 93.9 | Very high | 32 Ų | 32 | 32.6 Ų | 32.6 | 17% | 0.168 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62 | -38.1 | -177.6 | -173.2 | 131.2 | 0 | 0 | 0 | 112.2 | L228 Q229 A235 D281 M282 G287 | L228-L285 HydrophobicContact CB-CD1 3.66Å; L228-L285 HydrophobicContact CB-CD2 4.07Å; L228-L285 HydrophobicContact CD1-CD2 4.47Å; Q229-L285 HydrophobicContact CG-CD1 3.88Å; A235-L285 HydrophobicContact CB-CD2 3.24Å; A235-L285 HydrophobicContact CB-CG 4.21Å; D281-L285 VanDerWaalsContact O-CB 3.24Å; D281-L285 WeakPolarHBondContact O-CB 3.32Å; D281-L285 PolarHBondContact O-N 2.86Å; M282-L285 PolarHBondContact O-N 2.91Å; L285-G287 VanDerWaalsContact C-N 3.31Å; L285-G287 PolarHBondContact O-N 2.89Å |
| 286 | Y | 92.3 | Very high | 93.9 | Very high | 4 Ų | 4 | 32.5 Ų | 32.5 | 2% | 0.016 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87 | 6.8 | 176.1 | -75.9 | -86.5 | 0 | 0 | 0 | 114.4 | R105 A106 A235 D241 Y243 M282 R284 R289 A290 | R105-Y286 HydrophobicContact CB-CD1 3.9Å; A106-Y286 HydrophobicContact CB-CD1 3.72Å; A106-Y286 HydrophobicContact CB-CD2 3.77Å; A106-Y286 HydrophobicContact CB-CE1 3.6Å; A106-Y286 HydrophobicContact CB-CE2 3.68Å; A106-Y286 HydrophobicContact CB-CG 3.8Å; A235-Y286 HydrophobicContact CB-CD1 3.89Å; A235-Y286 HydrophobicContact CB-CD2 4.4Å; A235-Y286 HydrophobicContact CB-CE1 3.52Å; A235-Y286 HydrophobicContact CB-CE2 4.05Å; A235-Y286 HydrophobicContact CB-CG 4.31Å; D241-Y286 HydrophobicContact CB-CE1 4.25Å; D241-Y286 WeakPolarHBondContact OD2-CE1 3.23Å; D241-Y286 VanDerWaalsContact OD2-CZ 3.28Å; D241-Y286 PolarHBondContact OD2-OH 3.22Å; Y243-Y286 HydrophobicContact CE2-CE2 4.3Å; Y243-Y286 WeakPolarHBondContact CE2-OH 3.35Å; Y243-Y286 PolarHBondContact OH-OH 2.59Å; M282-Y286 HydrophobicContact CE-CE2 3.88Å; M282-Y286 WeakPolarHBondContact O-CD2 3.39Å; M282-Y286 PolarHBondContact O-N 3.22Å; R284-Y286 VanDerWaalsContact C-N 3.3Å; R284-Y286 PolarHBondContact O-N 2.71Å; Y286-R289 PolarHBondContact O-NE 3.35Å; Y286-A290 HydrophobicContact CD2-CB 4.21Å; Y286-A290 HydrophobicContact CG-CB 4.23Å |
| 287 | G | 90.9 | Very high | 93.8 | Very high | 47 Ų | 47 | 32 Ų | 32 | 49% | 0.485 | 15% | 0.153 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 65.4 | 47 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y283 R284 L285 R289 | Y283-G287 PolarHBondContact O-N 3.49Å; R284-G287 PolarHBondContact O-N 2.91Å; R284-G287 VanDerWaalsContact O-N 3.08Å; L285-G287 VanDerWaalsContact C-N 3.31Å; L285-G287 PolarHBondContact O-N 2.89Å; G287-R289 PolarHBondContact O-N 3.19Å |
| 288 | N | 92.2 | Very high | 93.5 | Very high | 87 Ų | 87 | 30.5 Ų | 30.5 | 47% | 0.465 | 15% | 0.146 | S | C | . | . | S | Bend | trans | 64.9 | 25.2 | 178.6 | -53.9 | -13.9 | 0 | 0 | 0 | 113.9 | P57 Y283 | P57-N288 WeakPolarHBondContact CB-O 3.43Å; Y283-N288 HydrophobicContact CD1-CB 4.42Å; Y283-N288 HydrophobicContact CE1-CB 3.68Å; Y283-N288 WeakPolarHBondContact CE1-OD1 3.18Å; Y283-N288 HydrophobicContact CE2-CB 4.15Å; Y283-N288 WeakPolarHBondContact O-CA 3.4Å; Y283-N288 PolarHBondContact O-N 2.88Å |
| 289 | R | 92.2 | Very high | 92.9 | Very high | 92 Ų | 92 | 33.6 Ų | 33.6 | 35% | 0.347 | 17% | 0.166 | S | C | . | . | trans | -118.8 | 22.8 | 179.4 | -62.6 | 179.6 | -64.4 | 168.2 | 5.6 | 112.2 | F59 P104 R105 Y286 G287 | F59-R289 HydrophobicContact CE1-CG 4.28Å; F59-R289 HydrophobicContact CZ-CG 4.43Å; P104-R289 CarbonylContact C-O 3.56Å; P104-R289 WeakPolarHBondContact CA-O 3.38Å; P104-R289 WeakPolarHBondContact CB-O 3.22Å; R105-R289 HydrophobicContact CB-CB 4.26Å; R105-R289 HydrophobicContact CG-CB 4.04Å; R105-R289 PolarHBondContact N-O 2.92Å; Y286-R289 PolarHBondContact O-NE 3.35Å; G287-R289 PolarHBondContact O-N 3.19Å | ||
| 290 | A | 93.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.175 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 147.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | P57 A106 Y283 Y286 | P57-A290 WeakPolarHBondContact CD-O 3.26Å; A106-A290 HydrophobicContact CB-CB 4Å; A106-A290 CarbonylContact O-C 3.57Å; A106-A290 VanDerWaalsContact O-CA 3.28Å; A106-A290 WeakPolarHBondContact O-CA 3.33Å; Y283-A290 VanDerWaalsContact CD2-O 3.24Å; Y283-A290 WeakPolarHBondContact CD2-O 3.34Å; Y283-A290 WeakPolarHBondContact CE2-O 3.23Å; Y286-A290 HydrophobicContact CD2-CB 4.21Å; Y286-A290 HydrophobicContact CG-CB 4.23Å |
| 291 | V | 95.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.186 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 130.4 | 166.4 | 177.6 | 0 | 0 | 0 | 0 | 107.3 | Q55 P57 V60 F62 P104 A106 V108 E293 | Q55-V291 WeakPolarHBondContact O-CA 3.39Å; P57-V291 HydrophobicContact CG-CG2 4.32Å; V60-V291 HydrophobicContact CG1-CG2 4.49Å; V60-V291 HydrophobicContact CG2-CG2 4.32Å; F62-V291 HydrophobicContact CE2-CG1 4.29Å; F62-V291 HydrophobicContact CZ-CG1 4.37Å; P104-V291 HydrophobicContact CB-CG2 4Å; P104-V291 HydrophobicContact CG-CG2 3.62Å; A106-V291 PolarHBondContact O-N 3.29Å; V108-V291 PolarHBondContact N-O 3.13Å; V291-E293 HydrophobicContact CG1-CG 3.86Å; V291-E293 WeakPolarHBondContact CG1-OE1 3.43Å |
| 292 | V | 96.5 | Very high | 89.8 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.006 | 21% | 0.209 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 120.2 | 179.3 | -174.1 | 0 | 0 | 0 | 0 | 109.1 | L54 Q55 V108 M282 | L54-V292 HydrophobicContact CB-CB 4.44Å; L54-V292 HydrophobicContact CB-CG1 4.35Å; L54-V292 HydrophobicContact CD1-CG1 4.3Å; L54-V292 PolarHBondContact N-O 3.5Å; Q55-V292 HydrophobicContact CB-CB 4.15Å; Q55-V292 HydrophobicContact CB-CG2 4.16Å; Q55-V292 PolarHBondContact N-O 3.17Å; Q55-V292 PolarHBondContact O-N 3.36Å; V108-V292 HydrophobicContact CB-CG1 4.28Å; V108-V292 HydrophobicContact CB-CG2 4.21Å; V108-V292 HydrophobicContact CG1-CG1 4.31Å; V108-V292 HydrophobicContact CG2-CG2 4.43Å; V108-V292 CarbonylContact O-C 3.55Å; V108-V292 WeakPolarHBondContact O-CA 3.2Å; M282-V292 HydrophobicContact CB-CG2 4.4Å |
