| 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 | 70.4 | Confident | 78.8 | Confident | 200 Ų | 200 | 120.5 Ų | 120.5 | 99% | 0.985 | 62% | 0.624 | S | S | * | * | 0 | -35.3 | 0 | -57.9 | -147.1 | 90.1 | 0 | 0 | 112.5 | C3 R4 L5 | M1-C3 VanDerWaalsContact C-N 3.32Å; M1-C3 PolarHBondContact O-N 3.23Å; M1-R4 PolarHBondContact O-N 3.29Å; M1-R4 VanDerWaalsContact O-N 3.13Å; M1-L5 PolarHBondContact O-N 3.13Å | |||
| 2 | L | 77.8 | Confident | 78.4 | Confident | 133 Ų | 133 | 118.8 Ų | 118.8 | 70% | 0.696 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -50.6 | -43.8 | 172.9 | -106.8 | 87 | 0 | 0 | 0 | 114.3 | R4 L5 L6 | L2-R4 VanDerWaalsContact C-N 3.25Å; L2-R4 PolarHBondContact O-N 3.47Å; L2-L5 PolarHBondContact O-N 2.99Å; L2-L5 VanDerWaalsContact O-N 3.11Å; L2-L6 WeakPolarHBondContact O-CG 3.47Å; L2-L6 PolarHBondContact O-N 3.12Å |
| 3 | C | 73.8 | Confident | 77.8 | Confident | 93 Ų | 93 | 119.3 Ų | 119.3 | 63% | 0.628 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -61.3 | -31.3 | -179.3 | -65.5 | 0 | 0 | 0 | 0 | 113.7 | M1 L7 | M1-C3 VanDerWaalsContact C-N 3.32Å; M1-C3 PolarHBondContact O-N 3.23Å; C3-L7 WeakPolarHBondContact O-CB 3.34Å; C3-L7 WeakPolarHBondContact O-CD1 3.42Å; C3-L7 WeakPolarHBondContact O-CG 3.45Å; C3-L7 PolarHBondContact O-N 3.38Å |
| 4 | R | 80.5 | Confident | 76.9 | Confident | 201 Ų | 201 | 118.8 Ų | 118.8 | 76% | 0.758 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -72.5 | -36.2 | 176.5 | -69.9 | -163.7 | -179.2 | -161.1 | 1.6 | 111.9 | M1 L2 C8 | M1-R4 PolarHBondContact O-N 3.29Å; M1-R4 VanDerWaalsContact O-N 3.13Å; L2-R4 VanDerWaalsContact C-N 3.25Å; L2-R4 PolarHBondContact O-N 3.47Å; R4-C8 WeakPolarHBondContact O-CB 3.46Å; R4-C8 PolarHBondContact O-N 3.42Å |
| 5 | L | 81.9 | Confident | 76 | Confident | 119 Ų | 119 | 117.2 Ų | 117.2 | 62% | 0.623 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.2 | -44.5 | 174.3 | -64.6 | 172.1 | 0 | 0 | 0 | 110.6 | M1 L2 L7 C8 E9 | M1-L5 PolarHBondContact O-N 3.13Å; L2-L5 PolarHBondContact O-N 2.99Å; L2-L5 VanDerWaalsContact O-N 3.11Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 3.27Å; L5-C8 WeakPolarHBondContact O-CB 3.18Å; L5-C8 PolarHBondContact O-N 2.89Å; L5-C8 VanDerWaalsContact O-N 3.12Å; L5-E9 WeakPolarHBondContact O-CG 3.43Å; L5-E9 PolarHBondContact O-N 3Å |
| 6 | L | 81.6 | Confident | 75 | Confident | 104 Ų | 104 | 112.7 Ų | 112.7 | 55% | 0.545 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -59.5 | -43.8 | 175.1 | -70.8 | 170.3 | 0 | 0 | 0 | 112.1 | L2 C8 E9 C10 | L2-L6 WeakPolarHBondContact O-CG 3.47Å; L2-L6 PolarHBondContact O-N 3.12Å; L6-C8 VanDerWaalsContact C-N 3.31Å; L6-C8 PolarHBondContact O-N 3.11Å; L6-E9 PolarHBondContact O-N 3.03Å; L6-C10 PolarHBondContact O-N 3.49Å; L6-C10 PolarHBondContact O-SG 3.03Å |
