| 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 | 49.1 | Very low | 61.6 | Low | 227 Ų | 227 | 149.9 Ų | 149.9 | 100% | 1.118 | 79% | 0.791 | S | S | * | * | 0 | 113.9 | 0 | -72.7 | -61.2 | -70.3 | 0 | 0 | 108.1 | |||||
| 2 | P | 48.3 | Very low | 63.3 | Low | 126 Ų | 126 | 146.3 Ų | 146.3 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -68.2 | 134.3 | 177.1 | -10.3 | 25.9 | 0 | 0 | 0 | 109.7 | L4 | P2-L4 PolarHBondContact O-N 3.38Š| ||
| 3 | A | 50.4 | Low | 65.1 | Low | 91 Ų | 91 | 139.3 Ų | 139.3 | 75% | 0.752 | 75% | 0.749 | S | S | * | * | trans | -64.8 | 128.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q5 | A3-Q5 PolarHBondContact O-N 3.43Š| ||
| 4 | L | 56.4 | Low | 66.9 | Low | 165 Ų | 165 | 137.4 Ų | 137.4 | 86% | 0.864 | 74% | 0.735 | S | S | * | * | trans | -66.7 | 97.1 | 164.1 | -77 | 164 | 0 | 0 | 0 | 107.4 | P2 D6 | P2-L4 PolarHBondContact O-N 3.38Å; L4-D6 VanDerWaalsContact C-N 3.31Å; L4-D6 PolarHBondContact O-N 3.25Å | ||
| 5 | Q | 54.5 | Low | 68.3 | Low | 183 Ų | 183 | 131.1 Ų | 131.1 | 86% | 0.855 | 71% | 0.709 | S | S | * | * | trans | -66.2 | 99.9 | 162.3 | -91.8 | 162 | -20.8 | 0 | 0 | 107.2 | A3 R7 | A3-Q5 PolarHBondContact O-N 3.43Å; Q5-R7 PolarHBondContact O-N 3.38Å | ||
| 6 | D | 57.3 | Low | 69.5 | Low | 146 Ų | 146 | 132.3 Ų | 132.3 | 78% | 0.781 | 70% | 0.701 | S | S | * | * | trans | -53.3 | 107.2 | 170.5 | -78.9 | -42 | 0 | 0 | 0 | 108.5 | L4 | L4-D6 VanDerWaalsContact C-N 3.31Å; L4-D6 PolarHBondContact O-N 3.25Å | ||
| 7 | R | 63.1 | Low | 70.9 | Confident | 224 Ų | 224 | 128.1 Ų | 128.1 | 85% | 0.845 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 134.4 | 171.8 | -102.8 | 176.4 | 173.8 | -178.5 | -2.2 | 108.2 | Q5 K9 | Q5-R7 PolarHBondContact O-N 3.38Å; R7-K9 PolarHBondContact O-N 3.33Å |
| 8 | P | 69.6 | Low | 72.3 | Confident | 125 Ų | 125 | 125.6 Ų | 125.6 | 81% | 0.812 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 116.3 | 174.5 | -22.4 | 30.3 | 0 | 0 | 0 | 109.4 | L10 | P8-L10 PolarHBondContact O-N 3.2Š|
| 9 | K | 73.4 | Confident | 73.4 | Confident | 195 Ų | 195 | 125.2 Ų | 125.2 | 85% | 0.848 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 120 | 176.3 | -68 | -179.2 | -178.4 | 175.4 | 0 | 107 | R7 S11 | R7-K9 PolarHBondContact O-N 3.33Å; K9-S11 PolarHBondContact O-N 3.26Å |
| 10 | L | 72.6 | Confident | 74.4 | Confident | 90 Ų | 90 | 125.2 Ų | 125.2 | 47% | 0.471 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -48.6 | 126.3 | 175.1 | -129.9 | 85.2 | 0 | 0 | 0 | 108.3 | P8 N12 M14 L18 | P8-L10 PolarHBondContact O-N 3.2Å; L10-N12 PolarHBondContact O-N 3.19Å; L10-M14 HydrophobicContact CD1-SD 4Å; L10-M14 HydrophobicContact CD2-CB 3.91Å; L10-M14 HydrophobicContact CD2-CG 3.58Å; L10-M14 HydrophobicContact CD2-SD 3.92Å; L10-M14 HydrophobicContact CG-CB 4.04Å; L10-M14 HydrophobicContact CG-CG 3.85Å; L10-M14 HydrophobicContact CG-SD 3.61Å; L10-L18 HydrophobicContact CD2-CB 4.47Å; L10-L18 HydrophobicContact CD2-CD2 3.94Å |
| 11 | S | 82.8 | Confident | 75.4 | Confident | 77 Ų | 77 | 123.7 Ų | 123.7 | 54% | 0.538 | 65% | 0.651 | S | S | . | * | P | Polyproline II helix | trans | -51.3 | 141.4 | 176.9 | 170 | 0 | 0 | 0 | 0 | 109.6 | K9 A13 M14 A15 | K9-S11 PolarHBondContact O-N 3.26Å; S11-A13 PolarHBondContact O-N 2.68Å; S11-M14 CarbonylContact O-C 3.54Å; S11-M14 WeakPolarHBondContact O-CA 3.21Å; S11-M14 WeakPolarHBondContact O-CB 3.13Å; S11-M14 PolarHBondContact O-N 3.19Å; S11-A15 PolarHBondContact O-N 2.87Å |
| 12 | N | 81.8 | Confident | 77.6 | Confident | 106 Ų | 106 | 116.3 Ų | 116.3 | 57% | 0.567 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -54.4 | -33.5 | -176.4 | -165.4 | -21 | 0 | 0 | 0 | 111.9 | L10 A15 R16 | L10-N12 PolarHBondContact O-N 3.19Å; N12-A15 PolarHBondContact O-N 3.49Å; N12-R16 WeakPolarHBondContact O-CG 3.34Å; N12-R16 PolarHBondContact O-N 3.48Å; N12-R16 VanDerWaalsContact O-N 3.09Å; N12-R16 PolarHBondContact OD1-NH1 2.89Å |
| 13 | A | 87.8 | Confident | 79.8 | Confident | 56 Ų | 56 | 113.7 Ų | 113.7 | 46% | 0.463 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.3 | -44.1 | 172 | 0 | 0 | 0 | 0 | 0 | 112.7 | S11 A17 | S11-A13 PolarHBondContact O-N 2.68Å; A13-A17 WeakPolarHBondContact O-CB 3.36Å; A13-A17 PolarHBondContact O-N 2.75Å |
| 14 | M | 89.9 | Confident | 81.8 | Confident | 112 Ų | 112 | 115.4 Ų | 115.4 | 55% | 0.552 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.1 | -37 | 177.7 | -163.9 | -179.9 | -72.9 | 0 | 0 | 111.5 | L10 S11 A17 L18 | L10-M14 HydrophobicContact CD1-SD 4Å; L10-M14 HydrophobicContact CD2-CB 3.91Å; L10-M14 HydrophobicContact CD2-CG 3.58Å; L10-M14 HydrophobicContact CD2-SD 3.92Å; L10-M14 HydrophobicContact CG-CB 4.04Å; L10-M14 HydrophobicContact CG-CG 3.85Å; L10-M14 HydrophobicContact CG-SD 3.61Å; S11-M14 CarbonylContact O-C 3.54Å; S11-M14 WeakPolarHBondContact O-CA 3.21Å; S11-M14 WeakPolarHBondContact O-CB 3.13Å; S11-M14 PolarHBondContact O-N 3.19Å; M14-A17 PolarHBondContact O-N 3.45Å; M14-L18 VanDerWaalsContact O-CB 3.25Å; M14-L18 WeakPolarHBondContact O-CB 3.29Å; M14-L18 PolarHBondContact O-N 3.38Å |
| 15 | A | 87.1 | Confident | 83.6 | Confident | 43 Ų | 43 | 110.8 Ų | 110.8 | 36% | 0.355 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.4 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S11 N12 H19 | S11-A15 PolarHBondContact O-N 2.87Å; N12-A15 PolarHBondContact O-N 3.49Å; A15-H19 WeakPolarHBondContact O-CB 3.44Å; A15-H19 PolarHBondContact O-N 2.94Å |
| 16 | R | 88.6 | Confident | 85.4 | Confident | 151 Ų | 151 | 110.1 Ų | 110.1 | 57% | 0.57 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.9 | -41.8 | 174.2 | -69.6 | -175.2 | -62.9 | -113.1 | 9.5 | 112.4 | N12 H19 K20 | N12-R16 WeakPolarHBondContact O-CG 3.34Å; N12-R16 PolarHBondContact O-N 3.48Å; N12-R16 VanDerWaalsContact O-N 3.09Å; N12-R16 PolarHBondContact OD1-NH1 2.89Å; R16-H19 PolarHBondContact O-N 3.44Å; R16-K20 WeakPolarHBondContact O-CB 3.35Å; R16-K20 PolarHBondContact O-N 2.84Å |
| 17 | A | 93.3 | Very high | 86.9 | Confident | 60 Ų | 60 | 107 Ų | 107 | 50% | 0.496 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.7 | -44.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A13 M14 K20 H21 | A13-A17 WeakPolarHBondContact O-CB 3.36Å; A13-A17 PolarHBondContact O-N 2.75Å; M14-A17 PolarHBondContact O-N 3.45Å; A17-K20 PolarHBondContact O-N 2.92Å; A17-H21 WeakPolarHBondContact O-CB 3.5Å; A17-H21 PolarHBondContact O-N 3.46Å |
| 18 | L | 95.1 | Very high | 88.2 | Confident | 84 Ų | 84 | 102.1 Ų | 102.1 | 44% | 0.44 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.4 | -44.7 | 177.2 | -177.8 | 61.4 | 0 | 0 | 0 | 111.5 | L10 M14 K20 H21 I22 | L10-L18 HydrophobicContact CD2-CB 4.47Å; L10-L18 HydrophobicContact CD2-CD2 3.94Å; M14-L18 VanDerWaalsContact O-CB 3.25Å; M14-L18 WeakPolarHBondContact O-CB 3.29Å; M14-L18 PolarHBondContact O-N 3.38Å; L18-K20 PolarHBondContact O-N 2.91Å; L18-H21 WeakPolarHBondContact O-CB 3.38Å; L18-H21 PolarHBondContact O-N 3.32Å; L18-H21 VanDerWaalsContact O-N 3.16Å; L18-I22 HydrophobicContact CD1-CD1 4.02Å; L18-I22 HydrophobicContact CD1-CG1 4.2Å; L18-I22 HydrophobicContact CD2-CD1 4.45Å; L18-I22 HydrophobicContact CG-CD1 3.79Å; L18-I22 HydrophobicContact CG-CG1 4.38Å; L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.36Å; L18-I22 PolarHBondContact O-N 3.07Å |
| 19 | H | 93.3 | Very high | 89.2 | Confident | 118 Ų | 118 | 103.1 Ų | 103.1 | 55% | 0.546 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 176.1 | -177.1 | 73.8 | 0 | 0 | 0 | 111.8 | A15 R16 H21 I22 M23 | A15-H19 WeakPolarHBondContact O-CB 3.44Å; A15-H19 PolarHBondContact O-N 2.94Å; R16-H19 PolarHBondContact O-N 3.44Å; H19-H21 VanDerWaalsContact C-N 3.3Å; H19-H21 PolarHBondContact O-N 2.9Å; H19-I22 PolarHBondContact O-N 2.96Å; H19-M23 WeakPolarHBondContact O-CG 3.4Å; H19-M23 PolarHBondContact O-N 2.84Å |
| 20 | K | 94.4 | Very high | 90 | Very high | 125 Ų | 125 | 101.7 Ų | 101.7 | 54% | 0.543 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.4 | -36.8 | 175.2 | -168.9 | -179.2 | -176.8 | -179.8 | 0 | 112.3 | R16 A17 L18 R24 | R16-K20 WeakPolarHBondContact O-CB 3.35Å; R16-K20 PolarHBondContact O-N 2.84Å; A17-K20 PolarHBondContact O-N 2.92Å; L18-K20 PolarHBondContact O-N 2.91Å; K20-R24 VanDerWaalsContact CE-NH2 3.26Å; K20-R24 WeakPolarHBondContact O-CB 3.4Å; K20-R24 WeakPolarHBondContact O-CG 3.36Å; K20-R24 PolarHBondContact O-N 3.21Å; K20-R24 VanDerWaalsContact O-N 3.09Å; K20-R24 PolarHBondContact O-NH1 3.43Å |
| 21 | H | 94.7 | Very high | 90.7 | Very high | 94 Ų | 94 | 103.7 Ų | 103.7 | 44% | 0.435 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.4 | -48.4 | 174.7 | 179.9 | 63.4 | 0 | 0 | 0 | 111.4 | A17 L18 H19 M23 R24 E25 | A17-H21 WeakPolarHBondContact O-CB 3.5Å; A17-H21 PolarHBondContact O-N 3.46Å; L18-H21 WeakPolarHBondContact O-CB 3.38Å; L18-H21 PolarHBondContact O-N 3.32Å; L18-H21 VanDerWaalsContact O-N 3.16Å; H19-H21 VanDerWaalsContact C-N 3.3Å; H19-H21 PolarHBondContact O-N 2.9Å; H21-M23 VanDerWaalsContact C-N 3.34Å; H21-M23 PolarHBondContact O-N 3.43Å; H21-R24 PolarHBondContact O-N 3.46Å; H21-E25 IonicContact CE1-OE1 3.91Å; H21-E25 WeakPolarHBondContact O-CB 3.44Å; H21-E25 WeakPolarHBondContact O-CG 3.31Å; H21-E25 PolarHBondContact O-N 3.32Å |
| 22 | I | 95.1 | Very high | 90.6 | Very high | 72 Ų | 72 | 104.9 Ų | 104.9 | 37% | 0.369 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61 | -41.4 | 178.2 | -67 | 167.6 | 0 | 0 | 0 | 111.5 | L18 H19 E25 R26 | L18-I22 HydrophobicContact CD1-CD1 4.02Å; L18-I22 HydrophobicContact CD1-CG1 4.2Å; L18-I22 HydrophobicContact CD2-CD1 4.45Å; L18-I22 HydrophobicContact CG-CD1 3.79Å; L18-I22 HydrophobicContact CG-CG1 4.38Å; L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.36Å; L18-I22 PolarHBondContact O-N 3.07Å; H19-I22 PolarHBondContact O-N 2.96Å; I22-E25 PolarHBondContact O-N 2.92Å; I22-R26 HydrophobicContact CG2-CG 4.43Å; I22-R26 WeakPolarHBondContact O-CB 3.32Å; I22-R26 VanDerWaalsContact O-CG 3.25Å; I22-R26 WeakPolarHBondContact O-CG 3.41Å; I22-R26 PolarHBondContact O-N 3.22Å |
| 23 | M | 94.1 | Very high | 90.4 | Very high | 71 Ų | 71 | 106.3 Ų | 106.3 | 35% | 0.35 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.2 | -49.4 | 175.6 | -69 | -61.2 | 99.4 | 0 | 0 | 110.9 | H19 H21 E25 R26 D27 | H19-M23 WeakPolarHBondContact O-CG 3.4Å; H19-M23 PolarHBondContact O-N 2.84Å; H21-M23 VanDerWaalsContact C-N 3.34Å; H21-M23 PolarHBondContact O-N 3.43Å; M23-E25 VanDerWaalsContact C-N 3.28Å; M23-E25 PolarHBondContact O-N 2.83Å; M23-R26 PolarHBondContact O-N 2.88Å; M23-R26 VanDerWaalsContact O-N 3.16Å; M23-D27 WeakPolarHBondContact O-CB 3.4Å; M23-D27 PolarHBondContact O-N 3.36Å |
| 24 | R | 93.6 | Very high | 90.1 | Very high | 127 Ų | 127 | 109.9 Ų | 109.9 | 48% | 0.479 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.5 | -39 | 174.5 | -80.1 | -161.9 | -127.9 | 86.8 | -16.3 | 113.2 | K20 H21 D27 R28 | K20-R24 VanDerWaalsContact CE-NH2 3.26Å; K20-R24 WeakPolarHBondContact O-CB 3.4Å; K20-R24 WeakPolarHBondContact O-CG 3.36Å; K20-R24 PolarHBondContact O-N 3.21Å; K20-R24 VanDerWaalsContact O-N 3.09Å; K20-R24 PolarHBondContact O-NH1 3.43Å; H21-R24 PolarHBondContact O-N 3.46Å; R24-D27 PolarHBondContact O-N 2.93Å; R24-R28 WeakPolarHBondContact O-CB 3.41Å; R24-R28 PolarHBondContact O-N 3.4Å |
| 25 | E | 92.9 | Very high | 89.8 | Confident | 67 Ų | 67 | 111 Ų | 111 | 31% | 0.313 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 177.9 | -79.5 | -59.5 | 96.9 | 0 | 0 | 111.9 | H21 I22 M23 R28 K29 | H21-E25 IonicContact CE1-OE1 3.91Å; H21-E25 WeakPolarHBondContact O-CB 3.44Å; H21-E25 WeakPolarHBondContact O-CG 3.31Å; H21-E25 PolarHBondContact O-N 3.32Å; I22-E25 PolarHBondContact O-N 2.92Å; M23-E25 VanDerWaalsContact C-N 3.28Å; M23-E25 PolarHBondContact O-N 2.83Å; E25-R28 IonicContact OE1-CZ 2.83Å; E25-R28 IonicContact OE1-NE 2.7Å; E25-R28 PolarHBondContact OE1-NE 2.78Å; E25-R28 IonicContact OE1-NH1 2.97Å; E25-R28 IonicContact OE1-NH2 3.66Å; E25-R28 PolarHBondContact OE1-NH2 2.7Å; E25-R28 IonicContact OE2-CZ 3.85Å; E25-R28 IonicContact OE2-NE 2.69Å; E25-R28 IonicContact OE2-NH2 3.93Å; E25-R28 PolarHBondContact OE2-NH2 3.39Å; E25-K29 VanDerWaalsContact O-CB 3.28Å; E25-K29 WeakPolarHBondContact O-CB 3.36Å; E25-K29 PolarHBondContact O-N 3.3Å |
| 26 | R | 92.6 | Very high | 89.7 | Confident | 169 Ų | 169 | 113.1 Ų | 113.1 | 64% | 0.638 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.6 | -38.9 | 177.4 | -71.7 | 177.2 | 76.6 | 127 | 4.9 | 111.6 | I22 M23 K29 R30 | I22-R26 HydrophobicContact CG2-CG 4.43Å; I22-R26 WeakPolarHBondContact O-CB 3.32Å; I22-R26 VanDerWaalsContact O-CG 3.25Å; I22-R26 WeakPolarHBondContact O-CG 3.41Å; I22-R26 PolarHBondContact O-N 3.22Å; M23-R26 PolarHBondContact O-N 2.88Å; M23-R26 VanDerWaalsContact O-N 3.16Å; R26-K29 PolarHBondContact O-N 2.85Å; R26-R30 WeakPolarHBondContact O-CB 3.37Å; R26-R30 PolarHBondContact O-N 2.76Å |
| 27 | D | 88.8 | Confident | 89.6 | Confident | 80 Ų | 80 | 110.8 Ų | 110.8 | 43% | 0.428 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.7 | -42.2 | 176.9 | -65.1 | -23.6 | 0 | 0 | 0 | 110.9 | M23 R24 R30 Q31 | M23-D27 WeakPolarHBondContact O-CB 3.4Å; M23-D27 PolarHBondContact O-N 3.36Å; R24-D27 PolarHBondContact O-N 2.93Å; D27-R30 PolarHBondContact O-N 2.69Å; D27-Q31 WeakPolarHBondContact O-CG 3.45Å; D27-Q31 PolarHBondContact O-N 3.21Å |
| 28 | R | 91.8 | Very high | 89.6 | Confident | 123 Ų | 123 | 114.7 Ų | 114.7 | 46% | 0.464 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 173.2 | 179.7 | 173.8 | 65.3 | 153.4 | 10.4 | 111.6 | R24 E25 R30 Q31 E32 | R24-R28 WeakPolarHBondContact O-CB 3.41Å; R24-R28 PolarHBondContact O-N 3.4Å; E25-R28 IonicContact OE1-CZ 2.83Å; E25-R28 IonicContact OE1-NE 2.7Å; E25-R28 PolarHBondContact OE1-NE 2.78Å; E25-R28 IonicContact OE1-NH1 2.97Å; E25-R28 IonicContact OE1-NH2 3.66Å; E25-R28 PolarHBondContact OE1-NH2 2.7Å; E25-R28 IonicContact OE2-CZ 3.85Å; E25-R28 IonicContact OE2-NE 2.69Å; E25-R28 IonicContact OE2-NH2 3.93Å; E25-R28 PolarHBondContact OE2-NH2 3.39Å; R28-R30 VanDerWaalsContact C-N 3.28Å; R28-R30 PolarHBondContact O-N 2.6Å; R28-Q31 PolarHBondContact O-N 3.08Å; R28-Q31 VanDerWaalsContact O-N 3.17Å; R28-E32 WeakPolarHBondContact CG-OE1 3.43Å; R28-E32 WeakPolarHBondContact O-CG 3.44Å; R28-E32 PolarHBondContact O-N 2.72Å |
