| 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 | 61 | Low | 84 | Confident | 200 Ų | 200 | 106.9 Ų | 106.9 | 99% | 0.985 | 60% | 0.601 | S | S | * | * | 0 | -20.1 | 0 | -66.2 | -158.9 | -73.6 | 0 | 0 | 113.7 | T4 | M1-T4 PolarHBondContact O-OG1 2.82Š| |||
| 2 | S | 60.4 | Low | 85.1 | Confident | 86 Ų | 86 | 102.4 Ų | 102.4 | 60% | 0.601 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.8 | -43.7 | 175.9 | 50.2 | 0 | 0 | 0 | 0 | 113.6 | T4 I5 E6 | S2-T4 VanDerWaalsContact C-N 3.26Å; S2-T4 PolarHBondContact O-N 3.13Å; S2-I5 PolarHBondContact O-N 3.19Å; S2-I5 VanDerWaalsContact O-N 3.13Å; S2-E6 PolarHBondContact O-N 3.33Å; S2-E6 VanDerWaalsContact O-N 3.1Å |
| 3 | C | 71 | Confident | 85.9 | Confident | 79 Ų | 79 | 105.5 Ų | 105.5 | 53% | 0.534 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.5 | -26.8 | -177.1 | -165.3 | 0 | 0 | 0 | 0 | 114.1 | K7 | C3-K7 WeakPolarHBondContact O-CG 3.47Å; C3-K7 PolarHBondContact O-N 3.1Å |
| 4 | T | 86.9 | Confident | 86.7 | Confident | 96 Ų | 96 | 101.1 Ų | 101.1 | 59% | 0.589 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -76.6 | -36.7 | 175.6 | 27.5 | 0 | 0 | 0 | 0 | 112.9 | M1 S2 A8 | M1-T4 PolarHBondContact O-OG1 2.82Å; S2-T4 VanDerWaalsContact C-N 3.26Å; S2-T4 PolarHBondContact O-N 3.13Å; T4-A8 PolarHBondContact O-N 3.15Å; T4-A8 VanDerWaalsContact O-N 3.15Å |
| 5 | I | 88.6 | Confident | 87.4 | Confident | 112 Ų | 112 | 100.1 Ų | 100.1 | 57% | 0.574 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -70.7 | -40.5 | 177.3 | -67.1 | 169.5 | 0 | 0 | 0 | 110 | S2 K7 A8 L9 | S2-I5 PolarHBondContact O-N 3.19Å; S2-I5 VanDerWaalsContact O-N 3.13Å; I5-K7 PolarHBondContact O-N 3.28Å; I5-A8 PolarHBondContact O-N 2.89Å; I5-L9 HydrophobicContact CG2-CD1 4.28Å; I5-L9 WeakPolarHBondContact O-CB 3.48Å; I5-L9 PolarHBondContact O-N 3.47Å |
| 6 | E | 90.2 | Very high | 88 | Confident | 127 Ų | 127 | 99.4 Ų | 99.4 | 59% | 0.593 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -60.8 | -42.4 | 176.2 | -73.9 | 174.6 | -177.5 | 0 | 0 | 112.5 | S2 L9 A10 | S2-E6 PolarHBondContact O-N 3.33Å; S2-E6 VanDerWaalsContact O-N 3.1Å; E6-L9 PolarHBondContact O-N 2.9Å; E6-A10 WeakPolarHBondContact O-CB 3.33Å; E6-A10 PolarHBondContact O-N 3.33Å |
| 7 | K | 91.2 | Very high | 88.6 | Confident | 144 Ų | 144 | 99.8 Ų | 99.8 | 63% | 0.626 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62 | -46.1 | 173.8 | -77 | -177.2 | 178.3 | -175.6 | 0 | 112.3 | C3 I5 L9 A10 D11 | C3-K7 WeakPolarHBondContact O-CG 3.47Å; C3-K7 PolarHBondContact O-N 3.1Å; I5-K7 PolarHBondContact O-N 3.28Å; K7-L9 VanDerWaalsContact C-N 3.28Å; K7-L9 PolarHBondContact O-N 2.92Å; K7-A10 PolarHBondContact O-N 3.28Å; K7-A10 VanDerWaalsContact O-N 3.17Å; K7-D11 PolarHBondContact O-N 3.04Å |
| 8 | A | 92.5 | Very high | 89.1 | Confident | 61 Ų | 61 | 101.3 Ų | 101.3 | 50% | 0.504 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.6 | -38.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | T4 I5 A12 | T4-A8 PolarHBondContact O-N 3.15Å; T4-A8 VanDerWaalsContact O-N 3.15Å; I5-A8 PolarHBondContact O-N 2.89Å; A8-A12 VanDerWaalsContact O-CB 3.27Å; A8-A12 WeakPolarHBondContact O-CB 3.44Å; A8-A12 PolarHBondContact O-N 3.47Å |
| 9 | L | 93.5 | Very high | 89.5 | Confident | 97 Ų | 97 | 100.7 Ų | 100.7 | 51% | 0.508 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.6 | -39.7 | 174.1 | -105.9 | 160.1 | 0 | 0 | 0 | 112.4 | I5 E6 K7 K13 | I5-L9 HydrophobicContact CG2-CD1 4.28Å; I5-L9 WeakPolarHBondContact O-CB 3.48Å; I5-L9 PolarHBondContact O-N 3.47Å; E6-L9 PolarHBondContact O-N 2.9Å; K7-L9 VanDerWaalsContact C-N 3.28Å; K7-L9 PolarHBondContact O-N 2.92Å; L9-K13 WeakPolarHBondContact O-CG 3.27Å; L9-K13 PolarHBondContact O-N 2.9Å |
| 10 | A | 94.2 | Very high | 89.9 | Confident | 55 Ų | 55 | 103.4 Ų | 103.4 | 46% | 0.455 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.9 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | E6 K7 K13 A14 | E6-A10 WeakPolarHBondContact O-CB 3.33Å; E6-A10 PolarHBondContact O-N 3.33Å; K7-A10 PolarHBondContact O-N 3.28Å; K7-A10 VanDerWaalsContact O-N 3.17Å; A10-K13 PolarHBondContact O-N 3.31Å; A10-A14 WeakPolarHBondContact O-CB 3.49Å; A10-A14 PolarHBondContact O-N 2.98Å |
| 11 | D | 94.8 | Very high | 90.2 | Very high | 119 Ų | 119 | 103 Ų | 103 | 64% | 0.636 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.6 | -41.9 | 176.7 | -80.1 | -6.2 | 0 | 0 | 0 | 111.9 | K7 K13 A14 L15 | K7-D11 PolarHBondContact O-N 3.04Å; D11-K13 VanDerWaalsContact C-N 3.34Å; D11-K13 PolarHBondContact O-N 3.17Å; D11-A14 PolarHBondContact O-N 3.19Å; D11-L15 WeakPolarHBondContact O-CB 3.39Å; D11-L15 PolarHBondContact O-N 2.98Å |
| 12 | A | 96.7 | Very high | 92 | Very high | 53 Ų | 53 | 99 Ų | 99 | 44% | 0.438 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A8 L15 V16 | A8-A12 VanDerWaalsContact O-CB 3.27Å; A8-A12 WeakPolarHBondContact O-CB 3.44Å; A8-A12 PolarHBondContact O-N 3.47Å; A12-L15 PolarHBondContact O-N 2.91Å; A12-V16 WeakPolarHBondContact O-CG2 3.42Å; A12-V16 PolarHBondContact O-N 3.36Å |
| 13 | K | 96.2 | Very high | 93.8 | Very high | 143 Ų | 143 | 99.9 Ų | 99.9 | 62% | 0.622 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.6 | -45.9 | 174.1 | -76.2 | 177.4 | -179.9 | -176.8 | 0 | 112 | L9 A10 D11 L15 V16 E17 | L9-K13 WeakPolarHBondContact O-CG 3.27Å; L9-K13 PolarHBondContact O-N 2.9Å; A10-K13 PolarHBondContact O-N 3.31Å; D11-K13 VanDerWaalsContact C-N 3.34Å; D11-K13 PolarHBondContact O-N 3.17Å; K13-L15 VanDerWaalsContact C-N 3.27Å; K13-L15 PolarHBondContact O-N 3.39Å; K13-V16 PolarHBondContact O-N 3.14Å; K13-E17 PolarHBondContact O-N 2.89Å |
| 14 | A | 96.4 | Very high | 95 | Very high | 44 Ų | 44 | 100.2 Ų | 100.2 | 36% | 0.364 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.2 | -34.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A10 D11 R18 | A10-A14 WeakPolarHBondContact O-CB 3.49Å; A10-A14 PolarHBondContact O-N 2.98Å; D11-A14 PolarHBondContact O-N 3.19Å; A14-R18 WeakPolarHBondContact O-CB 3.33Å; A14-R18 PolarHBondContact O-N 2.94Å; A14-R18 VanDerWaalsContact O-N 3.14Å |
| 15 | L | 97.1 | Very high | 95.5 | Very high | 86 Ų | 86 | 98.5 Ų | 98.5 | 45% | 0.45 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.7 | -41.8 | 174.1 | -177.2 | 64.5 | 0 | 0 | 0 | 111.7 | D11 A12 K13 R18 L19 | D11-L15 WeakPolarHBondContact O-CB 3.39Å; D11-L15 PolarHBondContact O-N 2.98Å; A12-L15 PolarHBondContact O-N 2.91Å; K13-L15 VanDerWaalsContact C-N 3.27Å; K13-L15 PolarHBondContact O-N 3.39Å; L15-R18 PolarHBondContact O-N 3.38Å; L15-L19 HydrophobicContact CG-CD1 4.23Å; L15-L19 WeakPolarHBondContact O-CB 3.39Å; L15-L19 WeakPolarHBondContact O-CG 3.46Å; L15-L19 PolarHBondContact O-N 3.27Å |
| 16 | V | 97.9 | Very high | 96 | Very high | 88 Ų | 88 | 95.4 Ų | 95.4 | 53% | 0.533 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.5 | -45.1 | 177.7 | 170.3 | 0 | 0 | 0 | 0 | 111.3 | A12 K13 R18 L19 R20 | A12-V16 WeakPolarHBondContact O-CG2 3.42Å; A12-V16 PolarHBondContact O-N 3.36Å; K13-V16 PolarHBondContact O-N 3.14Å; V16-R18 VanDerWaalsContact C-N 3.31Å; V16-R18 PolarHBondContact O-N 2.86Å; V16-L19 PolarHBondContact O-N 2.87Å; V16-R20 WeakPolarHBondContact O-CB 3.37Å; V16-R20 PolarHBondContact O-N 3.31Å |
| 17 | E | 96.9 | Very high | 96.4 | Very high | 106 Ų | 106 | 95.7 Ų | 95.7 | 50% | 0.495 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.8 | -43.6 | 175 | -69.4 | -59.3 | 139.6 | 0 | 0 | 111 | K13 L19 R20 D21 | K13-E17 PolarHBondContact O-N 2.89Å; E17-L19 VanDerWaalsContact C-N 3.35Å; E17-L19 PolarHBondContact O-N 3.14Å; E17-R20 WeakPolarHBondContact O-CB 3.49Å; E17-R20 PolarHBondContact O-N 3.12Å; E17-R20 VanDerWaalsContact O-N 3.14Å; E17-D21 PolarHBondContact O-N 3.41Å |
| 18 | R | 97.7 | Very high | 96.7 | Very high | 128 Ų | 128 | 91.4 Ų | 91.4 | 48% | 0.483 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.1 | -35.7 | 178.5 | -155 | -173.5 | -52.3 | 121.6 | 5.4 | 113.2 | A14 L15 V16 R20 H22 | A14-R18 WeakPolarHBondContact O-CB 3.33Å; A14-R18 PolarHBondContact O-N 2.94Å; A14-R18 VanDerWaalsContact O-N 3.14Å; L15-R18 PolarHBondContact O-N 3.38Å; V16-R18 VanDerWaalsContact C-N 3.31Å; V16-R18 PolarHBondContact O-N 2.86Å; R18-R20 VanDerWaalsContact C-N 3.32Å; R18-H22 VanDerWaalsContact O-CG 3.27Å; R18-H22 PolarHBondContact O-N 3.41Å; R18-H22 VanDerWaalsContact O-N 3.12Å |
| 19 | L | 97.3 | Very high | 96.9 | Very high | 90 Ų | 90 | 94 Ų | 94 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.8 | -39.9 | 173.5 | -77.3 | 171.3 | 0 | 0 | 0 | 110.6 | L15 V16 E17 H22 D23 | L15-L19 HydrophobicContact CG-CD1 4.23Å; L15-L19 WeakPolarHBondContact O-CB 3.39Å; L15-L19 WeakPolarHBondContact O-CG 3.46Å; L15-L19 PolarHBondContact O-N 3.27Å; V16-L19 PolarHBondContact O-N 2.87Å; E17-L19 VanDerWaalsContact C-N 3.35Å; E17-L19 PolarHBondContact O-N 3.14Å; L19-H22 PolarHBondContact O-N 3.43Å; L19-D23 PolarHBondContact O-N 3.15Å |
| 20 | R | 97.4 | Very high | 97.2 | Very high | 153 Ų | 153 | 94.5 Ų | 94.5 | 58% | 0.577 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.3 | -43.9 | 177 | -164.4 | 179.8 | 178.7 | -179.3 | -0.7 | 112.3 | V16 E17 R18 H22 D23 D24 | V16-R20 WeakPolarHBondContact O-CB 3.37Å; V16-R20 PolarHBondContact O-N 3.31Å; E17-R20 WeakPolarHBondContact O-CB 3.49Å; E17-R20 PolarHBondContact O-N 3.12Å; E17-R20 VanDerWaalsContact O-N 3.14Å; R18-R20 VanDerWaalsContact C-N 3.32Å; R20-H22 VanDerWaalsContact C-N 3.28Å; R20-H22 PolarHBondContact O-N 3.07Å; R20-D23 PolarHBondContact O-N 2.9Å; R20-D24 PolarHBondContact O-N 3.37Å |
| 21 | D | 97.3 | Very high | 97.3 | Very high | 97 Ų | 97 | 98.3 Ų | 98.3 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.2 | -38.7 | 174.5 | -67.7 | -26.6 | 0 | 0 | 0 | 111.8 | E17 A25 | E17-D21 PolarHBondContact O-N 3.41Å; D21-A25 WeakPolarHBondContact O-CB 3.38Å; D21-A25 PolarHBondContact O-N 3.01Å |
| 22 | H | 97.9 | Very high | 97.5 | Very high | 116 Ų | 116 | 98.7 Ų | 98.7 | 54% | 0.537 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -69.3 | -39.1 | 175.6 | -72.1 | 171.4 | 0 | 0 | 0 | 112.6 | R18 L19 R20 A25 A26 | R18-H22 VanDerWaalsContact O-CG 3.27Å; R18-H22 PolarHBondContact O-N 3.41Å; R18-H22 VanDerWaalsContact O-N 3.12Å; L19-H22 PolarHBondContact O-N 3.43Å; R20-H22 VanDerWaalsContact C-N 3.28Å; R20-H22 PolarHBondContact O-N 3.07Å; H22-A25 PolarHBondContact O-N 2.89Å; H22-A26 WeakPolarHBondContact O-CB 3.45Å; H22-A26 PolarHBondContact O-N 2.91Å |
| 23 | D | 97.6 | Very high | 97.6 | Very high | 103 Ų | 103 | 100.2 Ų | 100.2 | 55% | 0.551 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.7 | -45.1 | 175.3 | -76.4 | -16.4 | 0 | 0 | 0 | 110.5 | L19 R20 A25 A26 E27 | L19-D23 PolarHBondContact O-N 3.15Å; R20-D23 PolarHBondContact O-N 2.9Å; D23-A25 VanDerWaalsContact C-N 3.34Å; D23-A25 PolarHBondContact O-N 3.42Å; D23-A26 WeakPolarHBondContact O-CB 3.36Å; D23-A26 PolarHBondContact O-N 3.19Å; D23-A26 VanDerWaalsContact O-N 3.15Å; D23-E27 PolarHBondContact O-N 2.89Å |
| 24 | D | 97.3 | Very high | 97.7 | Very high | 87 Ų | 87 | 96.7 Ų | 96.7 | 47% | 0.465 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -40.5 | 175.9 | -69.5 | -14.6 | 0 | 0 | 0 | 111.6 | R20 E27 S28 | R20-D24 PolarHBondContact O-N 3.37Å; D24-E27 PolarHBondContact O-N 3.3Å; D24-S28 PolarHBondContact O-N 3.4Å |
| 25 | A | 97.8 | Very high | 97.8 | Very high | 60 Ų | 60 | 96.9 Ų | 96.9 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -37.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | D21 H22 D23 S28 L29 | D21-A25 WeakPolarHBondContact O-CB 3.38Å; D21-A25 PolarHBondContact O-N 3.01Å; H22-A25 PolarHBondContact O-N 2.89Å; D23-A25 VanDerWaalsContact C-N 3.34Å; D23-A25 PolarHBondContact O-N 3.42Å; A25-S28 PolarHBondContact O-N 2.98Å; A25-L29 PolarHBondContact O-N 3.03Å |
| 26 | A | 98.2 | Very high | 97.8 | Very high | 47 Ų | 47 | 97.1 Ų | 97.1 | 39% | 0.388 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | H22 D23 L29 I30 | H22-A26 WeakPolarHBondContact O-CB 3.45Å; H22-A26 PolarHBondContact O-N 2.91Å; D23-A26 WeakPolarHBondContact O-CB 3.36Å; D23-A26 PolarHBondContact O-N 3.19Å; D23-A26 VanDerWaalsContact O-N 3.15Å; A26-L29 PolarHBondContact O-N 2.93Å; A26-I30 VanDerWaalsContact O-CG1 3.29Å; A26-I30 WeakPolarHBondContact O-CG1 3.29Å; A26-I30 PolarHBondContact O-N 3.45Å |
| 27 | E | 98 | Very high | 97.8 | Very high | 133 Ų | 133 | 96.8 Ų | 96.8 | 62% | 0.621 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.2 | -45 | 173.9 | -74.7 | -171.9 | 177.5 | 0 | 0 | 111.8 | D23 D24 L29 I30 E31 | D23-E27 PolarHBondContact O-N 2.89Å; D24-E27 PolarHBondContact O-N 3.3Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 2.94Å; E27-I30 WeakPolarHBondContact O-CB 3.48Å; E27-I30 PolarHBondContact O-N 3.22Å; E27-E31 PolarHBondContact O-N 3.4Å |
| 28 | S | 97.9 | Very high | 97.9 | Very high | 54 Ų | 54 | 99 Ų | 99 | 38% | 0.378 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.2 | -38.9 | 175.8 | -170.7 | 0 | 0 | 0 | 0 | 112.6 | D24 A25 I30 E31 Q32 | D24-S28 PolarHBondContact O-N 3.4Å; A25-S28 PolarHBondContact O-N 2.98Å; S28-I30 VanDerWaalsContact C-N 3.35Å; S28-E31 PolarHBondContact O-N 2.92Å; S28-Q32 WeakPolarHBondContact O-CG 3.41Å; S28-Q32 PolarHBondContact O-N 3.25Å |
| 29 | L | 98 | Very high | 97.9 | Very high | 115 Ų | 115 | 100 Ų | 100 | 60% | 0.602 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.4 | -37.9 | 176.9 | -156.6 | 97.1 | 0 | 0 | 0 | 111.9 | A25 A26 E27 T33 | A25-L29 PolarHBondContact O-N 3.03Å; A26-L29 PolarHBondContact O-N 2.93Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 2.94Å; L29-T33 VanDerWaalsContact O-CB 3.31Å; L29-T33 WeakPolarHBondContact O-CB 3.49Å; L29-T33 PolarHBondContact O-N 2.97Å; L29-T33 PolarHBondContact O-OG1 2.9Å |
| 30 | I | 98 | Very high | 97.9 | Very high | 107 Ų | 107 | 98.8 Ų | 98.8 | 55% | 0.549 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -48.3 | 173.5 | -70.7 | 165.3 | 0 | 0 | 0 | 109.3 | A26 E27 S28 Q32 T33 T34 | A26-I30 VanDerWaalsContact O-CG1 3.29Å; A26-I30 WeakPolarHBondContact O-CG1 3.29Å; A26-I30 PolarHBondContact O-N 3.45Å; E27-I30 WeakPolarHBondContact O-CB 3.48Å; E27-I30 PolarHBondContact O-N 3.22Å; S28-I30 VanDerWaalsContact C-N 3.35Å; I30-Q32 PolarHBondContact O-N 3.12Å; I30-T33 WeakPolarHBondContact O-CB 3.35Å; I30-T33 PolarHBondContact O-N 3.17Å; I30-T33 VanDerWaalsContact O-N 3.14Å; I30-T34 HydrophobicContact CG2-CG2 4.3Å; I30-T34 WeakPolarHBondContact O-CG2 3.47Å; I30-T34 PolarHBondContact O-N 2.81Å |
| 31 | E | 98 | Very high | 97.9 | Very high | 135 Ų | 135 | 96.3 Ų | 96.3 | 63% | 0.631 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.3 | -48.3 | 179.2 | -168.9 | 175.5 | -161.6 | 0 | 0 | 111.7 | E27 S28 T33 T34 A35 | E27-E31 PolarHBondContact O-N 3.4Å; S28-E31 PolarHBondContact O-N 2.92Å; E31-T33 VanDerWaalsContact C-N 3.3Å; E31-T33 PolarHBondContact O-N 3.23Å; E31-T34 PolarHBondContact O-N 3.36Å; E31-T34 PolarHBondContact O-OG1 3.32Å; E31-A35 WeakPolarHBondContact O-CB 3.41Å; E31-A35 PolarHBondContact O-N 2.85Å |
| 32 | Q | 98.4 | Very high | 98 | Very high | 127 Ų | 127 | 93.4 Ų | 93.4 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.4 | -41.1 | 175.7 | -71.8 | -179.1 | 23.9 | 0 | 0 | 112.4 | S28 I30 A35 L36 | S28-Q32 WeakPolarHBondContact O-CG 3.41Å; S28-Q32 PolarHBondContact O-N 3.25Å; I30-Q32 PolarHBondContact O-N 3.12Å; Q32-A35 PolarHBondContact O-N 3.14Å; Q32-L36 WeakPolarHBondContact O-CB 3.31Å; Q32-L36 PolarHBondContact O-N 3.42Å |
| 33 | T | 98.3 | Very high | 98 | Very high | 85 Ų | 85 | 93.9 Ų | 93.9 | 52% | 0.521 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -42.8 | 178.2 | -63 | 0 | 0 | 0 | 0 | 111.1 | L29 I30 E31 L36 N37 | L29-T33 VanDerWaalsContact O-CB 3.31Å; L29-T33 WeakPolarHBondContact O-CB 3.49Å; L29-T33 PolarHBondContact O-N 2.97Å; L29-T33 PolarHBondContact O-OG1 2.9Å; I30-T33 WeakPolarHBondContact O-CB 3.35Å; I30-T33 PolarHBondContact O-N 3.17Å; I30-T33 VanDerWaalsContact O-N 3.14Å; E31-T33 VanDerWaalsContact C-N 3.3Å; E31-T33 PolarHBondContact O-N 3.23Å; T33-L36 PolarHBondContact O-N 3.5Å; T33-N37 WeakPolarHBondContact O-CB 3.28Å; T33-N37 PolarHBondContact O-N 2.82Å |