| 293 | E | 95.9 | Very high | 88.1 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 141.4 | -171.9 | -66.4 | 166.2 | -171.6 | 0 | 0 | 109.4 | F51 T52 V53 V78 N107 V108 L109 V110 V291 | F51-E293 HydrophobicContact CE2-CB 3.92Å; F51-E293 HydrophobicContact CE2-CG 4.13Å; F51-E293 HydrophobicContact CZ-CB 4.14Å; F51-E293 HydrophobicContact CZ-CG 3.83Å; T52-E293 CarbonylContact O-C 3.59Å; T52-E293 WeakPolarHBondContact O-CA 3.41Å; V53-E293 HydrophobicContact CG2-CG 4.39Å; V78-E293 WeakPolarHBondContact CG2-OE2 3Å; N107-E293 PolarHBondContact ND2-OE1 3.16Å; V108-E293 PolarHBondContact O-N 3.22Å; L109-E293 HydrophobicContact CD1-CB 3.61Å; V110-E293 PolarHBondContact N-O 3.44Å; V291-E293 HydrophobicContact CG1-CG 3.86Å; V291-E293 WeakPolarHBondContact CG1-OE1 3.43Å |
| 294 | V | 95.9 | Very high | 86.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 124.6 | 176.3 | -176.1 | 0 | 0 | 0 | 0 | 109.3 | T52 L54 V110 V112 F120 L275 T296 | T52-V294 PolarHBondContact N-O 3.24Å; T52-V294 PolarHBondContact O-N 3.08Å; L54-V294 HydrophobicContact CD1-CG2 3.48Å; L54-V294 VanDerWaalsContact CD1-CG2 3.48Å; L54-V294 HydrophobicContact CG-CG2 3.84Å; V110-V294 HydrophobicContact CB-CG2 4.35Å; V110-V294 CarbonylContact O-C 3.55Å; V110-V294 VanDerWaalsContact O-CA 3.23Å; V110-V294 WeakPolarHBondContact O-CA 3.45Å; V112-V294 HydrophobicContact CG2-CG1 3.96Å; F120-V294 HydrophobicContact CE2-CB 4.43Å; F120-V294 HydrophobicContact CE2-CG1 4.41Å; F120-V294 HydrophobicContact CZ-CB 4.21Å; F120-V294 HydrophobicContact CZ-CG1 3.97Å; F120-V294 HydrophobicContact CZ-CG2 4.24Å; L275-V294 HydrophobicContact CD1-CG1 4.25Å; V294-T296 HydrophobicContact CG1-CG2 4.33Å |
| 295 | V | 94.8 | Very high | 84.3 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 122 | 173.4 | -173.2 | 0 | 0 | 0 | 0 | 107.2 | S50 F51 V74 L109 V110 V111 V112 L129 F135 V297 | S50-V295 CarbonylContact O-C 3.57Å; S50-V295 WeakPolarHBondContact O-CA 3.28Å; F51-V295 HydrophobicContact CD2-CG2 3.73Å; F51-V295 HydrophobicContact CE2-CG2 4.27Å; V74-V295 HydrophobicContact CG1-CG2 4.15Å; L109-V295 HydrophobicContact CD1-CG2 3.69Å; L109-V295 HydrophobicContact CG-CG2 4.45Å; V110-V295 PolarHBondContact O-N 3.34Å; V111-V295 CarbonylContact C-O 3.52Å; V111-V295 WeakPolarHBondContact CA-O 3.18Å; V111-V295 HydrophobicContact CG1-CB 4.49Å; V111-V295 HydrophobicContact CG2-CB 4.32Å; V111-V295 HydrophobicContact CG2-CG2 4.45Å; V112-V295 PolarHBondContact N-O 3.12Å; L129-V295 HydrophobicContact CD2-CG1 3.78Å; F135-V295 HydrophobicContact CZ-CG1 4.45Å; F135-V295 HydrophobicContact CZ-CG2 4.09Å; V295-V297 HydrophobicContact CG1-CG2 3.81Å |
| 296 | T | 93.6 | Very high | 82.3 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 125.1 | 172.4 | 59.9 | 0 | 0 | 0 | 0 | 109.4 | D49 S50 V112 V115 D116 L118 V294 | D49-T296 CarbonylContact C-O 3.46Å; D49-T296 VanDerWaalsContact CA-O 3.23Å; D49-T296 WeakPolarHBondContact CA-O 3.31Å; D49-T296 WeakPolarHBondContact CB-O 3.44Å; S50-T296 PolarHBondContact N-O 3.42Å; S50-T296 PolarHBondContact N-OG1 2.86Å; S50-T296 PolarHBondContact O-N 3.26Å; S50-T296 PolarHBondContact O-OG1 3.25Å; S50-T296 PolarHBondContact OG-OG1 2.88Å; V112-T296 WeakPolarHBondContact O-CA 3.39Å; V115-T296 HydrophobicContact CG1-CG2 4.09Å; D116-T296 PolarHBondContact O-OG1 2.95Å; L118-T296 HydrophobicContact CB-CG2 4.1Å; L118-T296 HydrophobicContact CD1-CG2 3.84Å; L118-T296 HydrophobicContact CG-CG2 3.77Å; V294-T296 HydrophobicContact CG1-CG2 4.33Å |
| 297 | V | 91.6 | Very high | 80.2 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.4 | 130.1 | -179.4 | 178.5 | 0 | 0 | 0 | 0 | 109.1 | V112 R113 G114 V115 L129 P132 V295 F300 | V112-V297 PolarHBondContact O-N 3.45Å; R113-V297 CarbonylContact C-O 3.53Å; R113-V297 VanDerWaalsContact CA-O 3.25Å; R113-V297 WeakPolarHBondContact CA-O 3.44Å; G114-V297 PolarHBondContact N-O 3.46Å; V115-V297 PolarHBondContact N-O 2.93Å; V115-V297 CarbonylContact O-C 3.58Å; V115-V297 VanDerWaalsContact O-C 3.3Å; V115-V297 PolarHBondContact O-N 3.32Å; L129-V297 HydrophobicContact CD2-CG2 3.93Å; P132-V297 HydrophobicContact CB-CG1 3.83Å; P132-V297 HydrophobicContact CB-CG2 4.37Å; V295-V297 HydrophobicContact CG1-CG2 3.81Å; V297-F300 HydrophobicContact CG1-CD1 3.95Å; V297-F300 HydrophobicContact CG1-CE1 4.21Å; V297-F300 HydrophobicContact CG1-CG 4.36Å; V297-F300 HydrophobicContact CG2-CE1 4.1Å |
| 298 | K | 87.3 | Confident | 78.1 | Confident | 97 Ų | 97 | 68.2 Ų | 68.2 | 42% | 0.422 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -65.1 | -55.3 | 173.5 | -175 | -173.2 | -176.4 | 167.8 | 0 | 111 | D49 G114 D116 | D49-K298 WeakPolarHBondContact OD1-CB 3.21Å; D49-K298 PolarHBondContact OD1-N 2.9Å; G114-K298 VanDerWaalsContact CA-O 3.31Å; G114-K298 WeakPolarHBondContact CA-O 3.35Å; G114-K298 PolarHBondContact N-O 3.28Å; D116-K298 WeakPolarHBondContact OD1-CB 3.26Å; D116-K298 VanDerWaalsContact OD1-CD 3.27Å; D116-K298 WeakPolarHBondContact OD1-CD 3.17Å; D116-K298 WeakPolarHBondContact OD1-CG 3.49Å |
| 299 | T | 82.2 | Confident | 76.2 | Confident | 72 Ų | 72 | 75.1 Ų | 75.1 | 44% | 0.442 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -157.1 | 134.9 | 177.5 | 46.6 | 0 | 0 | 0 | 0 | 107.7 | E301 | T299-E301 PolarHBondContact O-N 3.37Š|
