| 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 | 46.7 | Very low | 59.7 | Low | 244 Ų | 244 | 100.8 Ų | 100.8 | 100% | 1.202 | 62% | 0.619 | S | S | * | * | 0 | 90 | 0 | -61.5 | 175.6 | 107.3 | 0 | 0 | 107.4 | S3 | M1-S3 PolarHBondContact O-N 3.29Š| |||
| 2 | V | 46.7 | Very low | 60.6 | Low | 147 Ų | 147 | 96.6 Ų | 96.6 | 89% | 0.891 | 60% | 0.602 | S | S | * | * | trans | -77.5 | 110.8 | -174.9 | 166.1 | 0 | 0 | 0 | 0 | 109.1 | A4 | V2-A4 PolarHBondContact O-N 3.18Š| ||
| 3 | S | 50.3 | Low | 61.6 | Low | 70 Ų | 70 | 96.8 Ų | 96.8 | 49% | 0.49 | 60% | 0.595 | S | S | . | * | trans | 31.3 | 69.1 | 147.8 | -151.6 | 0 | 0 | 0 | 0 | 118.1 | M1 A5 A6 P7 | M1-S3 PolarHBondContact O-N 3.29Å; S3-A5 PolarHBondContact O-N 3.45Å; S3-A6 VanDerWaalsContact OG-CB 3.29Å; S3-A6 WeakPolarHBondContact OG-CB 3.08Å; S3-A6 PolarHBondContact OG-N 2.97Å; S3-P7 WeakPolarHBondContact O-CD 3.49Å | ||
| 4 | A | 54.3 | Low | 62.6 | Low | 87 Ų | 87 | 98.4 Ų | 98.4 | 72% | 0.719 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -70.5 | -11.5 | 161.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V2 P7 | V2-A4 PolarHBondContact O-N 3.18Å; A4-P7 WeakPolarHBondContact O-CD 3.37Å; A4-P7 WeakPolarHBondContact O-CG 3.28Å |
| 5 | A | 53.8 | Low | 63.3 | Low | 72 Ų | 72 | 99.7 Ų | 99.7 | 60% | 0.595 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -82.9 | -30.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | S3 S8 L9 | S3-A5 PolarHBondContact O-N 3.45Å; A5-S8 PolarHBondContact O-N 3.28Å; A5-L9 WeakPolarHBondContact O-CB 2.79Å; A5-L9 PolarHBondContact O-N 2.83Å |
| 6 | A | 55.3 | Low | 63.4 | Low | 48 Ų | 48 | 100.9 Ų | 100.9 | 40% | 0.397 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -59.8 | -46.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S3 S8 L9 L10 | S3-A6 VanDerWaalsContact OG-CB 3.29Å; S3-A6 WeakPolarHBondContact OG-CB 3.08Å; S3-A6 PolarHBondContact OG-N 2.97Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 2.84Å; A6-L9 PolarHBondContact O-N 2.74Å; A6-L10 PolarHBondContact O-N 3.07Å; A6-L10 VanDerWaalsContact O-N 3.08Å |
| 7 | P | 65.2 | Low | 63.6 | Low | 65 Ų | 65 | 102.3 Ų | 102.3 | 42% | 0.422 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.6 | -35.4 | 175.9 | 25.2 | -32.9 | 0 | 0 | 0 | 111.6 | S3 A4 L9 L10 I11 | S3-P7 WeakPolarHBondContact O-CD 3.49Å; A4-P7 WeakPolarHBondContact O-CD 3.37Å; A4-P7 WeakPolarHBondContact O-CG 3.28Å; P7-L9 VanDerWaalsContact C-N 3.35Å; P7-L9 PolarHBondContact O-N 2.84Å; P7-L10 PolarHBondContact O-N 3.19Å; P7-I11 WeakPolarHBondContact O-CB 3.38Å; P7-I11 VanDerWaalsContact O-CD1 3.31Å; P7-I11 WeakPolarHBondContact O-CD1 3.16Å; P7-I11 WeakPolarHBondContact O-CG1 3.3Å; P7-I11 PolarHBondContact O-N 2.95Å |
| 8 | S | 66.1 | Low | 63.7 | Low | 76 Ų | 76 | 100.2 Ų | 100.2 | 53% | 0.531 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.7 | -36.9 | 177.3 | -174.5 | 0 | 0 | 0 | 0 | 112.7 | A5 A6 A12 | A5-S8 PolarHBondContact O-N 3.28Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 2.84Å; S8-A12 WeakPolarHBondContact O-CB 3.24Å; S8-A12 PolarHBondContact O-N 2.77Å |
| 9 | L | 69.1 | Low | 63.1 | Low | 98 Ų | 98 | 99.2 Ų | 99.2 | 51% | 0.513 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.1 | -40.1 | 177.1 | -156.9 | 101.1 | 0 | 0 | 0 | 111.1 | A5 A6 P7 A12 L13 V112 | A5-L9 WeakPolarHBondContact O-CB 2.79Å; A5-L9 PolarHBondContact O-N 2.83Å; A6-L9 PolarHBondContact O-N 2.74Å; P7-L9 VanDerWaalsContact C-N 3.35Å; P7-L9 PolarHBondContact O-N 2.84Å; L9-A12 PolarHBondContact O-N 2.81Å; L9-L13 VanDerWaalsContact O-CB 3.31Å; L9-L13 WeakPolarHBondContact O-CB 3.43Å; L9-L13 PolarHBondContact O-N 3.19Å; L9-V112 HydrophobicContact CD1-CG1 4.18Å |
| 10 | L | 73.5 | Confident | 62.4 | Low | 105 Ų | 105 | 99.6 Ų | 99.6 | 55% | 0.55 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -63 | -43.8 | 173.4 | -81.9 | 165.9 | 0 | 0 | 0 | 111.7 | A6 P7 L13 L14 | A6-L10 PolarHBondContact O-N 3.07Å; A6-L10 VanDerWaalsContact O-N 3.08Å; P7-L10 PolarHBondContact O-N 3.19Å; L10-L13 PolarHBondContact O-N 2.95Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.13Å; L10-L14 PolarHBondContact O-N 2.74Å |
| 11 | I | 75.6 | Confident | 61.7 | Low | 97 Ų | 97 | 99.5 Ų | 99.5 | 50% | 0.497 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.7 | -43.4 | 176.6 | -67.1 | 161 | 0 | 0 | 0 | 110.5 | P7 L13 L14 L15 | P7-I11 WeakPolarHBondContact O-CB 3.38Å; P7-I11 VanDerWaalsContact O-CD1 3.31Å; P7-I11 WeakPolarHBondContact O-CD1 3.16Å; P7-I11 WeakPolarHBondContact O-CG1 3.3Å; P7-I11 PolarHBondContact O-N 2.95Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 3.05Å; I11-L14 PolarHBondContact O-N 3.17Å; I11-L15 HydrophobicContact CG2-CD1 3.94Å; I11-L15 HydrophobicContact CG2-CG 4.38Å; I11-L15 WeakPolarHBondContact O-CB 3.39Å; I11-L15 VanDerWaalsContact O-CG 3.24Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3.42Å |
| 12 | A | 71.1 | Confident | 61.6 | Low | 50 Ų | 50 | 91.8 Ų | 91.8 | 41% | 0.413 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.7 | -38.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S8 L9 L15 L16 | S8-A12 WeakPolarHBondContact O-CB 3.24Å; S8-A12 PolarHBondContact O-N 2.77Å; L9-A12 PolarHBondContact O-N 2.81Å; A12-L15 PolarHBondContact O-N 3.3Å; A12-L16 PolarHBondContact O-N 3.09Å |
| 13 | L | 72.7 | Confident | 61.5 | Low | 99 Ų | 99 | 91 Ų | 91 | 52% | 0.518 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67.2 | -41.8 | 175.9 | -171 | 69.5 | 0 | 0 | 0 | 111.8 | L9 L10 I11 L16 L17 | L9-L13 VanDerWaalsContact O-CB 3.31Å; L9-L13 WeakPolarHBondContact O-CB 3.43Å; L9-L13 PolarHBondContact O-N 3.19Å; L10-L13 PolarHBondContact O-N 2.95Å; I11-L13 VanDerWaalsContact C-N 3.32Å; I11-L13 PolarHBondContact O-N 3.05Å; L13-L16 PolarHBondContact O-N 3.33Å; L13-L17 HydrophobicContact CD1-CD1 4.46Å; L13-L17 PolarHBondContact O-N 3.46Å |
| 14 | L | 75.9 | Confident | 61 | Low | 120 Ų | 120 | 94.4 Ų | 94.4 | 63% | 0.628 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65 | -38.4 | 175.1 | -72.9 | 169.3 | 0 | 0 | 0 | 111.9 | L10 I11 G18 | L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.13Å; L10-L14 PolarHBondContact O-N 2.74Å; I11-L14 PolarHBondContact O-N 3.17Å; L14-G18 PolarHBondContact O-N 3.35Å |
| 15 | L | 73.2 | Confident | 60.5 | Low | 118 Ų | 118 | 96.1 Ų | 96.1 | 62% | 0.618 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.2 | -39 | 174.2 | -71.7 | 169.7 | 0 | 0 | 0 | 111.6 | I11 A12 G18 S19 | I11-L15 HydrophobicContact CG2-CD1 3.94Å; I11-L15 HydrophobicContact CG2-CG 4.38Å; I11-L15 WeakPolarHBondContact O-CB 3.39Å; I11-L15 VanDerWaalsContact O-CG 3.24Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3.42Å; A12-L15 PolarHBondContact O-N 3.3Å; L15-G18 PolarHBondContact O-N 2.92Å; L15-S19 WeakPolarHBondContact O-CB 3.4Å; L15-S19 PolarHBondContact O-N 3.28Å; L15-S19 PolarHBondContact O-OG 2.96Å |
| 16 | L | 65.4 | Low | 59.6 | Low | 118 Ų | 118 | 104.2 Ų | 104.2 | 62% | 0.618 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.3 | -46.1 | 174.6 | -119.6 | 75.9 | 0 | 0 | 0 | 111.7 | A12 L13 S19 | A12-L16 PolarHBondContact O-N 3.09Å; L13-L16 PolarHBondContact O-N 3.33Å; L16-S19 PolarHBondContact O-N 3.41Å; L16-S19 PolarHBondContact O-OG 3.09Å |
| 17 | L | 66.8 | Low | 58.9 | Low | 125 Ų | 125 | 107.1 Ų | 107.1 | 65% | 0.654 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.6 | -36.3 | 177.2 | -99.6 | 65.5 | 0 | 0 | 0 | 112.8 | L13 S19 | L13-L17 HydrophobicContact CD1-CD1 4.46Å; L13-L17 PolarHBondContact O-N 3.46Å; L17-S19 VanDerWaalsContact C-N 3.31Å |
| 18 | G | 65 | Low | 57.6 | Low | 64 Ų | 64 | 109.6 Ų | 109.6 | 66% | 0.66 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -77.8 | -13.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L14 L15 | L14-G18 PolarHBondContact O-N 3.35Å; L15-G18 PolarHBondContact O-N 2.92Å |
| 19 | S | 52.8 | Low | 56.4 | Low | 81 Ų | 81 | 111.5 Ų | 111.5 | 57% | 0.566 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | 1.4 | 179.4 | 69 | 0 | 0 | 0 | 0 | 114.2 | L15 L16 L17 P21 | L15-S19 WeakPolarHBondContact O-CB 3.4Å; L15-S19 PolarHBondContact O-N 3.28Å; L15-S19 PolarHBondContact O-OG 2.96Å; L16-S19 PolarHBondContact O-N 3.41Å; L16-S19 PolarHBondContact O-OG 3.09Å; L17-S19 VanDerWaalsContact C-N 3.31Å; S19-P21 WeakPolarHBondContact O-CD 3.22Å; S19-P21 VanDerWaalsContact O-N 3.13Å |
| 20 | V | 49.5 | Very low | 54.9 | Low | 107 Ų | 107 | 114.9 Ų | 114.9 | 65% | 0.648 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -66.7 | 108.1 | 166.2 | 179.3 | 0 | 0 | 0 | 0 | 106.6 | A22 | V20-A22 PolarHBondContact O-N 2.83Š|
| 21 | P | 46.7 | Very low | 53.1 | Low | 99 Ų | 99 | 119 Ų | 119 | 64% | 0.643 | 68% | 0.681 | S | S | * | * | trans | -63.7 | 119.7 | 169.4 | 29.2 | -29.5 | 0 | 0 | 0 | 105 | S19 T23 | S19-P21 WeakPolarHBondContact O-CD 3.22Å; S19-P21 VanDerWaalsContact O-N 3.13Å; P21-T23 VanDerWaalsContact C-N 3.26Å; P21-T23 PolarHBondContact O-N 3.15Å | ||
| 22 | A | 45.1 | Very low | 51.5 | Low | 81 Ų | 81 | 118.9 Ų | 118.9 | 67% | 0.669 | 70% | 0.695 | S | S | * | * | trans | -50.9 | 105.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 105.3 | V20 D24 | V20-A22 PolarHBondContact O-N 2.83Å; A22-D24 PolarHBondContact O-N 3.45Å | ||
| 23 | T | 45.2 | Very low | 49.9 | Very low | 131 Ų | 131 | 120.3 Ų | 120.3 | 80% | 0.804 | 71% | 0.706 | S | S | * | * | trans | -68.7 | 79.1 | 162 | 47.8 | 0 | 0 | 0 | 0 | 104.9 | P21 T25 | P21-T23 VanDerWaalsContact C-N 3.26Å; P21-T23 PolarHBondContact O-N 3.15Å; T23-T25 PolarHBondContact O-N 3.37Å | ||
| 24 | D | 39.8 | Very low | 48.5 | Very low | 141 Ų | 141 | 124.1 Ų | 124.1 | 75% | 0.754 | 72% | 0.719 | S | S | * | * | trans | -54.2 | 120.6 | 167.6 | -107.3 | -38 | 0 | 0 | 0 | 106.3 | A22 R26 | A22-D24 PolarHBondContact O-N 3.45Å; D24-R26 PolarHBondContact O-N 2.86Å | ||
| 25 | T | 43.2 | Very low | 46.7 | Very low | 124 Ų | 124 | 126.9 Ų | 126.9 | 76% | 0.761 | 73% | 0.731 | S | S | * | * | trans | -45.9 | 116.7 | 167.2 | 41 | 0 | 0 | 0 | 0 | 109 | T23 S27 | T23-T25 PolarHBondContact O-N 3.37Å; T25-S27 PolarHBondContact O-N 2.95Å | ||
| 26 | R | 34.8 | Very low | 45.2 | Very low | 241 Ų | 241 | 128.3 Ų | 128.3 | 91% | 0.909 | 74% | 0.735 | S | S | * | * | trans | -48.6 | 93.2 | 171.4 | -173.3 | 175.7 | -171.5 | 155.1 | 0.6 | 110.2 | D24 | D24-R26 PolarHBondContact O-N 2.86Š| ||
| 27 | S | 40.7 | Very low | 44.2 | Very low | 109 Ų | 109 | 128.8 Ų | 128.8 | 76% | 0.762 | 74% | 0.738 | S | S | * | * | trans | -79.3 | 118.7 | 165.5 | 43.2 | 0 | 0 | 0 | 0 | 108.1 | T25 | T25-S27 PolarHBondContact O-N 2.95Š| ||
| 28 | V | 38.5 | Very low | 42.9 | Very low | 117 Ų | 117 | 130.1 Ų | 130.1 | 71% | 0.709 | 74% | 0.742 | S | S | * | * | trans | -70.9 | 126.4 | 175.4 | 172.6 | 0 | 0 | 0 | 0 | 108.4 | L30 | V28-L30 PolarHBondContact O-N 3.46Š| ||
| 29 | P | 40.5 | Very low | 41.8 | Very low | 116 Ų | 116 | 131.7 Ų | 131.7 | 75% | 0.753 | 75% | 0.749 | S | S | * | * | trans | -80.1 | 108.5 | 170.8 | 31 | -27.8 | 0 | 0 | 0 | 108.1 | K31 | P29-K31 PolarHBondContact O-N 2.84Š| ||
| 30 | L | 36.9 | Very low | 41.2 | Very low | 170 Ų | 170 | 131.5 Ų | 131.5 | 89% | 0.89 | 76% | 0.76 | S | S | * | * | trans | -70 | 94.8 | 172.6 | -154.6 | 125.2 | 0 | 0 | 0 | 107.9 | V28 A32 | V28-L30 PolarHBondContact O-N 3.46Å; L30-A32 PolarHBondContact O-N 2.97Å | ||