| 7 | L | 82.6 | Confident | 73.9 | Confident | 111 Ų | 111 | 118.4 Ų | 118.4 | 58% | 0.581 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64 | -36.6 | 175.6 | -72 | 168 | 0 | 0 | 0 | 112.3 | C3 L5 C10 L11 | C3-L7 WeakPolarHBondContact O-CB 3.34Å; C3-L7 WeakPolarHBondContact O-CD1 3.42Å; C3-L7 WeakPolarHBondContact O-CG 3.45Å; C3-L7 PolarHBondContact O-N 3.38Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 3.27Å; L7-C10 PolarHBondContact O-N 2.98Å; L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.35Å; L7-L11 PolarHBondContact O-N 3.41Å |
| 8 | C | 80.9 | Confident | 73 | Confident | 66 Ų | 66 | 116.2 Ų | 116.2 | 45% | 0.446 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -63.3 | -48.3 | 176.2 | -171.7 | 0 | 0 | 0 | 0 | 111.6 | R4 L5 L6 C10 L11 L12 | R4-C8 WeakPolarHBondContact O-CB 3.46Å; R4-C8 PolarHBondContact O-N 3.42Å; L5-C8 WeakPolarHBondContact O-CB 3.18Å; L5-C8 PolarHBondContact O-N 2.89Å; L5-C8 VanDerWaalsContact O-N 3.12Å; L6-C8 VanDerWaalsContact C-N 3.31Å; L6-C8 PolarHBondContact O-N 3.11Å; C8-C10 PolarHBondContact O-N 3.49Å; C8-L11 PolarHBondContact O-N 3.45Å; C8-L12 WeakPolarHBondContact O-CG 3.23Å; C8-L12 PolarHBondContact O-N 2.78Å; C8-L12 VanDerWaalsContact O-N 3.08Å |
| 9 | E | 78.8 | Confident | 72.1 | Confident | 114 Ų | 114 | 117.9 Ų | 117.9 | 53% | 0.533 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -61.4 | -43.4 | 176.5 | -66.3 | -60.3 | 150.1 | 0 | 0 | 111.8 | L5 L6 L11 L12 L13 | L5-E9 WeakPolarHBondContact O-CG 3.43Å; L5-E9 PolarHBondContact O-N 3Å; L6-E9 PolarHBondContact O-N 3.03Å; E9-L11 VanDerWaalsContact C-N 3.32Å; E9-L11 PolarHBondContact O-N 3.2Å; E9-L12 PolarHBondContact O-N 3.12Å; E9-L13 WeakPolarHBondContact O-CG 3.41Å; E9-L13 PolarHBondContact O-N 3.42Å |
| 10 | C | 79 | Confident | 71.4 | Confident | 68 Ų | 68 | 118.1 Ų | 118.1 | 46% | 0.459 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -60.7 | -40.2 | 176.5 | -68.8 | 0 | 0 | 0 | 0 | 112.4 | L6 L7 C8 L13 I14 | L6-C10 PolarHBondContact O-N 3.49Å; L6-C10 PolarHBondContact O-SG 3.03Å; L7-C10 PolarHBondContact O-N 2.98Å; C8-C10 PolarHBondContact O-N 3.49Å; C10-L13 PolarHBondContact O-N 3.49Å; C10-I14 WeakPolarHBondContact O-CD1 3.37Å; C10-I14 WeakPolarHBondContact O-CG1 3.21Å; C10-I14 PolarHBondContact O-N 3.13Å; C10-I14 VanDerWaalsContact O-N 3.13Å |
| 11 | L | 79.1 | Confident | 70.7 | Confident | 116 Ų | 116 | 119.4 Ų | 119.4 | 61% | 0.607 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.9 | -39.8 | 177.2 | -71.3 | 169.4 | 0 | 0 | 0 | 111.9 | L7 C8 E9 I14 T15 | L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.35Å; L7-L11 PolarHBondContact O-N 3.41Å; C8-L11 PolarHBondContact O-N 3.45Å; E9-L11 VanDerWaalsContact C-N 3.32Å; E9-L11 PolarHBondContact O-N 3.2Å; L11-I14 PolarHBondContact O-N 3.16Å; L11-T15 PolarHBondContact O-N 3.08Å; L11-T15 VanDerWaalsContact O-N 3.12Å; L11-T15 PolarHBondContact O-OG1 3.46Å |
| 12 | L | 73.9 | Confident | 70.3 | Confident | 101 Ų | 101 | 115.9 Ų | 115.9 | 53% | 0.529 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.8 | -41.2 | 177.1 | -68.8 | 171.3 | 0 | 0 | 0 | 112.3 | C8 E9 I14 T15 G16 | C8-L12 WeakPolarHBondContact O-CG 3.23Å; C8-L12 PolarHBondContact O-N 2.78Å; C8-L12 VanDerWaalsContact O-N 3.08Å; E9-L12 PolarHBondContact O-N 3.12Å; L12-I14 PolarHBondContact O-N 3.5Å; L12-T15 WeakPolarHBondContact CA-OG1 3.36Å; L12-T15 PolarHBondContact O-N 3.26Å; L12-T15 PolarHBondContact O-OG1 3.01Å; L12-G16 PolarHBondContact O-N 3.37Å; L12-G16 VanDerWaalsContact O-N 3.15Å |