| 300 | F | 81 | Confident | 74.2 | Confident | 41 Ų | 41 | 76 Ų | 76 | 18% | 0.18 | 39% | 0.391 | C | S | . | . | P | Polyproline II helix | trans | -64.1 | 131.1 | 173.8 | -72.6 | -61.4 | 0 | 0 | 0 | 111.2 | V111 R113 P132 V133 P134 V297 | V111-F300 HydrophobicContact CG1-CZ 3.92Å; R113-F300 HydrophobicContact CG-CE2 4.13Å; P132-F300 CarbonylContact O-C 3.51Å; P132-F300 WeakPolarHBondContact O-CA 3.46Å; V133-F300 VanDerWaalsContact C-CD1 3.43Å; V133-F300 WeakPolarHBondContact O-CE1 3.47Å; P134-F300 HydrophobicContact CB-CD1 4.49Å; P134-F300 HydrophobicContact CB-CD2 4.41Å; P134-F300 HydrophobicContact CB-CG 4.33Å; P134-F300 HydrophobicContact CG-CB 3.71Å; P134-F300 HydrophobicContact CG-CD1 4.23Å; P134-F300 HydrophobicContact CG-CD2 4.17Å; P134-F300 HydrophobicContact CG-CG 3.81Å; V297-F300 HydrophobicContact CG1-CD1 3.95Å; V297-F300 HydrophobicContact CG1-CE1 4.21Å; V297-F300 HydrophobicContact CG1-CG 4.36Å; V297-F300 HydrophobicContact CG2-CE1 4.1Å |
| 301 | E | 70.9 | Confident | 72 | Confident | 100 Ų | 100 | 83.6 Ų | 83.6 | 47% | 0.467 | 43% | 0.43 | S | S | . | . | P | Polyproline II helix | trans | -83.8 | 148.3 | 174.4 | -68.9 | -171.8 | 165.9 | 0 | 0 | 110.7 | P132 T299 | P132-E301 HydrophobicContact CG-CB 4.45Å; P132-E301 HydrophobicContact CG-CG 4.03Å; P132-E301 PolarHBondContact O-N 3.5Å; T299-E301 PolarHBondContact O-N 3.37Å |
| 302 | A | 66.3 | Low | 69.8 | Low | 79 Ų | 79 | 91.1 Ų | 91.1 | 65% | 0.653 | 47% | 0.47 | S | S | * | . | P | Polyproline II helix | trans | -67.3 | 135.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | L304 | A302-L304 PolarHBondContact O-N 2.95Š|
| 303 | P | 58.8 | Low | 67.2 | Low | 78 Ų | 78 | 100 Ų | 100 | 51% | 0.506 | 51% | 0.511 | S | S | . | . | trans | -60.8 | 113.6 | -176.3 | 23.2 | -32.9 | 0 | 0 | 0 | 110.7 | V133 T305 | V133-P303 HydrophobicContact CG1-CB 4.22Å; P303-T305 VanDerWaalsContact C-N 3.32Å; P303-T305 PolarHBondContact O-N 3.13Å | ||
| 304 | L | 57.5 | Low | 64.7 | Low | 149 Ų | 149 | 104.1 Ų | 104.1 | 78% | 0.78 | 54% | 0.54 | S | S | * | . | trans | -77.9 | 79 | 180 | -66.3 | 178.6 | 0 | 0 | 0 | 110.4 | A302 R306 | A302-L304 PolarHBondContact O-N 2.95Å; L304-R306 PolarHBondContact O-N 3.03Å | ||
| 305 | T | 49.4 | Very low | 62.5 | Low | 117 Ų | 117 | 114.3 Ų | 114.3 | 72% | 0.718 | 59% | 0.585 | S | S | * | * | trans | -75.8 | 96.2 | 174.1 | 56.3 | 0 | 0 | 0 | 0 | 111.1 | P303 K307 | P303-T305 VanDerWaalsContact C-N 3.32Å; P303-T305 PolarHBondContact O-N 3.13Å; T305-K307 PolarHBondContact O-N 3.38Å; T305-K307 VanDerWaalsContact O-N 3.09Å | ||
| 306 | R | 51 | Low | 60.3 | Low | 228 Ų | 228 | 120 Ų | 120 | 86% | 0.86 | 61% | 0.611 | S | S | * | * | trans | -75.3 | 98.2 | 171 | -171.5 | -178.6 | -178.9 | -170.1 | 0.6 | 110 | L304 S308 | L304-R306 PolarHBondContact O-N 3.03Å; R306-S308 PolarHBondContact O-N 3.34Å | ||
| 307 | K | 46.8 | Very low | 58.3 | Low | 190 Ų | 190 | 127.7 Ų | 127.7 | 83% | 0.826 | 65% | 0.65 | S | S | * | * | trans | -68.4 | 95.3 | 164.5 | -65 | -152.3 | 180 | -169.9 | 0 | 109.7 | T305 R309 | T305-K307 PolarHBondContact O-N 3.38Å; T305-K307 VanDerWaalsContact O-N 3.09Å; K307-R309 PolarHBondContact O-N 3.04Å | ||
| 308 | S | 46.8 | Very low | 56.3 | Low | 102 Ų | 102 | 132.1 Ų | 132.1 | 71% | 0.713 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 120.2 | 174.1 | -168.1 | 0 | 0 | 0 | 0 | 109.9 | R306 | R306-S308 PolarHBondContact O-N 3.34Š|
| 309 | R | 53.3 | Low | 54.9 | Low | 231 Ų | 231 | 130.4 Ų | 130.4 | 87% | 0.872 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 119.9 | 167.1 | -68.5 | -176 | 177.7 | -162 | -0.4 | 107.9 | K307 | K307-R309 PolarHBondContact O-N 3.04Š|
| 310 | S | 48.8 | Very low | 53.7 | Low | 110 Ų | 110 | 132.9 Ų | 132.9 | 77% | 0.769 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 131.9 | 171.1 | -176.9 | 0 | 0 | 0 | 0 | 110 | ||
| 311 | I | 49.1 | Very low | 52.8 | Low | 160 Ų | 160 | 134.8 Ų | 134.8 | 82% | 0.821 | 73% | 0.726 | S | S | * | * | trans | -90.3 | 1 | -170.3 | -67.3 | 178.5 | 0 | 0 | 0 | 113.1 | E313 | I311-E313 PolarHBondContact O-N 3.03Š| ||
| 312 | L | 47.5 | Very low | 52.3 | Low | 158 Ų | 158 | 131.5 Ų | 131.5 | 83% | 0.827 | 71% | 0.714 | S | S | * | * | trans | -98.8 | 80.3 | 179.5 | -66.1 | 174 | 0 | 0 | 0 | 111.3 | S314 | L312-S314 PolarHBondContact O-N 2.58Š| ||
| 313 | E | 42.4 | Very low | 52.1 | Low | 187 Ų | 187 | 133.3 Ų | 133.3 | 87% | 0.874 | 72% | 0.719 | S | S | * | * | trans | -72.9 | 88 | 170.4 | -170.4 | 173.2 | -169.6 | 0 | 0 | 109.8 | I311 | I311-E313 PolarHBondContact O-N 3.03Š| ||
| 314 | S | 43.7 | Very low | 52.4 | Low | 88 Ų | 88 | 138.6 Ų | 138.6 | 62% | 0.615 | 73% | 0.73 | S | S | * | * | trans | -74.3 | 131.9 | 165.3 | 60.2 | 0 | 0 | 0 | 0 | 109 | L312 Q316 | L312-S314 PolarHBondContact O-N 2.58Å; S314-Q316 VanDerWaalsContact O-CG 3.28Å; S314-Q316 WeakPolarHBondContact O-CG 3.41Å; S314-Q316 PolarHBondContact O-N 3.13Å | ||
| 315 | K | 48.9 | Very low | 52.9 | Low | 214 Ų | 214 | 133.9 Ų | 133.9 | 93% | 0.93 | 71% | 0.706 | S | S | * | * | trans | -47.4 | 100.2 | 178.1 | -147.4 | 177 | -170.9 | -178.9 | 0 | 111.1 | ||||
| 316 | Q | 49.4 | Very low | 54 | Low | 120 Ų | 120 | 133.3 Ų | 133.3 | 56% | 0.561 | 70% | 0.698 | S | S | * | * | trans | -82.5 | 130.3 | -170.5 | -72.6 | 179.8 | -54.5 | 0 | 0 | 111.5 | S314 S318 N325 | S314-Q316 VanDerWaalsContact O-CG 3.28Å; S314-Q316 WeakPolarHBondContact O-CG 3.41Å; S314-Q316 PolarHBondContact O-N 3.13Å; Q316-S318 PolarHBondContact O-N 2.69Å; Q316-N325 WeakPolarHBondContact CB-ND2 3.14Å; Q316-N325 VanDerWaalsContact CD-ND2 3.28Å; Q316-N325 VanDerWaalsContact OE1-CB 3.27Å; Q316-N325 PolarHBondContact OE1-ND2 3.08Å | ||
| 317 | I | 51.9 | Low | 54.7 | Low | 160 Ų | 160 | 126.8 Ų | 126.8 | 82% | 0.821 | 69% | 0.692 | S | S | * | * | trans | -69 | 111.1 | 166.4 | -60.5 | 164.1 | 0 | 0 | 0 | 106.5 | N319 | I317-N319 PolarHBondContact O-N 3.47Š| ||