| 34 | T | 98 | Very high | 97.9 | Very high | 70 Ų | 70 | 95.4 Ų | 95.4 | 43% | 0.429 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.5 | -38 | 175.9 | 66.4 | 0 | 0 | 0 | 0 | 112.3 | I30 E31 N37 K38 | I30-T34 HydrophobicContact CG2-CG2 4.3Å; I30-T34 WeakPolarHBondContact O-CG2 3.47Å; I30-T34 PolarHBondContact O-N 2.81Å; E31-T34 PolarHBondContact O-N 3.36Å; E31-T34 PolarHBondContact O-OG1 3.32Å; T34-N37 PolarHBondContact O-N 3.37Å; T34-K38 WeakPolarHBondContact O-CG 3.3Å; T34-K38 PolarHBondContact O-N 2.78Å |
| 35 | A | 98.1 | Very high | 97.9 | Very high | 47 Ų | 47 | 96.9 Ų | 96.9 | 39% | 0.388 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.1 | -40.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | E31 Q32 R39 | E31-A35 WeakPolarHBondContact O-CB 3.41Å; E31-A35 PolarHBondContact O-N 2.85Å; Q32-A35 PolarHBondContact O-N 3.14Å; A35-R39 PolarHBondContact O-N 3.35Å |
| 36 | L | 98.1 | Very high | 97.8 | Very high | 92 Ų | 92 | 101 Ų | 101 | 48% | 0.482 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.7 | -43.6 | 173.4 | -177.4 | 62.7 | 0 | 0 | 0 | 111.2 | Q32 T33 K38 R39 V40 | Q32-L36 WeakPolarHBondContact O-CB 3.31Å; Q32-L36 PolarHBondContact O-N 3.42Å; T33-L36 PolarHBondContact O-N 3.5Å; L36-K38 PolarHBondContact O-N 2.98Å; L36-R39 WeakPolarHBondContact O-CB 3.36Å; L36-R39 PolarHBondContact O-N 3.03Å; L36-R39 VanDerWaalsContact O-N 3.11Å; L36-V40 WeakPolarHBondContact O-CG2 3.38Å; L36-V40 PolarHBondContact O-N 2.89Å |
| 37 | N | 97.9 | Very high | 97.6 | Very high | 81 Ų | 81 | 103.8 Ų | 103.8 | 43% | 0.433 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -45.7 | 178 | -170.8 | 64.9 | 0 | 0 | 0 | 111.8 | T33 T34 R39 V40 E41 | T33-N37 WeakPolarHBondContact O-CB 3.28Å; T33-N37 PolarHBondContact O-N 2.82Å; T34-N37 PolarHBondContact O-N 3.37Å; N37-R39 VanDerWaalsContact C-N 3.27Å; N37-R39 PolarHBondContact O-N 3.03Å; N37-V40 PolarHBondContact O-N 3.39Å; N37-V40 VanDerWaalsContact O-N 3.12Å; N37-E41 PolarHBondContact ND2-OE1 3.48Å; N37-E41 PolarHBondContact O-N 3.22Å |
| 38 | K | 98.1 | Very high | 97.4 | Very high | 151 Ų | 151 | 103 Ų | 103 | 66% | 0.657 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -56.9 | -40.2 | 174.4 | -73.2 | 176.8 | -178.7 | 176.4 | 0 | 112.5 | T34 L36 E41 A42 | T34-K38 WeakPolarHBondContact O-CG 3.3Å; T34-K38 PolarHBondContact O-N 2.78Å; L36-K38 PolarHBondContact O-N 2.98Å; K38-E41 PolarHBondContact O-N 3.49Å; K38-A42 PolarHBondContact O-N 3.22Å |
| 39 | R | 98.1 | Very high | 97.2 | Very high | 149 Ų | 149 | 105.7 Ų | 105.7 | 56% | 0.562 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.9 | -40.2 | 177.3 | -164.3 | -174.8 | -51.5 | 134.6 | 8.9 | 112.1 | A35 L36 N37 A42 M43 | A35-R39 PolarHBondContact O-N 3.35Å; L36-R39 WeakPolarHBondContact O-CB 3.36Å; L36-R39 PolarHBondContact O-N 3.03Å; L36-R39 VanDerWaalsContact O-N 3.11Å; N37-R39 VanDerWaalsContact C-N 3.27Å; N37-R39 PolarHBondContact O-N 3.03Å; R39-A42 PolarHBondContact O-N 3.36Å; R39-M43 WeakPolarHBondContact O-CG 3.44Å; R39-M43 PolarHBondContact O-N 3.22Å |
| 40 | V | 98.2 | Very high | 96.7 | Very high | 65 Ų | 65 | 104.3 Ų | 104.3 | 39% | 0.394 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66 | -40.5 | 176.7 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | L36 N37 M43 K44 | L36-V40 WeakPolarHBondContact O-CG2 3.38Å; L36-V40 PolarHBondContact O-N 2.89Å; N37-V40 PolarHBondContact O-N 3.39Å; N37-V40 VanDerWaalsContact O-N 3.12Å; V40-M43 PolarHBondContact O-N 3.23Å; V40-K44 PolarHBondContact O-N 2.9Å |
| 41 | E | 97.7 | Very high | 96.1 | Very high | 101 Ų | 101 | 104.2 Ų | 104.2 | 47% | 0.472 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 174.7 | -74.2 | 179.8 | -170.5 | 0 | 0 | 112 | N37 K38 M43 K44 Q45 | N37-E41 PolarHBondContact ND2-OE1 3.48Å; N37-E41 PolarHBondContact O-N 3.22Å; K38-E41 PolarHBondContact O-N 3.49Å; E41-M43 VanDerWaalsContact C-N 3.35Å; E41-M43 PolarHBondContact O-N 2.93Å; E41-K44 WeakPolarHBondContact O-CB 3.43Å; E41-K44 PolarHBondContact O-N 3.35Å; E41-K44 VanDerWaalsContact O-N 3.17Å; E41-Q45 PolarHBondContact O-N 2.82Å |
| 42 | A | 97.9 | Very high | 95.6 | Very high | 36 Ų | 36 | 104.4 Ų | 104.4 | 30% | 0.298 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | K38 R39 K44 Q45 Y46 | K38-A42 PolarHBondContact O-N 3.22Å; R39-A42 PolarHBondContact O-N 3.36Å; A42-K44 VanDerWaalsContact C-N 3.31Å; A42-K44 PolarHBondContact O-N 2.93Å; A42-Q45 PolarHBondContact O-N 3.48Å; A42-Y46 HydrophobicContact CB-CE2 4.41Å; A42-Y46 WeakPolarHBondContact O-CD2 3.38Å; A42-Y46 PolarHBondContact O-N 3.48Å |
| 43 | M | 98.1 | Very high | 94.9 | Very high | 126 Ų | 126 | 104.3 Ų | 104.3 | 62% | 0.621 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.9 | -37.1 | 175.1 | -76.2 | 178.8 | 66.7 | 0 | 0 | 112.6 | R39 V40 E41 Q47 | R39-M43 WeakPolarHBondContact O-CG 3.44Å; R39-M43 PolarHBondContact O-N 3.22Å; V40-M43 PolarHBondContact O-N 3.23Å; E41-M43 VanDerWaalsContact C-N 3.35Å; E41-M43 PolarHBondContact O-N 2.93Å; M43-Q47 WeakPolarHBondContact O-CB 3.45Å; M43-Q47 PolarHBondContact O-N 3.39Å |
| 44 | K | 96.8 | Very high | 93.9 | Very high | 135 Ų | 135 | 103.4 Ų | 103.4 | 59% | 0.587 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64 | -46.3 | 174.2 | -83 | -175.4 | 169.8 | -175.2 | 0 | 111.7 | V40 E41 A42 Y46 Q47 E48 | V40-K44 PolarHBondContact O-N 2.9Å; E41-K44 WeakPolarHBondContact O-CB 3.43Å; E41-K44 PolarHBondContact O-N 3.35Å; E41-K44 VanDerWaalsContact O-N 3.17Å; A42-K44 VanDerWaalsContact C-N 3.31Å; A42-K44 PolarHBondContact O-N 2.93Å; K44-Y46 PolarHBondContact O-N 2.94Å; K44-Q47 WeakPolarHBondContact O-CB 3.41Å; K44-Q47 PolarHBondContact O-N 3.37Å; K44-Q47 VanDerWaalsContact O-N 3.12Å; K44-E48 WeakPolarHBondContact O-CG 3.43Å; K44-E48 PolarHBondContact O-N 2.96Å |
| 45 | Q | 96.6 | Very high | 93 | Very high | 118 Ų | 118 | 106.6 Ų | 106.6 | 55% | 0.551 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.1 | -48.7 | 177.5 | -73.8 | 176.4 | -15.6 | 0 | 0 | 111.7 | E41 A42 Q47 E48 E49 | E41-Q45 PolarHBondContact O-N 2.82Å; A42-Q45 PolarHBondContact O-N 3.48Å; Q45-Q47 VanDerWaalsContact C-N 3.25Å; Q45-Q47 PolarHBondContact O-N 2.93Å; Q45-E48 PolarHBondContact O-N 2.98Å; Q45-E48 VanDerWaalsContact O-N 3.16Å; Q45-E49 WeakPolarHBondContact O-CG 3.42Å; Q45-E49 PolarHBondContact O-N 3.45Å |
| 46 | Y | 95.7 | Very high | 91.9 | Very high | 148 Ų | 148 | 109 Ų | 109 | 58% | 0.58 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.3 | -37.1 | 175 | -71.4 | -57.4 | 0 | 0 | 0 | 112.8 | A42 K44 I50 | A42-Y46 HydrophobicContact CB-CE2 4.41Å; A42-Y46 WeakPolarHBondContact O-CD2 3.38Å; A42-Y46 PolarHBondContact O-N 3.48Å; K44-Y46 PolarHBondContact O-N 2.94Å; Y46-I50 WeakPolarHBondContact O-CB 3.08Å; Y46-I50 VanDerWaalsContact O-CG1 3.24Å; Y46-I50 WeakPolarHBondContact O-CG1 3.47Å; Y46-I50 PolarHBondContact O-N 3.12Å |
| 47 | Q | 94.4 | Very high | 90.6 | Very high | 104 Ų | 104 | 106.9 Ų | 106.9 | 49% | 0.486 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -69.1 | -38.2 | 178.3 | -167.1 | 65.9 | 50.7 | 0 | 0 | 111.9 | M43 K44 Q45 Q51 | M43-Q47 WeakPolarHBondContact O-CB 3.45Å; M43-Q47 PolarHBondContact O-N 3.39Å; K44-Q47 WeakPolarHBondContact O-CB 3.41Å; K44-Q47 PolarHBondContact O-N 3.37Å; K44-Q47 VanDerWaalsContact O-N 3.12Å; Q45-Q47 VanDerWaalsContact C-N 3.25Å; Q45-Q47 PolarHBondContact O-N 2.93Å; Q47-Q51 WeakPolarHBondContact O-CB 3.42Å; Q47-Q51 VanDerWaalsContact O-CG 3.29Å; Q47-Q51 WeakPolarHBondContact O-CG 3.45Å; Q47-Q51 PolarHBondContact O-N 2.9Å |
| 48 | E | 94.2 | Very high | 89.1 | Confident | 116 Ų | 116 | 111.3 Ų | 111.3 | 54% | 0.542 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 173.3 | -74.6 | 170.4 | -172 | 0 | 0 | 111 | K44 Q45 I50 Q51 E52 | K44-E48 WeakPolarHBondContact O-CG 3.43Å; K44-E48 PolarHBondContact O-N 2.96Å; Q45-E48 PolarHBondContact O-N 2.98Å; Q45-E48 VanDerWaalsContact O-N 3.16Å; E48-I50 VanDerWaalsContact C-N 3.33Å; E48-I50 PolarHBondContact O-N 3.44Å; E48-Q51 CarbonylContact O-C 3.6Å; E48-Q51 WeakPolarHBondContact O-CA 3.45Å; E48-Q51 WeakPolarHBondContact O-CB 3.35Å; E48-Q51 PolarHBondContact O-N 3.3Å; E48-E52 PolarHBondContact O-N 2.88Å |
| 49 | E | 92.9 | Very high | 87.3 | Confident | 111 Ų | 111 | 110.6 Ų | 110.6 | 52% | 0.519 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | 175.6 | -71.3 | 174.3 | -166.5 | 0 | 0 | 112.2 | Q45 Q51 L53 | Q45-E49 WeakPolarHBondContact O-CG 3.42Å; Q45-E49 PolarHBondContact O-N 3.45Å; E49-Q51 VanDerWaalsContact C-N 3.32Å; E49-Q51 PolarHBondContact O-N 3.11Å; E49-L53 WeakPolarHBondContact O-CB 3.41Å; E49-L53 PolarHBondContact O-N 3.05Å |
| 50 | I | 86.7 | Confident | 85.7 | Confident | 86 Ų | 86 | 110.3 Ų | 110.3 | 44% | 0.441 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.2 | -37 | 174.2 | -72.4 | 169.8 | 0 | 0 | 0 | 110.9 | Y46 E48 N54 | Y46-I50 WeakPolarHBondContact O-CB 3.08Å; Y46-I50 VanDerWaalsContact O-CG1 3.24Å; Y46-I50 WeakPolarHBondContact O-CG1 3.47Å; Y46-I50 PolarHBondContact O-N 3.12Å; E48-I50 VanDerWaalsContact C-N 3.33Å; E48-I50 PolarHBondContact O-N 3.44Å; I50-N54 WeakPolarHBondContact CG2-ND2 3.4Å; I50-N54 VanDerWaalsContact O-CB 3.32Å; I50-N54 WeakPolarHBondContact O-CB 3.48Å; I50-N54 VanDerWaalsContact O-CG 3.24Å; I50-N54 PolarHBondContact O-N 3.47Å; I50-N54 PolarHBondContact O-ND2 3.44Å |
| 51 | Q | 85.5 | Confident | 84.3 | Confident | 106 Ų | 106 | 110.8 Ų | 110.8 | 50% | 0.495 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.6 | -47.1 | 176.8 | -78 | 173.9 | 1.5 | 0 | 0 | 111.3 | Q47 E48 E49 L53 N54 E55 | Q47-Q51 WeakPolarHBondContact O-CB 3.42Å; Q47-Q51 VanDerWaalsContact O-CG 3.29Å; Q47-Q51 WeakPolarHBondContact O-CG 3.45Å; Q47-Q51 PolarHBondContact O-N 2.9Å; E48-Q51 CarbonylContact O-C 3.6Å; E48-Q51 WeakPolarHBondContact O-CA 3.45Å; E48-Q51 WeakPolarHBondContact O-CB 3.35Å; E48-Q51 PolarHBondContact O-N 3.3Å; E49-Q51 VanDerWaalsContact C-N 3.32Å; E49-Q51 PolarHBondContact O-N 3.11Å; Q51-L53 VanDerWaalsContact C-N 3.32Å; Q51-L53 PolarHBondContact O-N 2.95Å; Q51-N54 CarbonylContact O-C 3.56Å; Q51-N54 WeakPolarHBondContact O-CB 3.36Å; Q51-N54 PolarHBondContact O-N 3.26Å; Q51-N54 VanDerWaalsContact O-N 3.09Å; Q51-E55 WeakPolarHBondContact O-CG 3.03Å; Q51-E55 PolarHBondContact O-N 3.41Å |
| 52 | E | 88.2 | Confident | 83.2 | Confident | 139 Ų | 139 | 116.1 Ų | 116.1 | 65% | 0.65 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -55.6 | -46.9 | 173.5 | -84.2 | -170.9 | 154.6 | 0 | 0 | 111.5 | E48 N54 E55 V56 | E48-E52 PolarHBondContact O-N 2.88Å; E52-N54 VanDerWaalsContact C-N 3.29Å; E52-N54 PolarHBondContact O-N 2.91Å; E52-E55 PolarHBondContact O-N 3.34Å; E52-V56 WeakPolarHBondContact O-CG2 3.26Å; E52-V56 PolarHBondContact O-N 3.24Å |
| 53 | L | 83.4 | Confident | 82.2 | Confident | 125 Ų | 125 | 118.4 Ų | 118.4 | 65% | 0.654 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.3 | -37.2 | 178 | -169.1 | 67.6 | 0 | 0 | 0 | 112 | E49 Q51 A57 | E49-L53 WeakPolarHBondContact O-CB 3.41Å; E49-L53 PolarHBondContact O-N 3.05Å; Q51-L53 VanDerWaalsContact C-N 3.32Å; Q51-L53 PolarHBondContact O-N 2.95Å; L53-A57 WeakPolarHBondContact O-CB 3.39Å; L53-A57 PolarHBondContact O-N 2.97Å |
| 54 | N | 77.8 | Confident | 81.3 | Confident | 65 Ų | 65 | 114.9 Ų | 114.9 | 35% | 0.348 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -69.8 | -34.2 | 175.9 | -80.6 | -46.2 | 0 | 0 | 0 | 112.9 | I50 Q51 E52 A57 R58 H59 | I50-N54 WeakPolarHBondContact CG2-ND2 3.4Å; I50-N54 VanDerWaalsContact O-CB 3.32Å; I50-N54 WeakPolarHBondContact O-CB 3.48Å; I50-N54 VanDerWaalsContact O-CG 3.24Å; I50-N54 PolarHBondContact O-N 3.47Å; I50-N54 PolarHBondContact O-ND2 3.44Å; Q51-N54 CarbonylContact O-C 3.56Å; Q51-N54 WeakPolarHBondContact O-CB 3.36Å; Q51-N54 PolarHBondContact O-N 3.26Å; Q51-N54 VanDerWaalsContact O-N 3.09Å; E52-N54 VanDerWaalsContact C-N 3.29Å; E52-N54 PolarHBondContact O-N 2.91Å; N54-A57 CarbonylContact O-C 3.35Å; N54-A57 PolarHBondContact O-N 3.5Å; N54-R58 PolarHBondContact O-N 3.43Å; N54-H59 PolarHBondContact O-N 3.01Å |
| 55 | E | 79.1 | Confident | 80.5 | Confident | 137 Ų | 137 | 112.1 Ų | 112.1 | 64% | 0.64 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.8 | -45 | 173.2 | -73.5 | -168 | 174.1 | 0 | 0 | 111 | Q51 E52 A57 R58 | Q51-E55 WeakPolarHBondContact O-CG 3.03Å; Q51-E55 PolarHBondContact O-N 3.41Å; E52-E55 PolarHBondContact O-N 3.34Å; E55-A57 VanDerWaalsContact C-N 3.26Å; E55-A57 PolarHBondContact O-N 2.93Å; E55-R58 WeakPolarHBondContact O-CA 3.49Å; E55-R58 PolarHBondContact O-N 3.32Å |
| 56 | V | 75.7 | Confident | 79.9 | Confident | 97 Ų | 97 | 109.5 Ų | 109.5 | 59% | 0.588 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60.6 | -38.7 | 173.5 | 175.8 | 0 | 0 | 0 | 0 | 110.9 | E52 R58 | E52-V56 WeakPolarHBondContact O-CG2 3.26Å; E52-V56 PolarHBondContact O-N 3.24Å; V56-R58 PolarHBondContact O-N 3.17Å |
| 57 | A | 69.4 | Low | 79.2 | Confident | 48 Ų | 48 | 108 Ų | 108 | 40% | 0.397 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | 2.6 | 174 | 0 | 0 | 0 | 0 | 0 | 114 | L53 N54 E55 H59 R60 | L53-A57 WeakPolarHBondContact O-CB 3.39Å; L53-A57 PolarHBondContact O-N 2.97Å; N54-A57 CarbonylContact O-C 3.35Å; N54-A57 PolarHBondContact O-N 3.5Å; E55-A57 VanDerWaalsContact C-N 3.26Å; E55-A57 PolarHBondContact O-N 2.93Å; A57-H59 PolarHBondContact O-N 3.45Å; A57-R60 WeakPolarHBondContact O-CB 3.46Å; A57-R60 PolarHBondContact O-N 3.28Å |
| 58 | R | 66.2 | Low | 78.8 | Confident | 174 Ų | 174 | 104.8 Ų | 104.8 | 66% | 0.657 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.3 | 36.7 | -176.5 | -60.3 | -171.2 | -170.9 | -170.1 | 6.1 | 115 | N54 E55 V56 R60 E194 | N54-R58 PolarHBondContact O-N 3.43Å; E55-R58 WeakPolarHBondContact O-CA 3.49Å; E55-R58 PolarHBondContact O-N 3.32Å; V56-R58 PolarHBondContact O-N 3.17Å; R58-R60 PolarHBondContact O-N 3.01Å; R58-E194 IonicContact CZ-OE1 2.84Å; R58-E194 IonicContact NE-OE1 2.84Å; R58-E194 PolarHBondContact NE-OE1 3.4Å; R58-E194 IonicContact NH2-OE1 3.39Å; R58-E194 PolarHBondContact NH2-OE1 2.81Å |
| 59 | H | 61.7 | Low | 78.4 | Confident | 137 Ų | 137 | 102.7 Ų | 102.7 | 63% | 0.634 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48 | 30.9 | -171.9 | -60.8 | -68.8 | 0 | 0 | 0 | 113.2 | N54 A57 P61 | N54-H59 PolarHBondContact O-N 3.01Å; A57-H59 PolarHBondContact O-N 3.45Å; H59-P61 VanDerWaalsContact O-CD 3.25Å; H59-P61 WeakPolarHBondContact O-CD 3.44Å |
| 60 | R | 64.7 | Low | 78.2 | Confident | 142 Ų | 142 | 103.5 Ų | 103.5 | 54% | 0.536 | 52% | 0.521 | S | S | . | . | trans | -55 | 118 | 173.5 | -102.4 | -171.7 | 179.9 | 174.8 | 2.4 | 106.2 | A57 R58 R62 | A57-R60 WeakPolarHBondContact O-CB 3.46Å; A57-R60 PolarHBondContact O-N 3.28Å; R58-R60 PolarHBondContact O-N 3.01Å; R60-R62 PolarHBondContact O-N 2.99Å | ||
| 61 | P | 67 | Low | 78.4 | Confident | 75 Ų | 75 | 105.9 Ų | 105.9 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | trans | -57.6 | 133.9 | -179.8 | 18.8 | -25.9 | 0 | 0 | 0 | 106.7 | H59 S63 T64 | H59-P61 VanDerWaalsContact O-CD 3.25Å; H59-P61 WeakPolarHBondContact O-CD 3.44Å; P61-S63 CarbonylContact O-C 3.6Å; P61-S63 PolarHBondContact O-N 3.4Å; P61-T64 WeakPolarHBondContact CG-OG1 3.44Å; P61-T64 WeakPolarHBondContact O-CB 3.47Å; P61-T64 PolarHBondContact O-N 3.04Å | ||
| 62 | R | 75.2 | Confident | 78.5 | Confident | 213 Ų | 213 | 105.9 Ų | 105.9 | 80% | 0.804 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -45.8 | -32.1 | -176 | -178.2 | -179.4 | 169.7 | 114.2 | -1.3 | 112.2 | R60 V66 | R60-R62 PolarHBondContact O-N 2.99Å; R62-V66 HydrophobicContact CG-CG2 4.38Å; R62-V66 WeakPolarHBondContact O-CB 3.44Å; R62-V66 WeakPolarHBondContact O-CG2 3.48Å; R62-V66 PolarHBondContact O-N 3.13Å |