| 13 | L | 70.8 | Confident | 69.8 | Low | 125 Ų | 125 | 118.7 Ų | 118.7 | 65% | 0.654 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.3 | -40.2 | 176.3 | -71.9 | 168.1 | 0 | 0 | 0 | 112.1 | E9 C10 G16 Y17 | E9-L13 WeakPolarHBondContact O-CG 3.41Å; E9-L13 PolarHBondContact O-N 3.42Å; C10-L13 PolarHBondContact O-N 3.49Å; L13-G16 PolarHBondContact O-N 3.08Å; L13-Y17 WeakPolarHBondContact O-CB 3.43Å; L13-Y17 PolarHBondContact O-N 3.37Å; L13-Y17 VanDerWaalsContact O-N 3.08Å |
| 14 | I | 66.2 | Low | 69.3 | Low | 112 Ų | 112 | 120.1 Ų | 120.1 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68.4 | -38 | 178.7 | -66 | 163.3 | 0 | 0 | 0 | 111.1 | C10 L11 L12 G16 Y17 A18 | C10-I14 WeakPolarHBondContact O-CD1 3.37Å; C10-I14 WeakPolarHBondContact O-CG1 3.21Å; C10-I14 PolarHBondContact O-N 3.13Å; C10-I14 VanDerWaalsContact O-N 3.13Å; L11-I14 PolarHBondContact O-N 3.16Å; L12-I14 PolarHBondContact O-N 3.5Å; I14-G16 VanDerWaalsContact C-N 3.31Å; I14-G16 PolarHBondContact O-N 2.99Å; I14-Y17 PolarHBondContact O-N 3.15Å; I14-A18 WeakPolarHBondContact O-CB 3.48Å; I14-A18 PolarHBondContact O-N 3.24Å |
| 15 | T | 63 | Low | 68.9 | Low | 95 Ų | 95 | 113.3 Ų | 113.3 | 58% | 0.583 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -67.9 | -29.3 | 176.6 | 45.8 | 0 | 0 | 0 | 0 | 113.5 | L11 L12 | L11-T15 PolarHBondContact O-N 3.08Å; L11-T15 VanDerWaalsContact O-N 3.12Å; L11-T15 PolarHBondContact O-OG1 3.46Å; L12-T15 WeakPolarHBondContact CA-OG1 3.36Å; L12-T15 PolarHBondContact O-N 3.26Å; L12-T15 PolarHBondContact O-OG1 3.01Å |
| 16 | G | 59 | Low | 68.3 | Low | 45 Ų | 45 | 112.3 Ų | 112.3 | 46% | 0.464 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -76 | -30.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L12 L13 I14 | L12-G16 PolarHBondContact O-N 3.37Å; L12-G16 VanDerWaalsContact O-N 3.15Å; L13-G16 PolarHBondContact O-N 3.08Å; I14-G16 VanDerWaalsContact C-N 3.31Å; I14-G16 PolarHBondContact O-N 2.99Å |
| 17 | Y | 57.4 | Low | 68 | Low | 210 Ų | 210 | 110.9 Ų | 110.9 | 82% | 0.824 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -82.8 | -25.7 | -179.1 | -164 | -97.6 | 0 | 0 | 0 | 113.9 | L13 I14 | L13-Y17 WeakPolarHBondContact O-CB 3.43Å; L13-Y17 PolarHBondContact O-N 3.37Å; L13-Y17 VanDerWaalsContact O-N 3.08Å; I14-Y17 PolarHBondContact O-N 3.15Å |
| 18 | A | 57.3 | Low | 67.6 | Low | 79 Ų | 79 | 107.6 Ų | 107.6 | 65% | 0.653 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -85.7 | -9.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | I14 D20 | I14-A18 WeakPolarHBondContact O-CB 3.48Å; I14-A18 PolarHBondContact O-N 3.24Å; A18-D20 PolarHBondContact O-N 2.94Å |
| 19 | H | 56.6 | Low | 67.4 | Low | 148 Ų | 148 | 111.3 Ų | 111.3 | 69% | 0.685 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -86 | 97.9 | 157.9 | -141.1 | 48.3 | 0 | 0 | 0 | 103.9 | D21 | H19-D21 PolarHBondContact O-N 3.44Š|