| 318 | S | 50.1 | Low | 55.9 | Low | 94 Ų | 94 | 125.2 Ų | 125.2 | 66% | 0.657 | 68% | 0.682 | S | S | * | * | trans | -61.3 | 120.6 | -176.8 | 53.1 | 0 | 0 | 0 | 0 | 111.5 | Q316 | Q316-S318 PolarHBondContact O-N 2.69Š| ||
| 319 | N | 57.1 | Low | 57.2 | Low | 60 Ų | 60 | 130.1 Ų | 130.1 | 32% | 0.321 | 69% | 0.691 | S | S | . | * | trans | -69.3 | 131 | 173.4 | -90.4 | -37.5 | 0 | 0 | 0 | 111 | I317 G321 | I317-N319 PolarHBondContact O-N 3.47Å; N319-G321 PolarHBondContact O-N 3.14Å | ||
| 320 | P | 56.7 | Low | 58.5 | Low | 124 Ų | 124 | 127.3 Ų | 127.3 | 81% | 0.805 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | 89.4 | 176.5 | 30.1 | -32 | 0 | 0 | 0 | 109.6 | ||
| 321 | G | 62.8 | Low | 60 | Low | 82 Ų | 82 | 126.4 Ų | 126.4 | 85% | 0.845 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 153.6 | -7.9 | 175 | 0 | 0 | 0 | 0 | 0 | 116.4 | N319 | N319-G321 PolarHBondContact O-N 3.14Š|
| 322 | S | 60.7 | Low | 61.4 | Low | 31 Ų | 31 | 128.7 Ų | 128.7 | 22% | 0.217 | 67% | 0.672 | C | S | . | * | trans | -143.3 | 130.6 | 169.1 | 77 | 0 | 0 | 0 | 0 | 111.4 | Y324 L326 | S322-Y324 PolarHBondContact O-N 3.41Å; S322-Y324 VanDerWaalsContact O-N 3.09Å; S322-L326 PolarHBondContact OG-N 3.18Å | ||
| 323 | P | 61.8 | Low | 63.3 | Low | 116 Ų | 116 | 126.9 Ų | 126.9 | 75% | 0.753 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -2.2 | -178.9 | 26.2 | -31.7 | 0 | 0 | 0 | 113.7 | ||
| 324 | Y | 64.8 | Low | 65.6 | Low | 189 Ų | 189 | 123.7 Ų | 123.7 | 74% | 0.741 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.8 | 19.1 | -169.6 | -59.6 | -62.4 | 0 | 0 | 0 | 114.6 | S322 L326 | S322-Y324 PolarHBondContact O-N 3.41Å; S322-Y324 VanDerWaalsContact O-N 3.09Å; Y324-L326 PolarHBondContact O-N 3.03Å |
| 325 | N | 68.4 | Low | 67.7 | Low | 51 Ų | 51 | 122.5 Ų | 122.5 | 27% | 0.273 | 64% | 0.636 | S | S | . | * | trans | 44.7 | 43.3 | -179 | -93.3 | -21.9 | 0 | 0 | 0 | 113.4 | Q316 | Q316-N325 WeakPolarHBondContact CB-ND2 3.14Å; Q316-N325 VanDerWaalsContact CD-ND2 3.28Å; Q316-N325 VanDerWaalsContact OE1-CB 3.27Å; Q316-N325 PolarHBondContact OE1-ND2 3.08Å | ||
| 326 | L | 71.6 | Confident | 69.7 | Low | 105 Ų | 105 | 116.7 Ų | 116.7 | 55% | 0.55 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -67 | 144.6 | 176.6 | -66.3 | 160.6 | 0 | 0 | 0 | 108.8 | S322 Y324 | S322-L326 PolarHBondContact OG-N 3.18Å; Y324-L326 PolarHBondContact O-N 3.03Å |
| 327 | A | 66.9 | Low | 71.7 | Confident | 90 Ų | 90 | 114.8 Ų | 114.8 | 74% | 0.744 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 150.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | K329 | A327-K329 PolarHBondContact O-N 2.93Š|
| 328 | Y | 72.2 | Confident | 73.7 | Confident | 158 Ų | 158 | 111.7 Ų | 111.7 | 62% | 0.62 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 132 | 171.1 | -109.3 | -91.8 | 0 | 0 | 0 | 109.2 | Y330 | Y328-Y330 WeakPolarHBondContact O-CD2 3.42Å; Y328-Y330 PolarHBondContact O-N 3.05Å |
| 329 | K | 73.6 | Confident | 75.8 | Confident | 205 Ų | 205 | 110.8 Ų | 110.8 | 89% | 0.891 | 58% | 0.58 | S | S | * | * | trans | -72.6 | 99.7 | 174.8 | -66.6 | -174.9 | 178.3 | -175.4 | 0 | 108.3 | A327 | A327-K329 PolarHBondContact O-N 2.93Š| ||
| 330 | Y | 79.9 | Confident | 77.6 | Confident | 171 Ų | 171 | 113.2 Ų | 113.2 | 67% | 0.671 | 59% | 0.591 | S | S | * | * | trans | -77 | 141.7 | 168.4 | -75 | -87.6 | 0 | 0 | 0 | 109.6 | Y328 Y334 | Y328-Y330 WeakPolarHBondContact O-CD2 3.42Å; Y328-Y330 PolarHBondContact O-N 3.05Å; Y330-Y334 HydrophobicContact CD1-CD2 4.03Å; Y330-Y334 HydrophobicContact CD1-CE2 4.23Å; Y330-Y334 HydrophobicContact CD1-CG 4.22Å; Y330-Y334 HydrophobicContact CE1-CE2 4.3Å | ||
| 331 | N | 81.4 | Confident | 79.4 | Confident | 92 Ų | 92 | 111.1 Ų | 111.1 | 49% | 0.492 | 58% | 0.576 | S | S | . | * | trans | -66.7 | 136.6 | 169.3 | -174.9 | -19.9 | 0 | 0 | 0 | 108.6 | Q333 Y334 | N331-Q333 PolarHBondContact O-N 3.16Å; N331-Q333 PolarHBondContact OD1-N 3.31Å; N331-Y334 WeakPolarHBondContact O-CB 3.45Å; N331-Y334 PolarHBondContact O-N 2.91Å | ||
| 332 | F | 78 | Confident | 80.9 | Confident | 207 Ų | 207 | 110.1 Ų | 110.1 | 91% | 0.908 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -31.9 | 176.3 | -168.9 | -100.7 | 0 | 0 | 0 | 112.3 | Y334 | F332-Y334 PolarHBondContact O-N 3.09Š|
| 333 | Q | 87.6 | Confident | 82.6 | Confident | 121 Ų | 121 | 116.5 Ų | 116.5 | 57% | 0.565 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | 11.6 | 176.2 | -63.1 | -180 | -24.5 | 0 | 0 | 113.8 | N331 A335 V336 I337 | N331-Q333 PolarHBondContact O-N 3.16Å; N331-Q333 PolarHBondContact OD1-N 3.31Å; Q333-A335 VanDerWaalsContact C-N 3.29Å; Q333-A335 PolarHBondContact O-N 3.47Å; Q333-V336 PolarHBondContact O-N 3.48Å; Q333-I337 HydrophobicContact CB-CD1 4.19Å; Q333-I337 HydrophobicContact CB-CG1 4.46Å; Q333-I337 WeakPolarHBondContact O-CG1 3.3Å; Q333-I337 PolarHBondContact O-N 3.44Å |
| 334 | Y | 90.3 | Very high | 84.2 | Confident | 120 Ų | 120 | 116.2 Ų | 116.2 | 47% | 0.471 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -53.5 | -44.6 | -176.5 | 175.7 | -98.2 | 0 | 0 | 0 | 112.4 | Y330 N331 F332 V336 I337 F338 | Y330-Y334 HydrophobicContact CD1-CD2 4.03Å; Y330-Y334 HydrophobicContact CD1-CE2 4.23Å; Y330-Y334 HydrophobicContact CD1-CG 4.22Å; Y330-Y334 HydrophobicContact CE1-CE2 4.3Å; N331-Y334 WeakPolarHBondContact O-CB 3.45Å; N331-Y334 PolarHBondContact O-N 2.91Å; F332-Y334 PolarHBondContact O-N 3.09Å; Y334-V336 VanDerWaalsContact C-N 3.28Å; Y334-V336 PolarHBondContact O-N 3.41Å; Y334-I337 PolarHBondContact O-N 3.31Å; Y334-F338 HydrophobicContact CE1-CB 4.45Å; Y334-F338 WeakPolarHBondContact O-CB 3.31Å; Y334-F338 PolarHBondContact O-N 2.95Å |