| 31 | K | 35.4 | Very low | 41.3 | Very low | 191 Ų | 191 | 132.1 Ų | 132.1 | 83% | 0.83 | 77% | 0.769 | S | S | * | * | trans | -78.5 | 99.3 | 179.1 | -159.7 | 171.3 | -174.7 | 166.6 | 0 | 108.7 | P29 A33 | P29-K31 PolarHBondContact O-N 2.84Å; K31-A33 PolarHBondContact O-N 3.32Å | ||
| 32 | A | 43.2 | Very low | 41.1 | Very low | 95 Ų | 95 | 130.7 Ų | 130.7 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | -69.2 | 107.3 | 162.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | L30 | L30-A32 PolarHBondContact O-N 2.97Š| ||
| 33 | A | 36.1 | Very low | 41.2 | Very low | 79 Ų | 79 | 134.9 Ų | 134.9 | 65% | 0.653 | 78% | 0.778 | S | S | * | * | trans | -166.4 | 105.7 | 155.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | K31 | K31-A33 PolarHBondContact O-N 3.32Š| ||
| 34 | F | 43 | Very low | 41.2 | Very low | 179 Ų | 179 | 132.3 Ų | 132.3 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | 64.8 | 88.9 | 96.6 | -156.4 | -89.5 | 0 | 0 | 0 | 111.9 | |||||
| 35 | M | 39.8 | Very low | 41.5 | Very low | 179 Ų | 179 | 135.1 Ų | 135.1 | 88% | 0.882 | 78% | 0.779 | S | S | * | * | trans | -148.8 | 92.7 | 147.5 | -103.5 | -162 | 74.4 | 0 | 0 | 109 | ||||
| 36 | E | 41.4 | Very low | 41.4 | Very low | 148 Ų | 148 | 133 Ų | 133 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -51.4 | 122.6 | 143.4 | -147.3 | 145.8 | 106.6 | 0 | 0 | 108.3 | ||||
| 37 | D | 43.2 | Very low | 41.7 | Very low | 127 Ų | 127 | 127.1 Ų | 127.1 | 68% | 0.679 | 78% | 0.778 | S | S | * | * | 153 | 145 | 97.6 | -148.5 | 4.2 | 0 | 0 | 0 | 113.7 | |||||
| 38 | M | 40.6 | Very low | 42.2 | Very low | 153 Ų | 153 | 127.5 Ų | 127.5 | 75% | 0.754 | 78% | 0.78 | S | S | * | * | trans | 93.5 | 121.4 | 143.3 | -149.2 | 58.3 | 87.3 | 0 | 0 | 123.7 | ||||
| 39 | A | 41 | Very low | 42.1 | Very low | 98 Ų | 98 | 126.7 Ų | 126.7 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | 72 | 123.5 | 155.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 40 | G | 41.7 | Very low | 41.7 | Very low | 77 Ų | 77 | 127 Ų | 127 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | cis | 137.2 | 130.5 | 30.2 | 0 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 41 | S | 50.7 | Low | 41.7 | Very low | 119 Ų | 119 | 124.1 Ų | 124.1 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | 164.8 | 149.7 | 77.7 | -170.4 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 42 | G | 41.4 | Very low | 42.5 | Very low | 69 Ų | 69 | 120.9 Ų | 120.9 | 71% | 0.711 | 78% | 0.783 | S | S | * | * | trans | 155.1 | 72.9 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 43 | E | 47.3 | Very low | 42.2 | Very low | 169 Ų | 169 | 122.2 Ų | 122.2 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | -45.5 | 156.6 | 160.3 | 64.1 | -132 | 73.5 | 0 | 0 | 113 | ||||
| 44 | A | 46.8 | Very low | 42.5 | Very low | 78 Ų | 78 | 126.5 Ų | 126.5 | 65% | 0.645 | 80% | 0.798 | S | S | * | * | cis | -169.1 | 159 | 31.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 45 | E | 45.6 | Very low | 43.4 | Very low | 200 Ų | 200 | 123 Ų | 123 | 94% | 0.935 | 79% | 0.793 | S | S | * | * | trans | 69.9 | 132.6 | 154.1 | -34.3 | -149.3 | 97.4 | 0 | 0 | 117.9 | ||||
| 46 | G | 40 | Very low | 44.2 | Very low | 79 Ų | 79 | 119.7 Ų | 119.7 | 81% | 0.814 | 79% | 0.785 | S | S | * | * | cis | 155.8 | 137 | 13.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 47 | S | 41.3 | Very low | 44.6 | Very low | 118 Ų | 118 | 116.9 Ų | 116.9 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -70.1 | 150.9 | -166.6 | -78.7 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 48 | S | 51.3 | Low | 44.4 | Very low | 116 Ų | 116 | 123.6 Ų | 123.6 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | 41.1 | 125.6 | 136.5 | -59.4 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 49 | A | 36 | Very low | 44.2 | Very low | 100 Ų | 100 | 122.6 Ų | 122.6 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | trans | -165.9 | 122.6 | 139.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 50 | S | 34.2 | Very low | 44.1 | Very low | 124 Ų | 124 | 122.6 Ų | 122.6 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | 57.5 | 134.4 | 139.3 | -143.5 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 51 | S | 36.6 | Very low | 44 | Very low | 108 Ų | 108 | 122.8 Ų | 122.8 | 76% | 0.755 | 79% | 0.792 | S | S | * | * | trans | -61.5 | -169.6 | 175.9 | -43.4 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 52 | P | 52.3 | Low | 43.5 | Very low | 123 Ų | 123 | 124.8 Ų | 124.8 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | cis | -140.6 | 160.5 | -0.2 | 39.6 | -20.4 | 0 | 0 | 0 | 116.9 | ||||
| 53 | S | 35.7 | Very low | 43.4 | Very low | 124 Ų | 124 | 126.6 Ų | 126.6 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | trans | -173.5 | 118.2 | 145.1 | 54.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 54 | L | 43.4 | Very low | 43.6 | Very low | 168 Ų | 168 | 124.5 Ų | 124.5 | 88% | 0.88 | 80% | 0.795 | S | S | * | * | trans | -116.6 | 170.2 | 160.6 | -98 | 156.6 | 0 | 0 | 0 | 106.3 | ||||
| 55 | P | 62.2 | Low | 43.4 | Very low | 106 Ų | 106 | 127.2 Ų | 127.2 | 69% | 0.688 | 80% | 0.804 | S | S | * | * | cis | -138.2 | -144.9 | -18.7 | 39.7 | -16.8 | 0 | 0 | 0 | 110.4 | ||||
| 56 | P | 56.4 | Low | 43.6 | Very low | 109 Ų | 109 | 122.9 Ų | 122.9 | 71% | 0.708 | 80% | 0.796 | S | S | * | * | cis | -138 | -143.1 | -12.1 | 33.8 | -6.3 | 0 | 0 | 0 | 113 | ||||
| 57 | P | 49.9 | Very low | 44 | Very low | 90 Ų | 90 | 127.1 Ų | 127.1 | 58% | 0.584 | 80% | 0.799 | S | S | * | * | -136.3 | 138.7 | -75.9 | 37.1 | -18.9 | 0 | 0 | 0 | 114.2 | |||||
| 58 | W | 38.2 | Very low | 44.2 | Very low | 267 Ų | 267 | 124.8 Ų | 124.8 | 100% | 1.011 | 79% | 0.794 | S | S | * | * | trans | -131.8 | 94.8 | 157.9 | -78.4 | 64.7 | 0 | 0 | 0 | 111 | ||||
| 59 | T | 36.3 | Very low | 43.8 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 82% | 0.816 | 79% | 0.794 | S | S | * | * | trans | -74.4 | 131 | 161.6 | 28.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 60 | A | 38 | Very low | 44.4 | Very low | 98 Ų | 98 | 128.1 Ų | 128.1 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -141.5 | 93.4 | 148.1 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 61 | A | 39.6 | Very low | 45.2 | Very low | 80 Ų | 80 | 127.3 Ų | 127.3 | 66% | 0.661 | 78% | 0.782 | S | S | * | * | 55.2 | 96.7 | 70.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 62 | L | 41.2 | Very low | 45.8 | Very low | 162 Ų | 162 | 127.9 Ų | 127.9 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | trans | 69.7 | 104.5 | 138 | -49.2 | 172.5 | 0 | 0 | 0 | 119 | ||||
| 63 | S | 39.9 | Very low | 45.6 | Very low | 107 Ų | 107 | 133.8 Ų | 133.8 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | 162.5 | 147.6 | 99.6 | -71.8 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 64 | P | 51.8 | Low | 46.2 | Very low | 124 Ų | 124 | 135.3 Ų | 135.3 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | trans | -84 | 129.8 | 174.5 | 34.2 | -29.6 | 0 | 0 | 0 | 110.1 | ||||
| 65 | T | 41.3 | Very low | 46.5 | Very low | 135 Ų | 135 | 131 Ų | 131 | 83% | 0.828 | 78% | 0.782 | S | S | * | * | trans | -142.9 | 117.2 | 166.5 | -67 | 0 | 0 | 0 | 0 | 110.3 | L67 | T65-L67 PolarHBondContact O-N 2.95Š| ||
| 66 | S | 49.9 | Very low | 46.4 | Very low | 110 Ų | 110 | 128.4 Ų | 128.4 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | -44.8 | 117.1 | 163.1 | 161.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 67 | L | 49.4 | Very low | 46.8 | Very low | 167 Ų | 167 | 129.4 Ų | 129.4 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -163 | 118.9 | 140.2 | -142.8 | 83.6 | 0 | 0 | 0 | 107.9 | T65 | T65-L67 PolarHBondContact O-N 2.95Š| ||
| 68 | G | 45.4 | Very low | 47.5 | Very low | 70 Ų | 70 | 130 Ų | 130 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | -71.2 | 162.4 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 69 | P | 42.9 | Very low | 48.8 | Very low | 123 Ų | 123 | 122.3 Ų | 122.3 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | trans | -94.7 | 124 | 142.4 | 0.4 | 19.4 | 0 | 0 | 0 | 108.2 | ||||
| 70 | Q | 48.8 | Very low | 50 | Low | 162 Ų | 162 | 120.4 Ų | 120.4 | 76% | 0.757 | 76% | 0.761 | S | S | * | * | trans | -29.6 | 126.5 | 155.9 | -107.4 | -89.8 | 62.1 | 0 | 0 | 110.9 | T72 | Q70-T72 VanDerWaalsContact C-N 3.28Å; Q70-T72 PolarHBondContact O-N 3.29Å | ||
| 71 | P | 50.2 | Low | 51.4 | Low | 108 Ų | 108 | 121.1 Ų | 121.1 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | trans | -65 | 101 | 163.8 | 26.5 | -29.6 | 0 | 0 | 0 | 106.5 | R73 | P71-R73 PolarHBondContact O-N 2.96Š| ||
| 72 | T | 48.4 | Very low | 53 | Low | 120 Ų | 120 | 122.2 Ų | 122.2 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | trans | -42 | 107.3 | 162.9 | -61.6 | 0 | 0 | 0 | 0 | 106.9 | Q70 L74 | Q70-T72 VanDerWaalsContact C-N 3.28Å; Q70-T72 PolarHBondContact O-N 3.29Å; T72-L74 PolarHBondContact O-N 3.37Å | ||
| 73 | R | 48.3 | Very low | 55.1 | Low | 246 Ų | 246 | 123.8 Ų | 123.8 | 93% | 0.928 | 75% | 0.751 | S | S | * | * | trans | -63.4 | 86.5 | 170.6 | -132.4 | -176.3 | -179.5 | 176 | -0.3 | 105.1 | P71 G75 | P71-R73 PolarHBondContact O-N 2.96Å; R73-G75 VanDerWaalsContact C-N 3.35Å; R73-G75 PolarHBondContact O-N 2.89Å | ||
| 74 | L | 48.3 | Very low | 57.2 | Low | 157 Ų | 157 | 124.9 Ų | 124.9 | 82% | 0.822 | 75% | 0.748 | S | S | * | * | trans | -59.8 | 105.1 | 169.7 | -158.2 | 82 | 0 | 0 | 0 | 104.3 | T72 G76 | T72-L74 PolarHBondContact O-N 3.37Å; L74-G76 PolarHBondContact O-N 3.45Å | ||
| 75 | G | 50.9 | Low | 58.7 | Low | 78 Ų | 78 | 122.9 Ų | 122.9 | 80% | 0.804 | 73% | 0.73 | S | S | * | * | trans | -64.5 | 80.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | R73 | R73-G75 VanDerWaalsContact C-N 3.35Å; R73-G75 PolarHBondContact O-N 2.89Å | ||
| 76 | G | 60.2 | Low | 60.8 | Low | 51 Ų | 51 | 117.2 Ų | 117.2 | 53% | 0.526 | 70% | 0.699 | S | S | . | * | P | Polyproline II helix | trans | -62.7 | 143 | 160.2 | 0 | 0 | 0 | 0 | 0 | 108 | L74 S78 | L74-G76 PolarHBondContact O-N 3.45Å; G76-S78 PolarHBondContact O-N 3.46Å; G76-S78 VanDerWaalsContact O-N 3.17Å |
| 77 | P | 64.3 | Low | 62.5 | Low | 130 Ų | 130 | 116 Ų | 116 | 84% | 0.844 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 127.9 | 176.8 | 18.6 | -29.7 | 0 | 0 | 0 | 109 | ||
| 78 | S | 64.1 | Low | 64.3 | Low | 102 Ų | 102 | 111.4 Ų | 111.4 | 71% | 0.713 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 127.5 | -178.8 | 46.4 | 0 | 0 | 0 | 0 | 108.9 | G76 | G76-S78 PolarHBondContact O-N 3.46Å; G76-S78 VanDerWaalsContact O-N 3.17Å |
| 79 | P | 66.6 | Low | 66.2 | Low | 106 Ų | 106 | 112.5 Ų | 112.5 | 69% | 0.688 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 135.3 | 175.6 | 22.6 | -30.9 | 0 | 0 | 0 | 108.5 | T81 | P79-T81 PolarHBondContact O-N 3.3Š|
| 80 | P | 61 | Low | 68.3 | Low | 93 Ų | 93 | 112.9 Ų | 112.9 | 60% | 0.604 | 64% | 0.64 | S | S | * | * | trans | -58.1 | 114.4 | -174.9 | 23.2 | -32.7 | 0 | 0 | 0 | 107.9 | N82 | P80-N82 PolarHBondContact O-N 2.9Š| ||
| 81 | T | 67.3 | Low | 70.1 | Confident | 112 Ų | 112 | 110.8 Ų | 110.8 | 69% | 0.687 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -70.2 | -13.9 | -175.8 | 57.2 | 0 | 0 | 0 | 0 | 111.3 | P79 | P79-T81 PolarHBondContact O-N 3.3Š|