| 20 | D | 57 | Low | 67.5 | Low | 121 Ų | 121 | 112.9 Ų | 112.9 | 65% | 0.647 | 60% | 0.6 | S | S | * | * | trans | -44.2 | 117.1 | 160.6 | -80.7 | -60.1 | 0 | 0 | 0 | 105.2 | A18 D22 | A18-D20 PolarHBondContact O-N 2.94Å; D20-D22 PolarHBondContact O-N 3.46Å | ||
| 21 | D | 56.9 | Low | 67.5 | Low | 146 Ų | 146 | 112.8 Ų | 112.8 | 78% | 0.781 | 60% | 0.595 | S | S | * | * | trans | -65.8 | 65.8 | 166.1 | -79.1 | -45 | 0 | 0 | 0 | 106.1 | H19 W23 | H19-D21 PolarHBondContact O-N 3.44Å; D21-W23 PolarHBondContact O-N 2.68Å | ||
| 22 | D | 62.2 | Low | 67.6 | Low | 126 Ų | 126 | 113 Ų | 113 | 67% | 0.674 | 59% | 0.589 | S | S | * | * | trans | -66.8 | 73.6 | 164 | -77.7 | -25.1 | 0 | 0 | 0 | 104 | D20 I24 | D20-D22 PolarHBondContact O-N 3.46Å; D22-I24 WeakPolarHBondContact O-CG1 3.35Å; D22-I24 PolarHBondContact O-N 2.92Å | ||
| 23 | W | 67.5 | Low | 68 | Low | 193 Ų | 193 | 111.2 Ų | 111.2 | 73% | 0.731 | 58% | 0.58 | S | S | * | * | trans | -49 | 112.3 | 169.4 | 81.1 | -74 | 0 | 0 | 0 | 105.1 | D21 D25 | D21-W23 PolarHBondContact O-N 2.68Å; W23-D25 HydrophobicContact CH2-CB 4.06Å; W23-D25 HydrophobicContact CZ2-CB 4.5Å; W23-D25 HydrophobicContact CZ3-CB 4.39Å; W23-D25 PolarHBondContact O-N 2.73Å | ||
| 24 | I | 63.8 | Low | 68.6 | Low | 122 Ų | 122 | 109.5 Ų | 109.5 | 63% | 0.626 | 58% | 0.583 | S | S | * | * | trans | -73 | 119.7 | -176.6 | -66.9 | 170.3 | 0 | 0 | 0 | 105 | D22 D28 | D22-I24 WeakPolarHBondContact O-CG1 3.35Å; D22-I24 PolarHBondContact O-N 2.92Å; I24-D28 HydrophobicContact CG2-CB 3.79Å | ||
| 25 | D | 71.6 | Confident | 69.5 | Low | 58 Ų | 58 | 108.9 Ų | 108.9 | 31% | 0.31 | 60% | 0.595 | S | S | . | * | trans | -57 | 131.3 | 173.5 | -176.6 | -38.2 | 0 | 0 | 0 | 106.7 | W23 T27 D28 | W23-D25 HydrophobicContact CH2-CB 4.06Å; W23-D25 HydrophobicContact CZ2-CB 4.5Å; W23-D25 HydrophobicContact CZ3-CB 4.39Å; W23-D25 PolarHBondContact O-N 2.73Å; D25-T27 PolarHBondContact O-N 3.47Å; D25-T27 WeakPolarHBondContact OD1-CB 3.19Å; D25-T27 PolarHBondContact OD1-N 3.26Å; D25-T27 PolarHBondContact OD1-OG1 3.01Å; D25-D28 PolarHBondContact N-OD2 3.1Å; D25-D28 VanDerWaalsContact O-CB 3.26Å; D25-D28 WeakPolarHBondContact O-CB 3.41Å; D25-D28 PolarHBondContact O-N 3.38Å | ||
| 26 | P | 69.4 | Low | 70.5 | Confident | 98 Ų | 98 | 107.2 Ų | 107.2 | 64% | 0.636 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.5 | -25 | 175.5 | -28.2 | 34.3 | 0 | 0 | 0 | 113.9 | ||
| 27 | T | 73.9 | Confident | 71.6 | Confident | 75 Ų | 75 | 107 Ų | 107 | 46% | 0.46 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.2 | -28.8 | 175.2 | -43.3 | 0 | 0 | 0 | 0 | 113.1 | D25 M29 L30 N31 | D25-T27 PolarHBondContact O-N 3.47Å; D25-T27 WeakPolarHBondContact OD1-CB 3.19Å; D25-T27 PolarHBondContact OD1-N 3.26Å; D25-T27 PolarHBondContact OD1-OG1 3.01Å; T27-M29 VanDerWaalsContact C-N 3.25Å; T27-M29 PolarHBondContact O-N 3.41Å; T27-L30 WeakPolarHBondContact O-CB 3.48Å; T27-L30 PolarHBondContact O-N 3.39Å; T27-L30 VanDerWaalsContact O-N 3.08Å; T27-N31 PolarHBondContact O-N 3.24Å |