| 63 | S | 76.2 | Confident | 78.5 | Confident | 84 Ų | 84 | 102.3 Ų | 102.3 | 59% | 0.587 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -57.5 | -43.4 | 172.8 | 56.6 | 0 | 0 | 0 | 0 | 114.1 | P61 V66 M67 | P61-S63 CarbonylContact O-C 3.6Å; P61-S63 PolarHBondContact O-N 3.4Å; S63-V66 PolarHBondContact O-N 3.39Å; S63-M67 VanDerWaalsContact O-CB 3.29Å; S63-M67 WeakPolarHBondContact O-CB 3.24Å; S63-M67 PolarHBondContact O-N 2.91Å |
| 64 | T | 79.3 | Confident | 78.9 | Confident | 53 Ų | 53 | 104.1 Ų | 104.1 | 33% | 0.325 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.3 | -42.2 | -178.8 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | P61 M67 G68 | P61-T64 WeakPolarHBondContact CG-OG1 3.44Å; P61-T64 WeakPolarHBondContact O-CB 3.47Å; P61-T64 PolarHBondContact O-N 3.04Å; T64-M67 PolarHBondContact O-N 2.93Å; T64-G68 PolarHBondContact O-N 3.4Å |
| 65 | L | 80.3 | Confident | 79.7 | Confident | 77 Ų | 77 | 106.6 Ų | 106.6 | 40% | 0.403 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 174.9 | 179.1 | 63 | 0 | 0 | 0 | 111 | M67 G68 I69 | L65-M67 VanDerWaalsContact C-N 3.32Å; L65-M67 PolarHBondContact O-N 3.45Å; L65-G68 PolarHBondContact O-N 3.33Å; L65-I69 HydrophobicContact CD1-CD1 4.11Å; L65-I69 HydrophobicContact CD1-CG1 4.39Å; L65-I69 HydrophobicContact CG-CD1 3.93Å; L65-I69 VanDerWaalsContact O-CG1 3.32Å; L65-I69 WeakPolarHBondContact O-CG1 3.38Å; L65-I69 PolarHBondContact O-N 2.89Å |
| 66 | V | 84.1 | Confident | 80.4 | Confident | 63 Ų | 63 | 103.2 Ų | 103.2 | 38% | 0.382 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 177.6 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | R62 S63 I69 Q70 | R62-V66 HydrophobicContact CG-CG2 4.38Å; R62-V66 WeakPolarHBondContact O-CB 3.44Å; R62-V66 WeakPolarHBondContact O-CG2 3.48Å; R62-V66 PolarHBondContact O-N 3.13Å; S63-V66 PolarHBondContact O-N 3.39Å; V66-I69 PolarHBondContact O-N 3.28Å; V66-Q70 WeakPolarHBondContact O-CB 3.46Å; V66-Q70 WeakPolarHBondContact O-CG 3.4Å; V66-Q70 PolarHBondContact O-N 3.02Å |
| 67 | M | 81.7 | Confident | 81.2 | Confident | 117 Ų | 117 | 106.1 Ų | 106.1 | 58% | 0.576 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65 | -42.3 | 176.7 | -171.6 | 174.6 | 68.7 | 0 | 0 | 111.8 | S63 T64 L65 Q70 Q71 | S63-M67 VanDerWaalsContact O-CB 3.29Å; S63-M67 WeakPolarHBondContact O-CB 3.24Å; S63-M67 PolarHBondContact O-N 2.91Å; T64-M67 PolarHBondContact O-N 2.93Å; L65-M67 VanDerWaalsContact C-N 3.32Å; L65-M67 PolarHBondContact O-N 3.45Å; M67-Q70 PolarHBondContact O-N 2.91Å; M67-Q71 PolarHBondContact O-N 3.12Å |
| 68 | G | 85.5 | Confident | 82.2 | Confident | 35 Ų | 35 | 109.4 Ų | 109.4 | 36% | 0.361 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.2 | -48.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | T64 L65 Q70 Q71 E72 | T64-G68 PolarHBondContact O-N 3.4Å; L65-G68 PolarHBondContact O-N 3.33Å; G68-Q70 VanDerWaalsContact C-N 3.29Å; G68-Q70 PolarHBondContact O-N 2.97Å; G68-Q71 PolarHBondContact O-N 3.5Å; G68-Q71 VanDerWaalsContact O-N 3.13Å; G68-E72 PolarHBondContact O-N 3.16Å |
| 69 | I | 85.1 | Confident | 83.5 | Confident | 73 Ų | 73 | 105 Ų | 105 | 37% | 0.374 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.9 | -38.8 | 176.1 | -68.9 | 168.4 | 0 | 0 | 0 | 111.4 | L65 V66 N73 | L65-I69 HydrophobicContact CD1-CD1 4.11Å; L65-I69 HydrophobicContact CD1-CG1 4.39Å; L65-I69 HydrophobicContact CG-CD1 3.93Å; L65-I69 VanDerWaalsContact O-CG1 3.32Å; L65-I69 WeakPolarHBondContact O-CG1 3.38Å; L65-I69 PolarHBondContact O-N 2.89Å; V66-I69 PolarHBondContact O-N 3.28Å; I69-N73 VanDerWaalsContact CG2-ND2 3.29Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.47Å; I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.43Å; I69-N73 VanDerWaalsContact O-CG 3.32Å; I69-N73 PolarHBondContact O-N 3.49Å; I69-N73 PolarHBondContact O-ND2 3.29Å |
| 70 | Q | 89 | Confident | 85 | Confident | 127 Ų | 127 | 104.4 Ų | 104.4 | 59% | 0.593 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.4 | -37.6 | 177.2 | -77.8 | -179.2 | -8.3 | 0 | 0 | 112.7 | V66 M67 G68 R74 | V66-Q70 WeakPolarHBondContact O-CB 3.46Å; V66-Q70 WeakPolarHBondContact O-CG 3.4Å; V66-Q70 PolarHBondContact O-N 3.02Å; M67-Q70 PolarHBondContact O-N 2.91Å; G68-Q70 VanDerWaalsContact C-N 3.29Å; G68-Q70 PolarHBondContact O-N 2.97Å; Q70-R74 PolarHBondContact O-N 2.88Å; Q70-R74 VanDerWaalsContact O-N 3.15Å |
| 71 | Q | 91.2 | Very high | 86.3 | Confident | 137 Ų | 137 | 102.1 Ų | 102.1 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.2 | -46.1 | 176 | -175 | 173.7 | -3 | 0 | 0 | 111.1 | M67 G68 N73 R74 Q75 | M67-Q71 PolarHBondContact O-N 3.12Å; G68-Q71 PolarHBondContact O-N 3.5Å; G68-Q71 VanDerWaalsContact O-N 3.13Å; Q71-N73 PolarHBondContact O-N 2.9Å; Q71-R74 WeakPolarHBondContact O-CB 3.37Å; Q71-R74 PolarHBondContact O-N 3.36Å; Q71-R74 VanDerWaalsContact O-N 3.09Å; Q71-Q75 PolarHBondContact O-N 3.47Å |
| 72 | E | 87.5 | Confident | 87.6 | Confident | 105 Ų | 105 | 103.5 Ų | 103.5 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.7 | -47.7 | 176.3 | -171 | -169.1 | 175.2 | 0 | 0 | 111.2 | G68 R74 Q75 I76 | G68-E72 PolarHBondContact O-N 3.16Å; E72-R74 PolarHBondContact O-N 2.99Å; E72-Q75 PolarHBondContact O-N 3.47Å; E72-I76 HydrophobicContact CG-CD1 4.07Å; E72-I76 WeakPolarHBondContact O-CG1 3.29Å; E72-I76 PolarHBondContact O-N 2.91Å |
| 73 | N | 89.3 | Confident | 88.4 | Confident | 64 Ų | 64 | 97.3 Ų | 97.3 | 34% | 0.342 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.8 | -28.5 | 176.1 | -81.5 | -55 | 0 | 0 | 0 | 113.3 | I69 Q71 R77 | I69-N73 VanDerWaalsContact CG2-ND2 3.29Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.47Å; I69-N73 VanDerWaalsContact O-CB 3.29Å; I69-N73 WeakPolarHBondContact O-CB 3.43Å; I69-N73 VanDerWaalsContact O-CG 3.32Å; I69-N73 PolarHBondContact O-N 3.49Å; I69-N73 PolarHBondContact O-ND2 3.29Å; Q71-N73 PolarHBondContact O-N 2.9Å; N73-R77 VanDerWaalsContact O-CG 3.32Å; N73-R77 WeakPolarHBondContact O-CG 3.45Å; N73-R77 PolarHBondContact O-N 3.2Å; N73-R77 PolarHBondContact O-NH1 2.78Å |
| 74 | R | 91.7 | Very high | 89.3 | Confident | 164 Ų | 164 | 99.6 Ų | 99.6 | 62% | 0.619 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -69.5 | -49.2 | 172.9 | -174.5 | -174.1 | -62.5 | -140.3 | -0.5 | 110.3 | Q70 Q71 E72 I76 R77 E78 | Q70-R74 PolarHBondContact O-N 2.88Å; Q70-R74 VanDerWaalsContact O-N 3.15Å; Q71-R74 WeakPolarHBondContact O-CB 3.37Å; Q71-R74 PolarHBondContact O-N 3.36Å; Q71-R74 VanDerWaalsContact O-N 3.09Å; E72-R74 PolarHBondContact O-N 2.99Å; R74-I76 VanDerWaalsContact C-N 3.32Å; R74-I76 PolarHBondContact O-N 2.85Å; R74-R77 WeakPolarHBondContact O-CB 3.48Å; R74-R77 PolarHBondContact O-N 3.35Å; R74-R77 VanDerWaalsContact O-N 3.12Å; R74-E78 WeakPolarHBondContact CG-OE1 3.44Å; R74-E78 PolarHBondContact O-N 2.98Å |
| 75 | Q | 93.3 | Very high | 89.9 | Confident | 116 Ų | 116 | 102.6 Ų | 102.6 | 54% | 0.542 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.9 | -40.3 | 179 | -171.8 | 177 | 7.5 | 0 | 0 | 112.2 | Q71 E72 R77 E78 L79 | Q71-Q75 PolarHBondContact O-N 3.47Å; E72-Q75 PolarHBondContact O-N 3.47Å; Q75-R77 VanDerWaalsContact C-N 3.3Å; Q75-R77 PolarHBondContact O-N 2.85Å; Q75-E78 PolarHBondContact O-N 3.5Å; Q75-L79 HydrophobicContact CG-CD1 4.3Å; Q75-L79 WeakPolarHBondContact O-CG 3.32Å; Q75-L79 PolarHBondContact O-N 3.39Å |
| 76 | I | 93.5 | Very high | 90.7 | Very high | 66 Ų | 66 | 103.5 Ų | 103.5 | 34% | 0.338 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.7 | -43.4 | 175.1 | -68.9 | 168.8 | 0 | 0 | 0 | 110.7 | E72 R74 L79 Q80 | E72-I76 HydrophobicContact CG-CD1 4.07Å; E72-I76 WeakPolarHBondContact O-CG1 3.29Å; E72-I76 PolarHBondContact O-N 2.91Å; R74-I76 VanDerWaalsContact C-N 3.32Å; R74-I76 PolarHBondContact O-N 2.85Å; I76-L79 PolarHBondContact O-N 2.96Å; I76-Q80 HydrophobicContact CG2-CG 4.39Å; I76-Q80 WeakPolarHBondContact O-CB 3.4Å; I76-Q80 VanDerWaalsContact O-CG 3.23Å; I76-Q80 WeakPolarHBondContact O-CG 3.27Å; I76-Q80 PolarHBondContact O-N 2.87Å |
| 77 | R | 93.2 | Very high | 91.3 | Very high | 159 Ų | 159 | 108.9 Ų | 108.9 | 60% | 0.6 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.9 | -40.1 | 178 | -70.4 | 178.8 | -158.7 | 114.8 | 0.2 | 112.2 | N73 R74 Q75 Q80 Q81 | N73-R77 VanDerWaalsContact O-CG 3.32Å; N73-R77 WeakPolarHBondContact O-CG 3.45Å; N73-R77 PolarHBondContact O-N 3.2Å; N73-R77 PolarHBondContact O-NH1 2.78Å; R74-R77 WeakPolarHBondContact O-CB 3.48Å; R74-R77 PolarHBondContact O-N 3.35Å; R74-R77 VanDerWaalsContact O-N 3.12Å; Q75-R77 VanDerWaalsContact C-N 3.3Å; Q75-R77 PolarHBondContact O-N 2.85Å; R77-Q80 PolarHBondContact O-N 3.07Å; R77-Q81 WeakPolarHBondContact O-CB 3.42Å; R77-Q81 PolarHBondContact O-N 3.48Å |
| 78 | E | 90.6 | Very high | 91.8 | Very high | 116 Ų | 116 | 106.2 Ų | 106.2 | 54% | 0.542 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62 | -48.6 | 176.2 | -71 | 168.9 | -172.7 | 0 | 0 | 110.7 | R74 Q75 Q80 Q81 E82 | R74-E78 WeakPolarHBondContact CG-OE1 3.44Å; R74-E78 PolarHBondContact O-N 2.98Å; Q75-E78 PolarHBondContact O-N 3.5Å; E78-Q80 VanDerWaalsContact C-N 3.33Å; E78-Q80 PolarHBondContact O-N 3.01Å; E78-Q81 PolarHBondContact O-N 3.34Å; E78-E82 PolarHBondContact O-N 3.04Å |
| 79 | L | 94 | Very high | 92.2 | Very high | 81 Ų | 81 | 106.7 Ų | 106.7 | 42% | 0.424 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -37.8 | 175.6 | -74.5 | 171.4 | 0 | 0 | 0 | 112.6 | Q75 I76 N83 | Q75-L79 HydrophobicContact CG-CD1 4.3Å; Q75-L79 WeakPolarHBondContact O-CG 3.32Å; Q75-L79 PolarHBondContact O-N 3.39Å; I76-L79 PolarHBondContact O-N 2.96Å; L79-N83 VanDerWaalsContact O-CB 3.32Å; L79-N83 WeakPolarHBondContact O-CB 3.47Å; L79-N83 PolarHBondContact O-N 2.96Å; L79-N83 PolarHBondContact O-ND2 2.87Å |
| 80 | Q | 92.2 | Very high | 92.8 | Very high | 126 Ų | 126 | 108 Ų | 108 | 59% | 0.589 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.9 | -38.8 | 175.7 | -77.2 | 175.4 | -11.1 | 0 | 0 | 112 | I76 R77 E78 K84 | I76-Q80 HydrophobicContact CG2-CG 4.39Å; I76-Q80 WeakPolarHBondContact O-CB 3.4Å; I76-Q80 VanDerWaalsContact O-CG 3.23Å; I76-Q80 WeakPolarHBondContact O-CG 3.27Å; I76-Q80 PolarHBondContact O-N 2.87Å; R77-Q80 PolarHBondContact O-N 3.07Å; E78-Q80 VanDerWaalsContact C-N 3.33Å; E78-Q80 PolarHBondContact O-N 3.01Å; Q80-K84 WeakPolarHBondContact O-CB 3.5Å; Q80-K84 PolarHBondContact O-N 3.39Å |
| 81 | Q | 92.3 | Very high | 93.1 | Very high | 94 Ų | 94 | 107.6 Ų | 107.6 | 44% | 0.439 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.2 | -44.5 | 176.1 | 180 | 59.7 | 26 | 0 | 0 | 111.3 | R77 E78 N83 K84 E85 | R77-Q81 WeakPolarHBondContact O-CB 3.42Å; R77-Q81 PolarHBondContact O-N 3.48Å; E78-Q81 PolarHBondContact O-N 3.34Å; Q81-N83 PolarHBondContact O-N 3.39Å; Q81-K84 WeakPolarHBondContact O-CB 3.29Å; Q81-K84 PolarHBondContact O-N 3.03Å; Q81-K84 VanDerWaalsContact O-N 3.14Å; Q81-E85 PolarHBondContact NE2-OE1 3.04Å; Q81-E85 WeakPolarHBondContact O-CG 3.36Å; Q81-E85 PolarHBondContact O-N 2.91Å |
| 82 | E | 94.3 | Very high | 93.2 | Very high | 104 Ų | 104 | 106.9 Ų | 106.9 | 49% | 0.486 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 175 | -175 | -177.5 | 177.6 | 0 | 0 | 111.2 | E78 K84 E85 L86 | E78-E82 PolarHBondContact O-N 3.04Å; E82-K84 PolarHBondContact O-N 3.21Å; E82-E85 PolarHBondContact O-N 2.96Å; E82-E85 VanDerWaalsContact O-N 3.12Å; E82-L86 HydrophobicContact CG-CD1 4.11Å; E82-L86 HydrophobicContact CG-CG 4.37Å; E82-L86 WeakPolarHBondContact O-CB 3.32Å; E82-L86 WeakPolarHBondContact O-CG 3.49Å; E82-L86 PolarHBondContact O-N 2.85Å |
| 83 | N | 91.8 | Very high | 93.6 | Very high | 83 Ų | 83 | 107.5 Ų | 107.5 | 44% | 0.444 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.4 | -34.3 | 176.1 | -83.6 | -60.8 | 0 | 0 | 0 | 112.6 | L79 Q81 R87 | L79-N83 VanDerWaalsContact O-CB 3.32Å; L79-N83 WeakPolarHBondContact O-CB 3.47Å; L79-N83 PolarHBondContact O-N 2.96Å; L79-N83 PolarHBondContact O-ND2 2.87Å; Q81-N83 PolarHBondContact O-N 3.39Å; N83-R87 VanDerWaalsContact O-CG 3.25Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.92Å; N83-R87 VanDerWaalsContact O-N 3.11Å |
| 84 | K | 95.1 | Very high | 94 | Very high | 132 Ų | 132 | 109.3 Ų | 109.3 | 57% | 0.574 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.4 | -45.9 | 174.6 | -175.8 | -177 | 176.9 | -175.4 | 0 | 110.9 | Q80 Q81 E82 R87 T88 | Q80-K84 WeakPolarHBondContact O-CB 3.5Å; Q80-K84 PolarHBondContact O-N 3.39Å; Q81-K84 WeakPolarHBondContact O-CB 3.29Å; Q81-K84 PolarHBondContact O-N 3.03Å; Q81-K84 VanDerWaalsContact O-N 3.14Å; E82-K84 PolarHBondContact O-N 3.21Å; K84-R87 PolarHBondContact O-N 3.34Å; K84-T88 PolarHBondContact O-N 3.2Å; K84-T88 PolarHBondContact O-OG1 3.37Å; K84-T88 VanDerWaalsContact O-OG1 3.11Å |
| 85 | E | 92 | Very high | 94.1 | Very high | 115 Ų | 115 | 105 Ų | 105 | 54% | 0.537 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 177.9 | -71.8 | 172.5 | -166.3 | 0 | 0 | 112 | Q81 E82 R87 T88 S89 | Q81-E85 PolarHBondContact NE2-OE1 3.04Å; Q81-E85 WeakPolarHBondContact O-CG 3.36Å; Q81-E85 PolarHBondContact O-N 2.91Å; E82-E85 PolarHBondContact O-N 2.96Å; E82-E85 VanDerWaalsContact O-N 3.12Å; E85-R87 VanDerWaalsContact C-N 3.34Å; E85-R87 PolarHBondContact O-N 3.09Å; E85-T88 PolarHBondContact O-N 2.93Å; E85-S89 WeakPolarHBondContact O-CB 3.25Å; E85-S89 PolarHBondContact O-N 3.04Å |
| 86 | L | 96.6 | Very high | 94.3 | Very high | 96 Ų | 96 | 101.7 Ų | 101.7 | 50% | 0.503 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -40.3 | 175.4 | -71.3 | 173.9 | 0 | 0 | 0 | 112.1 | E82 L90 | E82-L86 HydrophobicContact CG-CD1 4.11Å; E82-L86 HydrophobicContact CG-CG 4.37Å; E82-L86 WeakPolarHBondContact O-CB 3.32Å; E82-L86 WeakPolarHBondContact O-CG 3.49Å; E82-L86 PolarHBondContact O-N 2.85Å; L86-L90 WeakPolarHBondContact O-CB 3.21Å; L86-L90 PolarHBondContact O-N 2.94Å |
| 87 | R | 96.7 | Very high | 94.5 | Very high | 176 Ų | 176 | 103.7 Ų | 103.7 | 66% | 0.664 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64 | -47.8 | 175.7 | -75.9 | 173.7 | -175.4 | -175.4 | 2.2 | 111.7 | N83 K84 E85 S89 L90 E91 | N83-R87 VanDerWaalsContact O-CG 3.25Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.92Å; N83-R87 VanDerWaalsContact O-N 3.11Å; K84-R87 PolarHBondContact O-N 3.34Å; E85-R87 VanDerWaalsContact C-N 3.34Å; E85-R87 PolarHBondContact O-N 3.09Å; R87-S89 PolarHBondContact O-N 2.88Å; R87-L90 WeakPolarHBondContact O-CB 3.44Å; R87-L90 PolarHBondContact O-N 2.83Å; R87-E91 WeakPolarHBondContact O-CG 3.32Å; R87-E91 PolarHBondContact O-N 2.87Å |
| 88 | T | 93.2 | Very high | 94.5 | Very high | 61 Ų | 61 | 102 Ų | 102 | 37% | 0.374 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.5 | -46.4 | 176.7 | -52.6 | 0 | 0 | 0 | 0 | 111.4 | K84 E85 L90 E91 E92 | K84-T88 PolarHBondContact O-N 3.2Å; K84-T88 PolarHBondContact O-OG1 3.37Å; K84-T88 VanDerWaalsContact O-OG1 3.11Å; E85-T88 PolarHBondContact O-N 2.93Å; T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact O-N 3.47Å; T88-E91 WeakPolarHBondContact O-CB 3.28Å; T88-E91 PolarHBondContact O-N 2.73Å; T88-E92 WeakPolarHBondContact O-CG 3.48Å; T88-E92 PolarHBondContact O-N 3.44Å |
| 89 | S | 94.5 | Very high | 94.7 | Very high | 46 Ų | 46 | 101.7 Ų | 101.7 | 32% | 0.322 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 178.3 | 179.8 | 0 | 0 | 0 | 0 | 112.2 | E85 R87 E92 H93 | E85-S89 WeakPolarHBondContact O-CB 3.25Å; E85-S89 PolarHBondContact O-N 3.04Å; R87-S89 PolarHBondContact O-N 2.88Å; S89-E92 PolarHBondContact O-N 2.91Å; S89-H93 WeakPolarHBondContact O-CB 3.29Å; S89-H93 PolarHBondContact O-N 3.41Å |