| 335 | A | 88.3 | Confident | 85.7 | Confident | 63 Ų | 63 | 112.6 Ų | 112.6 | 52% | 0.521 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.4 | -36.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q333 N339 | Q333-A335 VanDerWaalsContact C-N 3.29Å; Q333-A335 PolarHBondContact O-N 3.47Å; A335-N339 PolarHBondContact O-N 3.04Å; A335-N339 PolarHBondContact O-ND2 3.19Å |
| 336 | V | 90.6 | Very high | 87.1 | Confident | 92 Ų | 92 | 113.8 Ų | 113.8 | 56% | 0.558 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72.3 | -51.3 | 179.2 | -178.4 | 0 | 0 | 0 | 0 | 110.3 | Q333 Y334 F338 N339 I340 | Q333-V336 PolarHBondContact O-N 3.48Å; Y334-V336 VanDerWaalsContact C-N 3.28Å; Y334-V336 PolarHBondContact O-N 3.41Å; V336-F338 VanDerWaalsContact C-N 3.31Å; V336-F338 PolarHBondContact O-N 3.47Å; V336-N339 PolarHBondContact O-N 3.32Å; V336-I340 HydrophobicContact CG1-CD1 3.96Å; V336-I340 WeakPolarHBondContact O-CG1 3.2Å; V336-I340 PolarHBondContact O-N 2.77Å; V336-I340 VanDerWaalsContact O-N 3.1Å |
| 337 | I | 91.2 | Very high | 88.3 | Confident | 79 Ų | 79 | 111.5 Ų | 111.5 | 41% | 0.405 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.5 | -42.1 | -179.2 | -63 | 169.6 | 0 | 0 | 0 | 110.6 | Q333 Y334 N339 I340 V341 | Q333-I337 HydrophobicContact CB-CD1 4.19Å; Q333-I337 HydrophobicContact CB-CG1 4.46Å; Q333-I337 WeakPolarHBondContact O-CG1 3.3Å; Q333-I337 PolarHBondContact O-N 3.44Å; Y334-I337 PolarHBondContact O-N 3.31Å; I337-N339 PolarHBondContact O-N 3.29Å; I337-I340 PolarHBondContact O-N 2.62Å; I337-V341 HydrophobicContact CG2-CG2 4.35Å; I337-V341 WeakPolarHBondContact O-CG2 3.36Å; I337-V341 PolarHBondContact O-N 3.28Å |
| 338 | F | 94.1 | Very high | 89.6 | Confident | 95 Ų | 95 | 111.9 Ų | 111.9 | 42% | 0.417 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -58.6 | -48.1 | 178.3 | 175.7 | -100.6 | 0 | 0 | 0 | 111.8 | Y334 V336 V341 L342 | Y334-F338 HydrophobicContact CE1-CB 4.45Å; Y334-F338 WeakPolarHBondContact O-CB 3.31Å; Y334-F338 PolarHBondContact O-N 2.95Å; V336-F338 VanDerWaalsContact C-N 3.31Å; V336-F338 PolarHBondContact O-N 3.47Å; F338-V341 PolarHBondContact O-N 2.98Å; F338-L342 HydrophobicContact CE1-CD1 3.95Å; F338-L342 HydrophobicContact CE2-CD1 4.27Å; F338-L342 HydrophobicContact CZ-CD1 3.58Å; F338-L342 WeakPolarHBondContact O-CB 3.42Å; F338-L342 PolarHBondContact O-N 2.94Å |
| 339 | N | 94.1 | Very high | 90.8 | Very high | 76 Ų | 76 | 106.7 Ų | 106.7 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.4 | -41.9 | 179.9 | -83.6 | -68.5 | 0 | 0 | 0 | 112.2 | A335 V336 I337 V341 L342 W343 | A335-N339 PolarHBondContact O-N 3.04Å; A335-N339 PolarHBondContact O-ND2 3.19Å; V336-N339 PolarHBondContact O-N 3.32Å; I337-N339 PolarHBondContact O-N 3.29Å; N339-V341 PolarHBondContact O-N 3.4Å; N339-L342 PolarHBondContact O-N 2.96Å; N339-W343 PolarHBondContact O-N 2.85Å; N339-W343 VanDerWaalsContact O-N 3.1Å |
| 340 | I | 94.2 | Very high | 91.8 | Very high | 111 Ų | 111 | 102.1 Ų | 102.1 | 57% | 0.569 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.5 | -48.9 | 177.5 | -67.5 | 169.1 | 0 | 0 | 0 | 110.3 | V336 I337 L344 | V336-I340 HydrophobicContact CG1-CD1 3.96Å; V336-I340 WeakPolarHBondContact O-CG1 3.2Å; V336-I340 PolarHBondContact O-N 2.77Å; V336-I340 VanDerWaalsContact O-N 3.1Å; I337-I340 PolarHBondContact O-N 2.62Å; I340-L344 WeakPolarHBondContact O-CB 3.43Å; I340-L344 PolarHBondContact O-N 3.36Å; I340-L344 VanDerWaalsContact O-N 3.13Å |
| 341 | V | 95.3 | Very high | 92.6 | Very high | 80 Ų | 80 | 96.3 Ų | 96.3 | 49% | 0.485 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67 | -43.5 | -179.1 | 174.1 | 0 | 0 | 0 | 0 | 111.4 | I337 F338 N339 M345 | I337-V341 HydrophobicContact CG2-CG2 4.35Å; I337-V341 WeakPolarHBondContact O-CG2 3.36Å; I337-V341 PolarHBondContact O-N 3.28Å; F338-V341 PolarHBondContact O-N 2.98Å; N339-V341 PolarHBondContact O-N 3.4Å; V341-M345 HydrophobicContact CG1-CG 4.18Å; V341-M345 WeakPolarHBondContact O-CB 3.26Å; V341-M345 VanDerWaalsContact O-CG 3.25Å; V341-M345 WeakPolarHBondContact O-CG 3.36Å; V341-M345 PolarHBondContact O-N 3.41Å |
| 342 | L | 94.9 | Very high | 93.3 | Very high | 61 Ų | 61 | 96 Ų | 96 | 32% | 0.319 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -52.2 | -177.5 | -179.5 | 130.5 | 0 | 0 | 0 | 111.7 | F338 N339 M345 I346 | F338-L342 HydrophobicContact CE1-CD1 3.95Å; F338-L342 HydrophobicContact CE2-CD1 4.27Å; F338-L342 HydrophobicContact CZ-CD1 3.58Å; F338-L342 WeakPolarHBondContact O-CB 3.42Å; F338-L342 PolarHBondContact O-N 2.94Å; N339-L342 PolarHBondContact O-N 2.96Å; L342-M345 PolarHBondContact O-N 2.86Å; L342-I346 HydrophobicContact CD2-CD1 3.77Å; L342-I346 HydrophobicContact CG-CD1 3.98Å; L342-I346 VanDerWaalsContact O-CG1 3.28Å; L342-I346 WeakPolarHBondContact O-CG1 3.03Å; L342-I346 PolarHBondContact O-N 3.24Å |
| 343 | W | 95.5 | Very high | 94.2 | Very high | 164 Ų | 164 | 91.3 Ų | 91.3 | 62% | 0.621 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -69.8 | -36.5 | -178 | -68.9 | 116.1 | 0 | 0 | 0 | 112.6 | N339 I346 A347 | N339-W343 PolarHBondContact O-N 2.85Å; N339-W343 VanDerWaalsContact O-N 3.1Å; W343-I346 HydrophobicContact CE3-CD1 4.17Å; W343-I346 HydrophobicContact CZ3-CD1 4.28Å; W343-I346 PolarHBondContact O-N 3.11Å; W343-A347 WeakPolarHBondContact O-CB 3.26Å; W343-A347 PolarHBondContact O-N 3.45Å |
| 344 | L | 95.5 | Very high | 94.6 | Very high | 110 Ų | 110 | 87.8 Ų | 87.8 | 58% | 0.576 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.6 | -46.5 | 175 | -177.6 | 69.5 | 0 | 0 | 0 | 111.5 | I340 A347 L348 | I340-L344 WeakPolarHBondContact O-CB 3.43Å; I340-L344 PolarHBondContact O-N 3.36Å; I340-L344 VanDerWaalsContact O-N 3.13Å; L344-A347 PolarHBondContact O-N 3.5Å; L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 PolarHBondContact O-N 2.89Å |