| 28 | D | 74.9 | Confident | 72.6 | Confident | 42 Ų | 42 | 100.9 Ų | 100.9 | 23% | 0.225 | 57% | 0.569 | C | S | . | * | H | α-helix | trans | -65.9 | -30.2 | -179.9 | -71.3 | -25.8 | 0 | 0 | 0 | 112.3 | I24 D25 L30 N31 Y32 M39 | I24-D28 HydrophobicContact CG2-CB 3.79Å; D25-D28 PolarHBondContact N-OD2 3.1Å; D25-D28 VanDerWaalsContact O-CB 3.26Å; D25-D28 WeakPolarHBondContact O-CB 3.41Å; D25-D28 PolarHBondContact O-N 3.38Å; D28-L30 PolarHBondContact O-N 3.48Å; D28-N31 CarbonylContact O-C 3.41Å; D28-N31 WeakPolarHBondContact O-CA 3.43Å; D28-N31 PolarHBondContact O-N 3.13Å; D28-Y32 PolarHBondContact O-N 2.86Å; D28-M39 HydrophobicContact CB-CE 3.53Å; D28-M39 HydrophobicContact CB-SD 4.02Å; D28-M39 WeakPolarHBondContact OD1-CE 3.45Å |
| 29 | M | 77.9 | Confident | 73.4 | Confident | 143 Ų | 143 | 101.4 Ų | 101.4 | 70% | 0.704 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.5 | -29.8 | 174.3 | -169.9 | 175.8 | 58.1 | 0 | 0 | 112.1 | T27 N31 Y32 | T27-M29 VanDerWaalsContact C-N 3.25Å; T27-M29 PolarHBondContact O-N 3.41Å; M29-N31 VanDerWaalsContact C-N 3.32Å; M29-Y32 PolarHBondContact O-N 2.77Å |
| 30 | L | 79.8 | Confident | 74.2 | Confident | 147 Ų | 147 | 103 Ų | 103 | 77% | 0.77 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -74.1 | -25.4 | 172.6 | -62.9 | 173.9 | 0 | 0 | 0 | 112.3 | T27 D28 | T27-L30 WeakPolarHBondContact O-CB 3.48Å; T27-L30 PolarHBondContact O-N 3.39Å; T27-L30 VanDerWaalsContact O-N 3.08Å; D28-L30 PolarHBondContact O-N 3.48Å |
| 31 | N | 78.9 | Confident | 74.7 | Confident | 67 Ų | 67 | 106.7 Ų | 106.7 | 36% | 0.358 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -90.9 | -3.9 | 175.8 | -71 | -39.1 | 0 | 0 | 0 | 113 | T27 D28 M29 R40 | T27-N31 PolarHBondContact O-N 3.24Å; D28-N31 CarbonylContact O-C 3.41Å; D28-N31 WeakPolarHBondContact O-CA 3.43Å; D28-N31 PolarHBondContact O-N 3.13Å; M29-N31 VanDerWaalsContact C-N 3.32Å; N31-R40 WeakPolarHBondContact O-CB 3.38Å; N31-R40 WeakPolarHBondContact O-CG 3.33Å; N31-R40 PolarHBondContact O-N 2.82Å |
| 32 | Y | 82.2 | Confident | 75 | Confident | 121 Ų | 121 | 104.2 Ų | 104.2 | 48% | 0.475 | 56% | 0.564 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -79.5 | 123.2 | 178.2 | -170.2 | -99.6 | 0 | 0 | 0 | 110.7 | D28 M29 G37 M39 | D28-Y32 PolarHBondContact O-N 2.86Å; M29-Y32 PolarHBondContact O-N 2.77Å; Y32-G37 VanDerWaalsContact OH-CA 3.26Å; Y32-G37 WeakPolarHBondContact OH-CA 3.43Å; Y32-G37 PolarHBondContact OH-O 3.13Å; Y32-M39 HydrophobicContact CD2-CG 4.2Å |
| 33 | D | 82.2 | Confident | 74.8 | Confident | 63 Ų | 63 | 107.2 Ų | 107.2 | 34% | 0.337 | 57% | 0.574 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.2 | 109.7 | 172.3 | 170.8 | 20.4 | 0 | 0 | 0 | 109.7 | A35 S36 G37 T38 R40 | D33-A35 PolarHBondContact O-N 3.49Å; D33-A35 WeakPolarHBondContact OD1-CB 3.5Å; D33-A35 PolarHBondContact OD1-N 2.97Å; D33-S36 WeakPolarHBondContact CB-OG 3.44Å; D33-S36 PolarHBondContact O-N 3.13Å; D33-S36 PolarHBondContact O-OG 3.13Å; D33-S36 VanDerWaalsContact OD2-CB 3.29Å; D33-S36 WeakPolarHBondContact OD2-CB 3.26Å; D33-S36 PolarHBondContact OD2-OG 3.35Å; D33-G37 WeakPolarHBondContact O-CA 3.43Å; D33-G37 PolarHBondContact O-N 3.29Å; D33-T38 PolarHBondContact N-O 3.08Å; D33-T38 VanDerWaalsContact N-O 3.11Å; D33-R40 HydrophobicContact CB-CG 4.43Å |