| 29 | K | 89.7 | Confident | 89.2 | Confident | 145 Ų | 145 | 116.7 Ų | 116.7 | 63% | 0.63 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.6 | -36.6 | 177.8 | -172.6 | 170.3 | -177.3 | 176.3 | 0 | 112.2 | E25 R26 E33 | E25-K29 VanDerWaalsContact O-CB 3.28Å; E25-K29 WeakPolarHBondContact O-CB 3.36Å; E25-K29 PolarHBondContact O-N 3.3Å; R26-K29 PolarHBondContact O-N 2.85Å; K29-E33 WeakPolarHBondContact O-CB 3.42Å; K29-E33 PolarHBondContact O-N 3.07Å; K29-E33 VanDerWaalsContact O-N 3.08Å |
| 30 | R | 90.7 | Very high | 88.8 | Confident | 166 Ų | 166 | 116.7 Ų | 116.7 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.7 | -42.8 | 174.2 | -170.6 | -171.3 | -59.5 | -135.8 | 2.6 | 111.5 | R26 D27 R28 E33 E34 | R26-R30 WeakPolarHBondContact O-CB 3.37Å; R26-R30 PolarHBondContact O-N 2.76Å; D27-R30 PolarHBondContact O-N 2.69Å; R28-R30 VanDerWaalsContact C-N 3.28Å; R28-R30 PolarHBondContact O-N 2.6Å; R30-E33 PolarHBondContact O-N 3.19Å; R30-E34 WeakPolarHBondContact O-CB 3.3Å; R30-E34 PolarHBondContact O-N 2.86Å |
| 31 | Q | 87.9 | Confident | 88.4 | Confident | 131 Ų | 131 | 117.3 Ų | 117.3 | 61% | 0.612 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.7 | -42.5 | 177.4 | -73.9 | 176.2 | -4.7 | 0 | 0 | 112.3 | D27 R28 E34 E35 | D27-Q31 WeakPolarHBondContact O-CG 3.45Å; D27-Q31 PolarHBondContact O-N 3.21Å; R28-Q31 PolarHBondContact O-N 3.08Å; R28-Q31 VanDerWaalsContact O-N 3.17Å; Q31-E34 PolarHBondContact O-N 3.39Å; Q31-E35 WeakPolarHBondContact O-CB 3.45Å; Q31-E35 PolarHBondContact O-N 3.45Å |
| 32 | E | 80.2 | Confident | 88.1 | Confident | 103 Ų | 103 | 118.6 Ų | 118.6 | 48% | 0.481 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 176.5 | -73.4 | 172.1 | -168.3 | 0 | 0 | 111.7 | R28 E35 V36 | R28-E32 WeakPolarHBondContact CG-OE1 3.43Å; R28-E32 WeakPolarHBondContact O-CG 3.44Å; R28-E32 PolarHBondContact O-N 2.72Å; E32-E35 PolarHBondContact O-N 3.01Å; E32-V36 WeakPolarHBondContact O-CB 3.47Å; E32-V36 VanDerWaalsContact O-CG2 3.27Å; E32-V36 WeakPolarHBondContact O-CG2 3.4Å; E32-V36 PolarHBondContact O-N 3.46Å |
| 33 | E | 76.7 | Confident | 87.9 | Confident | 136 Ų | 136 | 121.9 Ų | 121.9 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.2 | -43.4 | 176 | -172.8 | 171.3 | -170.5 | 0 | 0 | 111.8 | K29 R30 V36 D37 | K29-E33 WeakPolarHBondContact O-CB 3.42Å; K29-E33 PolarHBondContact O-N 3.07Å; K29-E33 VanDerWaalsContact O-N 3.08Å; R30-E33 PolarHBondContact O-N 3.19Å; E33-V36 PolarHBondContact O-N 3.34Å; E33-D37 WeakPolarHBondContact O-CB 3.41Å; E33-D37 PolarHBondContact O-N 2.94Å |
| 34 | E | 81.5 | Confident | 87.5 | Confident | 130 Ų | 130 | 124.2 Ų | 124.2 | 61% | 0.607 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.6 | -34.7 | 176.4 | -168.9 | 173.8 | -176.7 | 0 | 0 | 112.2 | R30 Q31 K38 | R30-E34 WeakPolarHBondContact O-CB 3.3Å; R30-E34 PolarHBondContact O-N 2.86Å; Q31-E34 PolarHBondContact O-N 3.39Å; E34-K38 VanDerWaalsContact O-CB 3.24Å; E34-K38 WeakPolarHBondContact O-CB 3.45Å; E34-K38 PolarHBondContact O-N 2.89Å |
| 35 | E | 83.4 | Confident | 87.4 | Confident | 136 Ų | 136 | 125.1 Ų | 125.1 | 64% | 0.636 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -71.1 | -38.2 | 174.8 | -171.1 | 174.1 | -173.3 | 0 | 0 | 112.1 | Q31 E32 M39 | Q31-E35 WeakPolarHBondContact O-CB 3.45Å; Q31-E35 PolarHBondContact O-N 3.45Å; E32-E35 PolarHBondContact O-N 3.01Å; E35-M39 WeakPolarHBondContact O-CB 3.46Å; E35-M39 PolarHBondContact O-N 2.86Å |
| 36 | V | 85.1 | Confident | 87.2 | Confident | 87 Ų | 87 | 127.6 Ų | 127.6 | 53% | 0.527 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.7 | -42.6 | 173 | 168.3 | 0 | 0 | 0 | 0 | 111.2 | E32 E33 M39 M40 | E32-V36 WeakPolarHBondContact O-CB 3.47Å; E32-V36 VanDerWaalsContact O-CG2 3.27Å; E32-V36 WeakPolarHBondContact O-CG2 3.4Å; E32-V36 PolarHBondContact O-N 3.46Å; E33-V36 PolarHBondContact O-N 3.34Å; V36-M39 PolarHBondContact O-N 3.09Å; V36-M40 WeakPolarHBondContact O-CB 3.41Å; V36-M40 PolarHBondContact O-N 3.23Å |
| 37 | D | 86.7 | Confident | 86.6 | Confident | 103 Ų | 103 | 125.4 Ų | 125.4 | 55% | 0.551 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.4 | -45.7 | 177 | -166.1 | 48.9 | 0 | 0 | 0 | 110.9 | E33 M39 M40 E41 | E33-D37 WeakPolarHBondContact O-CB 3.41Å; E33-D37 PolarHBondContact O-N 2.94Å; D37-M39 VanDerWaalsContact C-N 3.33Å; D37-M39 PolarHBondContact O-N 3.13Å; D37-M40 WeakPolarHBondContact O-CB 3.46Å; D37-M40 PolarHBondContact O-N 3.37Å; D37-M40 VanDerWaalsContact O-N 3.13Å; D37-E41 WeakPolarHBondContact O-CB 3.35Å; D37-E41 PolarHBondContact O-N 3.07Å |
| 38 | K | 92.6 | Very high | 86.3 | Confident | 142 Ų | 142 | 126.9 Ų | 126.9 | 62% | 0.617 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -60.5 | -40.6 | 174 | -174.6 | 179.6 | 179.3 | -175.2 | 0 | 112.6 | E34 Q42 | E34-K38 VanDerWaalsContact O-CB 3.24Å; E34-K38 WeakPolarHBondContact O-CB 3.45Å; E34-K38 PolarHBondContact O-N 2.89Å; K38-Q42 VanDerWaalsContact O-CB 3.23Å; K38-Q42 WeakPolarHBondContact O-CB 3.27Å; K38-Q42 PolarHBondContact O-N 3.22Å |
| 39 | M | 87.8 | Confident | 85.9 | Confident | 125 Ų | 125 | 127.1 Ų | 127.1 | 62% | 0.616 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.3 | -40.5 | 175.7 | -170.5 | -153.4 | -71.1 | 0 | 0 | 110.8 | E35 V36 D37 Q42 K43 | E35-M39 WeakPolarHBondContact O-CB 3.46Å; E35-M39 PolarHBondContact O-N 2.86Å; V36-M39 PolarHBondContact O-N 3.09Å; D37-M39 VanDerWaalsContact C-N 3.33Å; D37-M39 PolarHBondContact O-N 3.13Å; M39-Q42 PolarHBondContact O-N 2.94Å; M39-K43 WeakPolarHBondContact O-CB 3.49Å; M39-K43 PolarHBondContact O-N 3.24Å |
| 40 | M | 83.8 | Confident | 85.8 | Confident | 118 Ų | 118 | 129.3 Ų | 129.3 | 58% | 0.581 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.6 | -45.2 | 177.4 | -172.3 | 178.1 | -62 | 0 | 0 | 111.2 | V36 D37 K43 M44 | V36-M40 WeakPolarHBondContact O-CB 3.41Å; V36-M40 PolarHBondContact O-N 3.23Å; D37-M40 WeakPolarHBondContact O-CB 3.46Å; D37-M40 PolarHBondContact O-N 3.37Å; D37-M40 VanDerWaalsContact O-N 3.13Å; M40-K43 PolarHBondContact O-N 3.03Å; M40-M44 WeakPolarHBondContact O-CB 3.49Å; M40-M44 WeakPolarHBondContact O-CG 3.43Å; M40-M44 PolarHBondContact O-N 3.46Å |
| 41 | E | 87.4 | Confident | 85.6 | Confident | 139 Ų | 139 | 128.6 Ų | 128.6 | 65% | 0.65 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -63 | -44.5 | 176.5 | -171.6 | 176.7 | -158 | 0 | 0 | 111.2 | D37 K43 M44 K45 | D37-E41 WeakPolarHBondContact O-CB 3.35Å; D37-E41 PolarHBondContact O-N 3.07Å; E41-K43 VanDerWaalsContact C-N 3.35Å; E41-K43 PolarHBondContact O-N 2.87Å; E41-M44 PolarHBondContact O-N 2.88Å; E41-K45 VanDerWaalsContact O-CB 3.3Å; E41-K45 WeakPolarHBondContact O-CB 3.36Å; E41-K45 PolarHBondContact O-N 3.23Å |
| 42 | Q | 88.6 | Confident | 85.6 | Confident | 121 Ų | 121 | 129.6 Ų | 129.6 | 57% | 0.565 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -62.4 | -42.1 | 175.6 | -175.9 | 174.5 | -10 | 0 | 0 | 111.8 | K38 M39 K45 E46 | K38-Q42 VanDerWaalsContact O-CB 3.23Å; K38-Q42 WeakPolarHBondContact O-CB 3.27Å; K38-Q42 PolarHBondContact O-N 3.22Å; M39-Q42 PolarHBondContact O-N 2.94Å; Q42-K45 PolarHBondContact O-N 3.36Å; Q42-E46 WeakPolarHBondContact O-CB 3.48Å; Q42-E46 PolarHBondContact O-N 3.12Å |
| 43 | K | 89.3 | Confident | 85.6 | Confident | 141 Ų | 141 | 128.7 Ų | 128.7 | 61% | 0.613 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.3 | -41.1 | 178.5 | -169.1 | -175 | -178.8 | -171.8 | 0 | 111.8 | M39 M40 E41 K45 E46 E47 | M39-K43 WeakPolarHBondContact O-CB 3.49Å; M39-K43 PolarHBondContact O-N 3.24Å; M40-K43 PolarHBondContact O-N 3.03Å; E41-K43 VanDerWaalsContact C-N 3.35Å; E41-K43 PolarHBondContact O-N 2.87Å; K43-K45 VanDerWaalsContact C-N 3.34Å; K43-E46 PolarHBondContact O-N 3.5Å; K43-E47 VanDerWaalsContact O-CB 3.28Å; K43-E47 WeakPolarHBondContact O-CB 3.47Å; K43-E47 PolarHBondContact O-N 2.93Å |
| 44 | M | 86.8 | Confident | 86.1 | Confident | 119 Ų | 119 | 129 Ų | 129 | 59% | 0.586 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -62.7 | -42.1 | 173.9 | -78.2 | -65.2 | -62.4 | 0 | 0 | 111.5 | M40 E41 E47 E48 | M40-M44 WeakPolarHBondContact O-CB 3.49Å; M40-M44 WeakPolarHBondContact O-CG 3.43Å; M40-M44 PolarHBondContact O-N 3.46Å; E41-M44 PolarHBondContact O-N 2.88Å; M44-E47 PolarHBondContact O-N 3.43Å; M44-E48 WeakPolarHBondContact O-CB 3.45Å; M44-E48 PolarHBondContact O-N 2.95Å |
| 45 | K | 91.6 | Very high | 86.1 | Confident | 147 Ų | 147 | 127.4 Ų | 127.4 | 64% | 0.639 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.5 | -43.7 | 178.1 | -172.2 | 175.6 | -179.1 | 178.3 | 0 | 112.4 | E41 Q42 K43 E48 E49 | E41-K45 VanDerWaalsContact O-CB 3.3Å; E41-K45 WeakPolarHBondContact O-CB 3.36Å; E41-K45 PolarHBondContact O-N 3.23Å; Q42-K45 PolarHBondContact O-N 3.36Å; K43-K45 VanDerWaalsContact C-N 3.34Å; K45-E48 PolarHBondContact O-N 3.29Å; K45-E49 WeakPolarHBondContact O-CB 3.43Å; K45-E49 PolarHBondContact O-N 3.42Å |
| 46 | E | 87.5 | Confident | 85.9 | Confident | 118 Ų | 118 | 125.7 Ų | 125.7 | 55% | 0.551 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.5 | -40.2 | 175.2 | -174.5 | -176.4 | 163.2 | 0 | 0 | 111.4 | Q42 K43 E49 R50 | Q42-E46 WeakPolarHBondContact O-CB 3.48Å; Q42-E46 PolarHBondContact O-N 3.12Å; K43-E46 PolarHBondContact O-N 3.5Å; E46-E49 PolarHBondContact O-N 3.3Å; E46-R50 VanDerWaalsContact O-CB 3.27Å; E46-R50 WeakPolarHBondContact O-CB 3.42Å; E46-R50 PolarHBondContact O-N 3.14Å |
| 47 | E | 79.8 | Confident | 85.5 | Confident | 124 Ų | 124 | 127.6 Ų | 127.6 | 58% | 0.579 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.8 | -40.7 | 175.7 | -172.3 | 174.6 | 176.2 | 0 | 0 | 111.8 | K43 M44 R50 K51 | K43-E47 VanDerWaalsContact O-CB 3.28Å; K43-E47 WeakPolarHBondContact O-CB 3.47Å; K43-E47 PolarHBondContact O-N 2.93Å; M44-E47 PolarHBondContact O-N 3.43Å; E47-R50 PolarHBondContact O-N 3.38Å; E47-K51 VanDerWaalsContact O-CB 3.31Å; E47-K51 WeakPolarHBondContact O-CB 3.38Å; E47-K51 PolarHBondContact O-N 3.37Å |
| 48 | E | 82.6 | Confident | 85.2 | Confident | 110 Ų | 110 | 129.2 Ų | 129.2 | 51% | 0.514 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.5 | -43.4 | 174.4 | -168.5 | -176.7 | 170 | 0 | 0 | 111.6 | M44 K45 K51 R52 | M44-E48 WeakPolarHBondContact O-CB 3.45Å; M44-E48 PolarHBondContact O-N 2.95Å; K45-E48 PolarHBondContact O-N 3.29Å; E48-K51 WeakPolarHBondContact O-CB 3.49Å; E48-K51 PolarHBondContact O-N 3.46Å; E48-R52 WeakPolarHBondContact O-CB 3.5Å; E48-R52 VanDerWaalsContact O-CG 3.23Å; E48-R52 WeakPolarHBondContact O-CG 3.39Å; E48-R52 PolarHBondContact O-N 2.85Å; E48-R52 IonicContact OE1-NH2 3.68Å |
| 49 | E | 84.1 | Confident | 84.9 | Confident | 128 Ų | 128 | 130.4 Ų | 130.4 | 60% | 0.598 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65.4 | -40.1 | 177.9 | -170.5 | 174.8 | 178.8 | 0 | 0 | 112 | K45 E46 K51 R52 T53 | K45-E49 WeakPolarHBondContact O-CB 3.43Å; K45-E49 PolarHBondContact O-N 3.42Å; E46-E49 PolarHBondContact O-N 3.3Å; E49-K51 VanDerWaalsContact C-N 3.32Å; E49-K51 PolarHBondContact O-N 3.41Å; E49-R52 PolarHBondContact O-N 2.83Å; E49-T53 WeakPolarHBondContact O-CB 3.43Å; E49-T53 PolarHBondContact O-N 2.84Å; E49-T53 PolarHBondContact O-OG1 3.01Å |
| 50 | R | 86.8 | Confident | 83.8 | Confident | 192 Ų | 192 | 130.4 Ų | 130.4 | 73% | 0.725 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.1 | -40.7 | 173.1 | -170.9 | 179.4 | -176.9 | 129.1 | 3.2 | 111.3 | E46 E47 K54 | E46-R50 VanDerWaalsContact O-CB 3.27Å; E46-R50 WeakPolarHBondContact O-CB 3.42Å; E46-R50 PolarHBondContact O-N 3.14Å; E47-R50 PolarHBondContact O-N 3.38Å; R50-K54 WeakPolarHBondContact O-CB 3.28Å; R50-K54 PolarHBondContact O-N 3.32Å |
| 51 | K | 88 | Confident | 83.8 | Confident | 150 Ų | 150 | 127.9 Ų | 127.9 | 65% | 0.652 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.7 | -43.8 | 176.3 | -173.9 | -178.8 | 177.1 | -173.8 | 0 | 111.6 | E47 E48 E49 K54 E55 | E47-K51 VanDerWaalsContact O-CB 3.31Å; E47-K51 WeakPolarHBondContact O-CB 3.38Å; E47-K51 PolarHBondContact O-N 3.37Å; E48-K51 WeakPolarHBondContact O-CB 3.49Å; E48-K51 PolarHBondContact O-N 3.46Å; E49-K51 VanDerWaalsContact C-N 3.32Å; E49-K51 PolarHBondContact O-N 3.41Å; K51-K54 PolarHBondContact O-N 3.4Å; K51-E55 WeakPolarHBondContact O-CB 3.42Å; K51-E55 PolarHBondContact O-N 3.14Å |
| 52 | R | 86.7 | Confident | 83.9 | Confident | 153 Ų | 153 | 125.9 Ų | 125.9 | 58% | 0.577 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -59.6 | -46.8 | 175.7 | -73.6 | -85.9 | -166.6 | 149.5 | 4.6 | 111.7 | E48 E49 K54 E55 I56 | E48-R52 WeakPolarHBondContact O-CB 3.5Å; E48-R52 VanDerWaalsContact O-CG 3.23Å; E48-R52 WeakPolarHBondContact O-CG 3.39Å; E48-R52 PolarHBondContact O-N 2.85Å; E48-R52 IonicContact OE1-NH2 3.68Å; E49-R52 PolarHBondContact O-N 2.83Å; R52-K54 VanDerWaalsContact C-N 3.34Å; R52-K54 PolarHBondContact O-N 2.94Å; R52-E55 PolarHBondContact O-N 3.31Å; R52-I56 VanDerWaalsContact O-CG1 3.28Å; R52-I56 WeakPolarHBondContact O-CG1 3.49Å; R52-I56 PolarHBondContact O-N 3Å |
| 53 | T | 81.5 | Confident | 83.8 | Confident | 84 Ų | 84 | 125.3 Ų | 125.3 | 52% | 0.515 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.1 | -45.3 | 178.7 | -57.4 | 0 | 0 | 0 | 0 | 111 | E49 E55 I56 E57 | E49-T53 WeakPolarHBondContact O-CB 3.43Å; E49-T53 PolarHBondContact O-N 2.84Å; E49-T53 PolarHBondContact O-OG1 3.01Å; T53-E55 VanDerWaalsContact C-N 3.35Å; T53-E55 PolarHBondContact O-N 3.47Å; T53-I56 PolarHBondContact O-N 3.42Å; T53-E57 PolarHBondContact O-N 3.4Å |