| 90 | L | 97.2 | Very high | 94.8 | Very high | 100 Ų | 100 | 103.1 Ų | 103.1 | 52% | 0.524 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -44 | 175 | -175.8 | 65.9 | 0 | 0 | 0 | 111.8 | L86 R87 T88 H93 Q94 | L86-L90 WeakPolarHBondContact O-CB 3.21Å; L86-L90 PolarHBondContact O-N 2.94Å; R87-L90 WeakPolarHBondContact O-CB 3.44Å; R87-L90 PolarHBondContact O-N 2.83Å; T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact O-N 3.47Å; L90-H93 PolarHBondContact O-N 3.16Å; L90-Q94 WeakPolarHBondContact O-CB 3.32Å; L90-Q94 VanDerWaalsContact O-CG 3.3Å; L90-Q94 WeakPolarHBondContact O-CG 3.39Å; L90-Q94 PolarHBondContact O-N 3.47Å |
| 91 | E | 95.5 | Very high | 95.1 | Very high | 119 Ų | 119 | 101.3 Ų | 101.3 | 56% | 0.556 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63 | -42.2 | 176.6 | -71.2 | 170.2 | -166.7 | 0 | 0 | 111.9 | R87 T88 Q94 S95 | R87-E91 WeakPolarHBondContact O-CG 3.32Å; R87-E91 PolarHBondContact O-N 2.87Å; T88-E91 WeakPolarHBondContact O-CB 3.28Å; T88-E91 PolarHBondContact O-N 2.73Å; E91-Q94 PolarHBondContact O-N 3.41Å; E91-S95 WeakPolarHBondContact O-CB 3.39Å; E91-S95 PolarHBondContact O-N 3.08Å; E91-S95 PolarHBondContact O-OG 3.38Å |
| 92 | E | 92.1 | Very high | 95.1 | Very high | 121 Ų | 121 | 99.2 Ų | 99.2 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -44.4 | 175.8 | -72.5 | 177.5 | 178.2 | 0 | 0 | 111.7 | T88 S89 S95 A96 | T88-E92 WeakPolarHBondContact O-CG 3.48Å; T88-E92 PolarHBondContact O-N 3.44Å; S89-E92 PolarHBondContact O-N 2.91Å; E92-S95 PolarHBondContact O-N 3.09Å; E92-A96 WeakPolarHBondContact O-CB 3.49Å; E92-A96 PolarHBondContact O-N 3.36Å |
| 93 | H | 97.7 | Very high | 95.1 | Very high | 118 Ų | 118 | 99.7 Ų | 99.7 | 55% | 0.546 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -39.8 | 175.9 | -74.8 | -21.2 | 0 | 0 | 0 | 112.7 | S89 L90 A96 L97 | S89-H93 WeakPolarHBondContact O-CB 3.29Å; S89-H93 PolarHBondContact O-N 3.41Å; L90-H93 PolarHBondContact O-N 3.16Å; H93-A96 PolarHBondContact O-N 2.91Å; H93-L97 WeakPolarHBondContact O-CB 3.48Å; H93-L97 WeakPolarHBondContact O-CG 3.37Å; H93-L97 PolarHBondContact O-N 3.47Å |
| 94 | Q | 96.7 | Very high | 95.3 | Very high | 103 Ų | 103 | 101.9 Ų | 101.9 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.5 | -46.8 | 173.2 | -76.1 | 175.3 | -5.3 | 0 | 0 | 111 | L90 E91 A96 L97 E98 | L90-Q94 WeakPolarHBondContact O-CB 3.32Å; L90-Q94 VanDerWaalsContact O-CG 3.3Å; L90-Q94 WeakPolarHBondContact O-CG 3.39Å; L90-Q94 PolarHBondContact O-N 3.47Å; E91-Q94 PolarHBondContact O-N 3.41Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.4Å; Q94-L97 PolarHBondContact O-N 3.06Å; Q94-E98 WeakPolarHBondContact O-CG 3.33Å; Q94-E98 PolarHBondContact O-N 3.35Å |
| 95 | S | 94.9 | Very high | 95.2 | Very high | 74 Ų | 74 | 100.8 Ų | 100.8 | 52% | 0.517 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.3 | -42.1 | 177.3 | -57.9 | 0 | 0 | 0 | 0 | 112.2 | E91 E92 E98 L99 | E91-S95 WeakPolarHBondContact O-CB 3.39Å; E91-S95 PolarHBondContact O-N 3.08Å; E91-S95 PolarHBondContact O-OG 3.38Å; E92-S95 PolarHBondContact O-N 3.09Å; S95-E98 PolarHBondContact O-N 2.96Å; S95-L99 PolarHBondContact O-N 3.49Å; S95-L99 VanDerWaalsContact O-N 3.1Å |
| 96 | A | 97.3 | Very high | 95 | Very high | 46 Ų | 46 | 99 Ų | 99 | 38% | 0.38 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E92 H93 Q94 L99 I100 | E92-A96 WeakPolarHBondContact O-CB 3.49Å; E92-A96 PolarHBondContact O-N 3.36Å; H93-A96 PolarHBondContact O-N 2.91Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.4Å; A96-L99 PolarHBondContact O-N 2.93Å; A96-I100 WeakPolarHBondContact O-CG1 3.23Å; A96-I100 PolarHBondContact O-N 2.89Å |
| 97 | L | 97.6 | Very high | 94.7 | Very high | 107 Ų | 107 | 100.3 Ų | 100.3 | 56% | 0.56 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.1 | -43 | 175.8 | -79 | 168 | 0 | 0 | 0 | 111.6 | H93 Q94 L99 I100 M101 | H93-L97 WeakPolarHBondContact O-CB 3.48Å; H93-L97 WeakPolarHBondContact O-CG 3.37Å; H93-L97 PolarHBondContact O-N 3.47Å; Q94-L97 PolarHBondContact O-N 3.06Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 3.44Å; L97-I100 PolarHBondContact O-N 3.44Å; L97-M101 WeakPolarHBondContact O-CB 3.37Å; L97-M101 VanDerWaalsContact O-CG 3.23Å; L97-M101 WeakPolarHBondContact O-CG 3.46Å; L97-M101 PolarHBondContact O-N 3.32Å |
| 98 | E | 93.2 | Very high | 94.3 | Very high | 123 Ų | 123 | 95.7 Ų | 95.7 | 58% | 0.575 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.1 | -42.3 | 176.7 | -74.7 | -177.2 | 175.5 | 0 | 0 | 112.1 | Q94 S95 S102 | Q94-E98 WeakPolarHBondContact O-CG 3.33Å; Q94-E98 PolarHBondContact O-N 3.35Å; S95-E98 PolarHBondContact O-N 2.96Å; E98-S102 VanDerWaalsContact O-CB 3.3Å; E98-S102 WeakPolarHBondContact O-CB 3.43Å; E98-S102 PolarHBondContact O-N 2.89Å; E98-S102 PolarHBondContact O-OG 2.98Å |
| 99 | L | 94 | Very high | 93.9 | Very high | 111 Ų | 111 | 95 Ų | 95 | 58% | 0.581 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.4 | -47.3 | 176.3 | -180 | 61.1 | 0 | 0 | 0 | 111.8 | S95 A96 L97 S102 K103 | S95-L99 PolarHBondContact O-N 3.49Å; S95-L99 VanDerWaalsContact O-N 3.1Å; A96-L99 PolarHBondContact O-N 2.93Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 3.44Å; L99-S102 PolarHBondContact O-N 2.98Å; L99-K103 WeakPolarHBondContact O-CG 3.36Å; L99-K103 PolarHBondContact O-N 3.24Å |
| 100 | I | 96.9 | Very high | 93.4 | Very high | 110 Ų | 110 | 99.6 Ų | 99.6 | 56% | 0.564 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.4 | -47.6 | 178.6 | -68.9 | 165.9 | 0 | 0 | 0 | 110.4 | A96 L97 S102 K103 Y104 | A96-I100 WeakPolarHBondContact O-CG1 3.23Å; A96-I100 PolarHBondContact O-N 2.89Å; L97-I100 PolarHBondContact O-N 3.44Å; I100-S102 VanDerWaalsContact C-N 3.29Å; I100-S102 PolarHBondContact O-N 3.17Å; I100-K103 PolarHBondContact O-N 2.92Å; I100-Y104 WeakPolarHBondContact O-CB 3.38Å; I100-Y104 PolarHBondContact O-N 3.13Å |
| 101 | M | 97.1 | Very high | 92.8 | Very high | 88 Ų | 88 | 100.5 Ų | 100.5 | 43% | 0.433 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.3 | -38.4 | 178.9 | -72.5 | -61.4 | -67.8 | 0 | 0 | 111.6 | L97 Y104 R105 | L97-M101 WeakPolarHBondContact O-CB 3.37Å; L97-M101 VanDerWaalsContact O-CG 3.23Å; L97-M101 WeakPolarHBondContact O-CG 3.46Å; L97-M101 PolarHBondContact O-N 3.32Å; M101-Y104 PolarHBondContact O-N 3.26Å; M101-R105 WeakPolarHBondContact O-CB 3.48Å; M101-R105 VanDerWaalsContact O-CG 3.23Å; M101-R105 WeakPolarHBondContact O-CG 3.48Å; M101-R105 PolarHBondContact O-N 3.42Å |
| 102 | S | 93 | Very high | 92.1 | Very high | 51 Ų | 51 | 98.8 Ų | 98.8 | 36% | 0.357 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 174.8 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | E98 L99 I100 R105 E106 | E98-S102 VanDerWaalsContact O-CB 3.3Å; E98-S102 WeakPolarHBondContact O-CB 3.43Å; E98-S102 PolarHBondContact O-N 2.89Å; E98-S102 PolarHBondContact O-OG 2.98Å; L99-S102 PolarHBondContact O-N 2.98Å; I100-S102 VanDerWaalsContact C-N 3.29Å; I100-S102 PolarHBondContact O-N 3.17Å; S102-R105 PolarHBondContact O-N 3.09Å; S102-E106 WeakPolarHBondContact O-CB 3.46Å; S102-E106 PolarHBondContact O-N 3.15Å |
| 103 | K | 94.4 | Very high | 91.2 | Very high | 114 Ų | 114 | 96 Ų | 96 | 50% | 0.496 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.7 | -38.5 | 175.8 | -71.9 | -70.2 | 165.4 | -159.8 | 0 | 113 | L99 I100 E106 Q107 | L99-K103 WeakPolarHBondContact O-CG 3.36Å; L99-K103 PolarHBondContact O-N 3.24Å; I100-K103 PolarHBondContact O-N 2.92Å; K103-E106 IonicContact NZ-OE2 2.86Å; K103-E106 PolarHBondContact NZ-OE2 3.4Å; K103-E106 WeakPolarHBondContact O-CB 3.39Å; K103-E106 PolarHBondContact O-N 3.13Å; K103-Q107 WeakPolarHBondContact O-CB 3.49Å; K103-Q107 PolarHBondContact O-N 3.42Å |
| 104 | Y | 95.8 | Very high | 90.3 | Very high | 129 Ų | 129 | 94.3 Ų | 94.3 | 51% | 0.506 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.4 | -47 | 174.5 | -177.4 | -94.5 | 0 | 0 | 0 | 111.5 | I100 M101 E106 Q107 M108 | I100-Y104 WeakPolarHBondContact O-CB 3.38Å; I100-Y104 PolarHBondContact O-N 3.13Å; M101-Y104 PolarHBondContact O-N 3.26Å; Y104-E106 VanDerWaalsContact C-N 3.32Å; Y104-E106 PolarHBondContact O-N 3.38Å; Y104-Q107 PolarHBondContact O-N 3.27Å; Y104-M108 HydrophobicContact CE1-CE 4.02Å; Y104-M108 WeakPolarHBondContact O-CB 3.47Å; Y104-M108 PolarHBondContact O-N 3.11Å; Y104-M108 WeakPolarHBondContact OH-CE 3.33Å |
| 105 | R | 92.2 | Very high | 89.3 | Confident | 108 Ų | 108 | 93.6 Ų | 93.6 | 41% | 0.408 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -58.5 | -43.8 | 174.6 | -70.7 | 171.8 | -162.5 | 138.9 | 0.4 | 111.3 | M101 S102 M108 F109 | M101-R105 WeakPolarHBondContact O-CB 3.48Å; M101-R105 VanDerWaalsContact O-CG 3.23Å; M101-R105 WeakPolarHBondContact O-CG 3.48Å; M101-R105 PolarHBondContact O-N 3.42Å; S102-R105 PolarHBondContact O-N 3.09Å; R105-M108 PolarHBondContact O-N 3.37Å; R105-F109 WeakPolarHBondContact O-CB 3.46Å; R105-F109 PolarHBondContact O-N 3.44Å |
| 106 | E | 89.1 | Confident | 87.6 | Confident | 78 Ų | 78 | 95.3 Ų | 95.3 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 177.6 | -160.7 | -158.2 | 132.1 | 0 | 0 | 112.1 | S102 K103 Y104 F109 R110 | S102-E106 WeakPolarHBondContact O-CB 3.46Å; S102-E106 PolarHBondContact O-N 3.15Å; K103-E106 IonicContact NZ-OE2 2.86Å; K103-E106 PolarHBondContact NZ-OE2 3.4Å; K103-E106 WeakPolarHBondContact O-CB 3.39Å; K103-E106 PolarHBondContact O-N 3.13Å; Y104-E106 VanDerWaalsContact C-N 3.32Å; Y104-E106 PolarHBondContact O-N 3.38Å; E106-F109 PolarHBondContact O-N 3.26Å; E106-R110 PolarHBondContact O-N 3.47Å; E106-R110 IonicContact OE1-CZ 3.42Å; E106-R110 IonicContact OE1-NE 3.26Å; E106-R110 PolarHBondContact OE1-NE 2.71Å; E106-R110 IonicContact OE1-NH2 2.77Å; E106-R110 PolarHBondContact OE1-NH2 3.08Å |
| 107 | Q | 90.7 | Very high | 85.5 | Confident | 123 Ų | 123 | 102 Ų | 102 | 58% | 0.575 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.6 | -44.7 | 177.3 | -176.9 | 176.4 | 12.2 | 0 | 0 | 111.8 | K103 Y104 F109 R110 L111 | K103-Q107 WeakPolarHBondContact O-CB 3.49Å; K103-Q107 PolarHBondContact O-N 3.42Å; Y104-Q107 PolarHBondContact O-N 3.27Å; Q107-F109 VanDerWaalsContact C-N 3.31Å; Q107-F109 PolarHBondContact O-N 3.14Å; Q107-R110 PolarHBondContact O-N 3.29Å; Q107-L111 PolarHBondContact O-N 2.84Å |
| 108 | M | 88 | Confident | 83.2 | Confident | 79 Ų | 79 | 103.9 Ų | 103.9 | 39% | 0.389 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 176.3 | -174 | 64.2 | 67.7 | 0 | 0 | 111.1 | Y104 R105 L111 L112 | Y104-M108 HydrophobicContact CE1-CE 4.02Å; Y104-M108 WeakPolarHBondContact O-CB 3.47Å; Y104-M108 PolarHBondContact O-N 3.11Å; Y104-M108 WeakPolarHBondContact OH-CE 3.33Å; R105-M108 PolarHBondContact O-N 3.37Å; M108-L111 PolarHBondContact O-N 3.48Å; M108-L112 HydrophobicContact CG-CD1 4.37Å; M108-L112 PolarHBondContact O-N 3.39Å |
| 109 | F | 84.9 | Confident | 81.4 | Confident | 48 Ų | 48 | 102.2 Ų | 102.2 | 21% | 0.211 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -59.9 | -48.7 | 175.1 | -177.2 | -95.5 | 0 | 0 | 0 | 111.3 | R105 E106 Q107 L111 L112 M113 L126 | R105-F109 WeakPolarHBondContact O-CB 3.46Å; R105-F109 PolarHBondContact O-N 3.44Å; E106-F109 PolarHBondContact O-N 3.26Å; Q107-F109 VanDerWaalsContact C-N 3.31Å; Q107-F109 PolarHBondContact O-N 3.14Å; F109-L111 VanDerWaalsContact C-N 3.28Å; F109-L111 PolarHBondContact O-N 3.06Å; F109-L112 PolarHBondContact O-N 2.91Å; F109-M113 HydrophobicContact CD1-CG 3.89Å; F109-M113 HydrophobicContact CE1-CG 3.54Å; F109-M113 HydrophobicContact CE1-SD 3.93Å; F109-M113 HydrophobicContact CE2-CG 4.41Å; F109-M113 HydrophobicContact CE2-SD 4.32Å; F109-M113 HydrophobicContact CG-CG 4.46Å; F109-M113 HydrophobicContact CZ-CG 3.84Å; F109-M113 HydrophobicContact CZ-SD 3.67Å; F109-M113 WeakPolarHBondContact O-CG 3.47Å; F109-M113 PolarHBondContact O-N 2.92Å; F109-L126 HydrophobicContact CE2-CB 4.02Å |
| 110 | R | 84.2 | Confident | 80 | Confident | 141 Ų | 141 | 101.8 Ų | 101.8 | 53% | 0.532 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.2 | -40 | 175.9 | -82.8 | -172.1 | -94.5 | 137.4 | -8.4 | 112.7 | E106 Q107 M113 A114 | E106-R110 PolarHBondContact O-N 3.47Å; E106-R110 IonicContact OE1-CZ 3.42Å; E106-R110 IonicContact OE1-NE 3.26Å; E106-R110 PolarHBondContact OE1-NE 2.71Å; E106-R110 IonicContact OE1-NH2 2.77Å; E106-R110 PolarHBondContact OE1-NH2 3.08Å; Q107-R110 PolarHBondContact O-N 3.29Å; R110-M113 PolarHBondContact O-N 2.96Å; R110-A114 WeakPolarHBondContact O-CB 3.4Å; R110-A114 PolarHBondContact O-N 2.96Å |
| 111 | L | 84.5 | Confident | 78.6 | Confident | 119 Ų | 119 | 98.7 Ų | 98.7 | 62% | 0.623 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.8 | -43 | 178.3 | -170.6 | 67.4 | 0 | 0 | 0 | 112.2 | Q107 M108 F109 M113 A114 S115 | Q107-L111 PolarHBondContact O-N 2.84Å; M108-L111 PolarHBondContact O-N 3.48Å; F109-L111 VanDerWaalsContact C-N 3.28Å; F109-L111 PolarHBondContact O-N 3.06Å; L111-M113 VanDerWaalsContact C-N 3.32Å; L111-M113 PolarHBondContact O-N 3.18Å; L111-A114 PolarHBondContact O-N 3.39Å; L111-S115 PolarHBondContact O-N 3.36Å |
| 112 | L | 79.7 | Confident | 77.1 | Confident | 83 Ų | 83 | 97.8 Ų | 97.8 | 44% | 0.435 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 174.2 | -79.3 | 165.2 | 0 | 0 | 0 | 112.3 | M108 F109 S115 K116 | M108-L112 HydrophobicContact CG-CD1 4.37Å; M108-L112 PolarHBondContact O-N 3.39Å; F109-L112 PolarHBondContact O-N 2.91Å; L112-S115 PolarHBondContact O-N 2.9Å; L112-S115 PolarHBondContact O-OG 3.48Å; L112-S115 VanDerWaalsContact O-OG 3.09Å; L112-K116 PolarHBondContact O-N 2.92Å; L112-K116 VanDerWaalsContact O-N 3.1Å |
| 113 | M | 73.5 | Confident | 75.7 | Confident | 64 Ų | 64 | 97.8 Ų | 97.8 | 32% | 0.315 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.7 | -40.7 | 175.5 | -69.1 | -70.2 | -59.5 | 0 | 0 | 111.9 | F109 R110 L111 S115 I123 | F109-M113 HydrophobicContact CD1-CG 3.89Å; F109-M113 HydrophobicContact CE1-CG 3.54Å; F109-M113 HydrophobicContact CE1-SD 3.93Å; F109-M113 HydrophobicContact CE2-CG 4.41Å; F109-M113 HydrophobicContact CE2-SD 4.32Å; F109-M113 HydrophobicContact CG-CG 4.46Å; F109-M113 HydrophobicContact CZ-CG 3.84Å; F109-M113 HydrophobicContact CZ-SD 3.67Å; F109-M113 WeakPolarHBondContact O-CG 3.47Å; F109-M113 PolarHBondContact O-N 2.92Å; R110-M113 PolarHBondContact O-N 2.96Å; L111-M113 VanDerWaalsContact C-N 3.32Å; L111-M113 PolarHBondContact O-N 3.18Å; M113-S115 VanDerWaalsContact C-N 3.32Å; M113-I123 HydrophobicContact CE-CB 4.15Å; M113-I123 HydrophobicContact CE-CD1 3.46Å; M113-I123 VanDerWaalsContact CE-CD1 3.46Å; M113-I123 HydrophobicContact CE-CG1 3.71Å; M113-I123 HydrophobicContact CE-CG2 3.42Å; M113-I123 VanDerWaalsContact CE-CG2 3.42Å; M113-I123 HydrophobicContact SD-CB 4.08Å; M113-I123 HydrophobicContact SD-CD1 3.93Å; M113-I123 HydrophobicContact SD-CG1 3.55Å; M113-I123 VanDerWaalsContact SD-CG1 3.55Å; M113-I123 HydrophobicContact SD-CG2 3.71Å |
| 114 | A | 79.8 | Confident | 74.5 | Confident | 81 Ų | 81 | 98.4 Ų | 98.4 | 67% | 0.669 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -69.5 | -29.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | R110 L111 | R110-A114 WeakPolarHBondContact O-CB 3.4Å; R110-A114 PolarHBondContact O-N 2.96Å; L111-A114 PolarHBondContact O-N 3.39Å |
| 115 | S | 74.1 | Confident | 73.2 | Confident | 88 Ų | 88 | 100 Ų | 100 | 62% | 0.615 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -81.5 | -25.2 | 177.8 | 76.2 | 0 | 0 | 0 | 0 | 113.6 | L111 L112 M113 K117 | L111-S115 PolarHBondContact O-N 3.36Å; L112-S115 PolarHBondContact O-N 2.9Å; L112-S115 PolarHBondContact O-OG 3.48Å; L112-S115 VanDerWaalsContact O-OG 3.09Å; M113-S115 VanDerWaalsContact C-N 3.32Å; S115-K117 PolarHBondContact O-N 3.46Å |
| 116 | K | 59.1 | Low | 71.9 | Confident | 110 Ų | 110 | 98.3 Ų | 98.3 | 48% | 0.478 | 51% | 0.51 | S | S | . | . | trans | -96.8 | 86.3 | 175.7 | -68.5 | -160.8 | 177.5 | -167.4 | 0 | 111.2 | L112 D118 | L112-K116 PolarHBondContact O-N 2.92Å; L112-K116 VanDerWaalsContact O-N 3.1Å; K116-D118 VanDerWaalsContact C-N 3.27Å; K116-D118 PolarHBondContact O-N 2.91Å | ||