| 82 | N | 73.1 | Confident | 71.8 | Confident | 104 Ų | 104 | 114.7 Ų | 114.7 | 56% | 0.556 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -152.7 | 137.3 | 178.9 | -65.1 | -77.3 | 0 | 0 | 0 | 110.5 | P80 L84 D85 | P80-N82 PolarHBondContact O-N 2.9Å; N82-L84 PolarHBondContact O-N 3.21Å; N82-L84 VanDerWaalsContact O-N 3.09Å; N82-D85 VanDerWaalsContact O-CB 3.3Å; N82-D85 WeakPolarHBondContact O-CB 3.46Å; N82-D85 PolarHBondContact O-N 3.05Å |
| 83 | F | 84.4 | Confident | 73.8 | Confident | 194 Ų | 194 | 116.2 Ų | 116.2 | 85% | 0.851 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -53.4 | -31 | 178.1 | -74 | -87.5 | 0 | 0 | 0 | 113.9 | D85 G86 I87 | F83-D85 VanDerWaalsContact C-N 3.27Å; F83-D85 PolarHBondContact O-N 3.48Å; F83-G86 PolarHBondContact O-N 2.97Å; F83-I87 WeakPolarHBondContact O-CG1 3.18Å; F83-I87 PolarHBondContact O-N 2.78Å; F83-I87 VanDerWaalsContact O-N 3.09Å |
| 84 | L | 85.4 | Confident | 76 | Confident | 131 Ų | 131 | 110.2 Ų | 110.2 | 69% | 0.686 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.8 | -33.9 | 177.4 | -62.9 | 177.3 | 0 | 0 | 0 | 112.4 | N82 I87 V88 | N82-L84 PolarHBondContact O-N 3.21Å; N82-L84 VanDerWaalsContact O-N 3.09Å; L84-I87 HydrophobicContact CD2-CD1 4.49Å; L84-I87 PolarHBondContact O-N 2.86Å; L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 3.48Å |
| 85 | D | 83.3 | Confident | 78 | Confident | 81 Ų | 81 | 106.8 Ų | 106.8 | 43% | 0.433 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -69.4 | -41.7 | 179.7 | -152.1 | 31.5 | 0 | 0 | 0 | 110.4 | N82 F83 I87 V88 D89 | N82-D85 VanDerWaalsContact O-CB 3.3Å; N82-D85 WeakPolarHBondContact O-CB 3.46Å; N82-D85 PolarHBondContact O-N 3.05Å; F83-D85 VanDerWaalsContact C-N 3.27Å; F83-D85 PolarHBondContact O-N 3.48Å; D85-I87 VanDerWaalsContact C-N 3.34Å; D85-I87 PolarHBondContact O-N 3.29Å; D85-V88 PolarHBondContact O-N 3.3Å; D85-D89 WeakPolarHBondContact O-CB 3.27Å; D85-D89 PolarHBondContact O-N 2.93Å |
| 86 | G | 84.4 | Confident | 80 | Confident | 17 Ų | 17 | 109.9 Ų | 109.9 | 18% | 0.175 | 59% | 0.587 | C | S | . | * | H | α-helix | trans | -58.4 | -45.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112 | F83 V88 D89 F90 | F83-G86 PolarHBondContact O-N 2.97Å; G86-V88 PolarHBondContact O-N 2.94Å; G86-D89 PolarHBondContact O-N 3.45Å; G86-F90 VanDerWaalsContact C-CD2 3.42Å; G86-F90 WeakPolarHBondContact O-CD2 3.39Å; G86-F90 WeakPolarHBondContact O-CE2 3.31Å; G86-F90 VanDerWaalsContact O-CG 3.28Å; G86-F90 WeakPolarHBondContact O-CG 3.32Å; G86-F90 PolarHBondContact O-N 3.36Å |
| 87 | I | 86.8 | Confident | 81.5 | Confident | 83 Ų | 83 | 112.3 Ų | 112.3 | 43% | 0.426 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -59.9 | -46 | 177.6 | -65.7 | 165.3 | 0 | 0 | 0 | 111.3 | F83 L84 D85 F90 F91 | F83-I87 WeakPolarHBondContact O-CG1 3.18Å; F83-I87 PolarHBondContact O-N 2.78Å; F83-I87 VanDerWaalsContact O-N 3.09Å; L84-I87 HydrophobicContact CD2-CD1 4.49Å; L84-I87 PolarHBondContact O-N 2.86Å; D85-I87 VanDerWaalsContact C-N 3.34Å; D85-I87 PolarHBondContact O-N 3.29Å; I87-F90 PolarHBondContact O-N 2.85Å; I87-F91 HydrophobicContact CG2-CD2 3.86Å; I87-F91 HydrophobicContact CG2-CE2 3.66Å; I87-F91 WeakPolarHBondContact O-CD2 3.43Å; I87-F91 PolarHBondContact O-N 2.88Å |
| 88 | V | 87.3 | Confident | 82.8 | Confident | 71 Ų | 71 | 109.7 Ų | 109.7 | 43% | 0.43 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.7 | -41.4 | 179 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | L84 D85 G86 F90 F91 R92 | L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 3.48Å; D85-V88 PolarHBondContact O-N 3.3Å; G86-V88 PolarHBondContact O-N 2.94Å; V88-F90 VanDerWaalsContact C-N 3.33Å; V88-F90 PolarHBondContact O-N 3.38Å; V88-F91 PolarHBondContact O-N 3.01Å; V88-R92 WeakPolarHBondContact O-CG 3.3Å; V88-R92 PolarHBondContact O-N 2.94Å |
| 89 | D | 85.3 | Confident | 84.3 | Confident | 93 Ų | 93 | 107.4 Ų | 107.4 | 50% | 0.497 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.1 | -36 | 176.1 | -82.8 | -15.8 | 0 | 0 | 0 | 112.4 | D85 G86 R92 Q93 | D85-D89 WeakPolarHBondContact O-CB 3.27Å; D85-D89 PolarHBondContact O-N 2.93Å; G86-D89 PolarHBondContact O-N 3.45Å; D89-R92 PolarHBondContact O-N 3.18Å; D89-Q93 WeakPolarHBondContact O-CB 3.33Å; D89-Q93 PolarHBondContact O-N 3.44Å |
| 90 | F | 85.8 | Confident | 85.7 | Confident | 131 Ų | 131 | 106.4 Ų | 106.4 | 58% | 0.575 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.5 | -44.8 | 171.4 | -67.9 | -55.9 | 0 | 0 | 0 | 111.5 | G86 I87 V88 R92 Q93 Y94 | G86-F90 VanDerWaalsContact C-CD2 3.42Å; G86-F90 WeakPolarHBondContact O-CD2 3.39Å; G86-F90 WeakPolarHBondContact O-CE2 3.31Å; G86-F90 VanDerWaalsContact O-CG 3.28Å; G86-F90 WeakPolarHBondContact O-CG 3.32Å; G86-F90 PolarHBondContact O-N 3.36Å; I87-F90 PolarHBondContact O-N 2.85Å; V88-F90 VanDerWaalsContact C-N 3.33Å; V88-F90 PolarHBondContact O-N 3.38Å; F90-R92 VanDerWaalsContact C-N 3.34Å; F90-R92 PolarHBondContact O-N 2.88Å; F90-Q93 PolarHBondContact O-N 3.31Å; F90-Y94 HydrophobicContact CB-CD2 4.4Å; F90-Y94 HydrophobicContact CD1-CE2 4.08Å; F90-Y94 WeakPolarHBondContact O-CB 3.3Å; F90-Y94 WeakPolarHBondContact O-CD2 3.11Å; F90-Y94 PolarHBondContact O-N 2.94Å |
| 91 | F | 86.7 | Confident | 87.4 | Confident | 119 Ų | 119 | 106.1 Ų | 106.1 | 52% | 0.522 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 175 | -82.3 | -73.8 | 0 | 0 | 0 | 111.3 | I87 V88 Q93 Y94 V95 I98 | I87-F91 HydrophobicContact CG2-CD2 3.86Å; I87-F91 HydrophobicContact CG2-CE2 3.66Å; I87-F91 WeakPolarHBondContact O-CD2 3.43Å; I87-F91 PolarHBondContact O-N 2.88Å; V88-F91 PolarHBondContact O-N 3.01Å; F91-Q93 VanDerWaalsContact C-N 3.35Å; F91-Q93 PolarHBondContact O-N 2.9Å; F91-Y94 CarbonylContact O-C 3.13Å; F91-Y94 PolarHBondContact O-N 3.42Å; F91-V95 WeakPolarHBondContact O-CA 3.38Å; F91-V95 WeakPolarHBondContact O-CG2 2.92Å; F91-V95 PolarHBondContact O-N 3.31Å; F91-I98 HydrophobicContact CD1-CD1 3.33Å; F91-I98 HydrophobicContact CE1-CD1 3.63Å; F91-I98 HydrophobicContact CG-CD1 4.35Å |
| 92 | R | 86.6 | Confident | 88.7 | Confident | 190 Ų | 190 | 101.9 Ų | 101.9 | 72% | 0.717 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 178.4 | -74.9 | -173 | -179.2 | -87.5 | 1 | 112.8 | V88 D89 F90 | V88-R92 WeakPolarHBondContact O-CG 3.3Å; V88-R92 PolarHBondContact O-N 2.94Å; D89-R92 PolarHBondContact O-N 3.18Å; F90-R92 VanDerWaalsContact C-N 3.34Å; F90-R92 PolarHBondContact O-N 2.88Å |
| 93 | Q | 89.9 | Confident | 89.8 | Confident | 152 Ų | 152 | 100.3 Ų | 100.3 | 71% | 0.71 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -73.2 | -31.2 | 179.2 | -167.1 | 65.5 | 8.7 | 0 | 0 | 112.4 | D89 F90 F91 | D89-Q93 WeakPolarHBondContact O-CB 3.33Å; D89-Q93 PolarHBondContact O-N 3.44Å; F90-Q93 PolarHBondContact O-N 3.31Å; F91-Q93 VanDerWaalsContact C-N 3.35Å; F91-Q93 PolarHBondContact O-N 2.9Å |
| 94 | Y | 93.8 | Very high | 90.3 | Very high | 119 Ų | 119 | 95.9 Ų | 95.9 | 47% | 0.467 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -112 | 16.4 | -173.8 | -60 | -64.2 | 0 | 0 | 0 | 114.4 | F90 F91 M96 L97 I98 | F90-Y94 HydrophobicContact CB-CD2 4.4Å; F90-Y94 HydrophobicContact CD1-CE2 4.08Å; F90-Y94 WeakPolarHBondContact O-CB 3.3Å; F90-Y94 WeakPolarHBondContact O-CD2 3.11Å; F90-Y94 PolarHBondContact O-N 2.94Å; F91-Y94 CarbonylContact O-C 3.13Å; F91-Y94 PolarHBondContact O-N 3.42Å; Y94-M96 PolarHBondContact O-N 2.85Å; Y94-L97 HydrophobicContact CD1-CD2 4.18Å; Y94-L97 WeakPolarHBondContact O-CB 3.31Å; Y94-L97 PolarHBondContact O-N 2.94Å; Y94-I98 VanDerWaalsContact O-CG1 3.3Å; Y94-I98 WeakPolarHBondContact O-CG1 3.45Å; Y94-I98 PolarHBondContact O-N 3.46Å |
| 95 | V | 91 | Very high | 90.8 | Very high | 85 Ų | 85 | 92.3 Ų | 92.3 | 52% | 0.515 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -51 | -46.2 | -179.3 | -177.9 | 0 | 0 | 0 | 0 | 111.4 | F91 I98 A99 | F91-V95 WeakPolarHBondContact O-CA 3.38Å; F91-V95 WeakPolarHBondContact O-CG2 2.92Å; F91-V95 PolarHBondContact O-N 3.31Å; V95-I98 PolarHBondContact O-N 2.95Å; V95-A99 WeakPolarHBondContact O-CB 3.31Å; V95-A99 PolarHBondContact O-N 2.95Å |
| 96 | M | 92.2 | Very high | 91.4 | Very high | 144 Ų | 144 | 95.9 Ų | 95.9 | 71% | 0.709 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.3 | -41 | -179.7 | -71 | -57.8 | -59.2 | 0 | 0 | 112.3 | Y94 A99 V100 | Y94-M96 PolarHBondContact O-N 2.85Å; M96-A99 PolarHBondContact O-N 3.38Å; M96-V100 VanDerWaalsContact O-CG2 3.27Å; M96-V100 WeakPolarHBondContact O-CG2 3.36Å; M96-V100 PolarHBondContact O-N 2.87Å |
| 97 | L | 92.4 | Very high | 91.9 | Very high | 102 Ų | 102 | 99.7 Ų | 99.7 | 53% | 0.534 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -44 | 177.5 | -177.3 | 64.7 | 0 | 0 | 0 | 110.8 | Y94 A99 V100 V101 | Y94-L97 HydrophobicContact CD1-CD2 4.18Å; Y94-L97 WeakPolarHBondContact O-CB 3.31Å; Y94-L97 PolarHBondContact O-N 2.94Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 2.79Å; L97-V100 PolarHBondContact O-N 3.43Å; L97-V101 HydrophobicContact CD1-CG2 4.14Å; L97-V101 HydrophobicContact CG-CG2 4.39Å; L97-V101 WeakPolarHBondContact O-CB 3.37Å; L97-V101 VanDerWaalsContact O-CG2 3.31Å; L97-V101 WeakPolarHBondContact O-CG2 3.22Å; L97-V101 PolarHBondContact O-N 3.16Å |
| 98 | I | 92.3 | Very high | 92.3 | Very high | 75 Ų | 75 | 100.1 Ų | 100.1 | 39% | 0.385 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.3 | -39.6 | 177.8 | -64.8 | 166.6 | 0 | 0 | 0 | 110.3 | F91 Y94 V95 G102 | F91-I98 HydrophobicContact CD1-CD1 3.33Å; F91-I98 HydrophobicContact CE1-CD1 3.63Å; F91-I98 HydrophobicContact CG-CD1 4.35Å; Y94-I98 VanDerWaalsContact O-CG1 3.3Å; Y94-I98 WeakPolarHBondContact O-CG1 3.45Å; Y94-I98 PolarHBondContact O-N 3.46Å; V95-I98 PolarHBondContact O-N 2.95Å; I98-G102 VanDerWaalsContact O-CA 3.3Å; I98-G102 WeakPolarHBondContact O-CA 3.32Å; I98-G102 PolarHBondContact O-N 3.4Å |
| 99 | A | 93.9 | Very high | 92.6 | Very high | 53 Ų | 53 | 101.8 Ų | 101.8 | 44% | 0.438 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V95 M96 L97 S103 | V95-A99 WeakPolarHBondContact O-CB 3.31Å; V95-A99 PolarHBondContact O-N 2.95Å; M96-A99 PolarHBondContact O-N 3.38Å; L97-A99 VanDerWaalsContact C-N 3.32Å; L97-A99 PolarHBondContact O-N 2.79Å; A99-S103 WeakPolarHBondContact O-CB 3.46Å; A99-S103 PolarHBondContact O-N 2.84Å; A99-S103 PolarHBondContact O-OG 3.08Å |
| 100 | V | 96.8 | Very high | 93 | Very high | 86 Ų | 86 | 104.2 Ų | 104.2 | 52% | 0.521 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.5 | -51.2 | 178.3 | 171.5 | 0 | 0 | 0 | 0 | 111.3 | M96 L97 G102 S103 L104 | M96-V100 VanDerWaalsContact O-CG2 3.27Å; M96-V100 WeakPolarHBondContact O-CG2 3.36Å; M96-V100 PolarHBondContact O-N 2.87Å; L97-V100 PolarHBondContact O-N 3.43Å; V100-G102 VanDerWaalsContact C-N 3.32Å; V100-G102 PolarHBondContact O-N 3.49Å; V100-S103 PolarHBondContact O-N 3.37Å; V100-S103 PolarHBondContact O-OG 3.37Å; V100-L104 WeakPolarHBondContact O-CB 3.32Å; V100-L104 PolarHBondContact O-N 2.83Å |
| 101 | V | 96.2 | Very high | 93.4 | Very high | 86 Ų | 86 | 102.4 Ų | 102.4 | 52% | 0.521 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 179.1 | 175.8 | 0 | 0 | 0 | 0 | 110.5 | L97 L104 A105 | L97-V101 HydrophobicContact CD1-CG2 4.14Å; L97-V101 HydrophobicContact CG-CG2 4.39Å; L97-V101 WeakPolarHBondContact O-CB 3.37Å; L97-V101 VanDerWaalsContact O-CG2 3.31Å; L97-V101 WeakPolarHBondContact O-CG2 3.22Å; L97-V101 PolarHBondContact O-N 3.16Å; V101-L104 PolarHBondContact O-N 3.36Å; V101-A105 WeakPolarHBondContact O-CB 3.07Å; V101-A105 PolarHBondContact O-N 3Å |