| 54 | K | 86.8 | Confident | 83.9 | Confident | 141 Ų | 141 | 125.1 Ų | 125.1 | 61% | 0.613 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -62.8 | -39.7 | 176.7 | -170.1 | 179.6 | 179.3 | -175.1 | 0 | 112.6 | R50 K51 R52 E57 E58 | R50-K54 WeakPolarHBondContact O-CB 3.28Å; R50-K54 PolarHBondContact O-N 3.32Å; K51-K54 PolarHBondContact O-N 3.4Å; R52-K54 VanDerWaalsContact C-N 3.34Å; R52-K54 PolarHBondContact O-N 2.94Å; K54-E57 PolarHBondContact O-N 2.93Å; K54-E58 WeakPolarHBondContact O-CB 3.18Å; K54-E58 PolarHBondContact O-N 2.86Å |
| 55 | E | 81.6 | Confident | 84.2 | Confident | 98 Ų | 98 | 122.9 Ų | 122.9 | 46% | 0.458 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66 | -39.4 | 176.6 | -172.3 | -176.4 | 169 | 0 | 0 | 111.9 | K51 R52 T53 E58 R59 | K51-E55 WeakPolarHBondContact O-CB 3.42Å; K51-E55 PolarHBondContact O-N 3.14Å; R52-E55 PolarHBondContact O-N 3.31Å; T53-E55 VanDerWaalsContact C-N 3.35Å; T53-E55 PolarHBondContact O-N 3.47Å; E55-E58 PolarHBondContact O-N 3.13Å; E55-R59 WeakPolarHBondContact O-CB 3.45Å; E55-R59 WeakPolarHBondContact O-CG 3.48Å; E55-R59 PolarHBondContact O-N 3.45Å |
| 56 | I | 78.6 | Confident | 84.3 | Confident | 100 Ų | 100 | 120.6 Ų | 120.6 | 51% | 0.513 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.6 | -44.3 | 175.8 | -66.7 | 163.3 | 0 | 0 | 0 | 110.4 | R52 T53 R59 M60 | R52-I56 VanDerWaalsContact O-CG1 3.28Å; R52-I56 WeakPolarHBondContact O-CG1 3.49Å; R52-I56 PolarHBondContact O-N 3Å; T53-I56 PolarHBondContact O-N 3.42Å; I56-R59 WeakPolarHBondContact O-CB 3.44Å; I56-R59 PolarHBondContact O-N 3.24Å; I56-M60 HydrophobicContact CG2-CE 4.19Å; I56-M60 HydrophobicContact CG2-SD 4.43Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.46Å; I56-M60 PolarHBondContact O-N 3.28Å |
| 57 | E | 76.2 | Confident | 84.7 | Confident | 126 Ų | 126 | 121.5 Ų | 121.5 | 59% | 0.589 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -60.4 | -46.1 | 175.8 | -174.8 | 179.9 | -170.5 | 0 | 0 | 111.9 | T53 K54 R59 M60 S61 | T53-E57 PolarHBondContact O-N 3.4Å; K54-E57 PolarHBondContact O-N 2.93Å; E57-R59 VanDerWaalsContact C-N 3.34Å; E57-R59 PolarHBondContact O-N 3.09Å; E57-M60 PolarHBondContact O-N 3.1Å; E57-S61 PolarHBondContact O-N 3.35Å |
| 58 | E | 80.9 | Confident | 85.5 | Confident | 137 Ų | 137 | 121.6 Ų | 121.6 | 64% | 0.64 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.9 | -39.3 | 176.8 | -171.5 | 178.7 | 166.6 | 0 | 0 | 111.7 | K54 E55 S61 L62 | K54-E58 WeakPolarHBondContact O-CB 3.18Å; K54-E58 PolarHBondContact O-N 2.86Å; E55-E58 PolarHBondContact O-N 3.13Å; E58-S61 PolarHBondContact O-N 3.3Å; E58-L62 VanDerWaalsContact O-CB 3.28Å; E58-L62 WeakPolarHBondContact O-CB 3.41Å; E58-L62 PolarHBondContact O-N 2.83Å |
| 59 | R | 86.3 | Confident | 86.1 | Confident | 168 Ų | 168 | 121 Ų | 121 | 63% | 0.634 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.4 | -43.9 | 173.1 | -77.4 | -87.2 | -172.5 | 161.3 | 0.9 | 111.6 | E55 I56 E57 E63 | E55-R59 WeakPolarHBondContact O-CB 3.45Å; E55-R59 WeakPolarHBondContact O-CG 3.48Å; E55-R59 PolarHBondContact O-N 3.45Å; I56-R59 WeakPolarHBondContact O-CB 3.44Å; I56-R59 PolarHBondContact O-N 3.24Å; E57-R59 VanDerWaalsContact C-N 3.34Å; E57-R59 PolarHBondContact O-N 3.09Å; R59-E63 WeakPolarHBondContact O-CB 3.41Å; R59-E63 PolarHBondContact O-N 3.07Å |
| 60 | M | 64.6 | Low | 86.7 | Confident | 124 Ų | 124 | 121 Ų | 121 | 61% | 0.611 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.2 | -42.1 | 177.8 | -69.7 | -171.4 | -57.2 | 0 | 0 | 111.6 | I56 E57 E63 E64 | I56-M60 HydrophobicContact CG2-CE 4.19Å; I56-M60 HydrophobicContact CG2-SD 4.43Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.46Å; I56-M60 PolarHBondContact O-N 3.28Å; E57-M60 PolarHBondContact O-N 3.1Å; M60-E63 WeakPolarHBondContact O-CB 3.32Å; M60-E63 PolarHBondContact O-N 3.43Å; M60-E64 PolarHBondContact O-N 3.24Å; M60-E64 VanDerWaalsContact O-N 3.09Å |
| 61 | S | 84.3 | Confident | 87.2 | Confident | 65 Ų | 65 | 119 Ų | 119 | 46% | 0.455 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.1 | -38.5 | 177.3 | -178.6 | 0 | 0 | 0 | 0 | 113 | E57 E58 E63 E64 T65 | E57-S61 PolarHBondContact O-N 3.35Å; E58-S61 PolarHBondContact O-N 3.3Å; S61-E63 VanDerWaalsContact C-N 3.3Å; S61-E63 PolarHBondContact O-N 3.02Å; S61-E64 PolarHBondContact O-N 3.42Å; S61-T65 PolarHBondContact O-N 2.96Å; S61-T65 VanDerWaalsContact O-N 3.16Å; S61-T65 PolarHBondContact O-OG1 3.46Å |
| 62 | L | 88.6 | Confident | 87.7 | Confident | 98 Ų | 98 | 118.1 Ų | 118.1 | 51% | 0.513 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.9 | -37.9 | 174.3 | -173.7 | 68.3 | 0 | 0 | 0 | 111.2 | E58 T65 K66 | E58-L62 VanDerWaalsContact O-CB 3.28Å; E58-L62 WeakPolarHBondContact O-CB 3.41Å; E58-L62 PolarHBondContact O-N 2.83Å; L62-T65 PolarHBondContact O-N 3.42Å; L62-K66 WeakPolarHBondContact O-CG 3.15Å; L62-K66 PolarHBondContact O-N 3.36Å |
| 63 | E | 87.8 | Confident | 88.2 | Confident | 108 Ų | 108 | 112.8 Ų | 112.8 | 51% | 0.505 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.3 | -42 | 176.8 | -155.3 | 63.8 | -153.2 | 0 | 0 | 111.7 | R59 M60 S61 T65 K66 E67 | R59-E63 WeakPolarHBondContact O-CB 3.41Å; R59-E63 PolarHBondContact O-N 3.07Å; M60-E63 WeakPolarHBondContact O-CB 3.32Å; M60-E63 PolarHBondContact O-N 3.43Å; S61-E63 VanDerWaalsContact C-N 3.3Å; S61-E63 PolarHBondContact O-N 3.02Å; E63-T65 VanDerWaalsContact C-N 3.3Å; E63-T65 PolarHBondContact O-N 3.03Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 2.91Å; E63-K66 VanDerWaalsContact O-N 3.17Å; E63-K66 IonicContact OE2-NZ 4Å; E63-K66 PolarHBondContact OE2-NZ 2.89Å; E63-E67 PolarHBondContact O-N 2.85Å |
| 64 | E | 90.9 | Very high | 89 | Confident | 137 Ų | 137 | 115 Ų | 115 | 64% | 0.64 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -58.3 | -41.8 | 173.6 | -173.3 | -177.6 | 177.5 | 0 | 0 | 111.9 | M60 S61 E67 Q68 | M60-E64 PolarHBondContact O-N 3.24Å; M60-E64 VanDerWaalsContact O-N 3.09Å; S61-E64 PolarHBondContact O-N 3.42Å; E64-E67 PolarHBondContact O-N 2.92Å; E64-Q68 PolarHBondContact O-N 3.36Å |
| 65 | T | 92.3 | Very high | 89.5 | Confident | 73 Ų | 73 | 115.5 Ų | 115.5 | 45% | 0.448 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.6 | -41.3 | 176.9 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | S61 L62 E63 E67 Q68 V69 | S61-T65 PolarHBondContact O-N 2.96Å; S61-T65 VanDerWaalsContact O-N 3.16Å; S61-T65 PolarHBondContact O-OG1 3.46Å; L62-T65 PolarHBondContact O-N 3.42Å; E63-T65 VanDerWaalsContact C-N 3.3Å; E63-T65 PolarHBondContact O-N 3.03Å; T65-E67 VanDerWaalsContact C-N 3.32Å; T65-E67 PolarHBondContact O-N 3.02Å; T65-Q68 PolarHBondContact O-N 3.48Å; T65-V69 WeakPolarHBondContact O-CG2 3.34Å; T65-V69 PolarHBondContact O-N 2.96Å; T65-V69 VanDerWaalsContact O-N 3.08Å |
| 66 | K | 94.8 | Very high | 90.3 | Very high | 98 Ų | 98 | 115.7 Ų | 115.7 | 43% | 0.426 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.3 | -42.6 | 175.1 | -71.1 | 179.7 | -162 | 156.7 | 0 | 111.5 | L62 E63 Q68 V69 M70 | L62-K66 WeakPolarHBondContact O-CG 3.15Å; L62-K66 PolarHBondContact O-N 3.36Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 2.91Å; E63-K66 VanDerWaalsContact O-N 3.17Å; E63-K66 IonicContact OE2-NZ 4Å; E63-K66 PolarHBondContact OE2-NZ 2.89Å; K66-Q68 VanDerWaalsContact C-N 3.32Å; K66-Q68 PolarHBondContact O-N 3.26Å; K66-V69 PolarHBondContact O-N 3.4Å; K66-M70 WeakPolarHBondContact O-CG 3.47Å; K66-M70 PolarHBondContact O-N 2.97Å |
| 67 | E | 95.1 | Very high | 91.2 | Very high | 137 Ų | 137 | 116.2 Ų | 116.2 | 64% | 0.64 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.9 | -43.2 | 178.2 | -168.8 | -176.9 | 168.3 | 0 | 0 | 111 | E63 E64 T65 V69 M70 K71 | E63-E67 PolarHBondContact O-N 2.85Å; E64-E67 PolarHBondContact O-N 2.92Å; T65-E67 VanDerWaalsContact C-N 3.32Å; T65-E67 PolarHBondContact O-N 3.02Å; E67-V69 PolarHBondContact O-N 2.92Å; E67-M70 PolarHBondContact O-N 3.37Å; E67-K71 WeakPolarHBondContact O-CB 3.31Å; E67-K71 PolarHBondContact O-N 3.05Å |
| 68 | Q | 96.5 | Very high | 92.3 | Very high | 127 Ų | 127 | 111.6 Ų | 111.6 | 59% | 0.593 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.9 | -42 | 176.3 | -167.3 | 177 | 35.4 | 0 | 0 | 112.3 | E64 T65 K66 K71 M72 | E64-Q68 PolarHBondContact O-N 3.36Å; T65-Q68 PolarHBondContact O-N 3.48Å; K66-Q68 VanDerWaalsContact C-N 3.32Å; K66-Q68 PolarHBondContact O-N 3.26Å; Q68-K71 PolarHBondContact O-N 3.43Å; Q68-M72 WeakPolarHBondContact O-CG 3.27Å; Q68-M72 PolarHBondContact O-N 2.89Å |
| 69 | V | 95.7 | Very high | 93.1 | Very high | 98 Ų | 98 | 109.6 Ų | 109.6 | 59% | 0.594 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -62.6 | -45.3 | 175.8 | 171.2 | 0 | 0 | 0 | 0 | 111 | T65 K66 E67 M72 G73 | T65-V69 WeakPolarHBondContact O-CG2 3.34Å; T65-V69 PolarHBondContact O-N 2.96Å; T65-V69 VanDerWaalsContact O-N 3.08Å; K66-V69 PolarHBondContact O-N 3.4Å; E67-V69 PolarHBondContact O-N 2.92Å; V69-M72 PolarHBondContact O-N 3.23Å; V69-G73 PolarHBondContact O-N 3.16Å |
| 70 | M | 97 | Very high | 93.7 | Very high | 127 Ų | 127 | 107.4 Ų | 107.4 | 63% | 0.626 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60 | -48 | 176.6 | -76.7 | -175.7 | 57.1 | 0 | 0 | 111.6 | K66 E67 M72 G73 E74 | K66-M70 WeakPolarHBondContact O-CG 3.47Å; K66-M70 PolarHBondContact O-N 2.97Å; E67-M70 PolarHBondContact O-N 3.37Å; M70-M72 VanDerWaalsContact C-N 3.32Å; M70-M72 PolarHBondContact O-N 2.98Å; M70-G73 CarbonylContact O-C 3.59Å; M70-G73 WeakPolarHBondContact O-CA 3.48Å; M70-G73 PolarHBondContact O-N 3.31Å; M70-E74 PolarHBondContact O-N 3.08Å |
| 71 | K | 97.9 | Very high | 95.3 | Very high | 150 Ų | 150 | 106.6 Ų | 106.6 | 65% | 0.652 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.4 | -40.1 | 178.7 | -174.1 | 174.5 | -173.8 | 171.4 | 0 | 112.7 | E67 Q68 K75 | E67-K71 WeakPolarHBondContact O-CB 3.31Å; E67-K71 PolarHBondContact O-N 3.05Å; Q68-K71 PolarHBondContact O-N 3.43Å; K71-K75 WeakPolarHBondContact O-CB 3.23Å; K71-K75 PolarHBondContact O-N 2.9Å |
| 72 | M | 97.9 | Very high | 96 | Very high | 132 Ų | 132 | 109 Ų | 109 | 65% | 0.65 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67 | -37.7 | 173.4 | -74.5 | -170.1 | 66.8 | 0 | 0 | 112 | Q68 V69 M70 K75 L76 | Q68-M72 WeakPolarHBondContact O-CG 3.27Å; Q68-M72 PolarHBondContact O-N 2.89Å; V69-M72 PolarHBondContact O-N 3.23Å; M70-M72 VanDerWaalsContact C-N 3.32Å; M70-M72 PolarHBondContact O-N 2.98Å; M72-K75 PolarHBondContact O-N 3.34Å; M72-L76 WeakPolarHBondContact O-CB 3.48Å; M72-L76 PolarHBondContact O-N 3.22Å |
| 73 | G | 96.8 | Very high | 96.4 | Very high | 40 Ų | 40 | 111.3 Ų | 111.3 | 41% | 0.412 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -59.7 | -48 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V69 M70 K75 L76 Q77 | V69-G73 PolarHBondContact O-N 3.16Å; M70-G73 CarbonylContact O-C 3.59Å; M70-G73 WeakPolarHBondContact O-CA 3.48Å; M70-G73 PolarHBondContact O-N 3.31Å; G73-K75 PolarHBondContact O-N 3.37Å; G73-L76 PolarHBondContact O-N 3.38Å; G73-Q77 PolarHBondContact O-N 3.48Å |
| 74 | E | 97.9 | Very high | 96.9 | Very high | 131 Ų | 131 | 111.2 Ų | 111.2 | 61% | 0.612 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -60.5 | -44.7 | 175.5 | -70.8 | 178.9 | 170.2 | 0 | 0 | 111.9 | M70 L76 Q77 G78 | M70-E74 PolarHBondContact O-N 3.08Å; E74-L76 VanDerWaalsContact C-N 3.32Å; E74-L76 PolarHBondContact O-N 3.33Å; E74-Q77 PolarHBondContact O-N 3.46Å; E74-G78 PolarHBondContact O-N 3.32Å |
| 75 | K | 98.2 | Very high | 97.3 | Very high | 151 Ų | 151 | 111.4 Ų | 111.4 | 66% | 0.657 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.1 | -40.8 | 177.2 | -172.8 | 174.8 | -177.8 | 178.1 | 0 | 112 | K71 M72 G73 Q77 G78 L79 | K71-K75 WeakPolarHBondContact O-CB 3.23Å; K71-K75 PolarHBondContact O-N 2.9Å; M72-K75 PolarHBondContact O-N 3.34Å; G73-K75 PolarHBondContact O-N 3.37Å; K75-Q77 VanDerWaalsContact C-N 3.35Å; K75-G78 PolarHBondContact O-N 3.44Å; K75-L79 HydrophobicContact CG-CD1 4.4Å; K75-L79 WeakPolarHBondContact O-CG 3.21Å; K75-L79 PolarHBondContact O-N 3.24Å |
| 76 | L | 98.4 | Very high | 97.6 | Very high | 102 Ų | 102 | 113.1 Ų | 113.1 | 53% | 0.534 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.4 | -43.3 | 176.3 | -178.3 | 64.1 | 0 | 0 | 0 | 111 | M72 G73 E74 L79 Q80 | M72-L76 WeakPolarHBondContact O-CB 3.48Å; M72-L76 PolarHBondContact O-N 3.22Å; G73-L76 PolarHBondContact O-N 3.38Å; E74-L76 VanDerWaalsContact C-N 3.32Å; E74-L76 PolarHBondContact O-N 3.33Å; L76-L79 PolarHBondContact O-N 3.05Å; L76-Q80 WeakPolarHBondContact O-CG 3.44Å; L76-Q80 PolarHBondContact O-N 3.28Å |
| 77 | Q | 98.3 | Very high | 97.8 | Very high | 111 Ų | 111 | 114.2 Ų | 114.2 | 52% | 0.519 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.2 | -48.5 | 176 | -177.3 | 179.7 | -21.6 | 0 | 0 | 111.4 | G73 E74 K75 L79 Q80 E81 | G73-Q77 PolarHBondContact O-N 3.48Å; E74-Q77 PolarHBondContact O-N 3.46Å; K75-Q77 VanDerWaalsContact C-N 3.35Å; Q77-L79 VanDerWaalsContact C-N 3.32Å; Q77-L79 PolarHBondContact O-N 3.17Å; Q77-Q80 WeakPolarHBondContact O-CB 3.38Å; Q77-Q80 PolarHBondContact O-N 2.92Å; Q77-E81 WeakPolarHBondContact CG-OE1 3.49Å; Q77-E81 PolarHBondContact NE2-OE1 3.48Å; Q77-E81 WeakPolarHBondContact O-CG 3.28Å; Q77-E81 PolarHBondContact O-N 3.16Å |
| 78 | G | 98.2 | Very high | 98 | Very high | 30 Ų | 30 | 111.5 Ų | 111.5 | 31% | 0.309 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -57.6 | -43.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E74 K75 Q80 E81 E82 | E74-G78 PolarHBondContact O-N 3.32Å; K75-G78 PolarHBondContact O-N 3.44Å; G78-Q80 VanDerWaalsContact C-N 3.33Å; G78-Q80 PolarHBondContact O-N 3.35Å; G78-E81 PolarHBondContact O-N 3.35Å; G78-E82 WeakPolarHBondContact O-CG 3.41Å; G78-E82 PolarHBondContact O-N 2.96Å |
| 79 | L | 98.5 | Very high | 98 | Very high | 94 Ų | 94 | 111.3 Ų | 111.3 | 49% | 0.492 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.7 | -35.2 | 175.8 | -72.1 | 173.2 | 0 | 0 | 0 | 112.9 | K75 L76 Q77 K83 | K75-L79 HydrophobicContact CG-CD1 4.4Å; K75-L79 WeakPolarHBondContact O-CG 3.21Å; K75-L79 PolarHBondContact O-N 3.24Å; L76-L79 PolarHBondContact O-N 3.05Å; Q77-L79 VanDerWaalsContact C-N 3.32Å; Q77-L79 PolarHBondContact O-N 3.17Å; L79-K83 VanDerWaalsContact O-CB 3.27Å; L79-K83 WeakPolarHBondContact O-CB 3.28Å; L79-K83 PolarHBondContact O-N 3.01Å |