| 117 | K | 53.7 | Low | 70.8 | Confident | 186 Ų | 186 | 101.5 Ų | 101.5 | 81% | 0.809 | 52% | 0.523 | S | S | * | . | trans | -70.3 | -10.7 | 177.3 | -139 | 174.7 | -179.5 | -178.7 | 0 | 114.9 | S115 | S115-K117 PolarHBondContact O-N 3.46Š| ||
| 118 | D | 49.4 | Very low | 69.9 | Low | 148 Ų | 148 | 100.4 Ų | 100.4 | 79% | 0.791 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -146.2 | 46.8 | -166.1 | -58.4 | -62.2 | 0 | 0 | 0 | 117.7 | K116 | K116-D118 VanDerWaalsContact C-N 3.27Å; K116-D118 PolarHBondContact O-N 2.91Å |
| 119 | D | 55.9 | Low | 68.8 | Low | 88 Ų | 88 | 103.5 Ų | 103.5 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | trans | -156.1 | 97.3 | 160 | -144.1 | -19.2 | 0 | 0 | 0 | 115.8 | G121 I122 | D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 2.89Å; D119-I122 HydrophobicContact CB-CD1 4.27Å | ||
| 120 | P | 63 | Low | 67.7 | Low | 102 Ų | 102 | 104.8 Ų | 104.8 | 66% | 0.662 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61 | -25.7 | -177 | -22.1 | 32 | 0 | 0 | 0 | 115.4 | ||
| 121 | G | 68.2 | Low | 66.9 | Low | 44 Ų | 44 | 101.6 Ų | 101.6 | 45% | 0.454 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -74.6 | -31.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | D119 | D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 2.89Å |
| 122 | I | 66.3 | Low | 65.9 | Low | 69 Ų | 69 | 101.9 Ų | 101.9 | 35% | 0.354 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -74.7 | -33.7 | 179.6 | -64.8 | 171.8 | 0 | 0 | 0 | 110.4 | D119 M124 K125 L126 | D119-I122 HydrophobicContact CB-CD1 4.27Å; I122-M124 PolarHBondContact O-N 3.04Å; I122-K125 PolarHBondContact O-N 2.86Å; I122-L126 HydrophobicContact CG2-CD1 3.61Å; I122-L126 VanDerWaalsContact O-CD1 3.29Å; I122-L126 WeakPolarHBondContact O-CD1 3.5Å; I122-L126 PolarHBondContact O-N 3.23Å; I122-L126 VanDerWaalsContact O-N 3.16Å |
| 123 | I | 62.9 | Low | 65 | Low | 51 Ų | 51 | 102 Ų | 102 | 26% | 0.262 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 180 | -66.1 | 174.3 | 0 | 0 | 0 | 111.5 | M113 K127 | M113-I123 HydrophobicContact CE-CB 4.15Å; M113-I123 HydrophobicContact CE-CD1 3.46Å; M113-I123 VanDerWaalsContact CE-CD1 3.46Å; M113-I123 HydrophobicContact CE-CG1 3.71Å; M113-I123 HydrophobicContact CE-CG2 3.42Å; M113-I123 VanDerWaalsContact CE-CG2 3.42Å; M113-I123 HydrophobicContact SD-CB 4.08Å; M113-I123 HydrophobicContact SD-CD1 3.93Å; M113-I123 HydrophobicContact SD-CG1 3.55Å; M113-I123 VanDerWaalsContact SD-CG1 3.55Å; M113-I123 HydrophobicContact SD-CG2 3.71Å; I123-K127 WeakPolarHBondContact O-CB 3.39Å; I123-K127 PolarHBondContact O-N 3.12Å; I123-K127 VanDerWaalsContact O-N 3.12Å |
| 124 | M | 68.9 | Low | 64.2 | Low | 127 Ų | 127 | 104 Ų | 104 | 63% | 0.626 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.4 | -41.1 | 180 | -92 | -131.5 | 45.3 | 0 | 0 | 112.9 | I122 K127 E128 | I122-M124 PolarHBondContact O-N 3.04Å; M124-K127 PolarHBondContact O-N 3.39Å; M124-E128 PolarHBondContact O-N 2.82Å; M124-E128 VanDerWaalsContact O-N 3.12Å |
| 125 | K | 68.5 | Low | 63 | Low | 163 Ų | 163 | 106.5 Ų | 106.5 | 71% | 0.709 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67 | -39.1 | 179.4 | -71.7 | -177.4 | 179.5 | 178.7 | 0 | 112.5 | I122 Q129 | I122-K125 PolarHBondContact O-N 2.86Å; K125-Q129 WeakPolarHBondContact O-CG 3.49Å; K125-Q129 PolarHBondContact O-N 3.4Å |
| 126 | L | 65.9 | Low | 62 | Low | 72 Ų | 72 | 106.9 Ų | 106.9 | 38% | 0.377 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70 | -38.1 | 175.4 | -89.4 | 97.7 | 0 | 0 | 0 | 112.6 | F109 I122 E128 Q129 H130 | F109-L126 HydrophobicContact CE2-CB 4.02Å; I122-L126 HydrophobicContact CG2-CD1 3.61Å; I122-L126 VanDerWaalsContact O-CD1 3.29Å; I122-L126 WeakPolarHBondContact O-CD1 3.5Å; I122-L126 PolarHBondContact O-N 3.23Å; I122-L126 VanDerWaalsContact O-N 3.16Å; L126-E128 VanDerWaalsContact C-N 3.29Å; L126-E128 PolarHBondContact O-N 2.84Å; L126-Q129 PolarHBondContact O-N 2.86Å; L126-H130 PolarHBondContact O-CD2 3.06Å; L126-H130 PolarHBondContact O-N 3.39Å |
| 127 | K | 66.4 | Low | 61.6 | Low | 146 Ų | 146 | 107.4 Ų | 107.4 | 64% | 0.635 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.6 | -37.4 | 177.1 | -168.2 | 176.8 | -179.9 | -176.6 | 0 | 112 | I123 M124 H130 S131 | I123-K127 WeakPolarHBondContact O-CB 3.39Å; I123-K127 PolarHBondContact O-N 3.12Å; I123-K127 VanDerWaalsContact O-N 3.12Å; M124-K127 PolarHBondContact O-N 3.39Å; K127-H130 PolarHBondContact O-N 3.06Å; K127-S131 PolarHBondContact O-N 3.18Å |
| 128 | E | 70 | Confident | 61.4 | Low | 100 Ų | 100 | 108 Ų | 108 | 47% | 0.467 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -71.6 | -34.6 | 177.4 | -169.3 | 168.7 | 153 | 0 | 0 | 113.2 | M124 L126 H130 S131 K132 | M124-E128 PolarHBondContact O-N 2.82Å; M124-E128 VanDerWaalsContact O-N 3.12Å; L126-E128 VanDerWaalsContact C-N 3.29Å; L126-E128 PolarHBondContact O-N 2.84Å; E128-H130 VanDerWaalsContact C-N 3.32Å; E128-H130 PolarHBondContact O-N 3.12Å; E128-S131 PolarHBondContact O-N 3.23Å; E128-K132 PolarHBondContact O-N 3.34Å; E128-K132 IonicContact OE1-NZ 3.45Å; E128-K132 PolarHBondContact OE1-NZ 3.2Å |
| 129 | Q | 66.2 | Low | 61 | Low | 144 Ų | 144 | 106.8 Ų | 106.8 | 67% | 0.673 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.5 | -35.8 | 174.3 | -69 | -141.8 | -33.2 | 0 | 0 | 112.4 | K125 L126 K132 I133 | K125-Q129 WeakPolarHBondContact O-CG 3.49Å; K125-Q129 PolarHBondContact O-N 3.4Å; L126-Q129 PolarHBondContact O-N 2.86Å; Q129-K132 PolarHBondContact O-N 2.96Å; Q129-I133 PolarHBondContact O-N 3.01Å |
| 130 | H | 61.3 | Low | 60.5 | Low | 74 Ų | 74 | 111.6 Ų | 111.6 | 34% | 0.343 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.3 | -41.6 | 174 | -85.8 | -73.2 | 0 | 0 | 0 | 112.7 | L126 K127 E128 K132 I133 D134 | L126-H130 PolarHBondContact O-CD2 3.06Å; L126-H130 PolarHBondContact O-N 3.39Å; K127-H130 PolarHBondContact O-N 3.06Å; E128-H130 VanDerWaalsContact C-N 3.32Å; E128-H130 PolarHBondContact O-N 3.12Å; H130-K132 VanDerWaalsContact C-N 3.26Å; H130-K132 PolarHBondContact O-N 3.4Å; H130-I133 PolarHBondContact O-N 3.46Å; H130-D134 PolarHBondContact O-N 2.94Å |
| 131 | S | 67.6 | Low | 59.5 | Low | 74 Ų | 74 | 111.2 Ų | 111.2 | 52% | 0.517 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.5 | -29.3 | 177.6 | -171.7 | 0 | 0 | 0 | 0 | 113.6 | K127 E128 | K127-S131 PolarHBondContact O-N 3.18Å; E128-S131 PolarHBondContact O-N 3.23Å |
| 132 | K | 62.6 | Low | 58 | Low | 125 Ų | 125 | 117.3 Ų | 117.3 | 54% | 0.543 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -75.6 | -30.5 | 178.6 | -79.2 | 172.3 | 178.5 | 156.3 | 0 | 112.8 | E128 Q129 H130 V136 | E128-K132 PolarHBondContact O-N 3.34Å; E128-K132 IonicContact OE1-NZ 3.45Å; E128-K132 PolarHBondContact OE1-NZ 3.2Å; Q129-K132 PolarHBondContact O-N 2.96Å; H130-K132 VanDerWaalsContact C-N 3.26Å; H130-K132 PolarHBondContact O-N 3.4Å; K132-V136 WeakPolarHBondContact O-CG2 3.25Å |
| 133 | I | 61.4 | Low | 56.3 | Low | 87 Ų | 87 | 117 Ų | 117 | 45% | 0.446 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -72.8 | -40.4 | 178.5 | -66.2 | 169.4 | 0 | 0 | 0 | 110.5 | Q129 H130 M135 V136 H137 | Q129-I133 PolarHBondContact O-N 3.01Å; H130-I133 PolarHBondContact O-N 3.46Å; I133-M135 PolarHBondContact O-N 2.89Å; I133-V136 PolarHBondContact O-N 3.25Å; I133-V136 VanDerWaalsContact O-N 3.12Å; I133-H137 PolarHBondContact O-CD2 3.4Å |
| 134 | D | 56.6 | Low | 54.7 | Low | 106 Ų | 106 | 124.3 Ų | 124.3 | 57% | 0.567 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -62.7 | -27.4 | 179.1 | -67.9 | -20.2 | 0 | 0 | 0 | 113.1 | H130 | H130-D134 PolarHBondContact O-N 2.94Å |
| 135 | M | 54 | Low | 52.8 | Low | 132 Ų | 132 | 127.4 Ų | 127.4 | 65% | 0.65 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -77.9 | -26.9 | 175.4 | -76 | -161.2 | 67.7 | 0 | 0 | 114.4 | I133 | I133-M135 PolarHBondContact O-N 2.89Å |
| 136 | V | 54.9 | Low | 51.1 | Low | 97 Ų | 97 | 126.9 Ų | 126.9 | 59% | 0.588 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -76.4 | -26.2 | -176.3 | 173.4 | 0 | 0 | 0 | 0 | 111.9 | K132 I133 | K132-V136 WeakPolarHBondContact O-CG2 3.25Å; I133-V136 PolarHBondContact O-N 3.25Å; I133-V136 VanDerWaalsContact O-N 3.12Å |
| 137 | H | 50.3 | Low | 49.3 | Very low | 120 Ų | 120 | 130.3 Ų | 130.3 | 56% | 0.556 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -79.4 | -26.7 | 179.4 | -71.8 | -73.3 | 0 | 0 | 0 | 113.7 | I133 N139 | I133-H137 PolarHBondContact O-CD2 3.4Å; H137-N139 VanDerWaalsContact C-N 3.3Å; H137-N139 PolarHBondContact O-N 3.05Å |
| 138 | R | 48.6 | Very low | 47.4 | Very low | 200 Ų | 200 | 128.1 Ų | 128.1 | 76% | 0.755 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -70 | -22.9 | 178.6 | -166.4 | 172.9 | -176.8 | 174.1 | 1.5 | 114.1 | S141 | R138-S141 PolarHBondContact O-OG 3.34Å; R138-S141 VanDerWaalsContact O-OG 3.13Å |
| 139 | N | 41.9 | Very low | 45.7 | Very low | 122 Ų | 122 | 128.4 Ų | 128.4 | 65% | 0.652 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -5.5 | -174.1 | -69.9 | -9.3 | 0 | 0 | 0 | 114.3 | H137 | H137-N139 VanDerWaalsContact C-N 3.3Å; H137-N139 PolarHBondContact O-N 3.05Å |
| 140 | K | 46 | Very low | 44.1 | Very low | 188 Ų | 188 | 132.4 Ų | 132.4 | 82% | 0.817 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -87.3 | -8.5 | 178.5 | -98.7 | 179.9 | 176 | -179.3 | 0 | 114 | ||
| 141 | S | 41.8 | Very low | 42.7 | Very low | 95 Ų | 95 | 137.5 Ų | 137.5 | 66% | 0.664 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -95.1 | -0.3 | -174.3 | 47.9 | 0 | 0 | 0 | 0 | 115.4 | R138 | R138-S141 PolarHBondContact O-OG 3.34Å; R138-S141 VanDerWaalsContact O-OG 3.13Å |
| 142 | E | 35.6 | Very low | 41 | Very low | 171 Ų | 171 | 141.8 Ų | 141.8 | 80% | 0.799 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -121.6 | 13.8 | -167.8 | -70.9 | -167.7 | 165.9 | 0 | 0 | 116.9 | ||
| 143 | G | 31.1 | Very low | 39.7 | Very low | 62 Ų | 62 | 143.6 Ų | 143.6 | 64% | 0.639 | 73% | 0.733 | S | S | * | * | trans | -128.9 | 61.1 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 144 | F | 28.9 | Very low | 38.3 | Very low | 206 Ų | 206 | 148.7 Ų | 148.7 | 90% | 0.904 | 76% | 0.756 | S | S | * | * | trans | -161.1 | 57.9 | 164.9 | -107.6 | -75.4 | 0 | 0 | 0 | 113.1 | ||||
| 145 | F | 29.2 | Very low | 37.3 | Very low | 191 Ų | 191 | 146.3 Ų | 146.3 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | -144.7 | 110.9 | 168 | -113.6 | -94.8 | 0 | 0 | 0 | 111.8 | ||||
| 146 | L | 31.8 | Very low | 36.6 | Very low | 153 Ų | 153 | 145.2 Ų | 145.2 | 80% | 0.801 | 75% | 0.753 | S | S | * | * | trans | 54.7 | 115.3 | 148.8 | -56.3 | 170.7 | 0 | 0 | 0 | 119.5 | ||||
| 147 | D | 28.2 | Very low | 36 | Very low | 143 Ų | 143 | 148.6 Ų | 148.6 | 77% | 0.765 | 76% | 0.763 | S | S | * | * | -173.5 | 108.6 | 118.3 | -166.1 | 6.8 | 0 | 0 | 0 | 110.8 | S149 | D147-S149 PolarHBondContact OD1-N 3.29Š| |||
| 148 | A | 28.1 | Very low | 35.7 | Very low | 100 Ų | 100 | 151.3 Ų | 151.3 | 83% | 0.826 | 78% | 0.775 | S | S | * | * | trans | -134.2 | 68.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 149 | S | 34 | Very low | 35.6 | Very low | 106 Ų | 106 | 143.3 Ų | 143.3 | 74% | 0.741 | 76% | 0.755 | S | S | * | * | trans | -154 | 77.2 | 168.6 | -79.4 | 0 | 0 | 0 | 0 | 112.4 | D147 | D147-S149 PolarHBondContact OD1-N 3.29Š| ||
| 150 | R | 32.7 | Very low | 36 | Very low | 228 Ų | 228 | 141 Ų | 141 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | trans | -146.3 | 106.8 | 156.4 | -87.3 | -168.6 | -176.7 | -160.7 | 0.6 | 110.5 | ||||
| 151 | H | 31.2 | Very low | 36 | Very low | 182 Ų | 182 | 139 Ų | 139 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | 177.1 | 107.8 | 128.6 | -101.2 | -75.8 | 0 | 0 | 0 | 109.7 | |||||
| 152 | I | 31.5 | Very low | 36.7 | Very low | 164 Ų | 164 | 143.7 Ų | 143.7 | 84% | 0.841 | 74% | 0.739 | S | S | * | * | trans | -115.1 | 117.1 | 162 | -64 | 177.2 | 0 | 0 | 0 | 105.9 | ||||
| 153 | L | 35.2 | Very low | 37.7 | Very low | 162 Ų | 162 | 141.9 Ų | 141.9 | 85% | 0.848 | 73% | 0.725 | S | S | * | * | trans | -126.9 | 129.7 | 165 | -136.8 | 84.4 | 0 | 0 | 0 | 107.9 | ||||
| 154 | E | 32.1 | Very low | 39.2 | Very low | 195 Ų | 195 | 145 Ų | 145 | 91% | 0.911 | 72% | 0.723 | S | S | * | * | trans | -60.6 | 146 | -171.3 | -66.5 | 174.5 | 125.1 | 0 | 0 | 114.5 | ||||
| 155 | A | 35.9 | Very low | 41 | Very low | 56 Ų | 56 | 141.4 Ų | 141.4 | 46% | 0.463 | 71% | 0.712 | S | S | . | * | trans | -152.3 | 156 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 156 | P | 38.7 | Very low | 43 | Very low | 108 Ų | 108 | 137.3 Ų | 137.3 | 70% | 0.701 | 70% | 0.696 | S | S | * | * | trans | -67.5 | 151.8 | -143 | -21.7 | 32.4 | 0 | 0 | 0 | 118.8 | H158 G159 | P156-H158 VanDerWaalsContact C-N 3.35Å; P156-H158 PolarHBondContact O-N 3.45Å; P156-H158 VanDerWaalsContact O-N 3.12Å; P156-G159 PolarHBondContact O-N 3.11Å | ||
| 157 | Q | 43.4 | Very low | 45 | Very low | 169 Ų | 169 | 132.4 Ų | 132.4 | 79% | 0.79 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | -13.6 | -158.6 | -62.8 | 177.6 | -5.6 | 0 | 0 | 117.1 | L160 | Q157-L160 HydrophobicContact CB-CD1 4.22Å; Q157-L160 HydrophobicContact CG-CD1 4.17Å |
| 158 | H | 43.4 | Very low | 47.4 | Very low | 176 Ų | 176 | 130.5 Ų | 130.5 | 82% | 0.815 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -14.3 | 174.7 | -94.8 | -63.2 | 0 | 0 | 0 | 114.7 | P156 L160 | P156-H158 VanDerWaalsContact C-N 3.35Å; P156-H158 PolarHBondContact O-N 3.45Å; P156-H158 VanDerWaalsContact O-N 3.12Å; H158-L160 VanDerWaalsContact C-N 3.29Å |
| 159 | G | 47.5 | Very low | 49.8 | Very low | 33 Ų | 33 | 132.3 Ų | 132.3 | 34% | 0.34 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -83.5 | -4.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | P156 R163 | P156-G159 PolarHBondContact O-N 3.11Å; G159-R163 VanDerWaalsContact O-CB 3.28Å; G159-R163 WeakPolarHBondContact O-CB 3.37Å; G159-R163 WeakPolarHBondContact O-CG 3.32Å; G159-R163 PolarHBondContact O-N 2.94Å; G159-R163 PolarHBondContact O-NE 3.36Å |
| 160 | L | 49.8 | Very low | 52.2 | Low | 74 Ų | 74 | 132.6 Ų | 132.6 | 39% | 0.387 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -79.5 | -40.2 | -175.1 | -64.5 | 177 | 0 | 0 | 0 | 112.4 | Q157 H158 H164 | Q157-L160 HydrophobicContact CB-CD1 4.22Å; Q157-L160 HydrophobicContact CG-CD1 4.17Å; H158-L160 VanDerWaalsContact C-N 3.29Å; L160-H164 VanDerWaalsContact O-CB 3.3Å; L160-H164 WeakPolarHBondContact O-CB 3.47Å; L160-H164 PolarHBondContact O-CD2 2.82Å; L160-H164 PolarHBondContact O-N 3.11Å |
| 161 | E | 46.9 | Very low | 54.9 | Low | 146 Ų | 146 | 127.6 Ų | 127.6 | 68% | 0.682 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -68 | -41.9 | 177.2 | -86.6 | -178.8 | 151.8 | 0 | 0 | 112.7 | H164 L165 | E161-H164 PolarHBondContact O-N 3.4Å; E161-L165 PolarHBondContact O-N 3.44Å |
| 162 | R | 55.7 | Low | 57.6 | Low | 193 Ų | 193 | 124.4 Ų | 124.4 | 73% | 0.728 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.3 | -41.2 | 176.7 | -128.6 | -168.3 | -82.5 | 166.1 | -7.5 | 111.5 | H164 L165 E166 | R162-H164 VanDerWaalsContact C-N 3.33Å; R162-H164 PolarHBondContact O-N 2.92Å; R162-L165 PolarHBondContact O-N 3.29Å; R162-E166 WeakPolarHBondContact O-CB 3.32Å; R162-E166 WeakPolarHBondContact O-CG 3.43Å; R162-E166 PolarHBondContact O-N 2.86Å |
| 163 | R | 55.5 | Low | 60.3 | Low | 132 Ų | 132 | 121.4 Ų | 121.4 | 50% | 0.498 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -65 | -34.2 | 171.3 | -83.2 | -168.8 | -73.2 | -167.7 | -0.5 | 112.9 | G159 A167 | G159-R163 VanDerWaalsContact O-CB 3.28Å; G159-R163 WeakPolarHBondContact O-CB 3.37Å; G159-R163 WeakPolarHBondContact O-CG 3.32Å; G159-R163 PolarHBondContact O-N 2.94Å; G159-R163 PolarHBondContact O-NE 3.36Å; R163-A167 WeakPolarHBondContact O-CB 3.41Å; R163-A167 PolarHBondContact O-N 2.99Å |