| 345 | M | 96.9 | Very high | 94.8 | Very high | 114 Ų | 114 | 87.1 Ų | 87.1 | 56% | 0.562 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -67.4 | -38.4 | -179.4 | -72.6 | -58.9 | -65.7 | 0 | 0 | 112.3 | V341 L342 L348 A349 | V341-M345 HydrophobicContact CG1-CG 4.18Å; V341-M345 WeakPolarHBondContact O-CB 3.26Å; V341-M345 VanDerWaalsContact O-CG 3.25Å; V341-M345 WeakPolarHBondContact O-CG 3.36Å; V341-M345 PolarHBondContact O-N 3.41Å; L342-M345 PolarHBondContact O-N 2.86Å; M345-L348 PolarHBondContact O-N 3.48Å; M345-A349 VanDerWaalsContact O-CB 3.26Å; M345-A349 WeakPolarHBondContact O-CB 3.42Å; M345-A349 PolarHBondContact O-N 3.4Å |
| 346 | I | 96.5 | Very high | 95.2 | Very high | 75 Ų | 75 | 86.7 Ų | 86.7 | 39% | 0.385 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.8 | -47.2 | 175 | -69.3 | 167.3 | 0 | 0 | 0 | 110.5 | L342 W343 L348 A349 L350 | L342-I346 HydrophobicContact CD2-CD1 3.77Å; L342-I346 HydrophobicContact CG-CD1 3.98Å; L342-I346 VanDerWaalsContact O-CG1 3.28Å; L342-I346 WeakPolarHBondContact O-CG1 3.03Å; L342-I346 PolarHBondContact O-N 3.24Å; W343-I346 HydrophobicContact CE3-CD1 4.17Å; W343-I346 HydrophobicContact CZ3-CD1 4.28Å; W343-I346 PolarHBondContact O-N 3.11Å; I346-L348 VanDerWaalsContact C-N 3.34Å; I346-L348 PolarHBondContact O-N 2.92Å; I346-A349 PolarHBondContact O-N 2.99Å; I346-L350 HydrophobicContact CG2-CD1 4.13Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.36Å |
| 347 | A | 96.4 | Very high | 95.5 | Very high | 58 Ų | 58 | 89.5 Ų | 89.5 | 48% | 0.479 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | W343 L344 L350 A351 | W343-A347 WeakPolarHBondContact O-CB 3.26Å; W343-A347 PolarHBondContact O-N 3.45Å; L344-A347 PolarHBondContact O-N 3.5Å; A347-L350 PolarHBondContact O-N 3.13Å; A347-A351 WeakPolarHBondContact O-CB 3.48Å; A347-A351 PolarHBondContact O-N 3Å |
| 348 | L | 95 | Very high | 95.5 | Very high | 98 Ų | 98 | 90.9 Ų | 90.9 | 51% | 0.513 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.3 | -41.1 | 179.4 | -159.6 | 153.7 | 0 | 0 | 0 | 111.5 | L344 M345 I346 A351 V352 | L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 PolarHBondContact O-N 2.89Å; M345-L348 PolarHBondContact O-N 3.48Å; I346-L348 VanDerWaalsContact C-N 3.34Å; I346-L348 PolarHBondContact O-N 2.92Å; L348-A351 PolarHBondContact O-N 3.05Å; L348-V352 HydrophobicContact CD2-CG2 4.08Å; L348-V352 WeakPolarHBondContact O-CG2 3.31Å; L348-V352 PolarHBondContact O-N 2.82Å |
| 349 | A | 96.4 | Very high | 95.5 | Very high | 49 Ų | 49 | 91.8 Ų | 91.8 | 41% | 0.405 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | M345 I346 A351 V352 I353 | M345-A349 VanDerWaalsContact O-CB 3.26Å; M345-A349 WeakPolarHBondContact O-CB 3.42Å; M345-A349 PolarHBondContact O-N 3.4Å; I346-A349 PolarHBondContact O-N 2.99Å; A349-A351 VanDerWaalsContact C-N 3.33Å; A349-A351 PolarHBondContact O-N 3.11Å; A349-V352 PolarHBondContact O-N 3.1Å; A349-I353 VanDerWaalsContact O-CG1 3.27Å; A349-I353 WeakPolarHBondContact O-CG1 3.45Å; A349-I353 PolarHBondContact O-N 3.1Å |
| 350 | L | 96.1 | Very high | 95.4 | Very high | 109 Ų | 109 | 98.8 Ų | 98.8 | 57% | 0.571 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -39.7 | 175.8 | -73.3 | 173.5 | 0 | 0 | 0 | 112.1 | I346 A347 I353 A354 | I346-L350 HydrophobicContact CG2-CD1 4.13Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.36Å; A347-L350 PolarHBondContact O-N 3.13Å; L350-I353 PolarHBondContact O-N 3.05Å; L350-A354 WeakPolarHBondContact O-CB 3.49Å; L350-A354 PolarHBondContact O-N 2.92Å |
| 351 | A | 96 | Very high | 95.2 | Very high | 49 Ų | 49 | 97.7 Ų | 97.7 | 41% | 0.405 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A347 L348 A349 A354 I355 | A347-A351 WeakPolarHBondContact O-CB 3.48Å; A347-A351 PolarHBondContact O-N 3Å; L348-A351 PolarHBondContact O-N 3.05Å; A349-A351 VanDerWaalsContact C-N 3.33Å; A349-A351 PolarHBondContact O-N 3.11Å; A351-A354 PolarHBondContact O-N 2.93Å; A351-I355 VanDerWaalsContact O-CG1 3.31Å; A351-I355 WeakPolarHBondContact O-CG1 3.23Å; A351-I355 PolarHBondContact O-N 3.12Å |
| 352 | V | 97.1 | Very high | 94.8 | Very high | 85 Ų | 85 | 100.2 Ų | 100.2 | 52% | 0.515 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 176.8 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | L348 A349 A354 I355 A356 | L348-V352 HydrophobicContact CD2-CG2 4.08Å; L348-V352 WeakPolarHBondContact O-CG2 3.31Å; L348-V352 PolarHBondContact O-N 2.82Å; A349-V352 PolarHBondContact O-N 3.1Å; V352-A354 VanDerWaalsContact C-N 3.34Å; V352-A354 PolarHBondContact O-N 3.1Å; V352-I355 PolarHBondContact O-N 3.17Å; V352-A356 VanDerWaalsContact O-CB 3.27Å; V352-A356 WeakPolarHBondContact O-CB 3.42Å; V352-A356 PolarHBondContact O-N 3.15Å |
| 353 | I | 96.6 | Very high | 94.1 | Very high | 108 Ų | 108 | 102.6 Ų | 102.6 | 55% | 0.554 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.7 | -45 | 177 | -68.8 | 164.8 | 0 | 0 | 0 | 110.7 | A349 L350 A356 Y357 | A349-I353 VanDerWaalsContact O-CG1 3.27Å; A349-I353 WeakPolarHBondContact O-CG1 3.45Å; A349-I353 PolarHBondContact O-N 3.1Å; L350-I353 PolarHBondContact O-N 3.05Å; I353-A356 PolarHBondContact O-N 3.27Å; I353-Y357 WeakPolarHBondContact O-CB 3.47Å; I353-Y357 PolarHBondContact O-N 3.16Å |
| 354 | A | 95.4 | Very high | 93.2 | Very high | 48 Ų | 48 | 99.2 Ų | 99.2 | 40% | 0.397 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L350 A351 V352 Y357 N358 | L350-A354 WeakPolarHBondContact O-CB 3.49Å; L350-A354 PolarHBondContact O-N 2.92Å; A351-A354 PolarHBondContact O-N 2.93Å; V352-A354 VanDerWaalsContact C-N 3.34Å; V352-A354 PolarHBondContact O-N 3.1Å; A354-Y357 PolarHBondContact O-N 2.79Å; A354-N358 PolarHBondContact O-N 3.39Å; A354-N358 PolarHBondContact O-ND2 3.3Å |