| 80 | Q | 98.3 | Very high | 98.2 | Very high | 122 Ų | 122 | 111.3 Ų | 111.3 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.5 | -40.1 | 174.4 | -74.2 | -178.9 | 1.1 | 0 | 0 | 111.9 | L76 Q77 G78 K83 H84 | L76-Q80 WeakPolarHBondContact O-CG 3.44Å; L76-Q80 PolarHBondContact O-N 3.28Å; Q77-Q80 WeakPolarHBondContact O-CB 3.38Å; Q77-Q80 PolarHBondContact O-N 2.92Å; G78-Q80 VanDerWaalsContact C-N 3.33Å; G78-Q80 PolarHBondContact O-N 3.35Å; Q80-K83 PolarHBondContact O-N 2.85Å; Q80-H84 WeakPolarHBondContact O-CB 3.48Å; Q80-H84 PolarHBondContact O-N 3.49Å |
| 81 | E | 98.1 | Very high | 98.2 | Very high | 107 Ų | 107 | 111.9 Ų | 111.9 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 175.6 | -70.6 | 174.5 | -165.8 | 0 | 0 | 111.7 | Q77 G78 H84 Q85 | Q77-E81 WeakPolarHBondContact CG-OE1 3.49Å; Q77-E81 PolarHBondContact NE2-OE1 3.48Å; Q77-E81 WeakPolarHBondContact O-CG 3.28Å; Q77-E81 PolarHBondContact O-N 3.16Å; G78-E81 PolarHBondContact O-N 3.35Å; E81-H84 CarbonylContact O-C 3.59Å; E81-H84 WeakPolarHBondContact O-CB 3.44Å; E81-H84 PolarHBondContact O-N 2.93Å; E81-H84 VanDerWaalsContact O-N 3.14Å; E81-Q85 PolarHBondContact O-N 3.21Å |
| 82 | E | 98 | Very high | 98.3 | Very high | 116 Ų | 116 | 111.4 Ų | 111.4 | 54% | 0.542 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.3 | -46.5 | 173.7 | -75.4 | -174.1 | 169.5 | 0 | 0 | 111.6 | G78 H84 Q85 L86 | G78-E82 WeakPolarHBondContact O-CG 3.41Å; G78-E82 PolarHBondContact O-N 2.96Å; E82-H84 PolarHBondContact O-N 3.46Å; E82-Q85 WeakPolarHBondContact O-CB 3.49Å; E82-Q85 PolarHBondContact O-N 3.38Å; E82-Q85 VanDerWaalsContact O-N 3.13Å; E82-L86 WeakPolarHBondContact O-CG 3.47Å; E82-L86 PolarHBondContact O-N 2.9Å |
| 83 | K | 98.4 | Very high | 98.3 | Very high | 146 Ų | 146 | 109 Ų | 109 | 64% | 0.635 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -58 | -38.9 | 174.6 | 179.4 | -95.7 | 178.5 | 175.8 | 0 | 111.3 | L79 Q80 F87 | L79-K83 VanDerWaalsContact O-CB 3.27Å; L79-K83 WeakPolarHBondContact O-CB 3.28Å; L79-K83 PolarHBondContact O-N 3.01Å; Q80-K83 PolarHBondContact O-N 2.85Å; K83-F87 WeakPolarHBondContact O-CB 3.35Å; K83-F87 PolarHBondContact O-N 3.05Å; K83-F87 VanDerWaalsContact O-N 3.12Å |
| 84 | H | 98.7 | Very high | 98.3 | Very high | 107 Ų | 107 | 112.1 Ų | 112.1 | 50% | 0.495 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.4 | -43.8 | 174.9 | -177.3 | 67.5 | 0 | 0 | 0 | 112.1 | Q80 E81 E82 F87 L88 | Q80-H84 WeakPolarHBondContact O-CB 3.48Å; Q80-H84 PolarHBondContact O-N 3.49Å; E81-H84 CarbonylContact O-C 3.59Å; E81-H84 WeakPolarHBondContact O-CB 3.44Å; E81-H84 PolarHBondContact O-N 2.93Å; E81-H84 VanDerWaalsContact O-N 3.14Å; E82-H84 PolarHBondContact O-N 3.46Å; H84-F87 WeakPolarHBondContact O-CB 3.46Å; H84-F87 PolarHBondContact O-N 2.93Å; H84-L88 WeakPolarHBondContact O-CG 3.27Å; H84-L88 PolarHBondContact O-N 3.26Å |
| 85 | Q | 98.6 | Very high | 98.3 | Very high | 141 Ų | 141 | 112.2 Ų | 112.2 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -59.1 | -47.5 | 175 | -95 | -168.1 | 50 | 0 | 0 | 112.3 | E81 E82 F87 L88 Q89 | E81-Q85 PolarHBondContact O-N 3.21Å; E82-Q85 WeakPolarHBondContact O-CB 3.49Å; E82-Q85 PolarHBondContact O-N 3.38Å; E82-Q85 VanDerWaalsContact O-N 3.13Å; Q85-F87 VanDerWaalsContact C-N 3.26Å; Q85-F87 PolarHBondContact O-N 2.83Å; Q85-L88 WeakPolarHBondContact O-CB 3.37Å; Q85-L88 PolarHBondContact O-N 2.93Å; Q85-L88 VanDerWaalsContact O-N 3.09Å; Q85-Q89 PolarHBondContact O-N 3.44Å |
| 86 | L | 98.6 | Very high | 98.2 | Very high | 109 Ų | 109 | 111.1 Ų | 111.1 | 57% | 0.571 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.9 | -38.7 | 177.6 | -71.2 | 174.5 | 0 | 0 | 0 | 111.4 | E82 L88 Q89 L90 | E82-L86 WeakPolarHBondContact O-CG 3.47Å; E82-L86 PolarHBondContact O-N 2.9Å; L86-L88 PolarHBondContact O-N 3.09Å; L86-Q89 PolarHBondContact O-N 3.28Å; L86-L90 WeakPolarHBondContact O-CB 3.3Å; L86-L90 PolarHBondContact O-N 3.48Å |
| 87 | F | 98.7 | Very high | 98 | Very high | 120 Ų | 120 | 110.4 Ų | 110.4 | 53% | 0.526 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.9 | -42.6 | 173.8 | 179.8 | -97.1 | 0 | 0 | 0 | 112.2 | K83 H84 Q85 L90 K91 | K83-F87 WeakPolarHBondContact O-CB 3.35Å; K83-F87 PolarHBondContact O-N 3.05Å; K83-F87 VanDerWaalsContact O-N 3.12Å; H84-F87 WeakPolarHBondContact O-CB 3.46Å; H84-F87 PolarHBondContact O-N 2.93Å; Q85-F87 VanDerWaalsContact C-N 3.26Å; Q85-F87 PolarHBondContact O-N 2.83Å; F87-L90 PolarHBondContact O-N 3.36Å; F87-K91 WeakPolarHBondContact O-CB 3.23Å; F87-K91 PolarHBondContact O-N 3.46Å |
| 88 | L | 98.6 | Very high | 97.8 | Very high | 81 Ų | 81 | 108.2 Ų | 108.2 | 42% | 0.424 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 174.9 | -67.2 | 178.3 | 0 | 0 | 0 | 112.1 | H84 Q85 L86 K91 K92 | H84-L88 WeakPolarHBondContact O-CG 3.27Å; H84-L88 PolarHBondContact O-N 3.26Å; Q85-L88 WeakPolarHBondContact O-CB 3.37Å; Q85-L88 PolarHBondContact O-N 2.93Å; Q85-L88 VanDerWaalsContact O-N 3.09Å; L86-L88 PolarHBondContact O-N 3.09Å; L88-K91 WeakPolarHBondContact O-CB 3.4Å; L88-K91 PolarHBondContact O-N 3.28Å; L88-K92 PolarHBondContact O-N 2.89Å |
| 89 | Q | 98.3 | Very high | 97.7 | Very high | 122 Ų | 122 | 114 Ų | 114 | 57% | 0.57 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.6 | -46.1 | 176.6 | -172.4 | 173.9 | 33.2 | 0 | 0 | 111.1 | Q85 L86 K91 K92 V93 | Q85-Q89 PolarHBondContact O-N 3.44Å; L86-Q89 PolarHBondContact O-N 3.28Å; Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 3.31Å; Q89-K92 WeakPolarHBondContact O-CB 3.41Å; Q89-K92 PolarHBondContact O-N 2.97Å; Q89-K92 VanDerWaalsContact O-N 3.14Å; Q89-V93 WeakPolarHBondContact O-CG2 3.44Å; Q89-V93 PolarHBondContact O-N 3.27Å |
| 90 | L | 98.3 | Very high | 97.5 | Very high | 98 Ų | 98 | 115.4 Ų | 115.4 | 51% | 0.513 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.8 | -45.5 | 174.6 | 179 | 61.3 | 0 | 0 | 0 | 111.1 | L86 F87 K92 V93 L94 | L86-L90 WeakPolarHBondContact O-CB 3.3Å; L86-L90 PolarHBondContact O-N 3.48Å; F87-L90 PolarHBondContact O-N 3.36Å; L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 3.05Å; L90-V93 PolarHBondContact O-N 2.96Å; L90-L94 HydrophobicContact CD1-CD1 4.36Å; L90-L94 HydrophobicContact CD1-CG 4.2Å; L90-L94 HydrophobicContact CG-CD1 4.19Å; L90-L94 HydrophobicContact CG-CG 4.44Å; L90-L94 WeakPolarHBondContact O-CG 3.42Å; L90-L94 PolarHBondContact O-N 3.42Å |
| 91 | K | 98.4 | Very high | 97.2 | Very high | 140 Ų | 140 | 115.8 Ų | 115.8 | 61% | 0.609 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -57.7 | -41 | 176 | -175.3 | -179.1 | 179.5 | -178 | 0 | 111.8 | F87 L88 Q89 H95 | F87-K91 WeakPolarHBondContact O-CB 3.23Å; F87-K91 PolarHBondContact O-N 3.46Å; L88-K91 WeakPolarHBondContact O-CB 3.4Å; L88-K91 PolarHBondContact O-N 3.28Å; Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 3.31Å; K91-H95 PolarHBondContact O-N 2.86Å; K91-H95 VanDerWaalsContact O-N 3.09Å |
| 92 | K | 98.3 | Very high | 96.9 | Very high | 140 Ų | 140 | 118.4 Ų | 118.4 | 61% | 0.609 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.8 | -49.2 | 176.3 | -175.9 | -175.9 | 176.4 | -174.6 | 0 | 111.3 | L88 Q89 L90 L94 H95 E96 | L88-K92 PolarHBondContact O-N 2.89Å; Q89-K92 WeakPolarHBondContact O-CB 3.41Å; Q89-K92 PolarHBondContact O-N 2.97Å; Q89-K92 VanDerWaalsContact O-N 3.14Å; L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 3.05Å; K92-L94 PolarHBondContact O-N 3.37Å; K92-H95 WeakPolarHBondContact O-CB 3.24Å; K92-H95 PolarHBondContact O-N 3.48Å; K92-H95 VanDerWaalsContact O-N 3.13Å; K92-E96 PolarHBondContact O-N 2.9Å |
| 93 | V | 98.2 | Very high | 96.4 | Very high | 82 Ų | 82 | 119.3 Ų | 119.3 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.7 | -44.4 | 179.7 | 172.4 | 0 | 0 | 0 | 0 | 111 | Q89 L90 H95 E96 E97 | Q89-V93 WeakPolarHBondContact O-CG2 3.44Å; Q89-V93 PolarHBondContact O-N 3.27Å; L90-V93 PolarHBondContact O-N 2.96Å; V93-H95 VanDerWaalsContact C-N 3.29Å; V93-H95 PolarHBondContact O-N 3.23Å; V93-E96 PolarHBondContact O-N 3.48Å; V93-E97 WeakPolarHBondContact O-CB 3.28Å; V93-E97 PolarHBondContact O-N 2.9Å |
| 94 | L | 97.9 | Very high | 95.7 | Very high | 104 Ų | 104 | 116.7 Ų | 116.7 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.8 | -36.3 | 175.7 | -70.6 | 178.4 | 0 | 0 | 0 | 112.6 | L90 K92 E98 | L90-L94 HydrophobicContact CD1-CD1 4.36Å; L90-L94 HydrophobicContact CD1-CG 4.2Å; L90-L94 HydrophobicContact CG-CD1 4.19Å; L90-L94 HydrophobicContact CG-CG 4.44Å; L90-L94 WeakPolarHBondContact O-CG 3.42Å; L90-L94 PolarHBondContact O-N 3.42Å; K92-L94 PolarHBondContact O-N 3.37Å; L94-E98 VanDerWaalsContact O-CB 3.3Å; L94-E98 WeakPolarHBondContact O-CB 3.32Å; L94-E98 PolarHBondContact O-N 3.31Å |
| 95 | H | 97.2 | Very high | 94.9 | Very high | 134 Ų | 134 | 117.1 Ų | 117.1 | 62% | 0.62 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67.8 | -40.3 | 176.4 | -170.1 | 75.5 | 0 | 0 | 0 | 112.3 | K91 K92 V93 K99 | K91-H95 PolarHBondContact O-N 2.86Å; K91-H95 VanDerWaalsContact O-N 3.09Å; K92-H95 WeakPolarHBondContact O-CB 3.24Å; K92-H95 PolarHBondContact O-N 3.48Å; K92-H95 VanDerWaalsContact O-N 3.13Å; V93-H95 VanDerWaalsContact C-N 3.29Å; V93-H95 PolarHBondContact O-N 3.23Å; H95-K99 WeakPolarHBondContact O-CB 3.41Å; H95-K99 PolarHBondContact O-N 2.85Å |
| 96 | E | 96.6 | Very high | 94.1 | Very high | 128 Ų | 128 | 113 Ų | 113 | 60% | 0.598 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.1 | -40 | 174.9 | -65.1 | -143.4 | 137.9 | 0 | 0 | 112 | K92 V93 K99 R100 | K92-E96 PolarHBondContact O-N 2.9Å; V93-E96 PolarHBondContact O-N 3.48Å; E96-K99 PolarHBondContact O-N 3.46Å; E96-R100 WeakPolarHBondContact O-CB 3.17Å; E96-R100 PolarHBondContact O-N 2.91Å |
| 97 | E | 94.3 | Very high | 93.1 | Very high | 87 Ų | 87 | 111.3 Ų | 111.3 | 41% | 0.407 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59 | -47.9 | 174.4 | -169.2 | 64.5 | -161.3 | 0 | 0 | 111.4 | V93 K99 R100 R101 | V93-E97 WeakPolarHBondContact O-CB 3.28Å; V93-E97 PolarHBondContact O-N 2.9Å; E97-K99 VanDerWaalsContact C-N 3.3Å; E97-K99 PolarHBondContact O-N 2.93Å; E97-R100 PolarHBondContact O-N 3.36Å; E97-R100 IonicContact OE1-CZ 3.97Å; E97-R100 IonicContact OE1-NH1 3.99Å; E97-R100 IonicContact OE1-NH2 3.05Å; E97-R100 PolarHBondContact OE1-NH2 3.29Å; E97-R100 IonicContact OE2-CZ 3.46Å; E97-R100 IonicContact OE2-NE 3.48Å; E97-R100 IonicContact OE2-NH2 2.6Å; E97-R100 PolarHBondContact OE2-NH2 3.32Å; E97-R101 VanDerWaalsContact O-CB 3.31Å; E97-R101 WeakPolarHBondContact O-CB 3.33Å; E97-R101 PolarHBondContact O-N 2.84Å |
| 98 | E | 94.3 | Very high | 92.2 | Very high | 65 Ų | 65 | 110.4 Ų | 110.4 | 30% | 0.304 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59 | -42.2 | 176.2 | -178.1 | 69.4 | -137.2 | 0 | 0 | 111.4 | L94 R101 R102 | L94-E98 VanDerWaalsContact O-CB 3.3Å; L94-E98 WeakPolarHBondContact O-CB 3.32Å; L94-E98 PolarHBondContact O-N 3.31Å; E98-R101 IonicContact OE1-CZ 3.7Å; E98-R101 IonicContact OE1-NE 3.94Å; E98-R101 IonicContact OE1-NH2 2.72Å; E98-R101 PolarHBondContact OE1-NH2 2.88Å; E98-R101 IonicContact OE2-CZ 3.57Å; E98-R101 IonicContact OE2-NH2 2.78Å; E98-R101 PolarHBondContact OE2-NH2 2.94Å; E98-R102 PolarHBondContact O-N 3.37Å; E98-R102 IonicContact OE1-NH2 2.7Å |
| 99 | K | 94.8 | Very high | 91.1 | Very high | 152 Ų | 152 | 110.5 Ų | 110.5 | 66% | 0.661 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.1 | -43.3 | 179 | -169.1 | -179.9 | 179.8 | -176.2 | 0 | 111.6 | H95 E96 E97 R102 K103 | H95-K99 WeakPolarHBondContact O-CB 3.41Å; H95-K99 PolarHBondContact O-N 2.85Å; E96-K99 PolarHBondContact O-N 3.46Å; E97-K99 VanDerWaalsContact C-N 3.3Å; E97-K99 PolarHBondContact O-N 2.93Å; K99-R102 PolarHBondContact O-N 3.3Å; K99-K103 PolarHBondContact O-N 3.43Å |
| 100 | R | 94.7 | Very high | 90 | Very high | 123 Ų | 123 | 108.9 Ų | 108.9 | 46% | 0.464 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.5 | -46.2 | 175.9 | -179.9 | 169.3 | 58.9 | 93 | -10.5 | 111.1 | E96 E97 R102 K103 E104 | E96-R100 WeakPolarHBondContact O-CB 3.17Å; E96-R100 PolarHBondContact O-N 2.91Å; E97-R100 PolarHBondContact O-N 3.36Å; E97-R100 IonicContact OE1-CZ 3.97Å; E97-R100 IonicContact OE1-NH1 3.99Å; E97-R100 IonicContact OE1-NH2 3.05Å; E97-R100 PolarHBondContact OE1-NH2 3.29Å; E97-R100 IonicContact OE2-CZ 3.46Å; E97-R100 IonicContact OE2-NE 3.48Å; E97-R100 IonicContact OE2-NH2 2.6Å; E97-R100 PolarHBondContact OE2-NH2 3.32Å; R100-R102 VanDerWaalsContact C-N 3.35Å; R100-R102 PolarHBondContact O-N 2.88Å; R100-K103 WeakPolarHBondContact O-CB 3.38Å; R100-K103 PolarHBondContact O-N 3.5Å; R100-E104 WeakPolarHBondContact CG-OE1 3.34Å; R100-E104 IonicContact NH1-OE1 3.08Å; R100-E104 PolarHBondContact NH1-OE1 2.85Å; R100-E104 VanDerWaalsContact NH1-OE1 3.08Å; R100-E104 PolarHBondContact O-N 3.35Å |
| 101 | R | 93.1 | Very high | 88.6 | Confident | 129 Ų | 129 | 110.2 Ų | 110.2 | 49% | 0.487 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.7 | -42.5 | 176.5 | -172.9 | -176.2 | 67.7 | 173.9 | 0.2 | 112.4 | E97 E98 K103 E104 Q105 | E97-R101 VanDerWaalsContact O-CB 3.31Å; E97-R101 WeakPolarHBondContact O-CB 3.33Å; E97-R101 PolarHBondContact O-N 2.84Å; E98-R101 IonicContact OE1-CZ 3.7Å; E98-R101 IonicContact OE1-NE 3.94Å; E98-R101 IonicContact OE1-NH2 2.72Å; E98-R101 PolarHBondContact OE1-NH2 2.88Å; E98-R101 IonicContact OE2-CZ 3.57Å; E98-R101 IonicContact OE2-NH2 2.78Å; E98-R101 PolarHBondContact OE2-NH2 2.94Å; R101-K103 VanDerWaalsContact C-N 3.3Å; R101-K103 PolarHBondContact O-N 2.9Å; R101-E104 PolarHBondContact O-N 2.93Å; R101-Q105 WeakPolarHBondContact O-CB 3.49Å; R101-Q105 PolarHBondContact O-N 3.38Å |
| 102 | R | 91.3 | Very high | 87.2 | Confident | 163 Ų | 163 | 106.6 Ų | 106.6 | 62% | 0.615 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.6 | -37.9 | 175.1 | -77 | -148.2 | -157.6 | 99.3 | 7.7 | 112.6 | E98 K99 R100 Q105 S106 | E98-R102 PolarHBondContact O-N 3.37Å; E98-R102 IonicContact OE1-NH2 2.7Å; K99-R102 PolarHBondContact O-N 3.3Å; R100-R102 VanDerWaalsContact C-N 3.35Å; R100-R102 PolarHBondContact O-N 2.88Å; R102-Q105 PolarHBondContact O-N 3.47Å; R102-S106 PolarHBondContact O-N 2.82Å; R102-S106 PolarHBondContact O-OG 2.69Å |