| 164 | H | 62.9 | Low | 63 | Low | 129 Ų | 129 | 116.3 Ų | 116.3 | 60% | 0.597 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.7 | -42 | 177.3 | -107.1 | -75.6 | 0 | 0 | 0 | 112.3 | L160 E161 R162 A167 N168 | L160-H164 VanDerWaalsContact O-CB 3.3Å; L160-H164 WeakPolarHBondContact O-CB 3.47Å; L160-H164 PolarHBondContact O-CD2 2.82Å; L160-H164 PolarHBondContact O-N 3.11Å; E161-H164 PolarHBondContact O-N 3.4Å; R162-H164 VanDerWaalsContact C-N 3.33Å; R162-H164 PolarHBondContact O-N 2.92Å; H164-A167 PolarHBondContact O-N 3.48Å; H164-N168 WeakPolarHBondContact O-CB 3.48Å; H164-N168 PolarHBondContact O-N 3.35Å |
| 165 | L | 67.1 | Low | 65.7 | Low | 130 Ų | 130 | 112 Ų | 112 | 68% | 0.681 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.9 | -45.4 | 174.9 | -106.5 | 82.1 | 0 | 0 | 0 | 111.7 | E161 R162 A167 N168 Q169 | E161-L165 PolarHBondContact O-N 3.44Å; R162-L165 PolarHBondContact O-N 3.29Å; L165-A167 VanDerWaalsContact C-N 3.33Å; L165-A167 PolarHBondContact O-N 3.3Å; L165-N168 PolarHBondContact O-N 3.4Å; L165-Q169 WeakPolarHBondContact O-CB 3.48Å; L165-Q169 PolarHBondContact O-N 2.98Å |
| 166 | E | 70.4 | Confident | 68.4 | Low | 105 Ų | 105 | 112.5 Ų | 112.5 | 49% | 0.491 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.2 | -39 | 176.3 | -73.7 | 171.6 | -174.6 | 0 | 0 | 111.6 | R162 Q169 N170 | R162-E166 WeakPolarHBondContact O-CB 3.32Å; R162-E166 WeakPolarHBondContact O-CG 3.43Å; R162-E166 PolarHBondContact O-N 2.86Å; E166-Q169 PolarHBondContact O-N 3.4Å; E166-N170 WeakPolarHBondContact O-CB 3.42Å; E166-N170 PolarHBondContact O-N 2.84Å; E166-N170 PolarHBondContact O-ND2 3.12Å |
| 167 | A | 75.7 | Confident | 70.9 | Confident | 50 Ų | 50 | 111.7 Ų | 111.7 | 41% | 0.413 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.2 | -48.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | R163 H164 L165 Q169 N170 E171 | R163-A167 WeakPolarHBondContact O-CB 3.41Å; R163-A167 PolarHBondContact O-N 2.99Å; H164-A167 PolarHBondContact O-N 3.48Å; L165-A167 VanDerWaalsContact C-N 3.33Å; L165-A167 PolarHBondContact O-N 3.3Å; A167-Q169 VanDerWaalsContact C-N 3.29Å; A167-Q169 PolarHBondContact O-N 3.12Å; A167-N170 PolarHBondContact O-N 3.24Å; A167-E171 WeakPolarHBondContact O-CB 3.43Å; A167-E171 PolarHBondContact O-N 3.25Å |
| 168 | N | 77.2 | Confident | 73.4 | Confident | 103 Ų | 103 | 108.7 Ų | 108.7 | 55% | 0.551 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60 | -39.7 | 176 | -103.4 | 20.6 | 0 | 0 | 0 | 112.1 | H164 L165 E171 L172 | H164-N168 WeakPolarHBondContact O-CB 3.48Å; H164-N168 PolarHBondContact O-N 3.35Å; L165-N168 PolarHBondContact O-N 3.4Å; N168-E171 PolarHBondContact O-N 3.48Å; N168-L172 WeakPolarHBondContact O-CB 3.3Å; N168-L172 PolarHBondContact O-N 3.41Å |
| 169 | Q | 79.7 | Confident | 75.7 | Confident | 137 Ų | 137 | 105.5 Ų | 105.5 | 64% | 0.64 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -68 | -39.6 | 178.8 | -170.9 | 167 | -2.4 | 0 | 0 | 111.6 | L165 E166 A167 L172 Q173 | L165-Q169 WeakPolarHBondContact O-CB 3.48Å; L165-Q169 PolarHBondContact O-N 2.98Å; E166-Q169 PolarHBondContact O-N 3.4Å; A167-Q169 VanDerWaalsContact C-N 3.29Å; A167-Q169 PolarHBondContact O-N 3.12Å; Q169-L172 PolarHBondContact O-N 3.28Å; Q169-Q173 WeakPolarHBondContact O-CB 3.42Å; Q169-Q173 PolarHBondContact O-N 3.21Å |
| 170 | N | 84.6 | Confident | 77.8 | Confident | 113 Ų | 113 | 107.8 Ų | 107.8 | 60% | 0.604 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67 | -39.8 | 174.2 | -70.9 | -23.7 | 0 | 0 | 0 | 112.2 | E166 A167 Q173 A174 | E166-N170 WeakPolarHBondContact O-CB 3.42Å; E166-N170 PolarHBondContact O-N 2.84Å; E166-N170 PolarHBondContact O-ND2 3.12Å; A167-N170 PolarHBondContact O-N 3.24Å; N170-Q173 PolarHBondContact O-N 3.23Å; N170-A174 WeakPolarHBondContact O-CB 3.32Å; N170-A174 PolarHBondContact O-N 3.47Å |
| 171 | E | 87.4 | Confident | 79.8 | Confident | 123 Ų | 123 | 110.6 Ų | 110.6 | 58% | 0.575 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.8 | -42.4 | 176.3 | -129.2 | 173.4 | -168.1 | 0 | 0 | 111.3 | A167 N168 A174 H175 | A167-E171 WeakPolarHBondContact O-CB 3.43Å; A167-E171 PolarHBondContact O-N 3.25Å; N168-E171 PolarHBondContact O-N 3.48Å; E171-A174 PolarHBondContact O-N 3.1Å; E171-H175 PolarHBondContact O-CD2 3.4Å; E171-H175 PolarHBondContact O-N 3.44Å |
| 172 | L | 88.6 | Confident | 82.1 | Confident | 115 Ų | 115 | 109.5 Ų | 109.5 | 60% | 0.602 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.8 | -42.8 | 174.3 | -175.3 | 64.6 | 0 | 0 | 0 | 111.4 | N168 Q169 A174 H175 V176 | N168-L172 WeakPolarHBondContact O-CB 3.3Å; N168-L172 PolarHBondContact O-N 3.41Å; Q169-L172 PolarHBondContact O-N 3.28Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-H175 PolarHBondContact O-N 3.44Å; L172-V176 WeakPolarHBondContact O-CG2 3.48Å; L172-V176 PolarHBondContact O-N 3.38Å |
| 173 | Q | 88.6 | Confident | 83.7 | Confident | 100 Ų | 100 | 102 Ų | 102 | 47% | 0.467 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 176.6 | -171.4 | 60.8 | 47.6 | 0 | 0 | 111.4 | Q169 N170 H175 V176 D177 | Q169-Q173 WeakPolarHBondContact O-CB 3.42Å; Q169-Q173 PolarHBondContact O-N 3.21Å; N170-Q173 PolarHBondContact O-N 3.23Å; Q173-H175 VanDerWaalsContact C-N 3.3Å; Q173-H175 PolarHBondContact O-N 2.73Å; Q173-V176 WeakPolarHBondContact O-CB 3.47Å; Q173-V176 PolarHBondContact O-N 3.43Å; Q173-V176 VanDerWaalsContact O-N 3.13Å; Q173-D177 PolarHBondContact NE2-OD1 3.33Å; Q173-D177 VanDerWaalsContact O-CG 3.27Å; Q173-D177 PolarHBondContact O-N 3.37Å |
| 174 | A | 91.4 | Very high | 85.4 | Confident | 56 Ų | 56 | 98 Ų | 98 | 46% | 0.463 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.5 | -40 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | N170 E171 L172 D177 Q178 | N170-A174 WeakPolarHBondContact O-CB 3.32Å; N170-A174 PolarHBondContact O-N 3.47Å; E171-A174 PolarHBondContact O-N 3.1Å; L172-A174 VanDerWaalsContact C-N 3.35Å; A174-D177 PolarHBondContact O-N 2.92Å; A174-Q178 WeakPolarHBondContact O-CB 3.34Å; A174-Q178 PolarHBondContact O-N 3.41Å |
| 175 | H | 89.5 | Confident | 87 | Confident | 105 Ų | 105 | 96.3 Ų | 96.3 | 49% | 0.486 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -39.1 | 173.6 | -77.6 | -42.8 | 0 | 0 | 0 | 113 | E171 L172 Q173 Q178 I179 | E171-H175 PolarHBondContact O-CD2 3.4Å; E171-H175 PolarHBondContact O-N 3.44Å; L172-H175 PolarHBondContact O-N 3.44Å; Q173-H175 VanDerWaalsContact C-N 3.3Å; Q173-H175 PolarHBondContact O-N 2.73Å; H175-Q178 PolarHBondContact O-N 2.94Å; H175-I179 VanDerWaalsContact O-CG1 3.26Å; H175-I179 WeakPolarHBondContact O-CG1 3.43Å; H175-I179 PolarHBondContact O-N 3.23Å |
| 176 | V | 92.3 | Very high | 88.3 | Confident | 66 Ų | 66 | 95.6 Ų | 95.6 | 40% | 0.4 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 175.1 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | L172 Q173 Q178 I179 T180 | L172-V176 WeakPolarHBondContact O-CG2 3.48Å; L172-V176 PolarHBondContact O-N 3.38Å; Q173-V176 WeakPolarHBondContact O-CB 3.47Å; Q173-V176 PolarHBondContact O-N 3.43Å; Q173-V176 VanDerWaalsContact O-N 3.13Å; V176-Q178 VanDerWaalsContact C-N 3.33Å; V176-Q178 PolarHBondContact O-N 3.4Å; V176-I179 PolarHBondContact O-N 2.95Å; V176-T180 WeakPolarHBondContact O-CB 3.23Å; V176-T180 PolarHBondContact O-N 3.17Å; V176-T180 PolarHBondContact O-OG1 2.87Å |
| 177 | D | 91.2 | Very high | 89.2 | Confident | 90 Ų | 90 | 98 Ų | 98 | 48% | 0.481 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.3 | -42.4 | 178.5 | -65.3 | -14.2 | 0 | 0 | 0 | 110.4 | Q173 A174 I179 T180 E181 | Q173-D177 PolarHBondContact NE2-OD1 3.33Å; Q173-D177 VanDerWaalsContact O-CG 3.27Å; Q173-D177 PolarHBondContact O-N 3.37Å; A174-D177 PolarHBondContact O-N 2.92Å; D177-I179 PolarHBondContact O-N 3.32Å; D177-T180 WeakPolarHBondContact O-CB 3.49Å; D177-T180 PolarHBondContact O-N 2.92Å; D177-E181 PolarHBondContact O-N 2.96Å |
| 178 | Q | 95.7 | Very high | 90.1 | Very high | 107 Ų | 107 | 100.8 Ų | 100.8 | 50% | 0.5 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 175.2 | -174 | 179.3 | 14.9 | 0 | 0 | 112.6 | A174 H175 V176 T180 E181 M182 | A174-Q178 WeakPolarHBondContact O-CB 3.34Å; A174-Q178 PolarHBondContact O-N 3.41Å; H175-Q178 PolarHBondContact O-N 2.94Å; V176-Q178 VanDerWaalsContact C-N 3.33Å; V176-Q178 PolarHBondContact O-N 3.4Å; Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 PolarHBondContact O-N 2.91Å; Q178-E181 PolarHBondContact O-N 3.15Å; Q178-M182 WeakPolarHBondContact O-CB 3.44Å; Q178-M182 PolarHBondContact O-N 3.26Å |
| 179 | I | 93 | Very high | 90.6 | Very high | 108 Ų | 108 | 98 Ų | 98 | 55% | 0.554 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.8 | -39.4 | 176 | -70.7 | 166.5 | 0 | 0 | 0 | 110.3 | H175 V176 D177 E181 M182 A183 | H175-I179 VanDerWaalsContact O-CG1 3.26Å; H175-I179 WeakPolarHBondContact O-CG1 3.43Å; H175-I179 PolarHBondContact O-N 3.23Å; V176-I179 PolarHBondContact O-N 2.95Å; D177-I179 PolarHBondContact O-N 3.32Å; I179-E181 VanDerWaalsContact C-N 3.35Å; I179-M182 PolarHBondContact O-N 3Å; I179-A183 WeakPolarHBondContact O-CB 3.44Å; I179-A183 PolarHBondContact O-N 3.34Å |
| 180 | T | 90.9 | Very high | 90.9 | Very high | 81 Ų | 81 | 94.7 Ų | 94.7 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 178.4 | -54.8 | 0 | 0 | 0 | 0 | 111 | V176 D177 Q178 A183 A184 | V176-T180 WeakPolarHBondContact O-CB 3.23Å; V176-T180 PolarHBondContact O-N 3.17Å; V176-T180 PolarHBondContact O-OG1 2.87Å; D177-T180 WeakPolarHBondContact O-CB 3.49Å; D177-T180 PolarHBondContact O-N 2.92Å; Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 PolarHBondContact O-N 2.91Å; T180-A183 PolarHBondContact O-N 3.44Å; T180-A184 PolarHBondContact O-N 3.38Å |
| 181 | E | 92.4 | Very high | 91.1 | Very high | 133 Ų | 133 | 93.3 Ų | 93.3 | 62% | 0.621 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.9 | -47.2 | 173.5 | -168.3 | 179.8 | -173.3 | 0 | 0 | 111.4 | D177 Q178 I179 A183 A184 V185 | D177-E181 PolarHBondContact O-N 2.96Å; Q178-E181 PolarHBondContact O-N 3.15Å; I179-E181 VanDerWaalsContact C-N 3.35Å; E181-A183 VanDerWaalsContact C-N 3.29Å; E181-A183 PolarHBondContact O-N 3.47Å; E181-A184 WeakPolarHBondContact O-CB 3.45Å; E181-A184 PolarHBondContact O-N 3.39Å; E181-V185 WeakPolarHBondContact O-CG2 3.48Å; E181-V185 PolarHBondContact O-N 3.48Å |
| 182 | M | 94.5 | Very high | 91.2 | Very high | 124 Ų | 124 | 91.7 Ų | 91.7 | 61% | 0.611 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -57.2 | -42 | 174.6 | -109 | 169 | 54.4 | 0 | 0 | 111.9 | Q178 I179 A184 V185 M186 | Q178-M182 WeakPolarHBondContact O-CB 3.44Å; Q178-M182 PolarHBondContact O-N 3.26Å; I179-M182 PolarHBondContact O-N 3Å; M182-A184 VanDerWaalsContact C-N 3.33Å; M182-A184 PolarHBondContact O-N 3.25Å; M182-V185 PolarHBondContact O-N 3.42Å; M182-M186 VanDerWaalsContact O-CB 3.27Å; M182-M186 WeakPolarHBondContact O-CB 3.3Å; M182-M186 PolarHBondContact O-N 2.95Å |
| 183 | A | 89.3 | Confident | 91 | Very high | 35 Ų | 35 | 90.6 Ų | 90.6 | 29% | 0.289 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65 | -37.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | I179 T180 E181 R187 | I179-A183 WeakPolarHBondContact O-CB 3.44Å; I179-A183 PolarHBondContact O-N 3.34Å; T180-A183 PolarHBondContact O-N 3.44Å; E181-A183 VanDerWaalsContact C-N 3.29Å; E181-A183 PolarHBondContact O-N 3.47Å; A183-R187 WeakPolarHBondContact O-CG 3.48Å; A183-R187 PolarHBondContact O-N 2.98Å |
| 184 | A | 91.7 | Very high | 90.7 | Very high | 47 Ų | 47 | 89.7 Ų | 89.7 | 39% | 0.388 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -67.2 | -45 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | T180 E181 M182 R187 K188 | T180-A184 PolarHBondContact O-N 3.38Å; E181-A184 WeakPolarHBondContact O-CB 3.45Å; E181-A184 PolarHBondContact O-N 3.39Å; M182-A184 VanDerWaalsContact C-N 3.33Å; M182-A184 PolarHBondContact O-N 3.25Å; A184-R187 PolarHBondContact O-N 3.4Å; A184-K188 PolarHBondContact O-N 3.12Å; A184-K188 VanDerWaalsContact O-N 3.08Å |
| 185 | V | 95.2 | Very high | 90.4 | Very high | 94 Ų | 94 | 91.9 Ų | 91.9 | 57% | 0.57 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.5 | -45.4 | 175.5 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | E181 M182 R187 K188 A189 | E181-V185 WeakPolarHBondContact O-CG2 3.48Å; E181-V185 PolarHBondContact O-N 3.48Å; M182-V185 PolarHBondContact O-N 3.42Å; V185-R187 PolarHBondContact O-N 3.26Å; V185-K188 PolarHBondContact O-N 2.86Å; V185-K188 VanDerWaalsContact O-N 3.16Å; V185-A189 PolarHBondContact O-N 3.39Å |
| 186 | M | 94.4 | Very high | 90.2 | Very high | 115 Ų | 115 | 91.2 Ų | 91.2 | 57% | 0.567 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.4 | -40.6 | -179.3 | -166.8 | 172.3 | 179.6 | 0 | 0 | 112 | M182 K188 A189 I190 | M182-M186 VanDerWaalsContact O-CB 3.27Å; M182-M186 WeakPolarHBondContact O-CB 3.3Å; M182-M186 PolarHBondContact O-N 2.95Å; M186-K188 VanDerWaalsContact C-N 3.34Å; M186-K188 PolarHBondContact O-N 3.18Å; M186-A189 PolarHBondContact O-N 3.3Å; M186-I190 HydrophobicContact CG-CD1 4.36Å; M186-I190 VanDerWaalsContact O-CG1 3.28Å; M186-I190 WeakPolarHBondContact O-CG1 3.45Å; M186-I190 PolarHBondContact O-N 2.93Å |
| 187 | R | 91.1 | Very high | 89.6 | Confident | 157 Ų | 157 | 89.6 Ų | 89.6 | 59% | 0.592 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -60.6 | -42.8 | 172.4 | -78.9 | -171.7 | -65.7 | -91.3 | -0.3 | 111.9 | A183 A184 V185 I190 E191 | A183-R187 WeakPolarHBondContact O-CG 3.48Å; A183-R187 PolarHBondContact O-N 2.98Å; A184-R187 PolarHBondContact O-N 3.4Å; V185-R187 PolarHBondContact O-N 3.26Å; R187-I190 PolarHBondContact O-N 3.42Å; R187-E191 PolarHBondContact O-N 2.77Å; R187-E191 VanDerWaalsContact O-N 3.09Å |
| 188 | K | 93.6 | Very high | 89.3 | Confident | 108 Ų | 108 | 89 Ų | 89 | 47% | 0.47 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68 | -38.4 | -179.7 | -170.5 | 59.5 | -178.4 | 175.6 | 0 | 112.3 | A184 V185 M186 E191 I192 | A184-K188 PolarHBondContact O-N 3.12Å; A184-K188 VanDerWaalsContact O-N 3.08Å; V185-K188 PolarHBondContact O-N 2.86Å; V185-K188 VanDerWaalsContact O-N 3.16Å; M186-K188 VanDerWaalsContact C-N 3.34Å; M186-K188 PolarHBondContact O-N 3.18Å; K188-E191 WeakPolarHBondContact CD-OE2 3.23Å; K188-E191 IonicContact NZ-OE1 3.91Å; K188-E191 IonicContact NZ-OE2 2.71Å; K188-E191 PolarHBondContact NZ-OE2 2.95Å; K188-E191 PolarHBondContact O-N 2.96Å; K188-I192 HydrophobicContact CG-CD1 4.11Å; K188-I192 WeakPolarHBondContact O-CG1 3.49Å; K188-I192 PolarHBondContact O-N 3.37Å; K188-I192 VanDerWaalsContact O-N 3.08Å |
| 189 | A | 88 | Confident | 89 | Confident | 44 Ų | 44 | 89.6 Ų | 89.6 | 36% | 0.364 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | V185 M186 E191 I192 D193 | V185-A189 PolarHBondContact O-N 3.39Å; M186-A189 PolarHBondContact O-N 3.3Å; A189-E191 PolarHBondContact O-N 2.84Å; A189-I192 PolarHBondContact O-N 3Å; A189-D193 WeakPolarHBondContact O-CB 3.33Å; A189-D193 PolarHBondContact O-N 2.91Å |
| 190 | I | 86.2 | Confident | 88.8 | Confident | 67 Ų | 67 | 89.9 Ų | 89.9 | 34% | 0.344 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.3 | -46.2 | 176.2 | -67.5 | 164.3 | 0 | 0 | 0 | 111.1 | M186 R187 I192 D193 E194 | M186-I190 HydrophobicContact CG-CD1 4.36Å; M186-I190 VanDerWaalsContact O-CG1 3.28Å; M186-I190 WeakPolarHBondContact O-CG1 3.45Å; M186-I190 PolarHBondContact O-N 2.93Å; R187-I190 PolarHBondContact O-N 3.42Å; I190-I192 VanDerWaalsContact C-N 3.33Å; I190-I192 PolarHBondContact O-N 3.01Å; I190-D193 PolarHBondContact O-N 3.38Å; I190-E194 HydrophobicContact CG2-CG 4.47Å; I190-E194 WeakPolarHBondContact O-CG 3.41Å; I190-E194 PolarHBondContact O-N 2.99Å |