| 34 | A | 83 | Confident | 73.9 | Confident | 88 Ų | 88 | 103.8 Ų | 103.8 | 73% | 0.727 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -24.4 | -179 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 35 | A | 85.5 | Confident | 73 | Confident | 99 Ų | 99 | 108.2 Ų | 108.2 | 82% | 0.818 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -35.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | D33 | D33-A35 PolarHBondContact O-N 3.49Å; D33-A35 WeakPolarHBondContact OD1-CB 3.5Å; D33-A35 PolarHBondContact OD1-N 2.97Å |
| 36 | S | 83.1 | Confident | 71.8 | Confident | 61 Ų | 61 | 111.6 Ų | 111.6 | 43% | 0.427 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.2 | -16 | 177.3 | 61.9 | 0 | 0 | 0 | 0 | 113.9 | D33 T38 | D33-S36 WeakPolarHBondContact CB-OG 3.44Å; D33-S36 PolarHBondContact O-N 3.13Å; D33-S36 PolarHBondContact O-OG 3.13Å; D33-S36 VanDerWaalsContact OD2-CB 3.29Å; D33-S36 WeakPolarHBondContact OD2-CB 3.26Å; D33-S36 PolarHBondContact OD2-OG 3.35Å; S36-T38 PolarHBondContact O-N 2.97Å; S36-T38 PolarHBondContact OG-OG1 3.42Å |
| 37 | G | 82.4 | Confident | 70.6 | Confident | 39 Ų | 39 | 109.9 Ų | 109.9 | 40% | 0.402 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 67.9 | 23.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y32 D33 | Y32-G37 VanDerWaalsContact OH-CA 3.26Å; Y32-G37 WeakPolarHBondContact OH-CA 3.43Å; Y32-G37 PolarHBondContact OH-O 3.13Å; D33-G37 WeakPolarHBondContact O-CA 3.43Å; D33-G37 PolarHBondContact O-N 3.29Å |
| 38 | T | 77.5 | Confident | 69 | Low | 82 Ų | 82 | 112.2 Ų | 112.2 | 50% | 0.503 | 63% | 0.625 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -134.6 | 150.4 | -175.1 | 63 | 0 | 0 | 0 | 0 | 111.6 | D33 S36 | D33-T38 PolarHBondContact N-O 3.08Å; D33-T38 VanDerWaalsContact N-O 3.11Å; S36-T38 PolarHBondContact O-N 2.97Å; S36-T38 PolarHBondContact OG-OG1 3.42Å |
| 39 | M | 75.6 | Confident | 67.6 | Low | 91 Ų | 91 | 115 Ų | 115 | 45% | 0.448 | 65% | 0.648 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -71.3 | 129.4 | 168.8 | -81.6 | 172 | 64.3 | 0 | 0 | 110 | D28 Y32 K41 | D28-M39 HydrophobicContact CB-CE 3.53Å; D28-M39 HydrophobicContact CB-SD 4.02Å; D28-M39 WeakPolarHBondContact OD1-CE 3.45Å; Y32-M39 HydrophobicContact CD2-CG 4.2Å; M39-K41 PolarHBondContact O-N 3.1Å; M39-K41 VanDerWaalsContact O-N 3.1Å |
| 40 | R | 72.7 | Confident | 65.8 | Low | 182 Ų | 182 | 116.8 Ų | 116.8 | 69% | 0.687 | 66% | 0.655 | S | S | * | * | trans | -65.1 | 112.4 | 170.2 | -66.2 | 179.2 | 70.4 | 161.9 | 2 | 108.1 | N31 D33 S42 | N31-R40 WeakPolarHBondContact O-CB 3.38Å; N31-R40 WeakPolarHBondContact O-CG 3.33Å; N31-R40 PolarHBondContact O-N 2.82Å; D33-R40 HydrophobicContact CB-CG 4.43Å; R40-S42 PolarHBondContact O-N 2.69Å; R40-S42 VanDerWaalsContact O-N 3.17Å | ||