| 355 | I | 95.8 | Very high | 92.2 | Very high | 106 Ų | 106 | 95.9 Ų | 95.9 | 54% | 0.544 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.4 | -44.9 | 177.7 | -66 | 164.5 | 0 | 0 | 0 | 110.5 | A351 V352 Y357 N358 L359 | A351-I355 VanDerWaalsContact O-CG1 3.31Å; A351-I355 WeakPolarHBondContact O-CG1 3.23Å; A351-I355 PolarHBondContact O-N 3.12Å; V352-I355 PolarHBondContact O-N 3.17Å; I355-Y357 VanDerWaalsContact C-N 3.34Å; I355-Y357 PolarHBondContact O-N 3.35Å; I355-N358 PolarHBondContact O-N 3.05Å; I355-L359 HydrophobicContact CG2-CD1 3.98Å; I355-L359 HydrophobicContact CG2-CG 4.49Å; I355-L359 WeakPolarHBondContact O-CG 3.3Å; I355-L359 PolarHBondContact O-N 2.91Å |
| 356 | A | 96.2 | Very high | 90.6 | Very high | 53 Ų | 53 | 96.5 Ų | 96.5 | 44% | 0.438 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | V352 I353 L359 W360 | V352-A356 VanDerWaalsContact O-CB 3.27Å; V352-A356 WeakPolarHBondContact O-CB 3.42Å; V352-A356 PolarHBondContact O-N 3.15Å; I353-A356 PolarHBondContact O-N 3.27Å; A356-L359 PolarHBondContact O-N 3.47Å; A356-W360 VanDerWaalsContact O-CB 3.31Å; A356-W360 WeakPolarHBondContact O-CB 3.46Å; A356-W360 PolarHBondContact O-N 3.12Å |
| 357 | Y | 95.4 | Very high | 89 | Confident | 151 Ų | 151 | 99.4 Ų | 99.4 | 59% | 0.592 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.8 | -42.4 | 176.6 | -176.5 | -97.5 | 0 | 0 | 0 | 112.2 | I353 A354 I355 W360 N361 | I353-Y357 WeakPolarHBondContact O-CB 3.47Å; I353-Y357 PolarHBondContact O-N 3.16Å; A354-Y357 PolarHBondContact O-N 2.79Å; I355-Y357 VanDerWaalsContact C-N 3.34Å; I355-Y357 PolarHBondContact O-N 3.35Å; Y357-W360 PolarHBondContact O-N 3.01Å; Y357-N361 WeakPolarHBondContact CE1-ND2 3.47Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.34Å; Y357-N361 PolarHBondContact O-N 3.11Å; Y357-N361 PolarHBondContact OH-ND2 3.05Å |
| 358 | N | 92.5 | Very high | 87.4 | Confident | 109 Ų | 109 | 101.3 Ų | 101.3 | 58% | 0.583 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.5 | -39.4 | 176.6 | -75.6 | -59.9 | 0 | 0 | 0 | 112.2 | A354 I355 N361 M362 | A354-N358 PolarHBondContact O-N 3.39Å; A354-N358 PolarHBondContact O-ND2 3.3Å; I355-N358 PolarHBondContact O-N 3.05Å; N358-N361 CarbonylContact O-C 3.6Å; N358-N361 PolarHBondContact O-N 2.78Å; N358-M362 PolarHBondContact O-N 3.48Å |
| 359 | L | 92.8 | Very high | 86.1 | Confident | 113 Ų | 113 | 102.3 Ų | 102.3 | 59% | 0.592 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.5 | -38.9 | 174.2 | -75.6 | 170.6 | 0 | 0 | 0 | 112 | I355 A356 N361 M362 | I355-L359 HydrophobicContact CG2-CD1 3.98Å; I355-L359 HydrophobicContact CG2-CG 4.49Å; I355-L359 WeakPolarHBondContact O-CG 3.3Å; I355-L359 PolarHBondContact O-N 2.91Å; A356-L359 PolarHBondContact O-N 3.47Å; L359-N361 VanDerWaalsContact C-N 3.33Å; L359-M362 WeakPolarHBondContact O-CB 3.46Å; L359-M362 PolarHBondContact O-N 3.08Å |
| 360 | W | 92.6 | Very high | 84.5 | Confident | 223 Ų | 223 | 103.4 Ų | 103.4 | 85% | 0.845 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.6 | -40.7 | 177.3 | -172.3 | -75.5 | 0 | 0 | 0 | 111.9 | A356 Y357 | A356-W360 VanDerWaalsContact O-CB 3.31Å; A356-W360 WeakPolarHBondContact O-CB 3.46Å; A356-W360 PolarHBondContact O-N 3.12Å; Y357-W360 PolarHBondContact O-N 3.01Å |
| 361 | N | 89.8 | Confident | 82.7 | Confident | 89 Ų | 89 | 104.4 Ų | 104.4 | 48% | 0.476 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.7 | 21.9 | 179.8 | -72.1 | -22.4 | 0 | 0 | 0 | 113.2 | Y357 N358 L359 D363 | Y357-N361 WeakPolarHBondContact CE1-ND2 3.47Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.34Å; Y357-N361 PolarHBondContact O-N 3.11Å; Y357-N361 PolarHBondContact OH-ND2 3.05Å; N358-N361 CarbonylContact O-C 3.6Å; N358-N361 PolarHBondContact O-N 2.78Å; L359-N361 VanDerWaalsContact C-N 3.33Å; N361-D363 PolarHBondContact O-N 3.48Å; N361-D363 VanDerWaalsContact O-N 3.13Å |
| 362 | M | 87.1 | Confident | 81.1 | Confident | 132 Ų | 132 | 112.3 Ų | 112.3 | 65% | 0.65 | 57% | 0.572 | S | S | * | * | trans | -67.2 | 115.5 | 176 | -169 | 171.3 | 68.5 | 0 | 0 | 108.4 | N358 L359 P364 | N358-M362 PolarHBondContact O-N 3.48Å; L359-M362 WeakPolarHBondContact O-CB 3.46Å; L359-M362 PolarHBondContact O-N 3.08Å; M362-P364 VanDerWaalsContact O-CD 3.26Å; M362-P364 WeakPolarHBondContact O-CD 3.48Å | ||
| 363 | D | 81.5 | Confident | 79.5 | Confident | 111 Ų | 111 | 115.7 Ų | 115.7 | 59% | 0.594 | 58% | 0.584 | S | S | * | * | trans | -63.1 | 116.2 | 177.5 | -175 | -5.9 | 0 | 0 | 0 | 108.6 | N361 G365 | N361-D363 PolarHBondContact O-N 3.48Å; N361-D363 VanDerWaalsContact O-N 3.13Å; D363-G365 PolarHBondContact O-N 3.39Å; D363-G365 VanDerWaalsContact O-N 3.13Å; D363-G365 PolarHBondContact OD1-N 3.21Å | ||
| 364 | P | 76.5 | Confident | 77.9 | Confident | 94 Ų | 94 | 115.3 Ų | 115.3 | 61% | 0.61 | 59% | 0.587 | S | S | * | * | trans | -70 | -5.4 | -179.4 | 29.5 | -35 | 0 | 0 | 0 | 112.8 | M362 | M362-P364 VanDerWaalsContact O-CD 3.26Å; M362-P364 WeakPolarHBondContact O-CD 3.48Å | ||
| 365 | G | 73.4 | Confident | 76.1 | Confident | 40 Ų | 40 | 118.7 Ų | 118.7 | 41% | 0.412 | 60% | 0.599 | S | S | . | * | trans | 71.4 | 104.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 109 | D363 D367 | D363-G365 PolarHBondContact O-N 3.39Å; D363-G365 VanDerWaalsContact O-N 3.13Å; D363-G365 PolarHBondContact OD1-N 3.21Å; G365-D367 PolarHBondContact O-N 3.5Å | ||