| 191 | E | 88.5 | Confident | 88.7 | Confident | 85 Ų | 85 | 91.7 Ų | 91.7 | 40% | 0.397 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.3 | -42.3 | 178.7 | -171 | -167.6 | -177.4 | 0 | 0 | 112 | R187 K188 A189 E194 Q195 | R187-E191 PolarHBondContact O-N 2.77Å; R187-E191 VanDerWaalsContact O-N 3.09Å; K188-E191 WeakPolarHBondContact CD-OE2 3.23Å; K188-E191 IonicContact NZ-OE1 3.91Å; K188-E191 IonicContact NZ-OE2 2.71Å; K188-E191 PolarHBondContact NZ-OE2 2.95Å; K188-E191 PolarHBondContact O-N 2.96Å; A189-E191 PolarHBondContact O-N 2.84Å; E191-E194 PolarHBondContact O-N 2.86Å; E191-Q195 WeakPolarHBondContact O-CG 3.48Å; E191-Q195 PolarHBondContact O-N 3.31Å; E191-Q195 VanDerWaalsContact O-N 3.11Å |
| 192 | I | 88.9 | Confident | 88.6 | Confident | 89 Ų | 89 | 91.2 Ų | 91.2 | 46% | 0.456 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.2 | -43.9 | 178 | -68.4 | 169.2 | 0 | 0 | 0 | 110.6 | K188 A189 I190 E194 Q195 Q196 | K188-I192 HydrophobicContact CG-CD1 4.11Å; K188-I192 WeakPolarHBondContact O-CG1 3.49Å; K188-I192 PolarHBondContact O-N 3.37Å; K188-I192 VanDerWaalsContact O-N 3.08Å; A189-I192 PolarHBondContact O-N 3Å; I190-I192 VanDerWaalsContact C-N 3.33Å; I190-I192 PolarHBondContact O-N 3.01Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.38Å; I192-Q195 PolarHBondContact O-N 3.48Å; I192-Q196 WeakPolarHBondContact O-CB 3.32Å; I192-Q196 PolarHBondContact O-N 3.34Å |
| 193 | D | 84.4 | Confident | 88.6 | Confident | 91 Ų | 91 | 91.9 Ų | 91.9 | 49% | 0.487 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.1 | -41.3 | 176.9 | -88 | 6.6 | 0 | 0 | 0 | 112.1 | A189 I190 Q196 G197 | A189-D193 WeakPolarHBondContact O-CB 3.33Å; A189-D193 PolarHBondContact O-N 2.91Å; I190-D193 PolarHBondContact O-N 3.38Å; D193-Q196 PolarHBondContact O-N 3.03Å; D193-G197 PolarHBondContact O-N 3.47Å |
| 194 | E | 83.5 | Confident | 88.9 | Confident | 81 Ų | 81 | 94 Ų | 94 | 38% | 0.379 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.4 | -45.5 | 176.1 | -74.6 | -166.9 | 134 | 0 | 0 | 111.5 | R58 I190 E191 I192 Q196 G197 C198 | R58-E194 IonicContact CZ-OE1 2.84Å; R58-E194 IonicContact NE-OE1 2.84Å; R58-E194 PolarHBondContact NE-OE1 3.4Å; R58-E194 IonicContact NH2-OE1 3.39Å; R58-E194 PolarHBondContact NH2-OE1 2.81Å; I190-E194 HydrophobicContact CG2-CG 4.47Å; I190-E194 WeakPolarHBondContact O-CG 3.41Å; I190-E194 PolarHBondContact O-N 2.99Å; E191-E194 PolarHBondContact O-N 2.86Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.38Å; E194-Q196 VanDerWaalsContact C-N 3.31Å; E194-Q196 PolarHBondContact O-N 3.12Å; E194-G197 PolarHBondContact O-N 3.16Å; E194-C198 PolarHBondContact O-N 2.94Å; E194-C198 PolarHBondContact O-SG 3.45Å; E194-C198 VanDerWaalsContact O-SG 3.4Å |
| 195 | Q | 83.5 | Confident | 89.1 | Confident | 102 Ų | 102 | 98 Ų | 98 | 48% | 0.477 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63 | -39.3 | 177.2 | -71.8 | -179.8 | 12.3 | 0 | 0 | 112.1 | E191 I192 K199 | E191-Q195 WeakPolarHBondContact O-CG 3.48Å; E191-Q195 PolarHBondContact O-N 3.31Å; E191-Q195 VanDerWaalsContact O-N 3.11Å; I192-Q195 PolarHBondContact O-N 3.48Å; Q195-K199 WeakPolarHBondContact O-CG 3.18Å; Q195-K199 PolarHBondContact O-N 3.44Å |
| 196 | Q | 85.3 | Confident | 89.1 | Confident | 92 Ų | 92 | 98.5 Ų | 98.5 | 43% | 0.43 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.2 | -42.8 | 178.1 | -162.2 | 69.5 | -2.2 | 0 | 0 | 111.2 | I192 D193 E194 C198 K199 E200 | I192-Q196 WeakPolarHBondContact O-CB 3.32Å; I192-Q196 PolarHBondContact O-N 3.34Å; D193-Q196 PolarHBondContact O-N 3.03Å; E194-Q196 VanDerWaalsContact C-N 3.31Å; E194-Q196 PolarHBondContact O-N 3.12Å; Q196-C198 VanDerWaalsContact C-N 3.33Å; Q196-C198 PolarHBondContact O-N 3.23Å; Q196-K199 PolarHBondContact O-N 3.4Å; Q196-K199 VanDerWaalsContact O-N 3.15Å; Q196-E200 WeakPolarHBondContact O-CG 3.34Å; Q196-E200 PolarHBondContact O-N 3.22Å |
| 197 | G | 79.7 | Confident | 89.2 | Confident | 32 Ų | 32 | 96.1 Ų | 96.1 | 33% | 0.33 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.4 | -38.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | D193 E194 E200 Q201 | D193-G197 PolarHBondContact O-N 3.47Å; E194-G197 PolarHBondContact O-N 3.16Å; G197-E200 PolarHBondContact O-N 3.24Å; G197-Q201 WeakPolarHBondContact O-CB 3.34Å; G197-Q201 PolarHBondContact O-N 2.95Å |
| 198 | C | 85.1 | Confident | 89.4 | Confident | 77 Ų | 77 | 94.2 Ų | 94.2 | 52% | 0.52 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 172.7 | -74.4 | 0 | 0 | 0 | 0 | 112.3 | E194 Q196 Q201 E202 | E194-C198 PolarHBondContact O-N 2.94Å; E194-C198 PolarHBondContact O-SG 3.45Å; E194-C198 VanDerWaalsContact O-SG 3.4Å; Q196-C198 VanDerWaalsContact C-N 3.33Å; Q196-C198 PolarHBondContact O-N 3.23Å; C198-Q201 PolarHBondContact O-N 3.32Å; C198-E202 WeakPolarHBondContact O-CG 3.4Å; C198-E202 PolarHBondContact O-N 2.95Å |
| 199 | K | 90 | Very high | 89.5 | Confident | 119 Ų | 119 | 94 Ų | 94 | 52% | 0.517 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 178.8 | -68.5 | 171.9 | -172.9 | 169 | 0 | 112.4 | Q195 Q196 E202 R203 | Q195-K199 WeakPolarHBondContact O-CG 3.18Å; Q195-K199 PolarHBondContact O-N 3.44Å; Q196-K199 PolarHBondContact O-N 3.4Å; Q196-K199 VanDerWaalsContact O-N 3.15Å; K199-E202 PolarHBondContact O-N 2.93Å; K199-R203 WeakPolarHBondContact O-CB 3.29Å; K199-R203 PolarHBondContact O-N 2.92Å |
| 200 | E | 88.1 | Confident | 89.9 | Confident | 114 Ų | 114 | 97.2 Ų | 97.2 | 53% | 0.533 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.5 | -43.4 | 176 | -74.3 | 176.5 | -176.4 | 0 | 0 | 111.2 | Q196 G197 E202 R203 I204 | Q196-E200 WeakPolarHBondContact O-CG 3.34Å; Q196-E200 PolarHBondContact O-N 3.22Å; G197-E200 PolarHBondContact O-N 3.24Å; E200-E202 PolarHBondContact O-N 3.27Å; E200-R203 PolarHBondContact O-N 3.33Å; E200-I204 WeakPolarHBondContact O-CG1 3.42Å; E200-I204 PolarHBondContact O-N 3.42Å |
| 201 | Q | 89.7 | Confident | 90.3 | Very high | 119 Ų | 119 | 97.9 Ų | 97.9 | 56% | 0.556 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.8 | -42.5 | 176.8 | -170.2 | 61.9 | 37.1 | 0 | 0 | 112.1 | G197 C198 R203 I204 F205 | G197-Q201 WeakPolarHBondContact O-CB 3.34Å; G197-Q201 PolarHBondContact O-N 2.95Å; C198-Q201 PolarHBondContact O-N 3.32Å; Q201-R203 VanDerWaalsContact C-N 3.31Å; Q201-R203 PolarHBondContact O-N 2.9Å; Q201-I204 PolarHBondContact O-N 3.49Å; Q201-F205 WeakPolarHBondContact O-CB 3.47Å; Q201-F205 PolarHBondContact O-N 3.29Å |
| 202 | E | 90.8 | Very high | 90.7 | Very high | 124 Ų | 124 | 99.3 Ų | 99.3 | 58% | 0.579 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.9 | -41.5 | 173.4 | -75.8 | 178.5 | -177.1 | 0 | 0 | 111.7 | C198 K199 E200 F205 Q206 | C198-E202 WeakPolarHBondContact O-CG 3.4Å; C198-E202 PolarHBondContact O-N 2.95Å; K199-E202 PolarHBondContact O-N 2.93Å; E200-E202 PolarHBondContact O-N 3.27Å; E202-F205 PolarHBondContact O-N 3.05Å; E202-Q206 WeakPolarHBondContact O-CG 3.49Å; E202-Q206 PolarHBondContact O-N 3.45Å |
| 203 | R | 94.8 | Very high | 91 | Very high | 138 Ų | 138 | 96.1 Ų | 96.1 | 52% | 0.521 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.1 | -41.4 | 178.1 | -175.9 | 58 | 176.4 | 178.6 | 3.4 | 112.1 | K199 E200 Q201 Q206 L207 | K199-R203 WeakPolarHBondContact O-CB 3.29Å; K199-R203 PolarHBondContact O-N 2.92Å; E200-R203 PolarHBondContact O-N 3.33Å; Q201-R203 VanDerWaalsContact C-N 3.31Å; Q201-R203 PolarHBondContact O-N 2.9Å; R203-Q206 PolarHBondContact O-N 2.84Å; R203-L207 HydrophobicContact CG-CD1 4.24Å; R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.87Å |
| 204 | I | 95.4 | Very high | 91.7 | Very high | 78 Ų | 78 | 96.1 Ų | 96.1 | 40% | 0.4 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.7 | -48.1 | 174.9 | -70.7 | 167.7 | 0 | 0 | 0 | 109.7 | E200 Q201 Q206 L207 E208 | E200-I204 WeakPolarHBondContact O-CG1 3.42Å; E200-I204 PolarHBondContact O-N 3.42Å; Q201-I204 PolarHBondContact O-N 3.49Å; I204-Q206 VanDerWaalsContact C-N 3.31Å; I204-Q206 PolarHBondContact O-N 3.48Å; I204-L207 CarbonylContact O-C 3.58Å; I204-L207 PolarHBondContact O-N 3.3Å; I204-L207 VanDerWaalsContact O-N 3.12Å; I204-E208 HydrophobicContact CG2-CG 4.24Å; I204-E208 WeakPolarHBondContact O-CG 3.48Å; I204-E208 PolarHBondContact O-N 2.85Å |
| 205 | F | 94.2 | Very high | 92.2 | Very high | 133 Ų | 133 | 101 Ų | 101 | 58% | 0.583 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.7 | -42.2 | 178.8 | -176.2 | -97.4 | 0 | 0 | 0 | 112.4 | Q201 E202 E208 Q209 | Q201-F205 WeakPolarHBondContact O-CB 3.47Å; Q201-F205 PolarHBondContact O-N 3.29Å; E202-F205 PolarHBondContact O-N 3.05Å; F205-E208 PolarHBondContact O-N 3.33Å; F205-Q209 PolarHBondContact O-N 3.01Å |
| 206 | Q | 95.6 | Very high | 92.8 | Very high | 104 Ų | 104 | 100.9 Ų | 100.9 | 49% | 0.486 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.1 | -46.8 | 174.1 | -72.2 | 171.8 | 16.7 | 0 | 0 | 112 | E202 R203 I204 E208 Q209 E210 | E202-Q206 WeakPolarHBondContact O-CG 3.49Å; E202-Q206 PolarHBondContact O-N 3.45Å; R203-Q206 PolarHBondContact O-N 2.84Å; I204-Q206 VanDerWaalsContact C-N 3.31Å; I204-Q206 PolarHBondContact O-N 3.48Å; Q206-E208 VanDerWaalsContact C-N 3.34Å; Q206-E208 PolarHBondContact O-N 3.49Å; Q206-Q209 PolarHBondContact O-N 3.1Å; Q206-E210 WeakPolarHBondContact O-CB 3.23Å; Q206-E210 PolarHBondContact O-N 2.98Å |
| 207 | L | 96.7 | Very high | 93.3 | Very high | 65 Ų | 65 | 101.4 Ų | 101.4 | 34% | 0.34 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.4 | -36.2 | 178.7 | -72.3 | 171.4 | 0 | 0 | 0 | 112.1 | R203 I204 E210 N211 | R203-L207 HydrophobicContact CG-CD1 4.24Å; R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.87Å; I204-L207 CarbonylContact O-C 3.58Å; I204-L207 PolarHBondContact O-N 3.3Å; I204-L207 VanDerWaalsContact O-N 3.12Å; L207-E210 PolarHBondContact O-N 3.29Å; L207-N211 VanDerWaalsContact O-CB 3.23Å; L207-N211 WeakPolarHBondContact O-CB 3.34Å; L207-N211 PolarHBondContact O-N 3.4Å; L207-N211 PolarHBondContact O-ND2 3.27Å |
| 208 | E | 95.5 | Very high | 94 | Very high | 116 Ų | 116 | 105.8 Ų | 105.8 | 54% | 0.542 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 174.5 | -75.5 | -178.8 | 160.5 | 0 | 0 | 111.2 | I204 F205 Q206 N211 K212 | I204-E208 HydrophobicContact CG2-CG 4.24Å; I204-E208 WeakPolarHBondContact O-CG 3.48Å; I204-E208 PolarHBondContact O-N 2.85Å; F205-E208 PolarHBondContact O-N 3.33Å; Q206-E208 VanDerWaalsContact C-N 3.34Å; Q206-E208 PolarHBondContact O-N 3.49Å; E208-N211 PolarHBondContact O-N 3.09Å; E208-K212 VanDerWaalsContact O-CB 3.29Å; E208-K212 WeakPolarHBondContact O-CB 3.25Å; E208-K212 PolarHBondContact O-N 2.93Å |
| 209 | Q | 95.3 | Very high | 94.4 | Very high | 103 Ų | 103 | 107.5 Ų | 107.5 | 48% | 0.481 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.5 | -40.6 | 177.2 | -175.5 | 56.2 | 85.6 | 0 | 0 | 112 | F205 Q206 K212 G213 | F205-Q209 PolarHBondContact O-N 3.01Å; Q206-Q209 PolarHBondContact O-N 3.1Å; Q209-K212 PolarHBondContact O-N 3.42Å; Q209-G213 PolarHBondContact O-N 3.01Å |
| 210 | E | 96.1 | Very high | 94.5 | Very high | 113 Ų | 113 | 106.6 Ų | 106.6 | 53% | 0.528 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -49.9 | 174.3 | -174.7 | -177.7 | 170.4 | 0 | 0 | 111 | Q206 L207 K212 G213 L214 | Q206-E210 WeakPolarHBondContact O-CB 3.23Å; Q206-E210 PolarHBondContact O-N 2.98Å; L207-E210 PolarHBondContact O-N 3.29Å; E210-K212 VanDerWaalsContact C-N 3.25Å; E210-K212 PolarHBondContact O-N 2.83Å; E210-G213 CarbonylContact O-C 3.6Å; E210-G213 WeakPolarHBondContact O-CA 3.29Å; E210-G213 PolarHBondContact O-N 3.48Å; E210-L214 HydrophobicContact CG-CD1 4.21Å; E210-L214 HydrophobicContact CG-CG 4.44Å; E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.03Å |
| 211 | N | 95.6 | Very high | 94.7 | Very high | 81 Ų | 81 | 105.1 Ų | 105.1 | 43% | 0.433 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.8 | -35.8 | 177.8 | -82 | -57.7 | 0 | 0 | 0 | 112.3 | L207 E208 R215 | L207-N211 VanDerWaalsContact O-CB 3.23Å; L207-N211 WeakPolarHBondContact O-CB 3.34Å; L207-N211 PolarHBondContact O-N 3.4Å; L207-N211 PolarHBondContact O-ND2 3.27Å; E208-N211 PolarHBondContact O-N 3.09Å; N211-R215 WeakPolarHBondContact O-CB 3.32Å; N211-R215 VanDerWaalsContact O-CG 3.25Å; N211-R215 WeakPolarHBondContact O-CG 3.48Å; N211-R215 PolarHBondContact O-N 2.99Å |
| 212 | K | 97.2 | Very high | 94.7 | Very high | 115 Ų | 115 | 108.3 Ų | 108.3 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.5 | -48.8 | 172.3 | -174.9 | -177.8 | 175.2 | -171.9 | 0 | 110.8 | E208 Q209 E210 L214 R215 E216 | E208-K212 VanDerWaalsContact O-CB 3.29Å; E208-K212 WeakPolarHBondContact O-CB 3.25Å; E208-K212 PolarHBondContact O-N 2.93Å; Q209-K212 PolarHBondContact O-N 3.42Å; E210-K212 VanDerWaalsContact C-N 3.25Å; E210-K212 PolarHBondContact O-N 2.83Å; K212-L214 PolarHBondContact O-N 3.21Å; K212-R215 WeakPolarHBondContact O-CB 3.4Å; K212-R215 PolarHBondContact O-N 3.47Å; K212-E216 WeakPolarHBondContact CE-OE1 3.49Å; K212-E216 WeakPolarHBondContact O-CG 3.36Å; K212-E216 PolarHBondContact O-N 3.4Å |
| 213 | G | 95.7 | Very high | 94.6 | Very high | 21 Ų | 21 | 106.9 Ų | 106.9 | 22% | 0.216 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.2 | -42.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q209 E210 R215 E216 I217 | Q209-G213 PolarHBondContact O-N 3.01Å; E210-G213 CarbonylContact O-C 3.6Å; E210-G213 WeakPolarHBondContact O-CA 3.29Å; E210-G213 PolarHBondContact O-N 3.48Å; G213-R215 VanDerWaalsContact C-N 3.31Å; G213-R215 PolarHBondContact O-N 2.95Å; G213-E216 PolarHBondContact O-N 3.24Å; G213-I217 WeakPolarHBondContact O-CG1 3.45Å; G213-I217 PolarHBondContact O-N 3.05Å |
| 214 | L | 97.3 | Very high | 94.2 | Very high | 91 Ų | 91 | 103 Ų | 103 | 48% | 0.476 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.8 | -38.3 | 175.7 | -69.3 | 174.7 | 0 | 0 | 0 | 112.1 | E210 K212 I217 L218 | E210-L214 HydrophobicContact CG-CD1 4.21Å; E210-L214 HydrophobicContact CG-CG 4.44Å; E210-L214 WeakPolarHBondContact O-CG 3.49Å; E210-L214 PolarHBondContact O-N 3.03Å; K212-L214 PolarHBondContact O-N 3.21Å; L214-I217 PolarHBondContact O-N 2.95Å; L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 PolarHBondContact O-N 3.49Å |
| 215 | R | 95.6 | Very high | 93.6 | Very high | 185 Ų | 185 | 105.3 Ų | 105.3 | 70% | 0.698 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.5 | -41 | 175.1 | -74 | 172.9 | -173.3 | -83.1 | 0.2 | 112.2 | N211 K212 G213 L218 Q219 | N211-R215 WeakPolarHBondContact O-CB 3.32Å; N211-R215 VanDerWaalsContact O-CG 3.25Å; N211-R215 WeakPolarHBondContact O-CG 3.48Å; N211-R215 PolarHBondContact O-N 2.99Å; K212-R215 WeakPolarHBondContact O-CB 3.4Å; K212-R215 PolarHBondContact O-N 3.47Å; G213-R215 VanDerWaalsContact C-N 3.31Å; G213-R215 PolarHBondContact O-N 2.95Å; R215-L218 PolarHBondContact O-N 2.93Å; R215-Q219 WeakPolarHBondContact O-CB 3.37Å; R215-Q219 PolarHBondContact O-N 3.38Å |
| 216 | E | 95.6 | Very high | 92.9 | Very high | 98 Ų | 98 | 103.4 Ų | 103.4 | 46% | 0.458 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 175.1 | -70.7 | 170.3 | -168.7 | 0 | 0 | 111 | K212 G213 L218 Q219 I220 | K212-E216 WeakPolarHBondContact CE-OE1 3.49Å; K212-E216 WeakPolarHBondContact O-CG 3.36Å; K212-E216 PolarHBondContact O-N 3.4Å; G213-E216 PolarHBondContact O-N 3.24Å; E216-L218 VanDerWaalsContact C-N 3.35Å; E216-L218 PolarHBondContact O-N 3.45Å; E216-Q219 WeakPolarHBondContact O-CB 3.45Å; E216-Q219 PolarHBondContact O-N 2.85Å; E216-I220 WeakPolarHBondContact O-CG1 3.5Å; E216-I220 PolarHBondContact O-N 2.79Å |
| 217 | I | 95.6 | Very high | 92.1 | Very high | 103 Ų | 103 | 102.8 Ų | 102.8 | 53% | 0.528 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -44 | 176 | -67.6 | 167.3 | 0 | 0 | 0 | 111.3 | G213 L214 Q219 I220 T221 | G213-I217 WeakPolarHBondContact O-CG1 3.45Å; G213-I217 PolarHBondContact O-N 3.05Å; L214-I217 PolarHBondContact O-N 2.95Å; I217-Q219 VanDerWaalsContact C-N 3.3Å; I217-Q219 PolarHBondContact O-N 3.44Å; I217-I220 PolarHBondContact O-N 2.9Å; I217-T221 WeakPolarHBondContact O-CB 3.32Å; I217-T221 PolarHBondContact O-N 3.35Å; I217-T221 PolarHBondContact O-OG1 3.15Å |