| 103 | K | 88.3 | Confident | 85.3 | Confident | 135 Ų | 135 | 103.2 Ų | 103.2 | 59% | 0.587 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.9 | -45.8 | 176.3 | -168.3 | -177.3 | 175.2 | -165.3 | 0 | 111.1 | K99 R100 R101 Q105 S106 D107 | K99-K103 PolarHBondContact O-N 3.43Å; R100-K103 WeakPolarHBondContact O-CB 3.38Å; R100-K103 PolarHBondContact O-N 3.5Å; R101-K103 VanDerWaalsContact C-N 3.3Å; R101-K103 PolarHBondContact O-N 2.9Å; K103-Q105 VanDerWaalsContact C-N 3.31Å; K103-Q105 PolarHBondContact O-N 2.89Å; K103-S106 WeakPolarHBondContact CA-OG 3.29Å; K103-S106 PolarHBondContact O-N 3.13Å; K103-S106 PolarHBondContact O-OG 3.38Å; K103-D107 WeakPolarHBondContact O-CB 3.44Å; K103-D107 PolarHBondContact O-N 2.85Å |
| 104 | E | 82.7 | Confident | 83.4 | Confident | 90 Ų | 90 | 102.4 Ų | 102.4 | 42% | 0.421 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.1 | -40.7 | 174.7 | -71.6 | 171.4 | -166.1 | 0 | 0 | 111.7 | R100 R101 D107 I108 | R100-E104 WeakPolarHBondContact CG-OE1 3.34Å; R100-E104 IonicContact NH1-OE1 3.08Å; R100-E104 PolarHBondContact NH1-OE1 2.85Å; R100-E104 VanDerWaalsContact NH1-OE1 3.08Å; R100-E104 PolarHBondContact O-N 3.35Å; R101-E104 PolarHBondContact O-N 2.93Å; E104-D107 PolarHBondContact O-N 2.95Å; E104-I108 WeakPolarHBondContact O-CB 3.5Å; E104-I108 PolarHBondContact O-N 2.7Å |
| 105 | Q | 83.1 | Confident | 81.1 | Confident | 116 Ų | 116 | 101.1 Ų | 101.1 | 54% | 0.542 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.4 | -40.1 | 176 | -160.4 | 78.1 | 49.1 | 0 | 0 | 112.3 | R101 R102 K103 T109 | R101-Q105 WeakPolarHBondContact O-CB 3.49Å; R101-Q105 PolarHBondContact O-N 3.38Å; R102-Q105 PolarHBondContact O-N 3.47Å; K103-Q105 VanDerWaalsContact C-N 3.31Å; K103-Q105 PolarHBondContact O-N 2.89Å; Q105-T109 WeakPolarHBondContact O-CB 3.44Å; Q105-T109 PolarHBondContact O-N 3.05Å; Q105-T109 PolarHBondContact O-OG1 3.43Å |
| 106 | S | 80.7 | Confident | 78.8 | Confident | 55 Ų | 55 | 103.3 Ų | 103.3 | 39% | 0.385 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.4 | -36.5 | 174.3 | 57.7 | 0 | 0 | 0 | 0 | 112.2 | R102 K103 T109 T110 | R102-S106 PolarHBondContact O-N 2.82Å; R102-S106 PolarHBondContact O-OG 2.69Å; K103-S106 WeakPolarHBondContact CA-OG 3.29Å; K103-S106 PolarHBondContact O-N 3.13Å; K103-S106 PolarHBondContact O-OG 3.38Å; S106-T109 PolarHBondContact O-N 3.17Å; S106-T110 VanDerWaalsContact O-CB 3.32Å; S106-T110 WeakPolarHBondContact O-CB 3.39Å; S106-T110 PolarHBondContact O-N 3.08Å; S106-T110 PolarHBondContact O-OG1 3.38Å |
| 107 | D | 78.3 | Confident | 76.5 | Confident | 73 Ų | 73 | 105.5 Ų | 105.5 | 39% | 0.39 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69.7 | -43 | 179.2 | -67.8 | -14.8 | 0 | 0 | 0 | 110.6 | K103 E104 T110 L111 | K103-D107 WeakPolarHBondContact O-CB 3.44Å; K103-D107 PolarHBondContact O-N 2.85Å; E104-D107 PolarHBondContact O-N 2.95Å; D107-T110 PolarHBondContact O-N 3.43Å; D107-L111 WeakPolarHBondContact O-CB 3.43Å; D107-L111 WeakPolarHBondContact O-CG 3.25Å; D107-L111 PolarHBondContact O-N 2.9Å |
| 108 | I | 78.4 | Confident | 74.2 | Confident | 101 Ų | 101 | 106.5 Ų | 106.5 | 52% | 0.518 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.9 | -45.5 | 172.7 | -81.3 | 169.8 | 0 | 0 | 0 | 111.6 | E104 T110 L111 T112 | E104-I108 WeakPolarHBondContact O-CB 3.5Å; E104-I108 PolarHBondContact O-N 2.7Å; I108-T110 VanDerWaalsContact C-N 3.31Å; I108-T110 PolarHBondContact O-N 2.85Å; I108-L111 PolarHBondContact O-N 2.94Å; I108-T112 WeakPolarHBondContact O-CB 3.37Å; I108-T112 PolarHBondContact O-N 3.38Å; I108-T112 PolarHBondContact O-OG1 2.9Å |
| 109 | T | 76.4 | Confident | 71.7 | Confident | 84 Ų | 84 | 107.6 Ų | 107.6 | 52% | 0.515 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.8 | -40 | 178.7 | -59.6 | 0 | 0 | 0 | 0 | 110.8 | Q105 S106 S113 | Q105-T109 WeakPolarHBondContact O-CB 3.44Å; Q105-T109 PolarHBondContact O-N 3.05Å; Q105-T109 PolarHBondContact O-OG1 3.43Å; S106-T109 PolarHBondContact O-N 3.17Å; T109-S113 WeakPolarHBondContact O-CB 3.48Å; T109-S113 PolarHBondContact O-N 3.38Å; T109-S113 PolarHBondContact O-OG 2.91Å |
| 110 | T | 74.8 | Confident | 69.1 | Low | 87 Ų | 87 | 108 Ų | 108 | 53% | 0.534 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.4 | -45.8 | 177.4 | -55.6 | 0 | 0 | 0 | 0 | 111.9 | S106 D107 I108 T112 S113 A114 | S106-T110 VanDerWaalsContact O-CB 3.32Å; S106-T110 WeakPolarHBondContact O-CB 3.39Å; S106-T110 PolarHBondContact O-N 3.08Å; S106-T110 PolarHBondContact O-OG1 3.38Å; D107-T110 PolarHBondContact O-N 3.43Å; I108-T110 VanDerWaalsContact C-N 3.31Å; I108-T110 PolarHBondContact O-N 2.85Å; T110-T112 PolarHBondContact O-N 2.79Å; T110-S113 WeakPolarHBondContact CA-OG 3.45Å; T110-S113 PolarHBondContact O-N 2.95Å; T110-S113 PolarHBondContact O-OG 3.28Å; T110-A114 WeakPolarHBondContact O-CB 3.25Å; T110-A114 PolarHBondContact O-N 2.99Å |
| 111 | L | 70.2 | Confident | 67.1 | Low | 126 Ų | 126 | 107.8 Ų | 107.8 | 66% | 0.66 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.1 | -37.8 | 177.5 | -77.4 | 164.4 | 0 | 0 | 0 | 112.4 | D107 I108 A114 S115 | D107-L111 WeakPolarHBondContact O-CB 3.43Å; D107-L111 WeakPolarHBondContact O-CG 3.25Å; D107-L111 PolarHBondContact O-N 2.9Å; I108-L111 PolarHBondContact O-N 2.94Å; L111-A114 PolarHBondContact O-N 2.96Å; L111-S115 WeakPolarHBondContact O-CB 3.49Å; L111-S115 PolarHBondContact O-N 3.3Å |
| 112 | T | 67.6 | Low | 64.9 | Low | 65 Ų | 65 | 109.5 Ų | 109.5 | 40% | 0.399 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.7 | -45.3 | 175.4 | -55.6 | 0 | 0 | 0 | 0 | 110.7 | I108 T110 A114 S115 Y116 | I108-T112 WeakPolarHBondContact O-CB 3.37Å; I108-T112 PolarHBondContact O-N 3.38Å; I108-T112 PolarHBondContact O-OG1 2.9Å; T110-T112 PolarHBondContact O-N 2.79Å; T112-A114 VanDerWaalsContact C-N 3.34Å; T112-A114 PolarHBondContact O-N 3.46Å; T112-S115 WeakPolarHBondContact O-CB 3.35Å; T112-S115 PolarHBondContact O-N 2.82Å; T112-Y116 HydrophobicContact CG2-CD2 3.95Å; T112-Y116 HydrophobicContact CG2-CE2 3.53Å; T112-Y116 WeakPolarHBondContact O-CD2 3.37Å; T112-Y116 PolarHBondContact O-N 3.5Å |
| 113 | S | 59.4 | Low | 62.6 | Low | 68 Ų | 68 | 109.7 Ų | 109.7 | 48% | 0.476 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.8 | -30.2 | 176.6 | 52.3 | 0 | 0 | 0 | 0 | 113.6 | T109 T110 | T109-S113 WeakPolarHBondContact O-CB 3.48Å; T109-S113 PolarHBondContact O-N 3.38Å; T109-S113 PolarHBondContact O-OG 2.91Å; T110-S113 WeakPolarHBondContact CA-OG 3.45Å; T110-S113 PolarHBondContact O-N 2.95Å; T110-S113 PolarHBondContact O-OG 3.28Å |
| 114 | A | 57.8 | Low | 60.9 | Low | 66 Ų | 66 | 110.6 Ų | 110.6 | 55% | 0.545 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -71.5 | -33.5 | 170 | 0 | 0 | 0 | 0 | 0 | 112.9 | T110 L111 T112 | T110-A114 WeakPolarHBondContact O-CB 3.25Å; T110-A114 PolarHBondContact O-N 2.99Å; L111-A114 PolarHBondContact O-N 2.96Å; T112-A114 VanDerWaalsContact C-N 3.34Å; T112-A114 PolarHBondContact O-N 3.46Å |
| 115 | S | 49.9 | Very low | 59.1 | Low | 77 Ų | 77 | 108.1 Ų | 108.1 | 54% | 0.538 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -67.2 | -34.8 | 176.4 | 157.1 | 0 | 0 | 0 | 0 | 113.1 | L111 T112 Q117 S118 | L111-S115 WeakPolarHBondContact O-CB 3.49Å; L111-S115 PolarHBondContact O-N 3.3Å; T112-S115 WeakPolarHBondContact O-CB 3.35Å; T112-S115 PolarHBondContact O-N 2.82Å; S115-Q117 PolarHBondContact O-N 2.82Å; S115-S118 PolarHBondContact O-N 3.31Å |
| 116 | Y | 48.2 | Very low | 57.5 | Low | 179 Ų | 179 | 110.3 Ų | 110.3 | 70% | 0.702 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -3.2 | -179.5 | -81.2 | -72.6 | 0 | 0 | 0 | 115 | T112 | T112-Y116 HydrophobicContact CG2-CD2 3.95Å; T112-Y116 HydrophobicContact CG2-CE2 3.53Å; T112-Y116 WeakPolarHBondContact O-CD2 3.37Å; T112-Y116 PolarHBondContact O-N 3.5Å |
| 117 | Q | 48.9 | Very low | 55.9 | Low | 175 Ų | 175 | 115.6 Ų | 115.6 | 82% | 0.818 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -7.3 | 172.2 | -68 | -66.7 | -55.3 | 0 | 0 | 113.3 | S115 | S115-Q117 PolarHBondContact O-N 2.82Š|
| 118 | S | 46.3 | Very low | 54.7 | Low | 107 Ų | 107 | 119.2 Ų | 119.2 | 75% | 0.748 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -102.7 | -1.5 | -172.8 | -165.7 | 0 | 0 | 0 | 0 | 116.4 | S115 | S115-S118 PolarHBondContact O-N 3.31Š|
| 119 | S | 41.3 | Very low | 53.4 | Low | 88 Ų | 88 | 122.1 Ų | 122.1 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -156.3 | 114.5 | 175.4 | 58.9 | 0 | 0 | 0 | 0 | 115.3 | ||
| 120 | L | 40.7 | Very low | 51.8 | Low | 162 Ų | 162 | 125.8 Ų | 125.8 | 85% | 0.848 | 69% | 0.693 | S | S | * | * | trans | 75.3 | 103.4 | 145.4 | -57.1 | 171 | 0 | 0 | 0 | 119.7 | ||||
| 121 | T | 52 | Low | 50.7 | Low | 118 Ų | 118 | 128.6 Ų | 128.6 | 72% | 0.724 | 70% | 0.703 | S | S | * | * | 26.5 | 115.6 | 108.6 | -53.2 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 122 | M | 45.9 | Very low | 49.9 | Very low | 164 Ų | 164 | 131.4 Ų | 131.4 | 81% | 0.808 | 71% | 0.713 | S | S | * | * | trans | 73.1 | 109.6 | 149.7 | -60.4 | -69.2 | 160.7 | 0 | 0 | 119.6 | ||||
| 123 | H | 43.4 | Very low | 48.7 | Very low | 167 Ų | 167 | 131.5 Ų | 131.5 | 77% | 0.773 | 73% | 0.727 | S | S | * | * | -171.3 | 109.1 | 119.9 | 47.3 | -70.2 | 0 | 0 | 0 | 111.3 | G125 | H123-G125 PolarHBondContact O-N 3.16Š| |||
| 124 | T | 52.1 | Low | 48 | Very low | 154 Ų | 154 | 133.6 Ų | 133.6 | 95% | 0.945 | 74% | 0.741 | S | S | * | * | trans | -79.2 | 94.9 | 157.3 | 52.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 125 | G | 46.7 | Very low | 47.6 | Very low | 39 Ų | 39 | 136.1 Ų | 136.1 | 40% | 0.402 | 75% | 0.752 | S | S | . | * | trans | -135.5 | 104.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | H123 H127 | H123-G125 PolarHBondContact O-N 3.16Å; G125-H127 PolarHBondContact O-CD2 3.4Å; G125-H127 PolarHBondContact O-N 2.93Å | ||
| 126 | Q | 49 | Very low | 47.3 | Very low | 161 Ų | 161 | 139.2 Ų | 139.2 | 75% | 0.752 | 77% | 0.768 | S | S | * | * | trans | -39.7 | 116.7 | 159.9 | -96.2 | -86.1 | 10.9 | 0 | 0 | 111.8 | ||||
| 127 | H | 47.2 | Very low | 46.9 | Very low | 167 Ų | 167 | 134.9 Ų | 134.9 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | trans | -124.1 | 85.7 | 160.6 | -56.4 | -57.7 | 0 | 0 | 0 | 108.5 | G125 L129 | G125-H127 PolarHBondContact O-CD2 3.4Å; G125-H127 PolarHBondContact O-N 2.93Å; H127-L129 PolarHBondContact O-N 3.44Å | ||
| 128 | L | 52.3 | Low | 46.8 | Very low | 149 Ų | 149 | 134 Ų | 134 | 78% | 0.78 | 76% | 0.759 | S | S | * | * | trans | -61.9 | 119 | 151.7 | -76.1 | 160.4 | 0 | 0 | 0 | 107.5 | ||||
| 129 | L | 52.1 | Low | 46.4 | Very low | 162 Ų | 162 | 136 Ų | 136 | 85% | 0.848 | 76% | 0.761 | S | S | * | * | trans | -174.3 | 91.6 | 139.4 | -94.8 | 169.9 | 0 | 0 | 0 | 108.5 | H127 I131 | H127-L129 PolarHBondContact O-N 3.44Å; L129-I131 PolarHBondContact O-N 3.44Å | ||
| 130 | N | 42.3 | Very low | 46.6 | Very low | 161 Ų | 161 | 143.5 Ų | 143.5 | 86% | 0.861 | 78% | 0.776 | S | S | * | * | trans | -72.3 | 104.1 | 168.1 | 172.2 | 49 | 0 | 0 | 0 | 109.1 | ||||
| 131 | I | 50.5 | Low | 47.1 | Very low | 145 Ų | 145 | 141.7 Ų | 141.7 | 74% | 0.744 | 77% | 0.774 | S | S | * | * | trans | -123.1 | 99.3 | 161.2 | -65.4 | 179.1 | 0 | 0 | 0 | 108 | L129 | L129-I131 PolarHBondContact O-N 3.44Š| ||
| 132 | Q | 53.2 | Low | 46.5 | Very low | 185 Ų | 185 | 139.5 Ų | 139.5 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | trans | 39.3 | 102 | 132.4 | -164.8 | 151 | 31.9 | 0 | 0 | 117.7 | ||||
| 133 | G | 42.4 | Very low | 46.6 | Very low | 68 Ų | 68 | 136.4 Ų | 136.4 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | trans | 173.4 | 91.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | P135 | G133-P135 VanDerWaalsContact O-CD 3.29Å; G133-P135 WeakPolarHBondContact O-CD 3.36Å | ||
| 134 | S | 45.8 | Very low | 46.8 | Very low | 111 Ų | 111 | 136.9 Ų | 136.9 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -68.7 | 130.5 | -176.2 | -173.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 135 | P | 49 | Very low | 46.9 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -128.2 | 89.9 | 151.1 | 32.7 | -13.3 | 0 | 0 | 0 | 109.1 | G133 S137 | G133-P135 VanDerWaalsContact O-CD 3.29Å; G133-P135 WeakPolarHBondContact O-CD 3.36Å; P135-S137 PolarHBondContact O-N 2.88Å | ||
| 136 | V | 43.4 | Very low | 46.9 | Very low | 142 Ų | 142 | 142.4 Ų | 142.4 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | trans | -81.5 | 100 | 167.5 | 162.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 137 | S | 40 | Very low | 47 | Very low | 87 Ų | 87 | 143.5 Ų | 143.5 | 61% | 0.608 | 81% | 0.808 | S | S | * | * | trans | -129.3 | 113.3 | 160 | 170.4 | 0 | 0 | 0 | 0 | 107 | P135 | P135-S137 PolarHBondContact O-N 2.88Š| ||
| 138 | H | 47.5 | Very low | 47.1 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | 165.9 | 123.2 | 130.2 | -85.1 | -5.2 | 0 | 0 | 0 | 113.3 | ||||
| 139 | N | 37.7 | Very low | 47 | Very low | 148 Ų | 148 | 145.5 Ų | 145.5 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | 38.2 | 115.1 | 133.4 | -67.2 | -30.7 | 0 | 0 | 0 | 119.7 | ||||
| 140 | R | 45.1 | Very low | 46.9 | Very low | 247 Ų | 247 | 147.1 Ų | 147.1 | 93% | 0.932 | 82% | 0.815 | S | S | * | * | -147.2 | 152.5 | 128.8 | -109.2 | -166.4 | 171.8 | -147.2 | -0.6 | 112 | |||||
| 141 | P | 50.8 | Low | 47.4 | Very low | 123 Ų | 123 | 147.4 Ų | 147.4 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -94.1 | 161.7 | -171.9 | 38.3 | -32.1 | 0 | 0 | 0 | 112.2 | ||||