| 41 | K | 67 | Low | 64.1 | Low | 197 Ų | 197 | 117.9 Ų | 117.9 | 86% | 0.857 | 65% | 0.653 | S | S | * | * | trans | -60.3 | 120.9 | 172.7 | -71 | -174.4 | 174.4 | -176.9 | 0 | 108.3 | M39 Q43 | M39-K41 PolarHBondContact O-N 3.1Å; M39-K41 VanDerWaalsContact O-N 3.1Å; K41-Q43 PolarHBondContact O-N 3.41Å | ||
| 42 | S | 63.7 | Low | 62.4 | Low | 95 Ų | 95 | 123.5 Ų | 123.5 | 66% | 0.664 | 68% | 0.675 | S | S | * | * | trans | -57.7 | 111.5 | 170.4 | 53.6 | 0 | 0 | 0 | 0 | 107.2 | R40 V44 | R40-S42 PolarHBondContact O-N 2.69Å; R40-S42 VanDerWaalsContact O-N 3.17Å; S42-V44 PolarHBondContact O-N 3.18Å | ||
| 43 | Q | 57.4 | Low | 60.5 | Low | 189 Ų | 189 | 126.1 Ų | 126.1 | 88% | 0.883 | 69% | 0.691 | S | S | * | * | trans | -71.4 | 75.3 | 165.9 | -74.5 | -173.2 | -23.8 | 0 | 0 | 106.5 | K41 R45 | K41-Q43 PolarHBondContact O-N 3.41Å; Q43-R45 PolarHBondContact O-N 2.87Å | ||
| 44 | V | 50.2 | Low | 58.9 | Low | 121 Ų | 121 | 128 Ų | 128 | 73% | 0.733 | 70% | 0.704 | S | S | * | * | trans | -65.7 | 84.8 | 155.5 | 175.6 | 0 | 0 | 0 | 0 | 104.8 | S42 S46 | S42-V44 PolarHBondContact O-N 3.18Å; V44-S46 PolarHBondContact O-N 3.29Å; V44-S46 VanDerWaalsContact O-N 3.15Å | ||
| 45 | R | 44.3 | Very low | 57.6 | Low | 215 Ų | 215 | 128 Ų | 128 | 81% | 0.811 | 70% | 0.699 | S | S | * | * | trans | -45.1 | 120.8 | 157.2 | -113.2 | -179.1 | 164.4 | -159.2 | -3.2 | 105.8 | Q43 G47 | Q43-R45 PolarHBondContact O-N 2.87Å; R45-G47 PolarHBondContact O-N 3.11Å | ||
| 46 | S | 45.7 | Very low | 56.1 | Low | 128 Ų | 128 | 128.3 Ų | 128.3 | 90% | 0.895 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -47.5 | 115.5 | 162 | -49.6 | 0 | 0 | 0 | 0 | 108.1 | V44 | V44-S46 PolarHBondContact O-N 3.29Å; V44-S46 VanDerWaalsContact O-N 3.15Å |
| 47 | G | 45.5 | Very low | 54.8 | Low | 63 Ų | 63 | 130.4 Ų | 130.4 | 65% | 0.649 | 70% | 0.7 | S | S | * | * | trans | 102 | 75.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | R45 | R45-G47 PolarHBondContact O-N 3.11Š| ||
| 48 | T | 38.6 | Very low | 53.7 | Low | 123 Ų | 123 | 133.3 Ų | 133.3 | 76% | 0.755 | 71% | 0.714 | S | S | * | * | -170.6 | 122.1 | 102.8 | 23 | 0 | 0 | 0 | 0 | 107.2 | E50 | T48-E50 PolarHBondContact O-N 3.29Š| |||
| 49 | S | 46.4 | Very low | 53.1 | Low | 102 Ų | 102 | 132.1 Ų | 132.1 | 71% | 0.713 | 71% | 0.709 | S | S | * | * | trans | -61.8 | 81.7 | 165.6 | 164.2 | 0 | 0 | 0 | 0 | 108.3 | K51 | S49-K51 PolarHBondContact O-N 3.31Š| ||
| 50 | E | 40.9 | Very low | 52.6 | Low | 179 Ų | 179 | 133.3 Ų | 133.3 | 84% | 0.836 | 71% | 0.713 | S | S | * | * | trans | -71.6 | 87.3 | 157.3 | -75.9 | -173.1 | 131.6 | 0 | 0 | 106.2 | T48 K52 | T48-E50 PolarHBondContact O-N 3.29Å; E50-K52 PolarHBondContact O-N 2.98Å | ||
| 51 | K | 43.9 | Very low | 52.6 | Low | 170 Ų | 170 | 127.6 Ų | 127.6 | 74% | 0.739 | 71% | 0.705 | S | S | * | * | trans | -55 | 96.3 | 154 | -67.5 | 177.1 | 179.2 | 177.6 | 0 | 104.6 | S49 E53 | S49-K51 PolarHBondContact O-N 3.31Å; K51-E53 PolarHBondContact O-N 3.46Å | ||
| 52 | K | 42.3 | Very low | 52.9 | Low | 185 Ų | 185 | 124.4 Ų | 124.4 | 80% | 0.804 | 69% | 0.693 | S | S | * | * | trans | -60.8 | 94.8 | 158.6 | -169.9 | 173.8 | -176.3 | 179.8 | 0 | 103.6 | E50 V54 | E50-K52 PolarHBondContact O-N 2.98Å; K52-V54 HydrophobicContact CG-CG2 4.48Å; K52-V54 PolarHBondContact O-N 2.95Å | ||