| 366 | Y | 63.1 | Low | 74.3 | Confident | 126 Ų | 126 | 121.7 Ų | 121.7 | 49% | 0.494 | 61% | 0.61 | S | S | . | * | trans | -69.4 | 13.7 | -176.2 | -74.3 | -81 | 0 | 0 | 0 | 114.8 | I370 Y371 | Y366-I370 HydrophobicContact CD1-CB 4.38Å; Y366-I370 HydrophobicContact CD1-CD1 4.49Å; Y366-I370 HydrophobicContact CD1-CG2 3.83Å; Y366-I370 HydrophobicContact CE1-CG2 4.22Å; Y366-Y371 WeakPolarHBondContact O-CD2 3.45Å; Y366-Y371 VanDerWaalsContact O-CE2 3.27Å; Y366-Y371 WeakPolarHBondContact O-CE2 3.23Å | ||
| 367 | D | 63.1 | Low | 72.4 | Confident | 137 Ų | 137 | 128.1 Ų | 128.1 | 73% | 0.733 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | 136.8 | -172.2 | -73.6 | -28.9 | 0 | 0 | 0 | 113.3 | G365 | G365-D367 PolarHBondContact O-N 3.5Š|
| 368 | S | 64.1 | Low | 70.9 | Confident | 98 Ų | 98 | 127.6 Ų | 127.6 | 69% | 0.685 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 84.5 | -77.6 | 175.8 | 75.5 | 0 | 0 | 0 | 0 | 118.8 | ||
| 369 | I | 66.7 | Low | 69 | Low | 119 Ų | 119 | 132.9 Ų | 132.9 | 61% | 0.61 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -86.9 | -36.2 | -168.2 | -72.2 | 170.4 | 0 | 0 | 0 | 113 | R372 M373 | I369-R372 WeakPolarHBondContact O-CB 3.5Å; I369-R372 PolarHBondContact O-N 3.16Å; I369-M373 PolarHBondContact O-N 3.27Å |
| 370 | I | 62.2 | Low | 67 | Low | 72 Ų | 72 | 136 Ų | 136 | 37% | 0.369 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -70 | -41.3 | -175.9 | -59.6 | -179.6 | 0 | 0 | 0 | 110.8 | Y366 R372 M373 T374 | Y366-I370 HydrophobicContact CD1-CB 4.38Å; Y366-I370 HydrophobicContact CD1-CD1 4.49Å; Y366-I370 HydrophobicContact CD1-CG2 3.83Å; Y366-I370 HydrophobicContact CE1-CG2 4.22Å; I370-R372 VanDerWaalsContact C-N 3.29Å; I370-R372 PolarHBondContact O-N 3.27Å; I370-M373 PolarHBondContact O-N 3.14Å; I370-M373 VanDerWaalsContact O-N 3.16Å; I370-T374 HydrophobicContact CG2-CG2 4.4Å; I370-T374 PolarHBondContact O-N 3.12Å; I370-T374 VanDerWaalsContact O-N 3.07Å; I370-T374 PolarHBondContact O-OG1 3.45Å; I370-T374 VanDerWaalsContact O-OG1 3.05Å |
| 371 | Y | 59.7 | Low | 64.8 | Low | 129 Ų | 129 | 136 Ų | 136 | 51% | 0.506 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -63.5 | -30 | 172.6 | -85.3 | -65.3 | 0 | 0 | 0 | 113.9 | Y366 M373 N375 | Y366-Y371 WeakPolarHBondContact O-CD2 3.45Å; Y366-Y371 VanDerWaalsContact O-CE2 3.27Å; Y366-Y371 WeakPolarHBondContact O-CE2 3.23Å; Y371-M373 VanDerWaalsContact C-N 3.29Å; Y371-M373 PolarHBondContact O-N 3.35Å; Y371-N375 WeakPolarHBondContact O-CB 3.39Å; Y371-N375 PolarHBondContact O-N 3.02Å; Y371-N375 VanDerWaalsContact O-N 3.13Å |
| 372 | R | 62.7 | Low | 63.6 | Low | 215 Ų | 215 | 138.4 Ų | 138.4 | 81% | 0.811 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -67.8 | -30.7 | 175.4 | -173.3 | 179.5 | 179.3 | -171.3 | 0.4 | 112 | I369 I370 | I369-R372 WeakPolarHBondContact O-CB 3.5Å; I369-R372 PolarHBondContact O-N 3.16Å; I370-R372 VanDerWaalsContact C-N 3.29Å; I370-R372 PolarHBondContact O-N 3.27Å |
| 373 | M | 63.1 | Low | 62.3 | Low | 156 Ų | 156 | 138.7 Ų | 138.7 | 77% | 0.768 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -84.8 | -33.1 | 177.2 | -72.4 | -141.8 | -176.1 | 0 | 0 | 113.3 | I369 I370 Y371 | I369-M373 PolarHBondContact O-N 3.27Å; I370-M373 PolarHBondContact O-N 3.14Å; I370-M373 VanDerWaalsContact O-N 3.16Å; Y371-M373 VanDerWaalsContact C-N 3.29Å; Y371-M373 PolarHBondContact O-N 3.35Å |
| 374 | T | 62.3 | Low | 61.3 | Low | 101 Ų | 101 | 140.3 Ų | 140.3 | 62% | 0.62 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -91 | -19.7 | -174.4 | 54.2 | 0 | 0 | 0 | 0 | 114.4 | I370 | I370-T374 HydrophobicContact CG2-CG2 4.4Å; I370-T374 PolarHBondContact O-N 3.12Å; I370-T374 VanDerWaalsContact O-N 3.07Å; I370-T374 PolarHBondContact O-OG1 3.45Å; I370-T374 VanDerWaalsContact O-OG1 3.05Å |
| 375 | N | 57.7 | Low | 60.4 | Low | 119 Ų | 119 | 143 Ų | 143 | 64% | 0.636 | 70% | 0.699 | S | S | * | * | trans | -113.4 | 66.8 | -177.3 | -141 | -4.2 | 0 | 0 | 0 | 112 | Y371 K377 | Y371-N375 WeakPolarHBondContact O-CB 3.39Å; Y371-N375 PolarHBondContact O-N 3.02Å; Y371-N375 VanDerWaalsContact O-N 3.13Å; N375-K377 VanDerWaalsContact C-N 3.27Å; N375-K377 PolarHBondContact O-N 2.67Å | ||
| 376 | Q | 58.8 | Low | 59.6 | Low | 168 Ų | 168 | 149.4 Ų | 149.4 | 79% | 0.785 | 72% | 0.716 | S | S | * | * | trans | -74.2 | 83.6 | 164.3 | -74.1 | -171.2 | -26 | 0 | 0 | 109.1 | I378 | Q376-I378 PolarHBondContact O-N 2.88Š| ||
| 377 | K | 56.1 | Low | 59.3 | Low | 189 Ų | 189 | 151 Ų | 151 | 82% | 0.822 | 73% | 0.731 | S | S | * | * | trans | -65.8 | 97.8 | 169.5 | -171.6 | 175 | -176.3 | 177.6 | 0 | 108.6 | N375 R379 | N375-K377 VanDerWaalsContact C-N 3.27Å; N375-K377 PolarHBondContact O-N 2.67Å; K377-R379 PolarHBondContact O-N 3.31Å | ||
| 378 | I | 63.4 | Low | 59.1 | Low | 140 Ų | 140 | 152 Ų | 152 | 72% | 0.718 | 73% | 0.731 | S | S | * | * | trans | -63.4 | 115.2 | 170.5 | -63.1 | 169.2 | 0 | 0 | 0 | 107.2 | Q376 M380 | Q376-I378 PolarHBondContact O-N 2.88Å; I378-M380 PolarHBondContact O-N 3.16Å | ||
| 379 | R | 52.2 | Low | 58.7 | Low | 220 Ų | 220 | 156.2 Ų | 156.2 | 83% | 0.83 | 74% | 0.735 | S | S | * | * | trans | -71.8 | 118.5 | 165.2 | -101.9 | -179.2 | 159.1 | 174 | -6.9 | 107.2 | K377 | K377-R379 PolarHBondContact O-N 3.31Š| ||
| 380 | M | 50.7 | Low | 58 | Low | 179 Ų | 179 | 159.3 Ų | 159.3 | 88% | 0.882 | 75% | 0.745 | S | S | * | * | trans | -85.3 | 118.2 | 160.2 | -70.1 | -138 | 160.8 | 0 | 0 | 107 | I378 | I378-M380 PolarHBondContact O-N 3.16Š| ||
| 381 | D | 47.3 | Very low | 57.6 | Low | 223 Ų | 223 | 167.2 Ų | 167.2 | 100% | 1.193 | 78% | 0.779 | S | S | * | * | trans | -84.1 | 0 | 167.7 | -69.1 | -28.9 | 0 | 0 | 0 | 110.3 |
Retrieved 381 of 381 residues in 327.5 ms
(Link to these results)