| 142 | G | 40.6 | Very low | 47 | Very low | 73 Ų | 73 | 148 Ų | 148 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | trans | 121 | 110.7 | 156.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 143 | A | 47.8 | Very low | 46.9 | Very low | 99 Ų | 99 | 147.9 Ų | 147.9 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | 54.3 | 105.2 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 144 | L | 47.8 | Very low | 47.2 | Very low | 177 Ų | 177 | 150.8 Ų | 150.8 | 93% | 0.927 | 82% | 0.818 | S | S | * | * | -177.1 | 76 | 127.5 | -92.8 | 169.3 | 0 | 0 | 0 | 107.8 | |||||
| 145 | M | 53.5 | Low | 46.9 | Very low | 192 Ų | 192 | 151.1 Ų | 151.1 | 95% | 0.946 | 82% | 0.816 | S | S | * | * | trans | -110.1 | 100 | 160 | -78.8 | -72.9 | 178.6 | 0 | 0 | 107 | ||||
| 146 | S | 47.4 | Very low | 46.7 | Very low | 117 Ų | 117 | 151 Ų | 151 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -160.4 | 134.7 | 143.7 | -158.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 147 | E | 49.9 | Very low | 46.7 | Very low | 184 Ų | 184 | 150.7 Ų | 150.7 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | S | Bend | trans | 87.8 | 57.7 | 163.9 | -147.4 | 163.4 | -153.4 | 0 | 0 | 118.5 | ||
| 148 | R | 50.4 | Low | 46.9 | Very low | 251 Ų | 251 | 154 Ų | 154 | 95% | 0.947 | 82% | 0.822 | S | S | * | * | trans | -145.8 | 62.1 | 147.6 | -159.2 | -177.3 | -178.6 | -163.3 | 0.8 | 112.3 | ||||
| 149 | S | 49.8 | Very low | 46.8 | Very low | 106 Ų | 106 | 152.3 Ų | 152.3 | 74% | 0.741 | 83% | 0.825 | S | S | * | * | trans | -141.8 | 77.8 | 173 | 49.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 150 | K | 48.9 | Very low | 46.7 | Very low | 196 Ų | 196 | 148.3 Ų | 148.3 | 85% | 0.852 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -169.5 | 151.7 | 139.2 | -62.8 | -147.6 | 179.8 | -175.7 | 0 | 107.8 | ||
| 151 | Q | 53.2 | Low | 46.1 | Very low | 167 Ų | 167 | 148 Ų | 148 | 78% | 0.78 | 82% | 0.818 | S | S | * | * | trans | 96.3 | 78.5 | 174.7 | -55.5 | -74 | -20.6 | 0 | 0 | 116.4 | ||||
| 152 | L | 43.6 | Very low | 45.4 | Very low | 159 Ų | 159 | 150 Ų | 150 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -134.4 | 31.5 | 156.4 | -85.8 | -178.8 | 0 | 0 | 0 | 113.2 | ||
| 153 | F | 51.2 | Low | 45.1 | Very low | 181 Ų | 181 | 156.8 Ų | 156.8 | 79% | 0.794 | 82% | 0.821 | S | S | * | * | trans | -148 | 121.8 | 164 | -64.8 | -73.1 | 0 | 0 | 0 | 110.6 | ||||
| 154 | P | 48.1 | Very low | 44.5 | Very low | 130 Ų | 130 | 160.5 Ų | 160.5 | 84% | 0.844 | 82% | 0.821 | S | S | * | * | trans | -88.8 | 112.4 | 163 | 31.7 | -24.8 | 0 | 0 | 0 | 109.4 | ||||
| 155 | T | 38.4 | Very low | 43.9 | Very low | 118 Ų | 118 | 156.4 Ų | 156.4 | 72% | 0.724 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 130.8 | 165.5 | -32.8 | 0 | 0 | 0 | 0 | 108 | V157 | T155-V157 PolarHBondContact O-N 3.16Š|
| 156 | P | 44.7 | Very low | 43.1 | Very low | 118 Ų | 118 | 155.4 Ų | 155.4 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 122.1 | -177.8 | 27.9 | -31.9 | 0 | 0 | 0 | 110.8 | ||
| 157 | V | 43.9 | Very low | 43.1 | Very low | 135 Ų | 135 | 155 Ų | 155 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 121 | 170.8 | -179.6 | 0 | 0 | 0 | 0 | 108.4 | T155 | T155-V157 PolarHBondContact O-N 3.16Š|
| 158 | I | 44.1 | Very low | 42.5 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 80% | 0.8 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 132.4 | 170.5 | -61.4 | 174.5 | 0 | 0 | 0 | 108.6 | ||
| 159 | P | 45.6 | Very low | 41.7 | Very low | 121 Ų | 121 | 147.6 Ų | 147.6 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 127.7 | 175.9 | -11 | 27.2 | 0 | 0 | 0 | 113.3 | ||
| 160 | G | 35.2 | Very low | 41 | Very low | 64 Ų | 64 | 148.3 Ų | 148.3 | 66% | 0.66 | 79% | 0.791 | S | S | * | * | trans | 74.4 | 103.3 | 135.7 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 161 | R | 33.6 | Very low | 40.6 | Very low | 241 Ų | 241 | 144.2 Ų | 144.2 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | -147.5 | 132 | 127.4 | -102.2 | -166.6 | -173.5 | -88.7 | -0.4 | 110.4 | |||||
| 162 | H | 36.1 | Very low | 39.8 | Very low | 166 Ų | 166 | 140.1 Ų | 140.1 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -82.5 | 141.4 | -176 | -41.5 | -88.6 | 0 | 0 | 0 | 110 | ||||
| 163 | Y | 34.3 | Very low | 39.5 | Very low | 215 Ų | 215 | 140.9 Ų | 140.9 | 84% | 0.843 | 80% | 0.801 | S | S | * | * | trans | -163.1 | 120.3 | 136.2 | -99.4 | -76.7 | 0 | 0 | 0 | 111 | ||||
| 164 | Q | 35.8 | Very low | 38.8 | Very low | 176 Ų | 176 | 136.1 Ų | 136.1 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 58 | 116 | 135.7 | -143.1 | 157.9 | 29.5 | 0 | 0 | 122.1 | ||||
| 165 | S | 34.3 | Very low | 38.2 | Very low | 92 Ų | 92 | 138 Ų | 138 | 64% | 0.643 | 79% | 0.792 | S | S | * | * | trans | -60.9 | 142.8 | 169.2 | 54.8 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 166 | Q | 36.7 | Very low | 38.2 | Very low | 171 Ų | 171 | 140.6 Ų | 140.6 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | trans | -166.3 | 160.1 | 134.7 | -94.6 | -34.6 | -70.6 | 0 | 0 | 109.8 | ||||
| 167 | P | 48.2 | Very low | 37.6 | Very low | 109 Ų | 109 | 138 Ų | 138 | 71% | 0.708 | 79% | 0.791 | S | S | * | * | trans | -106.8 | 169.6 | -136 | 33 | -15.5 | 0 | 0 | 0 | 113.5 | ||||
| 168 | G | 36.4 | Very low | 37.3 | Very low | 68 Ų | 68 | 140.1 Ų | 140.1 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | trans | -82.7 | -177.5 | -161.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 169 | F | 33.3 | Very low | 37 | Very low | 211 Ų | 211 | 142.8 Ų | 142.8 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | trans | -136.6 | 121 | 164.1 | -89.9 | -84.2 | 0 | 0 | 0 | 109.4 | ||||
| 170 | S | 36.4 | Very low | 36.6 | Very low | 120 Ų | 120 | 140.6 Ų | 140.6 | 84% | 0.839 | 80% | 0.798 | S | S | * | * | trans | -83.5 | 149.5 | 170.6 | -56.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 171 | A | 39.8 | Very low | 36.5 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 91% | 0.909 | 80% | 0.8 | S | S | * | * | trans | -63.6 | 141.3 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 172 | G | 35.5 | Very low | 36.5 | Very low | 82 Ų | 82 | 134.7 Ų | 134.7 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | trans | -153.4 | 126.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 173 | L | 37 | Very low | 36.6 | Very low | 175 Ų | 175 | 135.1 Ų | 135.1 | 92% | 0.916 | 80% | 0.796 | S | S | * | * | trans | -87.6 | 157.1 | 178.4 | -135.1 | 100.3 | 0 | 0 | 0 | 110.6 | ||||
| 174 | A | 36.5 | Very low | 36.7 | Very low | 80 Ų | 80 | 129.6 Ų | 129.6 | 66% | 0.661 | 79% | 0.789 | S | S | * | * | trans | 84.1 | 124.6 | 147.7 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 175 | E | 36 | Very low | 36.6 | Very low | 170 Ų | 170 | 127.2 Ų | 127.2 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | 80.6 | 130.6 | 135 | -101.9 | -176.3 | 117.7 | 0 | 0 | 123.6 | ||||
| 176 | H | 38 | Very low | 36.7 | Very low | 173 Ų | 173 | 131.2 Ų | 131.2 | 80% | 0.801 | 79% | 0.794 | S | S | * | * | trans | 74.1 | 108.4 | 154.2 | -97.8 | -85.9 | 0 | 0 | 0 | 121 | ||||
| 177 | G | 33.1 | Very low | 36.6 | Very low | 64 Ų | 64 | 129.5 Ų | 129.5 | 66% | 0.66 | 79% | 0.786 | S | S | * | * | 98.4 | 125.8 | 104.9 | 0 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 178 | Q | 37.7 | Very low | 35.9 | Very low | 179 Ų | 179 | 130 Ų | 130 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | 74 | 117.5 | 158.2 | -66.6 | 179.2 | 4 | 0 | 0 | 118.7 | ||||
| 179 | F | 37.7 | Very low | 35.8 | Very low | 211 Ų | 211 | 136.6 Ų | 136.6 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | -172.2 | 134.1 | 116.6 | -89.3 | -72.2 | 0 | 0 | 0 | 105.3 | |||||
| 180 | G | 36.9 | Very low | 35.9 | Very low | 76 Ų | 76 | 132.5 Ų | 132.5 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | 104.5 | 105.1 | 61.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 181 | G | 33.8 | Very low | 35.9 | Very low | 68 Ų | 68 | 133.5 Ų | 133.5 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | trans | -90.1 | 174.1 | -166.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 182 | S | 34.1 | Very low | 35.8 | Very low | 113 Ų | 113 | 132.8 Ų | 132.8 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | trans | 68.7 | 136.3 | 159.5 | 74.8 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 183 | Q | 37.3 | Very low | 35.7 | Very low | 175 Ų | 175 | 137.8 Ų | 137.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | cis | -151.9 | 162 | 35.1 | -72.7 | -164.4 | -0.5 | 0 | 0 | 113.6 | ||||
| 184 | S | 37 | Very low | 35.7 | Very low | 98 Ų | 98 | 134.7 Ų | 134.7 | 69% | 0.685 | 78% | 0.78 | S | S | * | * | trans | -55.5 | 159.2 | 157.9 | 53.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 185 | V | 34 | Very low | 35.8 | Very low | 127 Ų | 127 | 140.2 Ų | 140.2 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | 171.6 | 120.7 | 125.4 | 159.7 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 186 | H | 36.3 | Very low | 35.6 | Very low | 175 Ų | 175 | 139.7 Ų | 139.7 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | 62.6 | 133.4 | 148.5 | -108.2 | -93 | 0 | 0 | 0 | 126.6 | ||||
| 187 | E | 33.4 | Very low | 35.9 | Very low | 135 Ų | 135 | 137.6 Ų | 137.6 | 63% | 0.631 | 79% | 0.791 | S | S | * | * | trans | -60.6 | 160.8 | 163.5 | -66.6 | 176.6 | 121.6 | 0 | 0 | 114.6 | ||||
| 188 | S | 34.1 | Very low | 36.2 | Very low | 121 Ų | 121 | 140.2 Ų | 140.2 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | trans | -153.5 | 111.7 | 147.9 | -61.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 189 | Y | 34.4 | Very low | 36 | Very low | 205 Ų | 205 | 137.6 Ų | 137.6 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -68.8 | 141.5 | 161.6 | -78.3 | -97.9 | 0 | 0 | 0 | 110.2 | ||||
| 190 | S | 34.1 | Very low | 36 | Very low | 125 Ų | 125 | 138.4 Ų | 138.4 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -143.2 | 122.8 | 153.7 | 48.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 191 | V | 36.3 | Very low | 36 | Very low | 142 Ų | 142 | 139 Ų | 139 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | trans | -99.4 | 128.9 | 170.6 | 163 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 192 | A | 38.4 | Very low | 36.5 | Very low | 95 Ų | 95 | 142 Ų | 142 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -155.6 | 106.8 | 160.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 193 | Q | 33.2 | Very low | 36.5 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | 78.2 | 116 | 85.5 | -160.3 | 178.8 | 33.4 | 0 | 0 | 114.1 | |||||
| 194 | T | 38.3 | Very low | 36.6 | Very low | 110 Ų | 110 | 138.4 Ų | 138.4 | 68% | 0.675 | 80% | 0.798 | S | S | * | * | trans | -59.9 | 131.6 | -178.1 | -33.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 195 | Q | 37.7 | Very low | 36.7 | Very low | 195 Ų | 195 | 139.5 Ų | 139.5 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | trans | -148.2 | 123 | 148.2 | -73.2 | -163.8 | 2.4 | 0 | 0 | 110.6 | ||||
| 196 | H | 32.5 | Very low | 37.3 | Very low | 160 Ų | 160 | 139.5 Ų | 139.5 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | trans | -80.3 | 156.7 | 167.4 | -64.2 | -91.5 | 0 | 0 | 0 | 110 | ||||
| 197 | P | 44.5 | Very low | 37.9 | Very low | 129 Ų | 129 | 136.4 Ų | 136.4 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | -138.2 | 140.4 | 98.1 | 33.9 | -20.3 | 0 | 0 | 0 | 114.2 | |||||
| 198 | S | 37.7 | Very low | 38.4 | Very low | 118 Ų | 118 | 136 Ų | 136 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | -63 | 133.7 | 164.2 | -73.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 199 | S | 34.2 | Very low | 38.4 | Very low | 124 Ų | 124 | 135 Ų | 135 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -146.1 | 140 | 147 | -157.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 200 | Y | 38 | Very low | 38.6 | Very low | 228 Ų | 228 | 134.8 Ų | 134.8 | 89% | 0.894 | 80% | 0.804 | S | S | * | * | trans | -61.8 | 135 | -169.6 | -99.5 | -116.1 | 0 | 0 | 0 | 114.2 | ||||
| 201 | A | 37.3 | Very low | 38.6 | Very low | 89 Ų | 89 | 133.3 Ų | 133.3 | 74% | 0.736 | 80% | 0.8 | S | S | * | * | trans | -157.4 | 132.6 | 144.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 202 | P | 42.7 | Very low | 38.4 | Very low | 130 Ų | 130 | 134.4 Ų | 134.4 | 84% | 0.844 | 80% | 0.801 | S | S | * | * | trans | -94.6 | 117.1 | -177.6 | 34.1 | -26.6 | 0 | 0 | 0 | 110.6 | ||||
| 203 | S | 35.6 | Very low | 38.2 | Very low | 106 Ų | 106 | 135.1 Ų | 135.1 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | -149.9 | 117.2 | 163.4 | 59.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 204 | S | 39.3 | Very low | 39 | Very low | 107 Ų | 107 | 131.2 Ų | 131.2 | 75% | 0.748 | 79% | 0.793 | S | S | * | * | trans | 51 | 93.9 | 154.2 | 60.7 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 205 | S | 38.9 | Very low | 39.2 | Very low | 121 Ų | 121 | 135.1 Ų | 135.1 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | -67.8 | 122.6 | 158.9 | 53.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 206 | V | 46.1 | Very low | 39.5 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 77% | 0.77 | 80% | 0.798 | S | S | * | * | trans | -91.7 | 127.3 | 165.1 | -145.6 | 0 | 0 | 0 | 0 | 107.4 | V208 | V206-V208 PolarHBondContact O-N 3.39Š| ||
| 207 | P | 49.4 | Very low | 39.8 | Very low | 111 Ų | 111 | 137.3 Ų | 137.3 | 72% | 0.721 | 81% | 0.807 | S | S | * | * | trans | -77.3 | 111.6 | 174.6 | 28.5 | -30.6 | 0 | 0 | 0 | 110.1 | S209 | P207-S209 PolarHBondContact O-N 2.89Š| ||
| 208 | V | 42.9 | Very low | 39.3 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 76% | 0.764 | 81% | 0.806 | S | S | * | * | trans | -75.4 | 104.6 | 164.2 | 178.6 | 0 | 0 | 0 | 0 | 107.3 | V206 F210 | V206-V208 PolarHBondContact O-N 3.39Å; V208-F210 HydrophobicContact CG1-CD2 4.49Å; V208-F210 HydrophobicContact CG1-CE2 4.15Å | ||
| 209 | S | 33.8 | Very low | 39.2 | Very low | 99 Ų | 99 | 134.3 Ų | 134.3 | 69% | 0.692 | 81% | 0.808 | S | S | * | * | trans | -105.3 | 118.9 | 170.9 | -65.2 | 0 | 0 | 0 | 0 | 109.3 | P207 A211 | P207-S209 PolarHBondContact O-N 2.89Å; S209-A211 PolarHBondContact O-N 2.94Å | ||