| 218 | L | 93.2 | Very high | 91 | Very high | 124 Ų | 124 | 104.9 Ų | 104.9 | 65% | 0.649 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.4 | -40.4 | 177.9 | -171.1 | 74.1 | 0 | 0 | 0 | 111.2 | L214 R215 E216 T221 R222 | L214-L218 WeakPolarHBondContact O-CB 3.43Å; L214-L218 PolarHBondContact O-N 3.49Å; R215-L218 PolarHBondContact O-N 2.93Å; E216-L218 VanDerWaalsContact C-N 3.35Å; E216-L218 PolarHBondContact O-N 3.45Å; L218-T221 PolarHBondContact O-N 2.93Å; L218-R222 WeakPolarHBondContact O-CB 3.4Å; L218-R222 PolarHBondContact O-N 3.42Å |
| 219 | Q | 94.1 | Very high | 89.7 | Confident | 113 Ų | 113 | 107 Ų | 107 | 53% | 0.528 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.6 | -48.2 | 176 | -179.9 | 173.4 | -14.6 | 0 | 0 | 111.3 | R215 E216 I217 T221 R222 E223 | R215-Q219 WeakPolarHBondContact O-CB 3.37Å; R215-Q219 PolarHBondContact O-N 3.38Å; E216-Q219 WeakPolarHBondContact O-CB 3.45Å; E216-Q219 PolarHBondContact O-N 2.85Å; I217-Q219 VanDerWaalsContact C-N 3.3Å; I217-Q219 PolarHBondContact O-N 3.44Å; Q219-T221 VanDerWaalsContact C-N 3.29Å; Q219-T221 PolarHBondContact O-N 2.95Å; Q219-R222 PolarHBondContact O-N 2.86Å; Q219-R222 VanDerWaalsContact O-N 3.15Å; Q219-E223 HydrophobicContact CG-CG 4.42Å; Q219-E223 WeakPolarHBondContact CG-OE1 3.32Å; Q219-E223 PolarHBondContact NE2-OE1 3.21Å; Q219-E223 WeakPolarHBondContact O-CG 3.35Å; Q219-E223 PolarHBondContact O-N 3.42Å |
| 220 | I | 93.1 | Very high | 88.2 | Confident | 100 Ų | 100 | 108.9 Ų | 108.9 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.1 | -43.8 | 176.5 | -67 | 164.8 | 0 | 0 | 0 | 110.7 | E216 I217 R222 E223 S224 | E216-I220 WeakPolarHBondContact O-CG1 3.5Å; E216-I220 PolarHBondContact O-N 2.79Å; I217-I220 PolarHBondContact O-N 2.9Å; I220-R222 VanDerWaalsContact C-N 3.33Å; I220-R222 PolarHBondContact O-N 3.38Å; I220-E223 PolarHBondContact O-N 3Å; I220-S224 VanDerWaalsContact O-CB 3.32Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 2.85Å; I220-S224 PolarHBondContact O-OG 3.18Å |
| 221 | T | 91.7 | Very high | 86.3 | Confident | 83 Ų | 83 | 108.7 Ų | 108.7 | 51% | 0.509 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.6 | -40.7 | 178.9 | -54.7 | 0 | 0 | 0 | 0 | 111.2 | I217 L218 Q219 F225 | I217-T221 WeakPolarHBondContact O-CB 3.32Å; I217-T221 PolarHBondContact O-N 3.35Å; I217-T221 PolarHBondContact O-OG1 3.15Å; L218-T221 PolarHBondContact O-N 2.93Å; Q219-T221 VanDerWaalsContact C-N 3.29Å; Q219-T221 PolarHBondContact O-N 2.95Å; T221-F225 WeakPolarHBondContact O-CB 3.39Å; T221-F225 PolarHBondContact O-N 3.46Å |
| 222 | R | 90.2 | Very high | 84.4 | Confident | 187 Ų | 187 | 109.4 Ų | 109.4 | 71% | 0.706 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.9 | -43.7 | 176.8 | -172.9 | 177.8 | -178.1 | 166.2 | 0.8 | 112.1 | L218 Q219 I220 F225 L226 | L218-R222 WeakPolarHBondContact O-CB 3.4Å; L218-R222 PolarHBondContact O-N 3.42Å; Q219-R222 PolarHBondContact O-N 2.86Å; Q219-R222 VanDerWaalsContact O-N 3.15Å; I220-R222 VanDerWaalsContact C-N 3.33Å; I220-R222 PolarHBondContact O-N 3.38Å; R222-F225 PolarHBondContact O-N 3.36Å; R222-L226 HydrophobicContact CG-CD1 4.4Å; R222-L226 WeakPolarHBondContact O-CG 3.32Å; R222-L226 PolarHBondContact O-N 3.02Å |
| 223 | E | 88.9 | Confident | 82.3 | Confident | 94 Ų | 94 | 106.1 Ų | 106.1 | 44% | 0.439 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 176.4 | -73.3 | 174.8 | -169.9 | 0 | 0 | 111.2 | Q219 I220 F225 L226 N227 | Q219-E223 HydrophobicContact CG-CG 4.42Å; Q219-E223 WeakPolarHBondContact CG-OE1 3.32Å; Q219-E223 PolarHBondContact NE2-OE1 3.21Å; Q219-E223 WeakPolarHBondContact O-CG 3.35Å; Q219-E223 PolarHBondContact O-N 3.42Å; I220-E223 PolarHBondContact O-N 3Å; E223-F225 PolarHBondContact O-N 2.92Å; E223-L226 PolarHBondContact O-N 3.48Å; E223-N227 WeakPolarHBondContact O-CB 3.46Å; E223-N227 PolarHBondContact O-N 3Å; E223-N227 PolarHBondContact O-ND2 2.73Å |
| 224 | S | 86.3 | Confident | 80.2 | Confident | 55 Ų | 55 | 109.1 Ų | 109.1 | 39% | 0.385 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -58.3 | -49.8 | 174.8 | -57.7 | 0 | 0 | 0 | 0 | 110.8 | I220 L226 N227 L228 | I220-S224 VanDerWaalsContact O-CB 3.32Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 2.85Å; I220-S224 PolarHBondContact O-OG 3.18Å; S224-L226 VanDerWaalsContact C-N 3.34Å; S224-L226 PolarHBondContact O-N 3.39Å; S224-N227 PolarHBondContact O-N 3.33Å; S224-L228 WeakPolarHBondContact O-CD1 3.14Å; S224-L228 PolarHBondContact O-N 3.08Å |
| 225 | F | 83.3 | Confident | 77.9 | Confident | 127 Ų | 127 | 111.7 Ų | 111.7 | 56% | 0.557 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.2 | -39 | 179.1 | -172.3 | -93.7 | 0 | 0 | 0 | 113.2 | T221 R222 E223 R229 | T221-F225 WeakPolarHBondContact O-CB 3.39Å; T221-F225 PolarHBondContact O-N 3.46Å; R222-F225 PolarHBondContact O-N 3.36Å; E223-F225 PolarHBondContact O-N 2.92Å; F225-R229 HydrophobicContact CD1-CG 4.34Å; F225-R229 HydrophobicContact CE1-CG 3.96Å; F225-R229 HydrophobicContact CZ-CG 4.42Å; F225-R229 PolarHBondContact O-N 3.12Å; F225-R229 VanDerWaalsContact O-N 3.08Å |
| 226 | L | 78.7 | Confident | 75.4 | Confident | 94 Ų | 94 | 105.9 Ų | 105.9 | 49% | 0.492 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.1 | -34.9 | 176 | -73.4 | 173.9 | 0 | 0 | 0 | 112.5 | R222 E223 S224 R229 K230 | R222-L226 HydrophobicContact CG-CD1 4.4Å; R222-L226 WeakPolarHBondContact O-CG 3.32Å; R222-L226 PolarHBondContact O-N 3.02Å; E223-L226 PolarHBondContact O-N 3.48Å; S224-L226 VanDerWaalsContact C-N 3.34Å; S224-L226 PolarHBondContact O-N 3.39Å; L226-R229 PolarHBondContact O-N 3.3Å; L226-K230 PolarHBondContact O-N 3.48Å; L226-K230 VanDerWaalsContact O-N 3.12Å |
| 227 | N | 78 | Confident | 73 | Confident | 90 Ų | 90 | 106.1 Ų | 106.1 | 48% | 0.481 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.6 | -45.3 | 175.5 | -69.5 | -18.9 | 0 | 0 | 0 | 110.9 | E223 S224 R229 K230 D231 | E223-N227 WeakPolarHBondContact O-CB 3.46Å; E223-N227 PolarHBondContact O-N 3Å; E223-N227 PolarHBondContact O-ND2 2.73Å; S224-N227 PolarHBondContact O-N 3.33Å; N227-R229 VanDerWaalsContact C-N 3.32Å; N227-R229 PolarHBondContact O-N 3.1Å; N227-K230 PolarHBondContact O-N 3.06Å; N227-D231 PolarHBondContact O-N 3.34Å; N227-D231 VanDerWaalsContact O-N 3.1Å |
| 228 | L | 74.5 | Confident | 70.8 | Confident | 109 Ų | 109 | 105.4 Ų | 105.4 | 57% | 0.571 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -57.7 | -42.3 | 173.4 | -84.9 | 111.1 | 0 | 0 | 0 | 112.4 | S224 K230 D231 D232 | S224-L228 WeakPolarHBondContact O-CD1 3.14Å; S224-L228 PolarHBondContact O-N 3.08Å; L228-K230 VanDerWaalsContact C-N 3.29Å; L228-K230 PolarHBondContact O-N 3.41Å; L228-D231 PolarHBondContact O-N 3.27Å; L228-D232 PolarHBondContact O-N 3.07Å |
| 229 | R | 68.2 | Low | 68.6 | Low | 162 Ų | 162 | 105 Ų | 105 | 61% | 0.611 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.2 | -29.8 | 176.2 | -85.2 | -83.6 | -172.7 | 158 | -1.5 | 113.7 | F225 L226 N227 A233 | F225-R229 HydrophobicContact CD1-CG 4.34Å; F225-R229 HydrophobicContact CE1-CG 3.96Å; F225-R229 HydrophobicContact CZ-CG 4.42Å; F225-R229 PolarHBondContact O-N 3.12Å; F225-R229 VanDerWaalsContact O-N 3.08Å; L226-R229 PolarHBondContact O-N 3.3Å; N227-R229 VanDerWaalsContact C-N 3.32Å; N227-R229 PolarHBondContact O-N 3.1Å; R229-A233 WeakPolarHBondContact O-CB 3.33Å; R229-A233 PolarHBondContact O-N 2.85Å; R229-A233 VanDerWaalsContact O-N 3.07Å |
| 230 | K | 63.3 | Low | 66.5 | Low | 141 Ų | 141 | 103.6 Ų | 103.6 | 61% | 0.613 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -76.5 | -32.8 | 176.5 | -81 | 177.9 | 178 | 176.3 | 0 | 112 | L226 N227 L228 A233 S234 | L226-K230 PolarHBondContact O-N 3.48Å; L226-K230 VanDerWaalsContact O-N 3.12Å; N227-K230 PolarHBondContact O-N 3.06Å; L228-K230 VanDerWaalsContact C-N 3.29Å; L228-K230 PolarHBondContact O-N 3.41Å; K230-A233 PolarHBondContact O-N 3.02Å; K230-S234 WeakPolarHBondContact O-CB 3.45Å; K230-S234 PolarHBondContact O-N 3.49Å; K230-S234 PolarHBondContact O-OG 3.21Å |
| 231 | D | 56.6 | Low | 64.5 | Low | 109 Ų | 109 | 101.6 Ų | 101.6 | 58% | 0.583 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -69.9 | -43.3 | 174.6 | -65.8 | -21.4 | 0 | 0 | 0 | 110.1 | N227 L228 A233 S234 E235 | N227-D231 PolarHBondContact O-N 3.34Å; N227-D231 VanDerWaalsContact O-N 3.1Å; L228-D231 PolarHBondContact O-N 3.27Å; D231-A233 PolarHBondContact O-N 3.04Å; D231-S234 PolarHBondContact O-N 3.36Å; D231-E235 PolarHBondContact O-N 3.01Å; D231-E235 VanDerWaalsContact O-N 3.1Å |
| 232 | D | 55.1 | Low | 62.5 | Low | 97 Ų | 97 | 103.4 Ų | 103.4 | 52% | 0.519 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.1 | -38.3 | 173.2 | -71.5 | -29.9 | 0 | 0 | 0 | 112.5 | L228 S234 E235 S236 | L228-D232 PolarHBondContact O-N 3.07Å; D232-S234 VanDerWaalsContact C-N 3.34Å; D232-E235 PolarHBondContact O-N 2.56Å; D232-S236 VanDerWaalsContact O-CB 3.24Å; D232-S236 WeakPolarHBondContact O-CB 3.24Å; D232-S236 PolarHBondContact O-N 3.31Å; D232-S236 PolarHBondContact O-OG 2.94Å |
| 233 | A | 53.3 | Low | 60.6 | Low | 46 Ų | 46 | 99.5 Ų | 99.5 | 38% | 0.38 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.1 | -30.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | R229 K230 D231 S236 T237 | R229-A233 WeakPolarHBondContact O-CB 3.33Å; R229-A233 PolarHBondContact O-N 2.85Å; R229-A233 VanDerWaalsContact O-N 3.07Å; K230-A233 PolarHBondContact O-N 3.02Å; D231-A233 PolarHBondContact O-N 3.04Å; A233-S236 WeakPolarHBondContact CA-OG 3.3Å; A233-T237 VanDerWaalsContact O-CB 3.3Å; A233-T237 WeakPolarHBondContact O-CB 3.4Å; A233-T237 PolarHBondContact O-N 2.67Å; A233-T237 PolarHBondContact O-OG1 3.1Å |
| 234 | S | 52.3 | Low | 58.9 | Low | 83 Ų | 83 | 98.9 Ų | 98.9 | 58% | 0.58 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -73.7 | -33.4 | 176 | -60.6 | 0 | 0 | 0 | 0 | 111.7 | K230 D231 D232 | K230-S234 WeakPolarHBondContact O-CB 3.45Å; K230-S234 PolarHBondContact O-N 3.49Å; K230-S234 PolarHBondContact O-OG 3.21Å; D231-S234 PolarHBondContact O-N 3.36Å; D232-S234 VanDerWaalsContact C-N 3.34Å |
| 235 | E | 48.5 | Very low | 57.2 | Low | 146 Ų | 146 | 102 Ų | 102 | 68% | 0.682 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -81.1 | -36.4 | 172.3 | -70.6 | -164.9 | 161 | 0 | 0 | 113.3 | D231 D232 S238 L239 | D231-E235 PolarHBondContact O-N 3.01Å; D231-E235 VanDerWaalsContact O-N 3.1Å; D232-E235 PolarHBondContact O-N 2.56Å; E235-S238 PolarHBondContact O-N 2.83Å; E235-L239 PolarHBondContact O-N 3.34Å |
| 236 | S | 42.9 | Very low | 55.9 | Low | 62 Ų | 62 | 100.4 Ų | 100.4 | 43% | 0.434 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -78.4 | -22.1 | -179 | 54.6 | 0 | 0 | 0 | 0 | 114.2 | D232 A233 S238 L239 S240 | D232-S236 VanDerWaalsContact O-CB 3.24Å; D232-S236 WeakPolarHBondContact O-CB 3.24Å; D232-S236 PolarHBondContact O-N 3.31Å; D232-S236 PolarHBondContact O-OG 2.94Å; A233-S236 WeakPolarHBondContact CA-OG 3.3Å; S236-S238 VanDerWaalsContact C-N 3.27Å; S236-S238 PolarHBondContact O-N 3.46Å; S236-L239 PolarHBondContact O-N 3.46Å; S236-S240 VanDerWaalsContact O-CB 3.28Å; S236-S240 WeakPolarHBondContact O-CB 3.28Å; S236-S240 PolarHBondContact O-N 3.43Å |
| 237 | T | 46.2 | Very low | 54.5 | Low | 103 Ų | 103 | 101.8 Ų | 101.8 | 63% | 0.632 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -67 | -30 | 169 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | A233 | A233-T237 VanDerWaalsContact O-CB 3.3Å; A233-T237 WeakPolarHBondContact O-CB 3.4Å; A233-T237 PolarHBondContact O-N 2.67Å; A233-T237 PolarHBondContact O-OG1 3.1Å |
| 238 | S | 48.3 | Very low | 53.5 | Low | 88 Ų | 88 | 104.3 Ų | 104.3 | 62% | 0.615 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -79.2 | -27.3 | 176 | -61.8 | 0 | 0 | 0 | 0 | 113.7 | E235 S236 | E235-S238 PolarHBondContact O-N 2.83Å; S236-S238 VanDerWaalsContact C-N 3.27Å; S236-S238 PolarHBondContact O-N 3.46Å |
| 239 | L | 47.1 | Very low | 52.8 | Low | 116 Ų | 116 | 104.3 Ų | 104.3 | 61% | 0.607 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -93.1 | -30.2 | 180 | -66.5 | 176.8 | 0 | 0 | 0 | 113.7 | E235 S236 A241 L242 V243 | E235-L239 PolarHBondContact O-N 3.34Å; S236-L239 PolarHBondContact O-N 3.46Å; L239-A241 VanDerWaalsContact C-N 3.31Å; L239-A241 PolarHBondContact O-N 3.41Å; L239-L242 PolarHBondContact O-N 3.37Å; L239-V243 PolarHBondContact O-N 3.24Å |
| 240 | S | 49.3 | Very low | 52.3 | Low | 83 Ų | 83 | 104 Ų | 104 | 58% | 0.58 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73.7 | -21.7 | 179.5 | -151.8 | 0 | 0 | 0 | 0 | 113.3 | S236 | S236-S240 VanDerWaalsContact O-CB 3.28Å; S236-S240 WeakPolarHBondContact O-CB 3.28Å; S236-S240 PolarHBondContact O-N 3.43Å |
| 241 | A | 51.8 | Low | 51.8 | Low | 58 Ų | 58 | 108.3 Ų | 108.3 | 48% | 0.479 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -78.9 | -16.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L239 N245 | L239-A241 VanDerWaalsContact C-N 3.31Å; L239-A241 PolarHBondContact O-N 3.41Å; A241-N245 PolarHBondContact O-ND2 3.18Å |
| 242 | L | 48.9 | Very low | 51.6 | Low | 121 Ų | 121 | 112.6 Ų | 112.6 | 63% | 0.634 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -92.9 | -30.6 | -179.6 | -146.9 | 75.9 | 0 | 0 | 0 | 112.4 | L239 | L239-L242 PolarHBondContact O-N 3.37Å |
| 243 | V | 50.6 | Low | 50.9 | Low | 106 Ų | 106 | 117.4 Ų | 117.4 | 64% | 0.642 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -78.2 | -24.5 | -178.3 | 177.6 | 0 | 0 | 0 | 0 | 112.9 | L239 | L239-V243 PolarHBondContact O-N 3.24Å |
| 244 | T | 53.9 | Low | 50.7 | Low | 81 Ų | 81 | 121 Ų | 121 | 50% | 0.497 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -78.6 | -19.4 | 177.7 | 57 | 0 | 0 | 0 | 0 | 114 | ||
| 245 | N | 51.3 | Low | 50.7 | Low | 120 Ų | 120 | 123 Ų | 123 | 64% | 0.642 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -88.9 | -17.8 | -176.2 | -69.3 | -22.3 | 0 | 0 | 0 | 113.5 | A241 | A241-N245 PolarHBondContact O-ND2 3.18Å |
| 246 | S | 56.1 | Low | 50.8 | Low | 93 Ų | 93 | 121.7 Ų | 121.7 | 65% | 0.65 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -94.5 | -13.8 | 179.8 | -55.3 | 0 | 0 | 0 | 0 | 114 | ||
| 247 | D | 48 | Very low | 51.2 | Low | 124 Ų | 124 | 125.2 Ų | 125.2 | 66% | 0.663 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -98.9 | -1.1 | -174.7 | -145.7 | 1.6 | 0 | 0 | 0 | 114 | ||
| 248 | L | 57.9 | Low | 51.6 | Low | 143 Ų | 143 | 126.6 Ų | 126.6 | 75% | 0.749 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -98.2 | -7.2 | 177.3 | -69.9 | 173 | 0 | 0 | 0 | 114.4 | ||
| 249 | S | 58.5 | Low | 51.8 | Low | 108 Ų | 108 | 129.2 Ų | 129.2 | 76% | 0.755 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | 4.6 | 178.2 | -88.6 | 0 | 0 | 0 | 0 | 115.2 | ||
| 250 | L | 57.6 | Low | 52.1 | Low | 155 Ų | 155 | 130.1 Ų | 130.1 | 81% | 0.812 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | 17.8 | 177.8 | -77.2 | 167.8 | 0 | 0 | 0 | 114 | ||
| 251 | R | 53.7 | Low | 52.3 | Low | 233 Ų | 233 | 133.8 Ų | 133.8 | 88% | 0.879 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -126.4 | 15.5 | 179 | -98.4 | -171 | -178.4 | -173.5 | 3.4 | 116.6 | ||
| 252 | K | 51.9 | Low | 52.4 | Low | 199 Ų | 199 | 140.1 Ų | 140.1 | 87% | 0.865 | 76% | 0.764 | S | S | * | * | trans | -130.7 | 114 | 164.9 | -76.1 | -177.2 | 176.4 | 176.7 | 0 | 109.9 | ||||
| 253 | S | 39.9 | Very low | 52.7 | Low | 198 Ų | 198 | 141.8 Ų | 141.8 | 100% | 1.385 | 78% | 0.776 | S | S | * | * | trans | -44.6 | 0 | 163.8 | -58.5 | 0 | 0 | 0 | 0 | 113.9 |
Retrieved 253 of 253 residues in 60.4 ms
(Link to these results)