| 102 | G | 95.4 | Very high | 93.7 | Very high | 23 Ų | 23 | 99.9 Ų | 99.9 | 24% | 0.237 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -59.6 | -53.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I98 V100 L104 A105 F106 | I98-G102 VanDerWaalsContact O-CA 3.3Å; I98-G102 WeakPolarHBondContact O-CA 3.32Å; I98-G102 PolarHBondContact O-N 3.4Å; V100-G102 VanDerWaalsContact C-N 3.32Å; V100-G102 PolarHBondContact O-N 3.49Å; G102-L104 VanDerWaalsContact C-N 3.33Å; G102-L104 PolarHBondContact O-N 3.41Å; G102-A105 PolarHBondContact O-N 3.3Å; G102-A105 VanDerWaalsContact O-N 3.16Å; G102-F106 WeakPolarHBondContact O-CD2 3.49Å; G102-F106 PolarHBondContact O-N 2.91Å |
| 103 | S | 95.5 | Very high | 93.7 | Very high | 72 Ų | 72 | 93.2 Ų | 93.2 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.3 | -39.3 | 178.9 | 58.1 | 0 | 0 | 0 | 0 | 112.7 | A99 V100 F106 L107 | A99-S103 WeakPolarHBondContact O-CB 3.46Å; A99-S103 PolarHBondContact O-N 2.84Å; A99-S103 PolarHBondContact O-OG 3.08Å; V100-S103 PolarHBondContact O-N 3.37Å; V100-S103 PolarHBondContact O-OG 3.37Å; S103-F106 PolarHBondContact O-N 3.29Å; S103-L107 VanDerWaalsContact O-CB 3.31Å; S103-L107 WeakPolarHBondContact O-CB 3.29Å; S103-L107 PolarHBondContact O-N 2.84Å |
| 104 | L | 96.2 | Very high | 93.6 | Very high | 101 Ų | 101 | 87.8 Ų | 87.8 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 173.9 | -177.9 | 62.5 | 0 | 0 | 0 | 111.3 | V100 V101 G102 L107 L108 | V100-L104 WeakPolarHBondContact O-CB 3.32Å; V100-L104 PolarHBondContact O-N 2.83Å; V101-L104 PolarHBondContact O-N 3.36Å; G102-L104 VanDerWaalsContact C-N 3.33Å; G102-L104 PolarHBondContact O-N 3.41Å; L104-L107 PolarHBondContact O-N 3.46Å; L104-L108 HydrophobicContact CG-CD1 4.49Å; L104-L108 VanDerWaalsContact O-CG 3.32Å; L104-L108 WeakPolarHBondContact O-CG 3.25Å; L104-L108 PolarHBondContact O-N 2.94Å |
| 105 | A | 95.8 | Very high | 93.3 | Very high | 55 Ų | 55 | 83.8 Ų | 83.8 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V101 G102 L107 L108 M109 | V101-A105 WeakPolarHBondContact O-CB 3.07Å; V101-A105 PolarHBondContact O-N 3Å; G102-A105 PolarHBondContact O-N 3.3Å; G102-A105 VanDerWaalsContact O-N 3.16Å; A105-L107 PolarHBondContact O-N 3.5Å; A105-L108 PolarHBondContact O-N 3.44Å; A105-M109 WeakPolarHBondContact O-CB 3.41Å; A105-M109 PolarHBondContact O-N 3.28Å |
| 106 | F | 95.1 | Very high | 93 | Very high | 157 Ų | 157 | 82.4 Ų | 82.4 | 69% | 0.689 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -61 | -42.4 | 175 | -83 | -69 | 0 | 0 | 0 | 111.8 | G102 S103 M109 F110 | G102-F106 WeakPolarHBondContact O-CD2 3.49Å; G102-F106 PolarHBondContact O-N 2.91Å; S103-F106 PolarHBondContact O-N 3.29Å; F106-M109 PolarHBondContact O-N 2.89Å; F106-F110 WeakPolarHBondContact O-CB 3.33Å; F106-F110 PolarHBondContact O-N 3.37Å |
| 107 | L | 96 | Very high | 92.6 | Very high | 96 Ų | 96 | 80.3 Ų | 80.3 | 50% | 0.503 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.5 | -46 | 177.4 | -178.2 | 64.2 | 0 | 0 | 0 | 111.4 | S103 L104 A105 M109 F110 I111 | S103-L107 VanDerWaalsContact O-CB 3.31Å; S103-L107 WeakPolarHBondContact O-CB 3.29Å; S103-L107 PolarHBondContact O-N 2.84Å; L104-L107 PolarHBondContact O-N 3.46Å; A105-L107 PolarHBondContact O-N 3.5Å; L107-M109 VanDerWaalsContact C-N 3.34Å; L107-M109 PolarHBondContact O-N 3.46Å; L107-F110 PolarHBondContact O-N 2.98Å; L107-I111 HydrophobicContact CD1-CD1 4.3Å; L107-I111 HydrophobicContact CG-CD1 3.96Å; L107-I111 VanDerWaalsContact O-CG1 3.25Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 3.45Å |
| 108 | L | 94.4 | Very high | 91.9 | Very high | 93 Ų | 93 | 79 Ų | 79 | 49% | 0.487 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 176.7 | -70.4 | 175.5 | 0 | 0 | 0 | 111.6 | L104 A105 F110 I111 V112 | L104-L108 HydrophobicContact CG-CD1 4.49Å; L104-L108 VanDerWaalsContact O-CG 3.32Å; L104-L108 WeakPolarHBondContact O-CG 3.25Å; L104-L108 PolarHBondContact O-N 2.94Å; A105-L108 PolarHBondContact O-N 3.44Å; L108-F110 VanDerWaalsContact C-N 3.33Å; L108-F110 PolarHBondContact O-N 2.92Å; L108-I111 PolarHBondContact O-N 3.31Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3.25Å |
| 109 | M | 92.6 | Very high | 90.9 | Very high | 106 Ų | 106 | 83.7 Ų | 83.7 | 52% | 0.522 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.2 | -42.8 | 176.5 | -169.7 | -108.4 | 114.7 | 0 | 0 | 111.2 | A105 F106 L107 V112 C113 | A105-M109 WeakPolarHBondContact O-CB 3.41Å; A105-M109 PolarHBondContact O-N 3.28Å; F106-M109 PolarHBondContact O-N 2.89Å; L107-M109 VanDerWaalsContact C-N 3.34Å; L107-M109 PolarHBondContact O-N 3.46Å; M109-V112 PolarHBondContact O-N 2.88Å; M109-C113 HydrophobicContact CE-CB 3.75Å; M109-C113 WeakPolarHBondContact CE-SG 3.07Å; M109-C113 WeakPolarHBondContact O-CB 3.31Å; M109-C113 PolarHBondContact O-N 3.18Å |
| 110 | F | 94.6 | Very high | 89.4 | Confident | 144 Ų | 144 | 87 Ų | 87 | 63% | 0.632 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.9 | -45.5 | 175.6 | -175.1 | -99 | 0 | 0 | 0 | 112.5 | F106 L107 L108 V112 C113 A114 | F106-F110 WeakPolarHBondContact O-CB 3.33Å; F106-F110 PolarHBondContact O-N 3.37Å; L107-F110 PolarHBondContact O-N 2.98Å; L108-F110 VanDerWaalsContact C-N 3.33Å; L108-F110 PolarHBondContact O-N 2.92Å; F110-V112 PolarHBondContact O-N 3.47Å; F110-C113 PolarHBondContact O-N 3.3Å; F110-A114 VanDerWaalsContact O-CB 3.32Å; F110-A114 WeakPolarHBondContact O-CB 3.21Å; F110-A114 PolarHBondContact O-N 3.29Å |
| 111 | I | 94.4 | Very high | 87.8 | Confident | 92 Ų | 92 | 90.8 Ų | 90.8 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.9 | -46 | 177.2 | -67.6 | 163.2 | 0 | 0 | 0 | 110.6 | L107 L108 A114 A115 | L107-I111 HydrophobicContact CD1-CD1 4.3Å; L107-I111 HydrophobicContact CG-CD1 3.96Å; L107-I111 VanDerWaalsContact O-CG1 3.25Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 3.45Å; L108-I111 PolarHBondContact O-N 3.31Å; I111-A114 PolarHBondContact O-N 2.91Å; I111-A115 WeakPolarHBondContact O-CB 3.5Å; I111-A115 PolarHBondContact O-N 3.46Å |
| 112 | V | 93.3 | Very high | 86 | Confident | 66 Ų | 66 | 94 Ų | 94 | 40% | 0.4 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -45.4 | 177.4 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | L9 L108 M109 F110 A115 V116 | L9-V112 HydrophobicContact CD1-CG1 4.18Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3.25Å; M109-V112 PolarHBondContact O-N 2.88Å; F110-V112 PolarHBondContact O-N 3.47Å; V112-A115 WeakPolarHBondContact O-CB 3.34Å; V112-A115 PolarHBondContact O-N 3.39Å; V112-V116 HydrophobicContact CG1-CG2 4.47Å; V112-V116 VanDerWaalsContact O-CG2 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.4Å; V112-V116 PolarHBondContact O-N 3.39Å |
| 113 | C | 85.8 | Confident | 84.2 | Confident | 50 Ų | 50 | 101.4 Ų | 101.4 | 34% | 0.338 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.8 | -42.6 | 178.2 | -87.8 | 0 | 0 | 0 | 0 | 113.2 | M109 F110 A115 V116 I117 | M109-C113 HydrophobicContact CE-CB 3.75Å; M109-C113 WeakPolarHBondContact CE-SG 3.07Å; M109-C113 WeakPolarHBondContact O-CB 3.31Å; M109-C113 PolarHBondContact O-N 3.18Å; F110-C113 PolarHBondContact O-N 3.3Å; C113-A115 VanDerWaalsContact C-N 3.29Å; C113-A115 PolarHBondContact O-N 3.21Å; C113-V116 PolarHBondContact O-N 3.43Å; C113-I117 WeakPolarHBondContact O-CB 3.05Å; C113-I117 VanDerWaalsContact O-CG1 3.26Å; C113-I117 WeakPolarHBondContact O-CG1 3.36Å; C113-I117 PolarHBondContact O-N 2.78Å |
| 114 | A | 88.3 | Confident | 82.4 | Confident | 38 Ų | 38 | 102.2 Ų | 102.2 | 31% | 0.314 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.6 | -42.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | F110 I111 I117 T118 | F110-A114 VanDerWaalsContact O-CB 3.32Å; F110-A114 WeakPolarHBondContact O-CB 3.21Å; F110-A114 PolarHBondContact O-N 3.29Å; I111-A114 PolarHBondContact O-N 2.91Å; A114-I117 PolarHBondContact O-N 3.04Å; A114-T118 WeakPolarHBondContact O-CB 3.39Å; A114-T118 WeakPolarHBondContact O-CG2 3.22Å; A114-T118 PolarHBondContact O-N 2.73Å; A114-T118 PolarHBondContact O-OG1 2.91Å |
| 115 | A | 87.3 | Confident | 80.5 | Confident | 36 Ų | 36 | 100.7 Ų | 100.7 | 30% | 0.298 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.5 | -41 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | I111 V112 C113 T118 R119 | I111-A115 WeakPolarHBondContact O-CB 3.5Å; I111-A115 PolarHBondContact O-N 3.46Å; V112-A115 WeakPolarHBondContact O-CB 3.34Å; V112-A115 PolarHBondContact O-N 3.39Å; C113-A115 VanDerWaalsContact C-N 3.29Å; C113-A115 PolarHBondContact O-N 3.21Å; A115-T118 WeakPolarHBondContact CA-OG1 3.49Å; A115-T118 PolarHBondContact O-OG1 3.47Å; A115-T118 VanDerWaalsContact O-OG1 3.04Å; A115-R119 WeakPolarHBondContact O-CB 3.26Å; A115-R119 WeakPolarHBondContact O-CD 3.47Å; A115-R119 WeakPolarHBondContact O-CG 3.26Å; A115-R119 PolarHBondContact O-N 2.98Å |
| 116 | V | 84 | Confident | 78.9 | Confident | 55 Ų | 55 | 102 Ų | 102 | 33% | 0.333 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.8 | -46 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 111 | V112 C113 R119 Q120 | V112-V116 HydrophobicContact CG1-CG2 4.47Å; V112-V116 VanDerWaalsContact O-CG2 3.31Å; V112-V116 WeakPolarHBondContact O-CG2 3.4Å; V112-V116 PolarHBondContact O-N 3.39Å; C113-V116 PolarHBondContact O-N 3.43Å; V116-R119 PolarHBondContact O-N 2.81Å; V116-Q120 HydrophobicContact CG1-CG 4.49Å; V116-Q120 WeakPolarHBondContact O-CB 3.35Å; V116-Q120 VanDerWaalsContact O-CG 3.26Å; V116-Q120 WeakPolarHBondContact O-CG 3.33Å; V116-Q120 PolarHBondContact O-N 2.88Å |
| 117 | I | 83.8 | Confident | 77.6 | Confident | 101 Ų | 101 | 105 Ų | 105 | 52% | 0.518 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.7 | -44 | -179.6 | -65.4 | 164.8 | 0 | 0 | 0 | 111 | C113 A114 Q120 K121 | C113-I117 WeakPolarHBondContact O-CB 3.05Å; C113-I117 VanDerWaalsContact O-CG1 3.26Å; C113-I117 WeakPolarHBondContact O-CG1 3.36Å; C113-I117 PolarHBondContact O-N 2.78Å; A114-I117 PolarHBondContact O-N 3.04Å; I117-Q120 PolarHBondContact O-N 2.91Å; I117-K121 PolarHBondContact O-N 3.3Å |
| 118 | T | 78.4 | Confident | 76 | Confident | 73 Ų | 73 | 110.1 Ų | 110.1 | 45% | 0.448 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.4 | -41.1 | 176.5 | 52 | 0 | 0 | 0 | 0 | 111.4 | A114 A115 Q120 K121 H122 | A114-T118 WeakPolarHBondContact O-CB 3.39Å; A114-T118 WeakPolarHBondContact O-CG2 3.22Å; A114-T118 PolarHBondContact O-N 2.73Å; A114-T118 PolarHBondContact O-OG1 2.91Å; A115-T118 WeakPolarHBondContact CA-OG1 3.49Å; A115-T118 PolarHBondContact O-OG1 3.47Å; A115-T118 VanDerWaalsContact O-OG1 3.04Å; T118-Q120 VanDerWaalsContact C-N 3.31Å; T118-Q120 PolarHBondContact O-N 3.06Å; T118-K121 WeakPolarHBondContact O-CB 3.32Å; T118-K121 PolarHBondContact O-N 3.27Å; T118-H122 PolarHBondContact O-CD2 3.22Å; T118-H122 PolarHBondContact O-N 2.88Å |
| 119 | R | 70.9 | Confident | 74.5 | Confident | 174 Ų | 174 | 109.5 Ų | 109.5 | 66% | 0.657 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.7 | -30.9 | 173.7 | -72.4 | 172.2 | -173.5 | -81.8 | 2.4 | 113 | A115 V116 K123 | A115-R119 WeakPolarHBondContact O-CB 3.26Å; A115-R119 WeakPolarHBondContact O-CD 3.47Å; A115-R119 WeakPolarHBondContact O-CG 3.26Å; A115-R119 PolarHBondContact O-N 2.98Å; V116-R119 PolarHBondContact O-N 2.81Å; R119-K123 WeakPolarHBondContact O-CG 3.45Å |