| 210 | F | 40.5 | Very low | 39.6 | Very low | 202 Ų | 202 | 133.5 Ų | 133.5 | 89% | 0.886 | 80% | 0.803 | S | S | * | * | trans | -76.1 | 111 | 161.7 | -71.1 | -88.9 | 0 | 0 | 0 | 107.9 | V208 | V208-F210 HydrophobicContact CG1-CD2 4.49Å; V208-F210 HydrophobicContact CG1-CE2 4.15Å | ||
| 211 | A | 32.8 | Very low | 39.7 | Very low | 94 Ų | 94 | 127.2 Ų | 127.2 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | trans | -124.1 | 100.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | S209 | S209-A211 PolarHBondContact O-N 2.94Š| ||
| 212 | N | 32.9 | Very low | 39.8 | Very low | 164 Ų | 164 | 132.1 Ų | 132.1 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | trans | -76.8 | 149.8 | 155.6 | -167.9 | 15.7 | 0 | 0 | 0 | 108 | ||||
| 213 | S | 34.7 | Very low | 39.8 | Very low | 110 Ų | 110 | 134.9 Ų | 134.9 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | S | Bend | trans | 94.3 | 124.2 | 172.8 | -155.4 | 0 | 0 | 0 | 0 | 118.4 | ||
| 214 | S | 48.7 | Very low | 40 | Very low | 105 Ų | 105 | 134.6 Ų | 134.6 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | trans | -62.3 | 131.1 | 180 | -41.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 215 | Q | 42.3 | Very low | 40.3 | Very low | 192 Ų | 192 | 138.4 Ų | 138.4 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | trans | -151.7 | 131.6 | 148.2 | -79.8 | -58.7 | -27 | 0 | 0 | 110.2 | ||||
| 216 | I | 44 | Very low | 40.1 | Very low | 156 Ų | 156 | 141.5 Ų | 141.5 | 80% | 0.8 | 82% | 0.818 | S | S | * | * | trans | -80 | 135.4 | 175 | -67.9 | 177 | 0 | 0 | 0 | 109 | ||||
| 217 | R | 39.1 | Very low | 39.6 | Very low | 245 Ų | 245 | 146 Ų | 146 | 93% | 0.925 | 82% | 0.823 | S | S | * | * | trans | 152.9 | 130.2 | 131 | -164.9 | 179.6 | -61.8 | -135.7 | 3.8 | 114.5 | ||||
| 218 | G | 34.6 | Very low | 39.3 | Very low | 79 Ų | 79 | 148.7 Ų | 148.7 | 81% | 0.814 | 83% | 0.83 | S | S | * | * | trans | 112.5 | 129.4 | 162.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 219 | A | 36.4 | Very low | 39.7 | Very low | 105 Ų | 105 | 148 Ų | 148 | 87% | 0.868 | 83% | 0.829 | S | S | * | * | cis | -148.2 | 149.5 | 16 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 220 | S | 40.8 | Very low | 39.9 | Very low | 108 Ų | 108 | 151.8 Ų | 151.8 | 76% | 0.755 | 84% | 0.835 | S | S | * | * | trans | -73.3 | 133.4 | 178.3 | 179.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 221 | A | 40.1 | Very low | 39.6 | Very low | 95 Ų | 95 | 150.8 Ų | 150.8 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | trans | -101.4 | 89 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 222 | F | 39.5 | Very low | 40.4 | Very low | 192 Ų | 192 | 151.5 Ų | 151.5 | 84% | 0.842 | 83% | 0.83 | S | S | * | * | trans | -136.5 | 129.4 | 159.4 | -85.9 | -81.5 | 0 | 0 | 0 | 109.6 | ||||
| 223 | Q | 43.4 | Very low | 40.4 | Very low | 188 Ų | 188 | 146.6 Ų | 146.6 | 88% | 0.879 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 137.1 | 178.7 | -63.2 | -177.1 | 30.2 | 0 | 0 | 110.3 | M225 | Q223-M225 PolarHBondContact O-N 3.23Š|
| 224 | A | 40 | Very low | 40.3 | Very low | 101 Ų | 101 | 152.6 Ų | 152.6 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 124.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 225 | M | 44.3 | Very low | 40.2 | Very low | 187 Ų | 187 | 151.8 Ų | 151.8 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 136.7 | 168.9 | -81.3 | -69.4 | -97.8 | 0 | 0 | 110.6 | Q223 | Q223-M225 PolarHBondContact O-N 3.23Š|
| 226 | Q | 35.5 | Very low | 40.2 | Very low | 186 Ų | 186 | 149.5 Ų | 149.5 | 87% | 0.869 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 143.9 | -176.8 | -164.5 | 127.4 | 38.3 | 0 | 0 | 111.8 | ||
| 227 | Y | 36.2 | Very low | 40 | Very low | 222 Ų | 222 | 149 Ų | 149 | 87% | 0.871 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 151.1 | -173.6 | -83.2 | -107.4 | 0 | 0 | 0 | 117.3 | ||
| 228 | L | 42.9 | Very low | 39.6 | Very low | 166 Ų | 166 | 143.6 Ų | 143.6 | 87% | 0.869 | 82% | 0.818 | S | S | * | * | trans | -137.2 | 142.1 | 151.7 | -165.6 | 67 | 0 | 0 | 0 | 109.5 | ||||
| 229 | P | 51.5 | Low | 40 | Very low | 113 Ų | 113 | 147.2 Ų | 147.2 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | trans | -93.4 | 134.8 | -161.6 | 34.7 | -33 | 0 | 0 | 0 | 115.9 | ||||
| 230 | Q | 38.4 | Very low | 39.9 | Very low | 177 Ų | 177 | 151.8 Ų | 151.8 | 83% | 0.827 | 81% | 0.814 | S | S | * | * | trans | 34.2 | 120.8 | 135.6 | -156.1 | 160.1 | 29.3 | 0 | 0 | 121.8 | ||||
| 231 | Q | 33.3 | Very low | 39.7 | Very low | 181 Ų | 181 | 151.9 Ų | 151.9 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | trans | -147.9 | 152.8 | 144.2 | -77.4 | -57.3 | -28.6 | 0 | 0 | 111 | ||||
| 232 | P | 49.4 | Very low | 39.5 | Very low | 109 Ų | 109 | 153.2 Ų | 153.2 | 71% | 0.708 | 81% | 0.814 | S | S | * | * | trans | -106.6 | 163 | -160.6 | 40.2 | -33.9 | 0 | 0 | 0 | 116 | ||||
| 233 | G | 32.9 | Very low | 39.1 | Very low | 62 Ų | 62 | 151 Ų | 151 | 64% | 0.639 | 81% | 0.806 | S | S | * | * | trans | 92.8 | 129.6 | 166.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 234 | Y | 33.8 | Very low | 38.7 | Very low | 235 Ų | 235 | 150.2 Ų | 150.2 | 92% | 0.922 | 80% | 0.802 | S | S | * | * | cis | -154.2 | 155.1 | 34 | -72.9 | -94.6 | 0 | 0 | 0 | 111 | ||||
| 235 | A | 46.6 | Very low | 38.4 | Very low | 89 Ų | 89 | 149.3 Ų | 149.3 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | trans | -81.1 | 136.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 236 | V | 41.2 | Very low | 38.2 | Very low | 144 Ų | 144 | 149.7 Ų | 149.7 | 87% | 0.873 | 80% | 0.8 | S | S | * | * | trans | -141 | 114.4 | 151.3 | -179.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 237 | H | 40.5 | Very low | 38.7 | Very low | 146 Ų | 146 | 148.3 Ų | 148.3 | 68% | 0.676 | 80% | 0.797 | S | S | * | * | trans | -69.3 | 148.7 | 171.6 | -70.4 | 171.9 | 0 | 0 | 0 | 112 | ||||
| 238 | S | 30.8 | Very low | 39.3 | Very low | 131 Ų | 131 | 142.8 Ų | 142.8 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -162.8 | 92.2 | 138.9 | -83.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 239 | H | 41.8 | Very low | 39.3 | Very low | 154 Ų | 154 | 138.9 Ų | 138.9 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -103 | 127.7 | 163 | 43.7 | -89.3 | 0 | 0 | 0 | 108.1 | ||
| 240 | F | 34.8 | Very low | 39 | Very low | 202 Ų | 202 | 137.5 Ų | 137.5 | 89% | 0.886 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 142.9 | 175.6 | -145.5 | -101 | 0 | 0 | 0 | 109.7 | ||
| 241 | T | 37.2 | Very low | 39.9 | Very low | 110 Ų | 110 | 133.2 Ų | 133.2 | 68% | 0.675 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 127.7 | -175.1 | 132.8 | 0 | 0 | 0 | 0 | 111.4 | ||
| 242 | S | 34.8 | Very low | 41.1 | Very low | 122 Ų | 122 | 129.5 Ų | 129.5 | 85% | 0.853 | 77% | 0.774 | S | S | * | * | trans | -113.2 | 121.6 | 157.1 | 56.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 243 | Q | 32.6 | Very low | 42.1 | Very low | 146 Ų | 146 | 128.7 Ų | 128.7 | 68% | 0.682 | 77% | 0.769 | S | S | * | * | trans | -91.9 | 134.3 | 174.4 | -89.7 | -89.1 | 52.5 | 0 | 0 | 110.6 | ||||
| 244 | Q | 34 | Very low | 43.7 | Very low | 171 Ų | 171 | 132.2 Ų | 132.2 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | trans | 59.9 | 107.2 | 141.4 | -80.5 | 167.2 | -4.3 | 0 | 0 | 121.3 | ||||
| 245 | G | 34.5 | Very low | 45 | Very low | 82 Ų | 82 | 128.6 Ų | 128.6 | 85% | 0.845 | 76% | 0.764 | S | S | * | * | trans | 179 | 48.1 | 158.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 246 | F | 38.8 | Very low | 45.9 | Very low | 196 Ų | 196 | 130 Ų | 130 | 86% | 0.86 | 75% | 0.754 | S | S | * | * | trans | -82.4 | 130.2 | 177.3 | -110.1 | -91 | 0 | 0 | 0 | 110.8 | ||||
| 247 | I | 46.7 | Very low | 47 | Very low | 156 Ų | 156 | 129.4 Ų | 129.4 | 80% | 0.8 | 74% | 0.741 | S | S | * | * | trans | -115.7 | 132.3 | 143.1 | -47 | -176.6 | 0 | 0 | 0 | 106 | ||||
| 248 | P | 48.4 | Very low | 48.2 | Very low | 107 Ų | 107 | 128.2 Ų | 128.2 | 70% | 0.695 | 74% | 0.739 | S | S | * | * | trans | -72.4 | 142.9 | -175.2 | -9.7 | 25.8 | 0 | 0 | 0 | 111.5 | ||||
| 249 | G | 43.7 | Very low | 49.8 | Very low | 84 Ų | 84 | 127.8 Ų | 127.8 | 87% | 0.866 | 72% | 0.723 | S | S | * | * | trans | -61.2 | 134.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 250 | A | 45.3 | Very low | 50.7 | Low | 83 Ų | 83 | 126.2 Ų | 126.2 | 69% | 0.686 | 72% | 0.715 | S | S | * | * | trans | -118.6 | 125.2 | 145.7 | 0 | 0 | 0 | 0 | 0 | 106.5 | I252 | A250-I252 PolarHBondContact O-N 3.27Š| ||
| 251 | G | 56.1 | Low | 51.8 | Low | 88 Ų | 88 | 119.9 Ų | 119.9 | 91% | 0.907 | 70% | 0.7 | S | S | * | * | trans | -62.5 | 92.4 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 252 | I | 58.9 | Low | 52.5 | Low | 102 Ų | 102 | 120.9 Ų | 120.9 | 52% | 0.523 | 70% | 0.702 | S | S | . | * | trans | -102.7 | 121.8 | 168 | -59.9 | 174.1 | 0 | 0 | 0 | 106.5 | A250 L254 K256 | A250-I252 PolarHBondContact O-N 3.27Å; I252-L254 PolarHBondContact O-N 2.84Å; I252-K256 HydrophobicContact CG2-CB 3.35Å; I252-K256 HydrophobicContact CG2-CD 4.06Å; I252-K256 HydrophobicContact CG2-CG 4.34Å | ||
| 253 | P | 70.1 | Confident | 53.6 | Low | 92 Ų | 92 | 122.6 Ų | 122.6 | 60% | 0.597 | 70% | 0.696 | S | S | * | * | trans | -56.3 | 137.3 | 175.8 | -21 | 30.6 | 0 | 0 | 0 | 109.8 | Q255 K256 | P253-Q255 PolarHBondContact O-N 3.09Å; P253-K256 PolarHBondContact O-N 2.79Å | ||
| 254 | L | 66.3 | Low | 54.6 | Low | 136 Ų | 136 | 124.2 Ų | 124.2 | 71% | 0.712 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -45.7 | -28.9 | -178.3 | -155.9 | 81.1 | 0 | 0 | 0 | 113.4 | I252 Q257 L258 | I252-L254 PolarHBondContact O-N 2.84Å; L254-Q257 PolarHBondContact O-N 3.09Å; L254-L258 PolarHBondContact O-N 2.92Å |
| 255 | Q | 62.6 | Low | 55.3 | Low | 159 Ų | 159 | 120 Ų | 120 | 74% | 0.743 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -60.1 | -42.8 | 175 | -171.7 | 163.1 | -8.7 | 0 | 0 | 114 | P253 Q257 L258 E259 | P253-Q255 PolarHBondContact O-N 3.09Å; Q255-Q257 VanDerWaalsContact C-N 3.3Å; Q255-Q257 PolarHBondContact O-N 3.34Å; Q255-L258 PolarHBondContact O-N 3Å; Q255-E259 PolarHBondContact O-N 3Å |
| 256 | K | 64.4 | Low | 56.2 | Low | 119 Ų | 119 | 120 Ų | 120 | 52% | 0.517 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -69.5 | -30.1 | 176.7 | -102.7 | -173.3 | 175.7 | -169.4 | 0 | 112.1 | I252 P253 L258 E259 H260 | I252-K256 HydrophobicContact CG2-CB 3.35Å; I252-K256 HydrophobicContact CG2-CD 4.06Å; I252-K256 HydrophobicContact CG2-CG 4.34Å; P253-K256 PolarHBondContact O-N 2.79Å; K256-L258 VanDerWaalsContact C-N 3.34Å; K256-E259 PolarHBondContact O-N 3.46Å; K256-H260 PolarHBondContact O-CD2 2.98Å; K256-H260 PolarHBondContact O-N 2.87Å |
| 257 | Q | 64.3 | Low | 56.2 | Low | 131 Ų | 131 | 119 Ų | 119 | 61% | 0.612 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -70.9 | -32.2 | 178.3 | -162.6 | 169.7 | -26 | 0 | 0 | 111.7 | L254 Q255 A261 | L254-Q257 PolarHBondContact O-N 3.09Å; Q255-Q257 VanDerWaalsContact C-N 3.3Å; Q255-Q257 PolarHBondContact O-N 3.34Å; Q257-A261 PolarHBondContact O-N 3.46Å |
| 258 | L | 65.9 | Low | 56.4 | Low | 122 Ų | 122 | 117 Ų | 117 | 64% | 0.639 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -69.2 | -37 | 172.6 | -102.6 | 79.5 | 0 | 0 | 0 | 112.9 | L254 Q255 K256 H260 A261 N262 | L254-L258 PolarHBondContact O-N 2.92Å; Q255-L258 PolarHBondContact O-N 3Å; K256-L258 VanDerWaalsContact C-N 3.34Å; L258-H260 VanDerWaalsContact C-N 3.3Å; L258-H260 PolarHBondContact O-N 3Å; L258-A261 PolarHBondContact O-N 2.94Å; L258-N262 PolarHBondContact O-N 2.98Å |
| 259 | E | 63.9 | Low | 56.2 | Low | 122 Ų | 122 | 120 Ų | 120 | 57% | 0.57 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -63.8 | -32.8 | 177.4 | -87.7 | 178 | 124.5 | 0 | 0 | 113.1 | Q255 K256 | Q255-E259 PolarHBondContact O-N 3Å; K256-E259 PolarHBondContact O-N 3.46Å |
| 260 | H | 60.6 | Low | 56.2 | Low | 120 Ų | 120 | 119.2 Ų | 119.2 | 56% | 0.556 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -79.6 | -28.3 | 177.3 | -65.2 | -59.9 | 0 | 0 | 0 | 113.3 | K256 L258 N262 | K256-H260 PolarHBondContact O-CD2 2.98Å; K256-H260 PolarHBondContact O-N 2.87Å; L258-H260 VanDerWaalsContact C-N 3.3Å; L258-H260 PolarHBondContact O-N 3Å; H260-N262 VanDerWaalsContact C-N 3.34Å |
| 261 | A | 58.1 | Low | 55.8 | Low | 69 Ų | 69 | 118.9 Ų | 118.9 | 57% | 0.57 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -69.8 | -31.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q257 L258 Q263 | Q257-A261 PolarHBondContact O-N 3.46Å; L258-A261 PolarHBondContact O-N 2.94Å; A261-Q263 VanDerWaalsContact C-N 3.29Å; A261-Q263 PolarHBondContact O-N 3.2Å |
| 262 | N | 52.7 | Low | 55 | Low | 131 Ų | 131 | 119.4 Ų | 119.4 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -13.8 | -178.8 | -148.1 | -0.5 | 0 | 0 | 0 | 113.6 | L258 H260 | L258-N262 PolarHBondContact O-N 2.98Å; H260-N262 VanDerWaalsContact C-N 3.34Å |
| 263 | Q | 58.4 | Low | 54.1 | Low | 158 Ų | 158 | 123.5 Ų | 123.5 | 74% | 0.738 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -10.2 | 178.7 | -70.4 | -172.3 | 89.7 | 0 | 0 | 114.4 | A261 | A261-Q263 VanDerWaalsContact C-N 3.29Å; A261-Q263 PolarHBondContact O-N 3.2Å |
| 264 | Q | 52.6 | Low | 53.4 | Low | 180 Ų | 180 | 130 Ų | 130 | 84% | 0.841 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -100.4 | -7 | 175.4 | -66.8 | -163.7 | -8.4 | 0 | 0 | 113.6 | G266 | Q264-G266 PolarHBondContact O-N 3.19Å; Q264-G266 VanDerWaalsContact O-N 3.1Å |
| 265 | S | 49.9 | Very low | 52.8 | Low | 84 Ų | 84 | 129.5 Ų | 129.5 | 59% | 0.587 | 72% | 0.723 | S | S | * | * | trans | -83 | 88.3 | 174.3 | -170.5 | 0 | 0 | 0 | 0 | 109.8 | F267 | S265-F267 PolarHBondContact O-N 3.43Š| ||
| 266 | G | 53.4 | Low | 52 | Low | 82 Ų | 82 | 130.9 Ų | 130.9 | 85% | 0.845 | 73% | 0.732 | S | S | * | * | trans | -68.5 | 69.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q264 | Q264-G266 PolarHBondContact O-N 3.19Å; Q264-G266 VanDerWaalsContact O-N 3.1Å | ||
| 267 | F | 38 | Very low | 50.8 | Low | 174 Ų | 174 | 133.1 Ų | 133.1 | 76% | 0.763 | 74% | 0.744 | S | S | * | * | trans | -136.2 | 91.8 | 169.3 | -142.3 | -96.3 | 0 | 0 | 0 | 110.9 | S265 | S265-F267 PolarHBondContact O-N 3.43Š| ||
| 268 | T | 50.3 | Low | 50.7 | Low | 113 Ų | 113 | 131.7 Ų | 131.7 | 69% | 0.693 | 75% | 0.746 | S | S | * | * | trans | 52.2 | 129.7 | 142.9 | 63.4 | 0 | 0 | 0 | 0 | 122 | ||||
| 269 | D | 45.3 | Very low | 49.3 | Very low | 172 Ų | 172 | 134.5 Ų | 134.5 | 92% | 0.92 | 76% | 0.756 | S | S | * | * | trans | 104.6 | 131.4 | 136.9 | -150.9 | 15.8 | 0 | 0 | 0 | 117.8 | ||||
| 270 | G | 43 | Very low | 47.9 | Very low | 66 Ų | 66 | 133.5 Ų | 133.5 | 68% | 0.68 | 76% | 0.762 | S | S | * | * | trans | 119.9 | 50.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | A272 | G270-A272 PolarHBondContact O-N 3.06Å; G270-A272 VanDerWaalsContact O-N 3.16Å | ||
| 271 | G | 36.8 | Very low | 46.9 | Very low | 76 Ų | 76 | 136 Ų | 136 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | trans | -72.3 | 100.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M273 | G271-M273 PolarHBondContact O-N 3.49Š| ||
| 272 | A | 39.2 | Very low | 45.9 | Very low | 99 Ų | 99 | 141.6 Ų | 141.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -60.2 | 118.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112 | G270 R274 | G270-A272 PolarHBondContact O-N 3.06Å; G270-A272 VanDerWaalsContact O-N 3.16Å; A272-R274 PolarHBondContact O-N 2.73Å | ||
| 273 | M | 40.5 | Very low | 45 | Very low | 188 Ų | 188 | 138.8 Ų | 138.8 | 93% | 0.926 | 79% | 0.788 | S | S | * | * | trans | -76.1 | 112.5 | 170 | -70.3 | -70.8 | -81.5 | 0 | 0 | 109.8 | G271 | G271-M273 PolarHBondContact O-N 3.49Š| ||
| 274 | R | 54.5 | Low | 44 | Very low | 228 Ų | 228 | 136.4 Ų | 136.4 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 157.4 | 168.7 | -104 | -156.3 | 173.9 | -158.8 | 1.2 | 111.8 | A272 | A272-R274 PolarHBondContact O-N 2.73Š|
| 275 | P | 54.5 | Low | 43.1 | Very low | 126 Ų | 126 | 134.3 Ų | 134.3 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 132.2 | 178.1 | 31.6 | -31 | 0 | 0 | 0 | 111.2 | ||
| 276 | M | 45.4 | Very low | 42.5 | Very low | 188 Ų | 188 | 135.2 Ų | 135.2 | 93% | 0.926 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 133.2 | 175.1 | -87.6 | -74.7 | -176.7 | 0 | 0 | 111.3 | ||
| 277 | H | 40.3 | Very low | 41.8 | Very low | 167 Ų | 167 | 135.1 Ų | 135.1 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 142.1 | 171.3 | -170.7 | -80 | 0 | 0 | 0 | 109.6 | ||
| 278 | P | 61.7 | Low | 41.8 | Very low | 101 Ų | 101 | 134.5 Ų | 134.5 | 66% | 0.656 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 141.3 | 179.7 | 34.1 | -30.2 | 0 | 0 | 0 | 110.2 | ||
| 279 | Q | 37.2 | Very low | 41.8 | Very low | 181 Ų | 181 | 136.5 Ų | 136.5 | 85% | 0.846 | 81% | 0.808 | S | S | * | * | trans | -176.1 | 139.1 | 137 | -79.5 | -136.1 | -29.7 | 0 | 0 | 112.5 | ||||
| 280 | S | 34.3 | Very low | 42.1 | Very low | 100 Ų | 100 | 133.4 Ų | 133.4 | 70% | 0.699 | 80% | 0.798 | S | S | * | * | trans | 67.2 | 104.6 | 150.4 | 73.5 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 281 | L | 39.7 | Very low | 42 | Very low | 172 Ų | 172 | 136.3 Ų | 136.3 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | 39.5 | 114.7 | 119.5 | -68.1 | 160 | 0 | 0 | 0 | 119.2 | |||||
| 282 | H | 35.8 | Very low | 42.4 | Very low | 188 Ų | 188 | 138.6 Ų | 138.6 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | -158.2 | 146.6 | 115.8 | -155.4 | -100.3 | 0 | 0 | 0 | 112.1 | |||||
| 283 | A | 34.4 | Very low | 42.5 | Very low | 72 Ų | 72 | 139.4 Ų | 139.4 | 60% | 0.595 | 80% | 0.803 | S | S | * | * | trans | -81.3 | 168.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 284 | S | 36.3 | Very low | 42.5 | Very low | 107 Ų | 107 | 138.5 Ų | 138.5 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | trans | 107.5 | 111.9 | 137 | -86.9 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 285 | V | 34.3 | Very low | 41.8 | Very low | 137 Ų | 137 | 132.2 Ų | 132.2 | 83% | 0.83 | 80% | 0.798 | S | S | * | * | trans | 79.5 | 130.8 | 135.9 | -121.4 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 286 | A | 37.7 | Very low | 41 | Very low | 103 Ų | 103 | 133.3 Ų | 133.3 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | 98.1 | 104.4 | 136.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 287 | G | 38 | Very low | 40.5 | Very low | 80 Ų | 80 | 133.1 Ų | 133.1 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | 158.4 | 93.7 | 159.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 288 | L | 39.1 | Very low | 40.6 | Very low | 160 Ų | 160 | 132.8 Ų | 132.8 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | trans | -89.2 | 135 | -177.2 | -84.2 | 163 | 0 | 0 | 0 | 112.8 | ||||
| 289 | L | 50.2 | Low | 39.8 | Very low | 155 Ų | 155 | 133.7 Ų | 133.7 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | 77.5 | 158.9 | 151.9 | -58.5 | 168.6 | 0 | 0 | 0 | 120.6 | ||||
| 290 | P | 50.8 | Low | 39.9 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | -129.5 | 167.4 | -60.3 | 36.4 | -18.9 | 0 | 0 | 0 | 113.7 | |||||
| 291 | T | 41.2 | Very low | 40.5 | Very low | 127 Ų | 127 | 133 Ų | 133 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | trans | -52.8 | 150.9 | 174.9 | 44.8 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 292 | P | 45.5 | Very low | 40.6 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 81% | 0.805 | 81% | 0.814 | S | S | * | * | trans | -117.7 | 122.3 | 134 | 32.8 | -27.7 | 0 | 0 | 0 | 112.6 | ||||
| 293 | S | 41.8 | Very low | 40.8 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -74.5 | 129.1 | 165.7 | -69.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 294 | L | 41 | Very low | 41.7 | Very low | 168 Ų | 168 | 131.5 Ų | 131.5 | 88% | 0.88 | 81% | 0.811 | S | S | * | * | trans | -109.5 | 107 | 163.9 | -80.6 | 168.4 | 0 | 0 | 0 | 108.8 | ||||
| 295 | A | 37.9 | Very low | 41.6 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 79% | 0.793 | 82% | 0.822 | S | S | * | * | trans | -92.6 | 131.6 | 161.8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 296 | V | 37.5 | Very low | 41.7 | Very low | 149 Ų | 149 | 139.3 Ų | 139.3 | 90% | 0.903 | 82% | 0.823 | S | S | * | * | trans | -106.1 | 113.5 | 174.3 | 175.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 297 | Q | 35.9 | Very low | 41.6 | Very low | 184 Ų | 184 | 139.5 Ų | 139.5 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -121.7 | 135.6 | 173.8 | -168.9 | 170.6 | 34.2 | 0 | 0 | 108.9 | ||||
| 298 | I | 41.4 | Very low | 41.4 | Very low | 160 Ų | 160 | 141.5 Ų | 141.5 | 82% | 0.821 | 82% | 0.82 | S | S | * | * | trans | -64.9 | 138.2 | -175.7 | -58.4 | 160.1 | 0 | 0 | 0 | 111.3 | ||||
| 299 | P | 45.8 | Very low | 42.2 | Very low | 120 Ų | 120 | 139.3 Ų | 139.3 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | trans | -106.2 | 133.5 | 167.5 | 11.1 | 8.9 | 0 | 0 | 0 | 114.3 | ||||
| 300 | T | 39.8 | Very low | 41.5 | Very low | 133 Ų | 133 | 141.3 Ų | 141.3 | 82% | 0.816 | 82% | 0.821 | S | S | * | * | trans | -87.6 | 151.7 | 156 | 48.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 301 | P | 47.2 | Very low | 41.1 | Very low | 133 Ų | 133 | 142.8 Ų | 142.8 | 86% | 0.864 | 83% | 0.828 | S | S | * | * | trans | -108.5 | 135 | 175.6 | 34.8 | -28.2 | 0 | 0 | 0 | 115.1 | ||||
| 302 | K | 40.1 | Very low | 41 | Very low | 208 Ų | 208 | 141.2 Ų | 141.2 | 90% | 0.904 | 83% | 0.828 | S | S | * | * | trans | -151.6 | 139.4 | 158.5 | -128.1 | 172.2 | -178.4 | 163.3 | 0 | 104.7 | ||||
| 303 | A | 41 | Very low | 41.1 | Very low | 87 Ų | 87 | 140.5 Ų | 140.5 | 72% | 0.719 | 82% | 0.823 | S | S | * | * | cis | -168.7 | -144.2 | 42.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 304 | P | 52.6 | Low | 40.9 | Very low | 107 Ų | 107 | 147 Ų | 147 | 70% | 0.695 | 83% | 0.83 | S | S | * | * | -120.9 | 159.4 | -95 | 37.3 | -21.1 | 0 | 0 | 0 | 115 | |||||
| 305 | F | 34.5 | Very low | 40.8 | Very low | 224 Ų | 224 | 147.5 Ų | 147.5 | 98% | 0.982 | 83% | 0.827 | S | S | * | * | trans | -152.8 | 153.4 | 157.6 | -86.6 | -70.5 | 0 | 0 | 0 | 113.9 | ||||
| 306 | Q | 36.3 | Very low | 40.7 | Very low | 183 Ų | 183 | 146.2 Ų | 146.2 | 86% | 0.855 | 82% | 0.816 | S | S | * | * | trans | -92.2 | 154.3 | -165.4 | -73.9 | -176.6 | -19.7 | 0 | 0 | 116.5 | ||||
| 307 | S | 36 | Very low | 40.6 | Very low | 108 Ų | 108 | 149.3 Ų | 149.3 | 76% | 0.755 | 82% | 0.818 | S | S | * | * | trans | 11.5 | 134.4 | 151.8 | 63.2 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 308 | S | 33.5 | Very low | 41.2 | Very low | 121 Ų | 121 | 147.3 Ų | 147.3 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | 178 | 157.6 | 108.3 | -146.9 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 309 | P | 55.7 | Low | 41.5 | Very low | 115 Ų | 115 | 146.1 Ų | 146.1 | 75% | 0.747 | 82% | 0.815 | S | S | * | * | trans | -105.8 | 157.6 | -155.6 | 39.7 | -32.2 | 0 | 0 | 0 | 115.5 | ||||
| 310 | Q | 35.7 | Very low | 41.2 | Very low | 196 Ų | 196 | 147.1 Ų | 147.1 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | trans | -145.6 | 128.7 | 160.9 | -164.2 | 171.5 | 6.2 | 0 | 0 | 111.5 | ||||
| 311 | T | 42.4 | Very low | 41.1 | Very low | 140 Ų | 140 | 145.6 Ų | 145.6 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -110.6 | 132.9 | -179.1 | -13.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 312 | A | 39 | Very low | 40.8 | Very low | 93 Ų | 93 | 147.3 Ų | 147.3 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | -164 | 160.1 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 313 | P | 48.3 | Very low | 40.9 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 71% | 0.714 | 80% | 0.802 | S | S | * | * | -119.5 | 161.5 | -119.2 | 35.4 | -21.4 | 0 | 0 | 0 | 114.4 | |||||
| 314 | R | 37.3 | Very low | 40.7 | Very low | 253 Ų | 253 | 143.9 Ų | 143.9 | 96% | 0.955 | 80% | 0.803 | S | S | * | * | trans | -119.1 | 107.9 | 167.9 | -85.7 | -171.7 | 152.5 | -175.3 | -5.8 | 111 | ||||
| 315 | H | 38.1 | Very low | 40.3 | Very low | 178 Ų | 178 | 145.8 Ų | 145.8 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | -90.5 | 158.2 | 149.1 | -69 | -85.1 | 0 | 0 | 0 | 107.3 | ||||
| 316 | A | 36.2 | Very low | 40.8 | Very low | 68 Ų | 68 | 146.6 Ų | 146.6 | 56% | 0.562 | 80% | 0.8 | S | S | * | * | cis | -174.5 | 150.6 | -17.3 | 0 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 317 | F | 36.8 | Very low | 41.3 | Very low | 214 Ų | 214 | 145.5 Ų | 145.5 | 94% | 0.939 | 79% | 0.792 | S | S | * | * | trans | -167 | 114.9 | 139.1 | -86.3 | -61.2 | 0 | 0 | 0 | 109 | ||||
| 318 | L | 46.9 | Very low | 41.9 | Very low | 143 Ų | 143 | 150.2 Ų | 150.2 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | trans | -71.2 | 161.7 | 162.6 | -94.4 | 71.6 | 0 | 0 | 0 | 109.6 | H320 | L318-H320 HydrophobicContact CD2-CB 4.32Š| ||
| 319 | P | 48.8 | Very low | 42.4 | Very low | 134 Ų | 134 | 150.9 Ų | 150.9 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | -132.3 | 143.5 | 96.9 | 30.9 | -17.3 | 0 | 0 | 0 | 113.9 | |||||
| 320 | H | 38.3 | Very low | 42 | Very low | 141 Ų | 141 | 153.5 Ų | 153.5 | 65% | 0.653 | 79% | 0.786 | S | S | * | * | trans | -89.8 | 134.9 | 174.8 | 177.5 | 78.8 | 0 | 0 | 0 | 109.8 | L318 Q322 | L318-H320 HydrophobicContact CD2-CB 4.32Å; H320-Q322 WeakPolarHBondContact NE2-CG 3.38Å | ||
| 321 | A | 38.1 | Very low | 42.3 | Very low | 101 Ų | 101 | 149.1 Ų | 149.1 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | trans | -144.6 | 129.1 | 153.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 322 | Q | 41.2 | Very low | 42.6 | Very low | 169 Ų | 169 | 155.9 Ų | 155.9 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | trans | -72.1 | 143.4 | -165.5 | -63.6 | 166.7 | -47.2 | 0 | 0 | 112.9 | H320 | H320-Q322 WeakPolarHBondContact NE2-CG 3.38Š| ||
| 323 | S | 41.5 | Very low | 42.8 | Very low | 116 Ų | 116 | 159.1 Ų | 159.1 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -122.2 | 102.5 | 157.9 | 64 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 324 | S | 38.5 | Very low | 42.5 | Very low | 107 Ų | 107 | 161.6 Ų | 161.6 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | trans | -158.1 | 126.9 | 156.2 | -106.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 325 | Q | 42.4 | Very low | 42.8 | Very low | 148 Ų | 148 | 156.6 Ų | 156.6 | 69% | 0.692 | 79% | 0.792 | S | S | * | * | trans | 75.2 | 103.4 | 148.4 | -57.4 | -64.5 | -10.8 | 0 | 0 | 118.7 | ||||
| 326 | R | 46.8 | Very low | 43.1 | Very low | 241 Ų | 241 | 155.3 Ų | 155.3 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | trans | -148.3 | 123.5 | 130.6 | -105.5 | 173.6 | -171.8 | -107.6 | 0.8 | 110.4 | ||||
| 327 | F | 46.4 | Very low | 43.5 | Very low | 159 Ų | 159 | 160.8 Ų | 160.8 | 70% | 0.697 | 81% | 0.805 | S | S | * | * | trans | -56.6 | 152.9 | 167.8 | -85.6 | -109.3 | 0 | 0 | 0 | 112.4 | ||||
| 328 | Y | 46.9 | Very low | 44 | Very low | 207 Ų | 207 | 157.2 Ų | 157.2 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | 165.3 | 101.4 | 136.7 | -84.3 | -67.9 | 0 | 0 | 0 | 106.8 | ||||
| 329 | H | 45.5 | Very low | 43.7 | Very low | 135 Ų | 135 | 158.2 Ų | 158.2 | 63% | 0.625 | 80% | 0.799 | S | S | * | * | 55.7 | 104.7 | 99.5 | -75.2 | -71 | 0 | 0 | 0 | 115.1 | |||||
| 330 | H | 46.1 | Very low | 43.4 | Very low | 170 Ų | 170 | 160.1 Ų | 160.1 | 79% | 0.787 | 79% | 0.794 | S | S | * | * | 164.4 | 130.8 | 102 | -78.6 | -47.9 | 0 | 0 | 0 | 112.8 | |||||
| 331 | S | 42.6 | Very low | 43.8 | Very low | 105 Ų | 105 | 161.7 Ų | 161.7 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -47.2 | 141.2 | 157 | 43.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 332 | K | 49.2 | Very low | 44.3 | Very low | 282 Ų | 282 | 167.2 Ų | 167.2 | 100% | 1.226 | 80% | 0.803 | S | S | * | * | -166.3 | 0 | 116.8 | -106.8 | 175.3 | 179.9 | -178.5 | 0 | 110.9 |
Retrieved 332 of 332 residues in 61.6 ms
(Link to these results)