| 120 | Q | 63.6 | Low | 73 | Confident | 123 Ų | 123 | 110.2 Ų | 110.2 | 58% | 0.575 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -72.6 | -37.8 | 172.4 | -73.8 | 176.1 | 8.4 | 0 | 0 | 111.7 | V116 I117 T118 H122 K123 A124 | V116-Q120 HydrophobicContact CG1-CG 4.49Å; V116-Q120 WeakPolarHBondContact O-CB 3.35Å; V116-Q120 VanDerWaalsContact O-CG 3.26Å; V116-Q120 WeakPolarHBondContact O-CG 3.33Å; V116-Q120 PolarHBondContact O-N 2.88Å; I117-Q120 PolarHBondContact O-N 2.91Å; T118-Q120 VanDerWaalsContact C-N 3.31Å; T118-Q120 PolarHBondContact O-N 3.06Å; Q120-H122 VanDerWaalsContact C-N 3.27Å; Q120-H122 PolarHBondContact O-N 3.41Å; Q120-K123 PolarHBondContact O-N 3.2Å; Q120-K123 VanDerWaalsContact O-N 3.12Å; Q120-A124 PolarHBondContact O-N 3.12Å |
| 121 | K | 62 | Low | 71.3 | Confident | 166 Ų | 166 | 107.3 Ų | 107.3 | 72% | 0.722 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -58.8 | -35 | 176.3 | -105.7 | -165.6 | 169.3 | 178.8 | 0 | 113.2 | I117 T118 | I117-K121 PolarHBondContact O-N 3.3Å; T118-K121 WeakPolarHBondContact O-CB 3.32Å; T118-K121 PolarHBondContact O-N 3.27Å |
| 122 | H | 59.8 | Low | 69.5 | Low | 152 Ų | 152 | 110.9 Ų | 110.9 | 70% | 0.704 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | -13.9 | 178.3 | -66 | -65.9 | 0 | 0 | 0 | 114.5 | T118 Q120 | T118-H122 PolarHBondContact O-CD2 3.22Å; T118-H122 PolarHBondContact O-N 2.88Å; Q120-H122 VanDerWaalsContact C-N 3.27Å; Q120-H122 PolarHBondContact O-N 3.41Å |
| 123 | K | 57.5 | Low | 68.1 | Low | 179 Ų | 179 | 110.9 Ų | 110.9 | 78% | 0.778 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | -16.3 | -178.6 | -71 | -178.2 | 178.2 | -162.9 | 0 | 114.1 | R119 Q120 | R119-K123 WeakPolarHBondContact O-CG 3.45Å; Q120-K123 PolarHBondContact O-N 3.2Å; Q120-K123 VanDerWaalsContact O-N 3.12Å |
| 124 | A | 57.7 | Low | 66.8 | Low | 89 Ų | 89 | 118.2 Ų | 118.2 | 74% | 0.736 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -90 | -5.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | Q120 | Q120-A124 PolarHBondContact O-N 3.12Š|
| 125 | S | 55.4 | Low | 65.6 | Low | 70 Ų | 70 | 125.3 Ų | 125.3 | 49% | 0.49 | 64% | 0.639 | S | S | . | * | S | Bend | trans | -106.4 | 32.7 | -175.6 | -173.3 | 0 | 0 | 0 | 0 | 113.4 | ||
| 126 | A | 61.8 | Low | 64.4 | Low | 83 Ų | 83 | 128.7 Ų | 128.7 | 69% | 0.686 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -127.3 | -5.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 127 | Y | 67.3 | Low | 63.3 | Low | 218 Ų | 218 | 134 Ų | 134 | 86% | 0.855 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -101.1 | -26.5 | 178 | -166.8 | -106.4 | 0 | 0 | 0 | 113.4 | ||
| 128 | Y | 63.9 | Low | 62.3 | Low | 205 Ų | 205 | 131.9 Ų | 131.9 | 80% | 0.804 | 65% | 0.653 | S | S | * | * | trans | -157.7 | 92.5 | 160.7 | -115.6 | -92.8 | 0 | 0 | 0 | 104.4 | S130 | Y128-S130 PolarHBondContact O-N 2.87Š| ||
| 129 | P | 62 | Low | 61.6 | Low | 79 Ų | 79 | 134.1 Ų | 134.1 | 51% | 0.513 | 66% | 0.663 | S | S | . | * | trans | -61.7 | 99 | 167.8 | 25 | -29.8 | 0 | 0 | 0 | 106.2 | S131 | P129-S131 PolarHBondContact O-N 3.37Š| ||
| 130 | S | 62.2 | Low | 61.3 | Low | 121 Ų | 121 | 132.7 Ų | 132.7 | 85% | 0.846 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -69.6 | 72.4 | 176.9 | 170 | 0 | 0 | 0 | 0 | 109.6 | Y128 | Y128-S130 PolarHBondContact O-N 2.87Š|
| 131 | S | 57.4 | Low | 61.2 | Low | 83 Ų | 83 | 131.7 Ų | 131.7 | 58% | 0.58 | 67% | 0.67 | S | S | * | * | -160.7 | 117.5 | 120.1 | 52.9 | 0 | 0 | 0 | 0 | 104.4 | P129 P133 | P129-S131 PolarHBondContact O-N 3.37Å; S131-P133 WeakPolarHBondContact O-CD 3.35Å; S131-P133 VanDerWaalsContact O-N 3.08Å | |||
| 132 | F | 56.8 | Low | 61.4 | Low | 167 Ų | 167 | 127.2 Ų | 127.2 | 73% | 0.732 | 65% | 0.654 | S | S | * | * | trans | -36 | 121.3 | 145 | -128.3 | -101.5 | 0 | 0 | 0 | 106.6 | K134 Y137 | F132-K134 PolarHBondContact O-N 3.39Å; F132-Y137 AromaticContact CD1-CD2 3.54Å; F132-Y137 HydrophobicContact CD1-CD2 3.54Å; F132-Y137 HydrophobicContact CD1-CE2 4.06Å; F132-Y137 HydrophobicContact CD1-CG 4.48Å; F132-Y137 AromaticContact CE1-CD2 3.44Å; F132-Y137 HydrophobicContact CE1-CD2 3.44Å; F132-Y137 VanDerWaalsContact CE1-CD2 3.44Å; F132-Y137 HydrophobicContact CE1-CE2 4.09Å; F132-Y137 HydrophobicContact CE1-CG 4.01Å | ||
| 133 | P | 64.8 | Low | 61.6 | Low | 67 Ų | 67 | 129.9 Ų | 129.9 | 44% | 0.435 | 66% | 0.658 | S | S | . | * | trans | -40.9 | 114.2 | 179.3 | -32.1 | 30.9 | 0 | 0 | 0 | 108.8 | S131 K135 Y137 | S131-P133 WeakPolarHBondContact O-CD 3.35Å; S131-P133 VanDerWaalsContact O-N 3.08Å; P133-K135 CarbonylContact O-C 3.51Å; P133-K135 PolarHBondContact O-N 2.84Å; P133-Y137 HydrophobicContact CB-CE2 3.91Å; P133-Y137 HydrophobicContact CG-CE2 3.76Å | ||
| 134 | K | 58.7 | Low | 61.9 | Low | 203 Ų | 203 | 125.9 Ų | 125.9 | 88% | 0.883 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -60.6 | -5.4 | -177.3 | -166.3 | 175.5 | 179.3 | -179 | 0 | 111.6 | F132 K136 | F132-K134 PolarHBondContact O-N 3.39Å; K134-K136 PolarHBondContact O-N 3.16Å |
| 135 | K | 61.7 | Low | 62.1 | Low | 188 Ų | 188 | 124.9 Ų | 124.9 | 82% | 0.817 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -73.2 | 79 | 155.4 | -59.7 | -170 | -179 | -179 | 0 | 109.3 | P133 Y137 | P133-K135 CarbonylContact O-C 3.51Å; P133-K135 PolarHBondContact O-N 2.84Å; K135-Y137 PolarHBondContact O-N 3.32Å; K135-Y137 VanDerWaalsContact O-N 3.14Å |
| 136 | K | 63.4 | Low | 62.9 | Low | 107 Ų | 107 | 123.4 Ų | 123.4 | 47% | 0.465 | 65% | 0.652 | S | S | . | * | trans | 20.5 | 86.5 | 141.4 | -84.2 | 174.5 | -178.8 | 156.7 | 0 | 113.9 | K134 V138 Q140 | K134-K136 PolarHBondContact O-N 3.16Å; K136-V138 WeakPolarHBondContact CB-O 3.31Å; K136-V138 WeakPolarHBondContact CG-O 3.42Å; K136-V138 PolarHBondContact O-N 3.32Å; K136-V138 VanDerWaalsContact O-N 3.08Å; K136-Q140 HydrophobicContact CD-CG 3.86Å | ||
| 137 | Y | 59.8 | Low | 63 | Low | 166 Ų | 166 | 125.8 Ų | 125.8 | 65% | 0.651 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -71.4 | 16.6 | 154.1 | -70.6 | -84.2 | 0 | 0 | 0 | 112.1 | F132 P133 K135 | F132-Y137 AromaticContact CD1-CD2 3.54Å; F132-Y137 HydrophobicContact CD1-CD2 3.54Å; F132-Y137 HydrophobicContact CD1-CE2 4.06Å; F132-Y137 HydrophobicContact CD1-CG 4.48Å; F132-Y137 AromaticContact CE1-CD2 3.44Å; F132-Y137 HydrophobicContact CE1-CD2 3.44Å; F132-Y137 VanDerWaalsContact CE1-CD2 3.44Å; F132-Y137 HydrophobicContact CE1-CE2 4.09Å; F132-Y137 HydrophobicContact CE1-CG 4.01Å; P133-Y137 HydrophobicContact CB-CE2 3.91Å; P133-Y137 HydrophobicContact CG-CE2 3.76Å; K135-Y137 PolarHBondContact O-N 3.32Å; K135-Y137 VanDerWaalsContact O-N 3.14Å |
| 138 | V | 64.1 | Low | 62.6 | Low | 57 Ų | 57 | 124.7 Ų | 124.7 | 35% | 0.345 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -137.9 | 100.6 | -178.2 | 172.6 | 0 | 0 | 0 | 0 | 102.9 | K136 Q140 D142 | K136-V138 WeakPolarHBondContact CB-O 3.31Å; K136-V138 WeakPolarHBondContact CG-O 3.42Å; K136-V138 PolarHBondContact O-N 3.32Å; K136-V138 VanDerWaalsContact O-N 3.08Å; V138-Q140 PolarHBondContact O-N 3Å; V138-D142 HydrophobicContact CG1-CB 4.05Å; V138-D142 WeakPolarHBondContact CG1-O 3.09Å |
| 139 | D | 64 | Low | 62.2 | Low | 120 Ų | 120 | 118.9 Ų | 118.9 | 64% | 0.642 | 65% | 0.649 | S | S | * | * | trans | -46.4 | 146.2 | 168.8 | -77.5 | -37.7 | 0 | 0 | 0 | 108.4 | S141 D142 | D139-S141 WeakPolarHBondContact CB-OG 3.28Å; D139-S141 PolarHBondContact O-N 3.27Å; D139-D142 PolarHBondContact O-N 3.36Å | ||
| 140 | Q | 64.6 | Low | 62 | Low | 144 Ų | 144 | 125.6 Ų | 125.6 | 67% | 0.673 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -55.7 | -19.5 | 179.6 | -79.5 | -164.5 | 58.6 | 0 | 0 | 113.3 | K136 V138 D142 | K136-Q140 HydrophobicContact CD-CG 3.86Å; V138-Q140 PolarHBondContact O-N 3Å; Q140-D142 VanDerWaalsContact C-N 3.33Å |
| 141 | S | 61 | Low | 61.8 | Low | 102 Ų | 102 | 123.8 Ų | 123.8 | 71% | 0.713 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -71.4 | -19 | 172.8 | 49.7 | 0 | 0 | 0 | 0 | 114.8 | D139 | D139-S141 WeakPolarHBondContact CB-OG 3.28Å; D139-S141 PolarHBondContact O-N 3.27Å |
| 142 | D | 65.2 | Low | 61.7 | Low | 71 Ų | 71 | 128 Ų | 128 | 38% | 0.38 | 67% | 0.669 | S | S | . | * | G | 310 helix | trans | -114.8 | 29.2 | -177.6 | -166.5 | 24.3 | 0 | 0 | 0 | 112.5 | V138 D139 Q140 A144 G145 | V138-D142 HydrophobicContact CG1-CB 4.05Å; V138-D142 WeakPolarHBondContact CG1-O 3.09Å; D139-D142 PolarHBondContact O-N 3.36Å; Q140-D142 VanDerWaalsContact C-N 3.33Å; D142-A144 PolarHBondContact O-N 3.08Å; D142-G145 PolarHBondContact O-N 3.44Å |
| 143 | R | 64.4 | Low | 61.5 | Low | 209 Ų | 209 | 126.1 Ų | 126.1 | 79% | 0.789 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -6.7 | -174.2 | -133.7 | -167.1 | -179.5 | -163.1 | 0.9 | 115.3 | ||
| 144 | A | 63.4 | Low | 61 | Low | 94 Ų | 94 | 128.3 Ų | 128.3 | 78% | 0.777 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | -10.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | D142 G146 | D142-A144 PolarHBondContact O-N 3.08Å; A144-G146 PolarHBondContact O-N 2.92Å |
| 145 | G | 63 | Low | 60.7 | Low | 68 Ų | 68 | 125.9 Ų | 125.9 | 70% | 0.701 | 68% | 0.682 | S | S | * | * | trans | 46.1 | 28.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | D142 | D142-G145 PolarHBondContact O-N 3.44Š| ||
| 146 | G | 71.9 | Confident | 60.1 | Low | 39 Ų | 39 | 127.7 Ų | 127.7 | 40% | 0.402 | 68% | 0.684 | S | S | . | * | S | Bend | trans | -104.7 | 156.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | A144 R148 | A144-G146 PolarHBondContact O-N 2.92Å; G146-R148 VanDerWaalsContact C-N 3.34Å; G146-R148 PolarHBondContact O-N 2.8Å |
| 147 | P | 62.5 | Low | 59.4 | Low | 134 Ų | 134 | 126.3 Ų | 126.3 | 87% | 0.87 | 69% | 0.692 | S | S | * | * | trans | -58.3 | 101.3 | 175.2 | 24.7 | -31.5 | 0 | 0 | 0 | 108.1 | A149 | P147-A149 VanDerWaalsContact C-N 3.34Å; P147-A149 PolarHBondContact O-N 3.43Å | ||
| 148 | R | 59 | Low | 59.1 | Low | 194 Ų | 194 | 124.1 Ų | 124.1 | 73% | 0.732 | 70% | 0.698 | S | S | * | * | trans | -52.8 | 109.1 | 159.9 | -91.7 | -81.1 | -132.9 | 176.1 | 4.8 | 104.2 | G146 F150 | G146-R148 VanDerWaalsContact C-N 3.34Å; G146-R148 PolarHBondContact O-N 2.8Å; R148-F150 PolarHBondContact O-N 3.42Å; R148-F150 VanDerWaalsContact O-N 3.14Å | ||
| 149 | A | 56.6 | Low | 58.3 | Low | 83 Ų | 83 | 128.9 Ų | 128.9 | 69% | 0.686 | 72% | 0.721 | S | S | * | * | trans | -48.2 | 128.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 105.8 | P147 S151 | P147-A149 VanDerWaalsContact C-N 3.34Å; P147-A149 PolarHBondContact O-N 3.43Å; A149-S151 PolarHBondContact O-N 2.82Å | ||
| 150 | F | 56.7 | Low | 57.3 | Low | 220 Ų | 220 | 128.9 Ų | 128.9 | 97% | 0.965 | 73% | 0.731 | S | S | * | * | trans | -54.6 | 82.3 | 174.3 | -75.5 | -98.5 | 0 | 0 | 0 | 108.6 | R148 E152 | R148-F150 PolarHBondContact O-N 3.42Å; R148-F150 VanDerWaalsContact O-N 3.14Å; F150-E152 PolarHBondContact O-N 3.28Å | ||
| 151 | S | 59.1 | Low | 56.5 | Low | 84 Ų | 84 | 129.8 Ų | 129.8 | 59% | 0.587 | 73% | 0.728 | S | S | * | * | trans | -88.6 | 107.2 | 168.3 | 66.3 | 0 | 0 | 0 | 0 | 105.3 | A149 | A149-S151 PolarHBondContact O-N 2.82Š| ||
| 152 | E | 55.4 | Low | 56.2 | Low | 170 Ų | 170 | 130 Ų | 130 | 79% | 0.794 | 73% | 0.727 | S | S | * | * | trans | 82.2 | 80.9 | 151.9 | -141.8 | 154.1 | -163.6 | 0 | 0 | 114 | F150 P154 | F150-E152 PolarHBondContact O-N 3.28Å; E152-P154 WeakPolarHBondContact O-CD 3.27Å | ||
| 153 | V | 52.9 | Low | 55.8 | Low | 129 Ų | 129 | 132.1 Ų | 132.1 | 78% | 0.782 | 74% | 0.735 | S | S | * | * | trans | -37 | 120.2 | 134.8 | 175.3 | 0 | 0 | 0 | 0 | 107.3 | D155 | V153-D155 PolarHBondContact O-N 3.46Š| ||
| 154 | P | 52.8 | Low | 55.4 | Low | 113 Ų | 113 | 128 Ų | 128 | 73% | 0.734 | 72% | 0.724 | S | S | * | * | trans | -59.9 | 103.9 | 169.3 | -23.7 | 34.7 | 0 | 0 | 0 | 108.2 | E152 R156 | E152-P154 WeakPolarHBondContact O-CD 3.27Å; P154-R156 PolarHBondContact O-N 2.92Å | ||
| 155 | D | 54.3 | Low | 55.2 | Low | 152 Ų | 152 | 126.7 Ų | 126.7 | 81% | 0.813 | 71% | 0.714 | S | S | * | * | trans | -69.9 | 89.1 | 170 | -151.7 | -11.5 | 0 | 0 | 0 | 106.9 | V153 | V153-D155 PolarHBondContact O-N 3.46Š| ||
| 156 | R | 48.8 | Very low | 55.2 | Low | 226 Ų | 226 | 128.4 Ų | 128.4 | 85% | 0.853 | 71% | 0.706 | S | S | * | * | trans | -126.4 | 84.6 | 173 | -90.6 | -70.7 | 174.9 | 158.1 | -1.5 | 110.9 | P154 | P154-R156 PolarHBondContact O-N 2.92Š| ||
| 157 | A | 47 | Very low | 55.1 | Low | 77 Ų | 77 | 131 Ų | 131 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | trans | 61.9 | 120.4 | 141.1 | 0 | 0 | 0 | 0 | 0 | 119.4 | D159 | A157-D159 PolarHBondContact O-N 2.95Š| ||
| 158 | P | 55.4 | Low | 55.7 | Low | 121 Ų | 121 | 128.1 Ų | 128.1 | 79% | 0.786 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -82.8 | 102 | 161.6 | 33.3 | -23.9 | 0 | 0 | 0 | 108 | ||
| 159 | D | 46.9 | Very low | 56.8 | Low | 156 Ų | 156 | 122.2 Ų | 122.2 | 83% | 0.834 | 68% | 0.682 | S | S | * | * | trans | 171.1 | 102.4 | 149.8 | -95.2 | -27.5 | 0 | 0 | 0 | 110.2 | A157 | A157-D159 PolarHBondContact O-N 2.95Š| ||
| 160 | S | 42.3 | Very low | 58.2 | Low | 120 Ų | 120 | 126.9 Ų | 126.9 | 84% | 0.839 | 68% | 0.682 | S | S | * | * | S | Bend | 164.2 | 132 | 123.8 | 47.4 | 0 | 0 | 0 | 0 | 111.2 | |||
| 161 | R | 48 | Very low | 59.6 | Low | 164 Ų | 164 | 122.6 Ų | 122.6 | 62% | 0.619 | 67% | 0.665 | S | S | * | * | trans | 77.7 | 99.5 | 170 | -82.2 | -175.4 | 168.8 | 173.1 | -3.4 | 119.4 | E163 | R161-E163 HydrophobicContact CG-CB 4.41Å; R161-E163 PolarHBondContact O-N 2.8Å | ||
| 162 | P | 55.3 | Low | 61 | Low | 107 Ų | 107 | 123.6 Ų | 123.6 | 70% | 0.695 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -62.6 | -10.9 | 151.6 | -17.7 | 31.1 | 0 | 0 | 0 | 114.3 | L166 | P162-L166 WeakPolarHBondContact O-CG 3.33Å; P162-L166 PolarHBondContact O-N 2.87Å |
| 163 | E | 55.5 | Low | 62.7 | Low | 114 Ų | 114 | 122 Ų | 122 | 53% | 0.533 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -72.5 | -41 | -171.1 | -87.7 | -132.9 | 122.1 | 0 | 0 | 114.6 | R161 A165 L166 D167 | R161-E163 HydrophobicContact CG-CB 4.41Å; R161-E163 PolarHBondContact O-N 2.8Å; E163-A165 VanDerWaalsContact C-N 3.27Å; E163-A165 PolarHBondContact O-N 3.06Å; E163-L166 PolarHBondContact O-N 3.33Å; E163-D167 PolarHBondContact O-N 2.74Å; E163-D167 VanDerWaalsContact O-N 3.12Å |
| 164 | E | 55.7 | Low | 64.3 | Low | 122 Ų | 122 | 118.4 Ų | 118.4 | 57% | 0.57 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.3 | -28 | 179.7 | -105.9 | 106.2 | 179.9 | 0 | 0 | 113 | S168 | E164-S168 WeakPolarHBondContact O-CB 3.46Å; E164-S168 PolarHBondContact O-N 2.89Å; E164-S168 VanDerWaalsContact O-N 3.08Å; E164-S168 PolarHBondContact O-OG 3.32Å |
| 165 | A | 59.9 | Low | 66.1 | Low | 67 Ų | 67 | 117.6 Ų | 117.6 | 55% | 0.554 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -76.2 | -32 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | E163 S169 | E163-A165 VanDerWaalsContact C-N 3.27Å; E163-A165 PolarHBondContact O-N 3.06Å; A165-S169 VanDerWaalsContact O-CB 3.3Å; A165-S169 WeakPolarHBondContact O-CB 3.48Å; A165-S169 PolarHBondContact O-N 2.9Å |
| 166 | L | 62.4 | Low | 67.9 | Low | 105 Ų | 105 | 115.2 Ų | 115.2 | 55% | 0.55 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -70.4 | -37.5 | 175.1 | -69.2 | 174.9 | 0 | 0 | 0 | 111.3 | P162 E163 S169 R170 | P162-L166 WeakPolarHBondContact O-CG 3.33Å; P162-L166 PolarHBondContact O-N 2.87Å; E163-L166 PolarHBondContact O-N 3.33Å; L166-S169 PolarHBondContact O-N 2.93Å; L166-R170 WeakPolarHBondContact O-CG 3.38Å; L166-R170 PolarHBondContact O-N 3.46Å |
| 167 | D | 70.1 | Confident | 69.7 | Low | 94 Ų | 94 | 110.2 Ų | 110.2 | 50% | 0.503 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.4 | -42.2 | 174 | -77.9 | -20.4 | 0 | 0 | 0 | 111.7 | E163 S169 R170 Q171 | E163-D167 PolarHBondContact O-N 2.74Å; E163-D167 VanDerWaalsContact O-N 3.12Å; D167-S169 VanDerWaalsContact C-N 3.3Å; D167-S169 PolarHBondContact O-N 3.2Å; D167-R170 PolarHBondContact O-N 3.43Å; D167-Q171 VanDerWaalsContact O-CB 3.27Å; D167-Q171 WeakPolarHBondContact O-CB 3.25Å; D167-Q171 PolarHBondContact O-N 3.48Å |
| 168 | S | 75.5 | Confident | 71.5 | Confident | 72 Ų | 72 | 108.1 Ų | 108.1 | 50% | 0.503 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -60.8 | -39.8 | 173.7 | -58.9 | 0 | 0 | 0 | 0 | 112.1 | E164 Q171 L172 | E164-S168 WeakPolarHBondContact O-CB 3.46Å; E164-S168 PolarHBondContact O-N 2.89Å; E164-S168 VanDerWaalsContact O-N 3.08Å; E164-S168 PolarHBondContact O-OG 3.32Å; S168-Q171 PolarHBondContact O-N 3.34Å; S168-L172 VanDerWaalsContact O-CB 3.3Å; S168-L172 WeakPolarHBondContact O-CB 3.37Å; S168-L172 PolarHBondContact O-N 3.14Å |
| 169 | S | 81.9 | Confident | 72.8 | Confident | 70 Ų | 70 | 104.9 Ų | 104.9 | 49% | 0.49 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.6 | -43.1 | 176.7 | -177.7 | 0 | 0 | 0 | 0 | 112.1 | A165 L166 D167 L172 Q173 | A165-S169 VanDerWaalsContact O-CB 3.3Å; A165-S169 WeakPolarHBondContact O-CB 3.48Å; A165-S169 PolarHBondContact O-N 2.9Å; L166-S169 PolarHBondContact O-N 2.93Å; D167-S169 VanDerWaalsContact C-N 3.3Å; D167-S169 PolarHBondContact O-N 3.2Å; S169-L172 PolarHBondContact O-N 2.83Å; S169-Q173 WeakPolarHBondContact O-CB 3.4Å; S169-Q173 PolarHBondContact O-N 2.86Å |
| 170 | R | 86.3 | Confident | 74.5 | Confident | 181 Ų | 181 | 100.9 Ų | 100.9 | 68% | 0.683 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.6 | -40.1 | 174.5 | -78.4 | -174.2 | 172.8 | -172.7 | 1.2 | 112.3 | L166 D167 Q173 A174 | L166-R170 WeakPolarHBondContact O-CG 3.38Å; L166-R170 PolarHBondContact O-N 3.46Å; D167-R170 PolarHBondContact O-N 3.43Å; R170-Q173 PolarHBondContact O-N 2.81Å; R170-A174 WeakPolarHBondContact O-CB 3.47Å; R170-A174 PolarHBondContact O-N 3.27Å |
| 171 | Q | 86.8 | Confident | 76.3 | Confident | 130 Ų | 130 | 101.5 Ų | 101.5 | 61% | 0.607 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64 | -45.6 | 176.4 | -175.6 | 170.7 | 0.5 | 0 | 0 | 111 | D167 S168 Q173 A174 D175 | D167-Q171 VanDerWaalsContact O-CB 3.27Å; D167-Q171 WeakPolarHBondContact O-CB 3.25Å; D167-Q171 PolarHBondContact O-N 3.48Å; S168-Q171 PolarHBondContact O-N 3.34Å; Q171-Q173 VanDerWaalsContact C-N 3.33Å; Q171-Q173 PolarHBondContact O-N 2.93Å; Q171-A174 WeakPolarHBondContact O-CB 3.42Å; Q171-A174 PolarHBondContact O-N 2.94Å; Q171-D175 PolarHBondContact O-N 3.39Å |
| 172 | L | 87.5 | Confident | 77.2 | Confident | 106 Ų | 106 | 100 Ų | 100 | 56% | 0.555 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61.9 | -40.2 | 174.6 | -179.3 | 62.3 | 0 | 0 | 0 | 112 | S168 S169 A174 D175 I176 | S168-L172 VanDerWaalsContact O-CB 3.3Å; S168-L172 WeakPolarHBondContact O-CB 3.37Å; S168-L172 PolarHBondContact O-N 3.14Å; S169-L172 PolarHBondContact O-N 2.83Å; L172-A174 VanDerWaalsContact C-N 3.34Å; L172-D175 PolarHBondContact O-N 3.42Å; L172-I176 HydrophobicContact CD1-CD1 4.29Å; L172-I176 HydrophobicContact CD1-CG1 4.45Å; L172-I176 HydrophobicContact CG-CD1 4.07Å; L172-I176 VanDerWaalsContact O-CG1 3.25Å; L172-I176 WeakPolarHBondContact O-CG1 3.27Å; L172-I176 PolarHBondContact O-N 3.08Å |
| 173 | Q | 90.8 | Very high | 77.6 | Confident | 136 Ų | 136 | 101.6 Ų | 101.6 | 64% | 0.636 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.4 | -39.4 | 175.5 | -171.2 | 178.1 | 11.6 | 0 | 0 | 111.9 | S169 R170 Q171 L177 | S169-Q173 WeakPolarHBondContact O-CB 3.4Å; S169-Q173 PolarHBondContact O-N 2.86Å; R170-Q173 PolarHBondContact O-N 2.81Å; Q171-Q173 VanDerWaalsContact C-N 3.33Å; Q171-Q173 PolarHBondContact O-N 2.93Å; Q173-L177 WeakPolarHBondContact O-CB 3.44Å; Q173-L177 PolarHBondContact O-N 2.95Å |
| 174 | A | 87.5 | Confident | 78.1 | Confident | 54 Ų | 54 | 104.6 Ų | 104.6 | 45% | 0.446 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.5 | -41.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | R170 Q171 L172 L177 A178 | R170-A174 WeakPolarHBondContact O-CB 3.47Å; R170-A174 PolarHBondContact O-N 3.27Å; Q171-A174 WeakPolarHBondContact O-CB 3.42Å; Q171-A174 PolarHBondContact O-N 2.94Å; L172-A174 VanDerWaalsContact C-N 3.34Å; A174-L177 PolarHBondContact O-N 3.08Å; A174-A178 VanDerWaalsContact O-CB 3.28Å; A174-A178 WeakPolarHBondContact O-CB 3.36Å; A174-A178 PolarHBondContact O-N 3.18Å |
| 175 | D | 90.3 | Very high | 78.1 | Confident | 96 Ų | 96 | 102.4 Ų | 102.4 | 51% | 0.513 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.9 | -39.7 | 177.8 | -79.6 | -7.5 | 0 | 0 | 0 | 112.2 | Q171 L172 A178 A179 | Q171-D175 PolarHBondContact O-N 3.39Å; L172-D175 PolarHBondContact O-N 3.42Å; D175-A178 PolarHBondContact O-N 3.4Å; D175-A179 WeakPolarHBondContact O-CB 3.2Å; D175-A179 PolarHBondContact O-N 2.81Å |
| 176 | I | 91.1 | Very high | 77.8 | Confident | 102 Ų | 102 | 105.8 Ų | 105.8 | 52% | 0.523 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.4 | -44.2 | 173.9 | -68.4 | 165.6 | 0 | 0 | 0 | 110.4 | L172 A178 A179 T180 | L172-I176 HydrophobicContact CD1-CD1 4.29Å; L172-I176 HydrophobicContact CD1-CG1 4.45Å; L172-I176 HydrophobicContact CG-CD1 4.07Å; L172-I176 VanDerWaalsContact O-CG1 3.25Å; L172-I176 WeakPolarHBondContact O-CG1 3.27Å; L172-I176 PolarHBondContact O-N 3.08Å; I176-A178 VanDerWaalsContact C-N 3.3Å; I176-A178 PolarHBondContact O-N 3.29Å; I176-A179 PolarHBondContact O-N 2.79Å; I176-T180 HydrophobicContact CG2-CG2 4.47Å; I176-T180 WeakPolarHBondContact O-CB 3.36Å; I176-T180 VanDerWaalsContact O-CG2 3.27Å; I176-T180 WeakPolarHBondContact O-CG2 3.46Å; I176-T180 PolarHBondContact O-N 2.89Å; I176-T180 PolarHBondContact O-OG1 3.19Å |
| 177 | L | 87.6 | Confident | 77.1 | Confident | 120 Ų | 120 | 106.4 Ų | 106.4 | 63% | 0.628 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.5 | -39.6 | 176.1 | -170.9 | 67.1 | 0 | 0 | 0 | 111.1 | Q173 A174 T180 Q181 | Q173-L177 WeakPolarHBondContact O-CB 3.44Å; Q173-L177 PolarHBondContact O-N 2.95Å; A174-L177 PolarHBondContact O-N 3.08Å; L177-T180 WeakPolarHBondContact CA-OG1 3.3Å; L177-T180 PolarHBondContact O-N 3.06Å; L177-T180 PolarHBondContact O-OG1 3.12Å; L177-Q181 WeakPolarHBondContact O-CG 3.3Å; L177-Q181 PolarHBondContact O-N 2.86Å; L177-Q181 VanDerWaalsContact O-N 3.08Å |
| 178 | A | 84.1 | Confident | 76.1 | Confident | 33 Ų | 33 | 112 Ų | 112 | 27% | 0.273 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.1 | -39.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | A174 D175 I176 Q181 N182 | A174-A178 VanDerWaalsContact O-CB 3.28Å; A174-A178 WeakPolarHBondContact O-CB 3.36Å; A174-A178 PolarHBondContact O-N 3.18Å; D175-A178 PolarHBondContact O-N 3.4Å; I176-A178 VanDerWaalsContact C-N 3.3Å; I176-A178 PolarHBondContact O-N 3.29Å; A178-Q181 WeakPolarHBondContact O-CG 3.22Å; A178-N182 PolarHBondContact O-N 2.91Å; A178-N182 PolarHBondContact O-ND2 3.47Å |
| 179 | A | 84.1 | Confident | 74.4 | Confident | 53 Ų | 53 | 113.9 Ų | 113.9 | 44% | 0.438 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.2 | -43.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | D175 I176 Q181 N182 L183 | D175-A179 WeakPolarHBondContact O-CB 3.2Å; D175-A179 PolarHBondContact O-N 2.81Å; I176-A179 PolarHBondContact O-N 2.79Å; A179-Q181 PolarHBondContact O-N 3.3Å; A179-N182 PolarHBondContact O-N 2.81Å; A179-N182 VanDerWaalsContact O-N 3.16Å; A179-L183 VanDerWaalsContact O-CG 3.31Å; A179-L183 WeakPolarHBondContact O-CG 2.96Å; A179-L183 PolarHBondContact O-N 2.63Å |
| 180 | T | 81.3 | Confident | 72.6 | Confident | 73 Ų | 73 | 114.1 Ų | 114.1 | 45% | 0.448 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -67.2 | -33.3 | -179.1 | 52.4 | 0 | 0 | 0 | 0 | 113.7 | I176 L177 L183 K184 | I176-T180 HydrophobicContact CG2-CG2 4.47Å; I176-T180 WeakPolarHBondContact O-CB 3.36Å; I176-T180 VanDerWaalsContact O-CG2 3.27Å; I176-T180 WeakPolarHBondContact O-CG2 3.46Å; I176-T180 PolarHBondContact O-N 2.89Å; I176-T180 PolarHBondContact O-OG1 3.19Å; L177-T180 WeakPolarHBondContact CA-OG1 3.3Å; L177-T180 PolarHBondContact O-N 3.06Å; L177-T180 PolarHBondContact O-OG1 3.12Å; T180-L183 PolarHBondContact O-N 3.49Å; T180-K184 PolarHBondContact O-N 3.14Å |
| 181 | Q | 79.6 | Confident | 70.5 | Confident | 132 Ų | 132 | 113.6 Ų | 113.6 | 62% | 0.617 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.2 | -30.8 | 171.8 | 63.8 | -178 | -8.8 | 0 | 0 | 113.1 | L177 A178 A179 L183 K184 | L177-Q181 WeakPolarHBondContact O-CG 3.3Å; L177-Q181 PolarHBondContact O-N 2.86Å; L177-Q181 VanDerWaalsContact O-N 3.08Å; A178-Q181 WeakPolarHBondContact O-CG 3.22Å; A179-Q181 PolarHBondContact O-N 3.3Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; Q181-K184 WeakPolarHBondContact O-CB 3.33Å; Q181-K184 PolarHBondContact O-N 2.75Å |
| 182 | N | 68.2 | Low | 68.2 | Low | 134 Ų | 134 | 111.4 Ų | 111.4 | 72% | 0.717 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -74.3 | -25.7 | 172.9 | -81.3 | -77.1 | 0 | 0 | 0 | 112.6 | A178 A179 K184 | A178-N182 PolarHBondContact O-N 2.91Å; A178-N182 PolarHBondContact O-ND2 3.47Å; A179-N182 PolarHBondContact O-N 2.81Å; A179-N182 VanDerWaalsContact O-N 3.16Å; N182-K184 VanDerWaalsContact C-N 3.27Å |
| 183 | L | 63.3 | Low | 65.7 | Low | 139 Ų | 139 | 110.4 Ų | 110.4 | 73% | 0.728 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -77 | -13.1 | 172 | -65.2 | 172.3 | 0 | 0 | 0 | 112.9 | A179 T180 Q181 S185 | A179-L183 VanDerWaalsContact O-CG 3.31Å; A179-L183 WeakPolarHBondContact O-CG 2.96Å; A179-L183 PolarHBondContact O-N 2.63Å; T180-L183 PolarHBondContact O-N 3.49Å; Q181-L183 VanDerWaalsContact C-N 3.34Å; L183-S185 PolarHBondContact O-N 3.39Å |
| 184 | K | 65.8 | Low | 63 | Low | 177 Ų | 177 | 107.6 Ų | 107.6 | 77% | 0.77 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -76.3 | 70.2 | 169.4 | -162.7 | 102.9 | 163.7 | -169.4 | 0 | 109.2 | T180 Q181 N182 | T180-K184 PolarHBondContact O-N 3.14Å; Q181-K184 WeakPolarHBondContact O-CB 3.33Å; Q181-K184 PolarHBondContact O-N 2.75Å; N182-K184 VanDerWaalsContact C-N 3.27Å |
| 185 | S | 55.7 | Low | 60.8 | Low | 76 Ų | 76 | 114.8 Ų | 114.8 | 53% | 0.531 | 69% | 0.692 | S | S | . | * | trans | -48 | 139.6 | 168.6 | 60.5 | 0 | 0 | 0 | 0 | 110.3 | L183 T187 | L183-S185 PolarHBondContact O-N 3.39Å; S185-T187 PolarHBondContact O-N 2.91Å; S185-T187 PolarHBondContact OG-OG1 2.86Å | ||
| 186 | P | 54.1 | Low | 58.1 | Low | 138 Ų | 138 | 113.5 Ų | 113.5 | 90% | 0.896 | 70% | 0.702 | S | S | * | * | trans | -72.4 | 75.8 | 172.3 | 29.2 | -31.2 | 0 | 0 | 0 | 108.8 | ||||
| 187 | T | 48.5 | Very low | 55.4 | Low | 118 Ų | 118 | 112.6 Ų | 112.6 | 72% | 0.724 | 71% | 0.709 | S | S | * | * | trans | -107.9 | 109.3 | 171.5 | -55.9 | 0 | 0 | 0 | 0 | 108.6 | S185 | S185-T187 PolarHBondContact O-N 2.91Å; S185-T187 PolarHBondContact OG-OG1 2.86Å | ||
| 188 | R | 47.4 | Very low | 53.1 | Low | 212 Ų | 212 | 118.2 Ų | 118.2 | 80% | 0.8 | 72% | 0.722 | S | S | * | * | trans | 106.4 | 76 | 161.8 | -155.7 | 178.1 | -178.2 | 170.4 | -0.1 | 116.7 | ||||
| 189 | A | 39.8 | Very low | 50.7 | Low | 112 Ų | 112 | 125.3 Ų | 125.3 | 93% | 0.926 | 75% | 0.752 | S | S | * | * | trans | -111.6 | 68.9 | 134 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 190 | A | 46 | Very low | 48.6 | Very low | 75 Ų | 75 | 128.7 Ų | 128.7 | 62% | 0.62 | 77% | 0.767 | S | S | * | * | trans | -121.1 | 89.8 | 158.9 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 191 | L | 41.6 | Very low | 46.5 | Very low | 170 Ų | 170 | 134.1 Ų | 134.1 | 89% | 0.89 | 79% | 0.787 | S | S | * | * | trans | -165 | 109.9 | 146.7 | -160.5 | 67 | 0 | 0 | 0 | 110.5 | ||||
| 192 | G | 38 | Very low | 44.2 | Very low | 83 Ų | 83 | 131.7 Ų | 131.7 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | 118 | 97.1 | 143.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 193 | G | 35.5 | Very low | 42.7 | Very low | 85 Ų | 85 | 136.7 Ų | 136.7 | 88% | 0.876 | 81% | 0.806 | S | S | * | * | trans | 134.2 | 107.4 | 143.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 194 | G | 33.2 | Very low | 41.1 | Very low | 77 Ų | 77 | 133.5 Ų | 133.5 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | 102.2 | 89.2 | 144.2 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 195 | E | 41.4 | Very low | 39.6 | Very low | 205 Ų | 205 | 130.1 Ų | 130.1 | 96% | 0.958 | 81% | 0.812 | S | S | * | * | 36.7 | 126 | 123.5 | -154.6 | 149.4 | 142.6 | 0 | 0 | 121.7 | |||||
| 196 | G | 34.2 | Very low | 38.8 | Very low | 70 Ų | 70 | 135 Ų | 135 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 143.5 | 69.6 | 163 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 197 | A | 35 | Very low | 37.9 | Very low | 83 Ų | 83 | 137.2 Ų | 137.2 | 69% | 0.686 | 83% | 0.825 | S | S | * | * | 59.3 | 101.2 | 91.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 198 | R | 38.9 | Very low | 37.1 | Very low | 238 Ų | 238 | 140.2 Ų | 140.2 | 90% | 0.898 | 83% | 0.831 | S | S | * | * | trans | 66.8 | 121.4 | 134.1 | 77.3 | -150.4 | -166.7 | -174.3 | 10.5 | 123.2 | ||||
| 199 | M | 34.1 | Very low | 36.3 | Very low | 181 Ų | 181 | 138.7 Ų | 138.7 | 89% | 0.892 | 83% | 0.832 | S | S | * | * | trans | 179 | 111.4 | 136 | -108.8 | 171.3 | 128.7 | 0 | 0 | 105.5 | ||||
| 200 | V | 39.9 | Very low | 36 | Very low | 124 Ų | 124 | 142.5 Ų | 142.5 | 75% | 0.752 | 83% | 0.828 | S | S | * | * | 45 | 97.3 | 55.5 | 172.7 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 201 | E | 37.3 | Very low | 35.4 | Very low | 187 Ų | 187 | 142.6 Ų | 142.6 | 87% | 0.874 | 84% | 0.837 | S | S | * | * | trans | 56.3 | 122 | 134.7 | -153.9 | 161.9 | 179 | 0 | 0 | 119.9 | ||||
| 202 | G | 30.2 | Very low | 34.9 | Very low | 81 Ų | 81 | 140.4 Ų | 140.4 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | trans | -162.1 | 113.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 203 | R | 37.8 | Very low | 35 | Very low | 239 Ų | 239 | 144.9 Ų | 144.9 | 90% | 0.902 | 83% | 0.834 | S | S | * | * | trans | -86.6 | 147.9 | -172.4 | -163.7 | -172.8 | -161.7 | -83.6 | 1.8 | 111.3 | ||||
| 204 | G | 28.2 | Very low | 34.8 | Very low | 73 Ų | 73 | 149.5 Ų | 149.5 | 75% | 0.753 | 83% | 0.833 | S | S | * | * | trans | 123.3 | 109.8 | 143.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 205 | A | 35.2 | Very low | 34.7 | Very low | 105 Ų | 105 | 149 Ų | 149 | 87% | 0.868 | 83% | 0.828 | S | S | * | * | -169.4 | 135.7 | 126.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 206 | E | 38.3 | Very low | 34.3 | Very low | 178 Ų | 178 | 145.7 Ų | 145.7 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | trans | -95.5 | -170.3 | -170.9 | -59.9 | 177.8 | 145.6 | 0 | 0 | 111.7 | ||||
| 207 | E | 34.8 | Very low | 34.5 | Very low | 186 Ų | 186 | 149.8 Ų | 149.8 | 87% | 0.869 | 82% | 0.817 | S | S | * | * | trans | 87 | 103.9 | -178.4 | -67.1 | -177.9 | 135.1 | 0 | 0 | 114.8 | ||||
| 208 | E | 32.3 | Very low | 34.4 | Very low | 181 Ų | 181 | 153.6 Ų | 153.6 | 85% | 0.846 | 82% | 0.821 | S | S | * | * | 59.2 | 103.7 | 65.4 | -160.4 | 175.7 | 176.3 | 0 | 0 | 112.3 | |||||
| 209 | E | 31.3 | Very low | 34.3 | Very low | 179 Ų | 179 | 148.4 Ų | 148.4 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | 166.5 | 147.2 | 113.6 | -167.8 | 164.8 | 150.4 | 0 | 0 | 111 | |||||
| 210 | K | 33.6 | Very low | 34.4 | Very low | 193 Ų | 193 | 148.1 Ų | 148.1 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | trans | -57.3 | 159.3 | 175.2 | -161.2 | 178.8 | 176.2 | -158.9 | 0 | 112.1 | ||||
| 211 | G | 32.3 | Very low | 33.9 | Very low | 77 Ų | 77 | 146.1 Ų | 146.1 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -68.6 | 173.6 | -167.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 212 | S | 32 | Very low | 33.7 | Very low | 124 Ų | 124 | 146.3 Ų | 146.3 | 87% | 0.867 | 82% | 0.817 | S | S | * | * | trans | -147.8 | 140.4 | 160.7 | -164 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 213 | Q | 38.7 | Very low | 33.6 | Very low | 177 Ų | 177 | 145.8 Ų | 145.8 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -75.7 | 142.6 | 169.9 | 174 | -176.5 | 32.1 | 0 | 0 | 109.9 | ||||
| 214 | E | 31.7 | Very low | 33.5 | Very low | 182 Ų | 182 | 141 Ų | 141 | 85% | 0.85 | 81% | 0.808 | S | S | * | * | trans | -176.2 | 133.4 | 144.3 | -143.2 | 134.6 | 145.6 | 0 | 0 | 106.6 | ||||
| 215 | G | 31.2 | Very low | 34.1 | Very low | 67 Ų | 67 | 142.8 Ų | 142.8 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | 64.8 | 125.8 | 64.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 216 | D | 32.6 | Very low | 34 | Very low | 134 Ų | 134 | 142.9 Ų | 142.9 | 72% | 0.717 | 80% | 0.796 | S | S | * | * | cis | 179 | 161 | 27.4 | -164.3 | 13.8 | 0 | 0 | 0 | 111.2 | ||||
| 217 | Q | 38.4 | Very low | 33.6 | Very low | 157 Ų | 157 | 142.1 Ų | 142.1 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | trans | 56.9 | 143.7 | 157.7 | -77.8 | 171.5 | 87.8 | 0 | 0 | 120.4 | ||||
| 218 | E | 34.6 | Very low | 33.3 | Very low | 163 Ų | 163 | 139.4 Ų | 139.4 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | cis | -165.6 | 145.8 | 33.5 | -152.4 | -172.2 | 110.6 | 0 | 0 | 106.3 | ||||
| 219 | V | 36.3 | Very low | 33.6 | Very low | 129 Ų | 129 | 135.7 Ų | 135.7 | 78% | 0.782 | 78% | 0.781 | S | S | * | * | -171.1 | 138 | 86.5 | 163.6 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 220 | Q | 35.1 | Very low | 33.5 | Very low | 174 Ų | 174 | 136.3 Ų | 136.3 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -54.2 | 141.5 | -179.7 | -161.4 | -179.8 | 88.4 | 0 | 0 | 116.3 | ||||
| 221 | G | 29.2 | Very low | 33.4 | Very low | 83 Ų | 83 | 131.3 Ų | 131.3 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | trans | -143 | 92.1 | 166 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 222 | H | 33.6 | Very low | 33.1 | Very low | 190 Ų | 190 | 136 Ų | 136 | 88% | 0.88 | 78% | 0.779 | S | S | * | * | trans | -75.7 | 140.1 | -177.3 | -151 | 46.4 | 0 | 0 | 0 | 110.9 | ||||
| 223 | G | 28.2 | Very low | 33 | Very low | 71 Ų | 71 | 139.5 Ų | 139.5 | 73% | 0.732 | 78% | 0.782 | S | S | * | * | trans | 172.1 | 72.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 224 | V | 36.6 | Very low | 33 | Very low | 137 Ų | 137 | 139 Ų | 139 | 83% | 0.83 | 78% | 0.78 | S | S | * | * | trans | -120.7 | 134.5 | 149.9 | 170.5 | 0 | 0 | 0 | 0 | 105 | ||||
| 225 | P | 40.8 | Very low | 33.6 | Very low | 112 Ų | 112 | 135.1 Ų | 135.1 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | -146 | 138.4 | 105.3 | 37.7 | -18.9 | 0 | 0 | 0 | 113.3 | |||||
| 226 | V | 33.3 | Very low | 33.3 | Very low | 106 Ų | 106 | 138.4 Ų | 138.4 | 64% | 0.642 | 78% | 0.782 | S | S | * | * | 95.5 | 102.2 | 106.1 | 158.9 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 227 | E | 29.6 | Very low | 33.3 | Very low | 163 Ų | 163 | 138 Ų | 138 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | 97.4 | 135.4 | 112.7 | -70 | -173.2 | -175.2 | 0 | 0 | 111 | |||||
| 228 | T | 28.2 | Very low | 32.7 | Very low | 128 Ų | 128 | 134 Ų | 134 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | -154.8 | 169 | 51.1 | 20.1 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 229 | P | 39.3 | Very low | 32.8 | Very low | 103 Ų | 103 | 132.4 Ų | 132.4 | 67% | 0.669 | 79% | 0.791 | S | S | * | * | trans | -101.5 | -163.5 | -164.5 | 40.3 | -30.2 | 0 | 0 | 0 | 113.1 | ||||
| 230 | E | 28.2 | Very low | 32.9 | Very low | 193 Ų | 193 | 132.1 Ų | 132.1 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | 95.2 | 123.3 | 172.9 | -50.1 | -169.9 | 115.9 | 0 | 0 | 113.8 | ||||
| 231 | A | 30.7 | Very low | 32.7 | Very low | 88 Ų | 88 | 131.5 Ų | 131.5 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | cis | -141.9 | 130.8 | 26.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 232 | Q | 27.9 | Very low | 32.7 | Very low | 174 Ų | 174 | 134.2 Ų | 134.2 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | 30.3 | 94.3 | 65.5 | -71.1 | -162.3 | 57 | 0 | 0 | 115 | |||||
| 233 | E | 29.3 | Very low | 32.6 | Very low | 198 Ų | 198 | 129.5 Ų | 129.5 | 93% | 0.925 | 78% | 0.782 | S | S | * | * | trans | -129 | 106 | 138.2 | -65 | -167 | 130.1 | 0 | 0 | 107.4 | ||||
| 234 | E | 38 | Very low | 32.7 | Very low | 166 Ų | 166 | 129.2 Ų | 129.2 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | -75.8 | 170.8 | 174 | -115.3 | -153.9 | 108.4 | 0 | 0 | 111.2 | ||||
| 235 | P | 43.9 | Very low | 32.5 | Very low | 102 Ų | 102 | 132.6 Ų | 132.6 | 66% | 0.662 | 79% | 0.786 | S | S | * | * | trans | -77.4 | 149.1 | -174.2 | 34.3 | -33.1 | 0 | 0 | 0 | 111.2 | ||||
| 236 | C | 25.1 | Very low | 32.1 | Very low | 136 Ų | 136 | 130.4 Ų | 130.4 | 92% | 0.919 | 78% | 0.784 | S | S | * | * | trans | -148.8 | 117.3 | 161 | -99.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 237 | S | 33.1 | Very low | 32 | Very low | 126 Ų | 126 | 135.1 Ų | 135.1 | 88% | 0.881 | 80% | 0.799 | S | S | * | * | trans | -66.4 | 144.6 | 156.7 | 173.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 238 | G | 26.1 | Very low | 31.9 | Very low | 71 Ų | 71 | 130.4 Ų | 130.4 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | 161.8 | 93.4 | 167 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 239 | V | 35.9 | Very low | 32.1 | Very low | 131 Ų | 131 | 133.2 Ų | 133.2 | 79% | 0.794 | 80% | 0.798 | S | S | * | * | trans | -75.9 | 158.1 | 169.9 | -178.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 240 | P | 39.6 | Very low | 31.7 | Very low | 122 Ų | 122 | 136.6 Ų | 136.6 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | -135.1 | 124.4 | 100.6 | 29.5 | -12.9 | 0 | 0 | 0 | 111.2 | |||||
| 241 | E | 31.1 | Very low | 32.1 | Very low | 162 Ų | 162 | 136 Ų | 136 | 76% | 0.757 | 81% | 0.807 | S | S | * | * | 83.1 | 110.8 | 80.5 | -158.3 | -158.5 | 142.1 | 0 | 0 | 112.3 | |||||
| 242 | V | 28.5 | Very low | 32 | Very low | 140 Ų | 140 | 134.8 Ų | 134.8 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | -149.6 | 113 | 129.2 | 166.2 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 243 | A | 31.1 | Very low | 32.1 | Very low | 90 Ų | 90 | 132.1 Ų | 132.1 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | trans | 48.5 | 131.4 | 142.3 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 244 | G | 30.5 | Very low | 32.1 | Very low | 65 Ų | 65 | 130.1 Ų | 130.1 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | cis | -179.3 | 155.1 | 6 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 245 | E | 32.9 | Very low | 31.8 | Very low | 208 Ų | 208 | 128.9 Ų | 128.9 | 97% | 0.972 | 80% | 0.796 | S | S | * | * | trans | 49.8 | 131.3 | 144.1 | -58.8 | 177.1 | 94.6 | 0 | 0 | 119.6 | ||||
| 246 | G | 31 | Very low | 31.1 | Very low | 67 Ų | 67 | 131.4 Ų | 131.4 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | cis | -166.6 | 146.3 | 5.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 247 | Q | 31.4 | Very low | 31.6 | Very low | 204 Ų | 204 | 128.5 Ų | 128.5 | 95% | 0.953 | 79% | 0.789 | S | S | * | * | 72 | 129.6 | 91 | -154.9 | 172.6 | -0.3 | 0 | 0 | 112.9 | |||||
| 248 | G | 29 | Very low | 31.7 | Very low | 64 Ų | 64 | 129.9 Ų | 129.9 | 66% | 0.66 | 78% | 0.782 | S | S | * | * | cis | -148.5 | 160.7 | 9.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 249 | E | 30.6 | Very low | 31.9 | Very low | 187 Ų | 187 | 134.4 Ų | 134.4 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | 71.2 | 109.1 | 94.5 | -160.9 | 179.1 | 115.6 | 0 | 0 | 112.7 | |||||
| 250 | L | 32.7 | Very low | 31.9 | Very low | 174 Ų | 174 | 132 Ų | 132 | 91% | 0.911 | 78% | 0.777 | S | S | * | * | trans | -144.8 | 75.6 | 164.5 | -134 | 164.2 | 0 | 0 | 0 | 108.6 | ||||
| 251 | E | 36.6 | Very low | 31.7 | Very low | 182 Ų | 182 | 135.5 Ų | 135.5 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | trans | -87.6 | 140.3 | 151.6 | -81.9 | -145.8 | 106.2 | 0 | 0 | 109.3 | ||||
| 252 | G | 27.8 | Very low | 31.7 | Very low | 62 Ų | 62 | 131.3 Ų | 131.3 | 64% | 0.639 | 78% | 0.783 | S | S | * | * | trans | 97.7 | 133.5 | 141.7 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 253 | S | 30.7 | Very low | 32.8 | Very low | 118 Ų | 118 | 130.5 Ų | 130.5 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | 91.2 | 94.2 | 162.6 | -41.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 254 | L | 29.1 | Very low | 33.2 | Very low | 155 Ų | 155 | 133.4 Ų | 133.4 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | 45.8 | 114.2 | 64.2 | -103.4 | 178.5 | 0 | 0 | 0 | 114.8 | |||||
| 255 | L | 30.6 | Very low | 33.4 | Very low | 140 Ų | 140 | 133.3 Ų | 133.3 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | trans | 99.6 | 129.9 | 145.8 | -64.9 | 180 | 0 | 0 | 0 | 121.5 | ||||
| 256 | L | 29.7 | Very low | 34.5 | Very low | 156 Ų | 156 | 129.8 Ų | 129.8 | 82% | 0.817 | 78% | 0.783 | S | S | * | * | trans | 66.3 | 139.6 | 147 | -95.8 | 124.1 | 0 | 0 | 0 | 116.5 | ||||
| 257 | A | 36.3 | Very low | 34.7 | Very low | 74 Ų | 74 | 131.3 Ų | 131.3 | 61% | 0.612 | 78% | 0.783 | S | S | * | * | cis | -158.1 | 136.2 | 19.3 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 258 | Q | 33.9 | Very low | 35.2 | Very low | 156 Ų | 156 | 130 Ų | 130 | 73% | 0.729 | 78% | 0.777 | S | S | * | * | 66.2 | 122.4 | 94.5 | -157.4 | -169.4 | 10.4 | 0 | 0 | 115.4 | |||||
| 259 | E | 31.6 | Very low | 35.7 | Very low | 166 Ų | 166 | 132.1 Ų | 132.1 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | 67.4 | 144 | 153.2 | -93.8 | 175.2 | 74.7 | 0 | 0 | 118.3 | ||||
| 260 | A | 35.7 | Very low | 36.9 | Very low | 79 Ų | 79 | 128.4 Ų | 128.4 | 65% | 0.653 | 77% | 0.774 | S | S | * | * | cis | -158.2 | 141.9 | 15 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 261 | Q | 34.5 | Very low | 37 | Very low | 197 Ų | 197 | 126 Ų | 126 | 92% | 0.921 | 77% | 0.77 | S | S | * | * | 45.8 | 103.8 | 126.4 | -141.4 | 157.4 | 95.4 | 0 | 0 | 120.5 | |||||
| 262 | G | 31.5 | Very low | 37.5 | Very low | 73 Ų | 73 | 122.1 Ų | 122.1 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | 84.3 | 158.8 | 124.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 263 | P | 52.7 | Low | 38 | Very low | 124 Ų | 124 | 125.1 Ų | 125.1 | 81% | 0.805 | 78% | 0.78 | S | S | * | * | trans | -121.4 | 144 | -139.3 | 37.1 | -22.7 | 0 | 0 | 0 | 114.8 | ||||
| 264 | V | 38 | Very low | 38.9 | Very low | 150 Ų | 150 | 125 Ų | 125 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | -154.9 | 128.2 | 158.9 | 171.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 265 | G | 36 | Very low | 39.9 | Very low | 64 Ų | 64 | 122.8 Ų | 122.8 | 66% | 0.66 | 78% | 0.776 | S | S | * | * | trans | -86.8 | -149.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 266 | P | 55.1 | Low | 40.9 | Very low | 134 Ų | 134 | 122.5 Ų | 122.5 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | -123.9 | 156.9 | -97 | 38.2 | -27.1 | 0 | 0 | 0 | 114.1 | |||||
| 267 | S | 35.8 | Very low | 41.8 | Very low | 99 Ų | 99 | 123.2 Ų | 123.2 | 69% | 0.692 | 78% | 0.778 | S | S | * | * | trans | -174 | 143.8 | 156.6 | 62.6 | 0 | 0 | 0 | 0 | 105 | ||||
| 268 | E | 40.8 | Very low | 42.9 | Very low | 175 Ų | 175 | 125.3 Ų | 125.3 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | cis | -177.9 | 140.1 | 34.4 | 36.7 | -148 | 69 | 0 | 0 | 106.9 | ||||
| 269 | S | 40.2 | Very low | 43.6 | Very low | 110 Ų | 110 | 123.3 Ų | 123.3 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | -72.9 | 167.1 | 173.4 | 69.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 270 | P | 56 | Low | 44.4 | Very low | 108 Ų | 108 | 125.6 Ų | 125.6 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | -157.5 | 158.8 | 65.5 | 38.1 | -14.7 | 0 | 0 | 0 | 119.6 | |||||
| 271 | C | 34.8 | Very low | 44.8 | Very low | 123 Ų | 123 | 128 Ų | 128 | 83% | 0.831 | 82% | 0.822 | S | S | * | * | trans | 66.8 | 112.2 | 142.1 | -66.3 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 272 | A | 45.9 | Very low | 45.3 | Very low | 101 Ų | 101 | 124.3 Ų | 124.3 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | -150.5 | 112.7 | 126.1 | 0 | 0 | 0 | 0 | 0 | 110 | |||||
| 273 | C | 39.3 | Very low | 46.1 | Very low | 126 Ų | 126 | 127.2 Ų | 127.2 | 85% | 0.851 | 82% | 0.821 | S | S | * | * | trans | -74.9 | 135.2 | 170.8 | -66.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 274 | S | 50.1 | Low | 45.7 | Very low | 115 Ų | 115 | 127.4 Ų | 127.4 | 80% | 0.804 | 82% | 0.822 | S | S | * | * | trans | -150.2 | 99.2 | 149.7 | -49.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 275 | S | 49.4 | Very low | 46.2 | Very low | 109 Ų | 109 | 125.9 Ų | 125.9 | 76% | 0.762 | 82% | 0.816 | S | S | * | * | trans | -5.5 | 135.9 | 149.1 | 56.8 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 276 | V | 52.9 | Low | 46.9 | Very low | 133 Ų | 133 | 130.1 Ų | 130.1 | 81% | 0.806 | 83% | 0.827 | S | S | * | * | 160.4 | 133.6 | 103.3 | 170.5 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 277 | H | 46.5 | Very low | 46.3 | Very low | 171 Ų | 171 | 129.8 Ų | 129.8 | 79% | 0.792 | 82% | 0.823 | S | S | * | * | trans | -51.6 | 159.8 | 175 | -106.1 | -96.5 | 0 | 0 | 0 | 115.4 | ||||
| 278 | P | 60.8 | Low | 47.1 | Very low | 118 Ų | 118 | 132.2 Ų | 132.2 | 77% | 0.766 | 83% | 0.834 | S | S | * | * | trans | -111.8 | 136.2 | 134.5 | 26.8 | -13.9 | 0 | 0 | 0 | 111.5 | ||||
| 279 | S | 48.9 | Very low | 47.6 | Very low | 114 Ų | 114 | 128.6 Ų | 128.6 | 80% | 0.797 | 84% | 0.835 | S | S | * | * | trans | -64.9 | 158 | 166.6 | -73.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 280 | V | 46.8 | Very low | 48.3 | Very low | 215 Ų | 215 | 130.3 Ų | 130.3 | 100% | 1.303 | 84% | 0.841 | S | S | * | * | trans | -46.3 | 0 | 167.9 | -178.6 | 0 | 0 | 0 | 0 | 112.8 |
Retrieved 280 of 280 residues in 972.9 ms
(Link to these results)