| 53 | E | 43.7 | Very low | 53.6 | Low | 176 Ų | 176 | 126.4 Ų | 126.4 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | trans | -60.2 | 91 | 163.2 | -69.7 | -158.7 | 168.9 | 0 | 0 | 105.2 | K51 S55 | K51-E53 PolarHBondContact O-N 3.46Å; E53-S55 PolarHBondContact O-N 3.35Å | ||
| 54 | V | 47.8 | Very low | 55 | Low | 102 Ų | 102 | 122.8 Ų | 122.8 | 62% | 0.618 | 68% | 0.678 | S | S | * | * | trans | -63.6 | 98.6 | 154.3 | 174.4 | 0 | 0 | 0 | 0 | 102.8 | K52 P56 | K52-V54 HydrophobicContact CG-CG2 4.48Å; K52-V54 PolarHBondContact O-N 2.95Å; V54-P56 VanDerWaalsContact O-CD 3.31Å; V54-P56 WeakPolarHBondContact O-CD 3.29Å; V54-P56 VanDerWaalsContact O-N 3.09Å | ||
| 55 | S | 55.7 | Low | 56.7 | Low | 88 Ų | 88 | 119.9 Ų | 119.9 | 62% | 0.615 | 66% | 0.663 | S | S | * | * | trans | -47.1 | 117.4 | 161.6 | 177.6 | 0 | 0 | 0 | 0 | 105.8 | E53 D57 | E53-S55 PolarHBondContact O-N 3.35Å; S55-D57 VanDerWaalsContact C-N 3.25Å; S55-D57 PolarHBondContact O-N 3.02Å | ||
| 56 | P | 54 | Low | 58.9 | Low | 107 Ų | 107 | 114.2 Ų | 114.2 | 70% | 0.695 | 65% | 0.649 | S | S | * | * | trans | -65.9 | 97.8 | 173.9 | 25.9 | -29.2 | 0 | 0 | 0 | 105.6 | V54 S58 | V54-P56 VanDerWaalsContact O-CD 3.31Å; V54-P56 WeakPolarHBondContact O-CD 3.29Å; V54-P56 VanDerWaalsContact O-N 3.09Å; P56-S58 PolarHBondContact O-N 3.36Å | ||
| 57 | D | 55.2 | Low | 61.1 | Low | 105 Ų | 105 | 112.1 Ų | 112.1 | 56% | 0.561 | 63% | 0.633 | S | S | * | * | trans | -58.1 | 117.2 | 169.9 | -105.7 | -12.4 | 0 | 0 | 0 | 105.5 | S55 S59 E60 | S55-D57 VanDerWaalsContact C-N 3.25Å; S55-D57 PolarHBondContact O-N 3.02Å; D57-S59 PolarHBondContact O-N 2.78Å; D57-E60 PolarHBondContact O-N 2.9Å | ||
| 58 | S | 60.5 | Low | 63.3 | Low | 99 Ų | 99 | 114.7 Ų | 114.7 | 69% | 0.692 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -56.2 | -18.9 | -171.6 | 52 | 0 | 0 | 0 | 0 | 113.2 | P56 E62 | P56-S58 PolarHBondContact O-N 3.36Å; S58-E62 PolarHBondContact O-N 2.81Å |
| 59 | S | 63.3 | Low | 66 | Low | 58 Ų | 58 | 115.4 Ų | 115.4 | 41% | 0.406 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -69.3 | -35.9 | 175.2 | 66.4 | 0 | 0 | 0 | 0 | 113.2 | D57 A61 E62 E63 | D57-S59 PolarHBondContact O-N 2.78Å; S59-A61 VanDerWaalsContact C-N 3.33Å; S59-A61 PolarHBondContact O-N 2.73Å; S59-E62 PolarHBondContact O-N 3.47Å; S59-E63 WeakPolarHBondContact O-CG 3.26Å; S59-E63 PolarHBondContact O-N 2.97Å |
| 60 | E | 65.6 | Low | 68.3 | Low | 116 Ų | 116 | 119.4 Ų | 119.4 | 54% | 0.542 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -67.6 | -38.1 | -179.9 | -63.9 | -171.9 | 159.1 | 0 | 0 | 111 | D57 L64 | D57-E60 PolarHBondContact O-N 2.9Å; E60-L64 WeakPolarHBondContact O-CB 3.44Å; E60-L64 WeakPolarHBondContact O-CG 3.46Å; E60-L64 PolarHBondContact O-N 2.9Å |
| 61 | A | 72.8 | Confident | 70.9 | Confident | 61 Ų | 61 | 116 Ų | 116 | 50% | 0.504 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.2 | -36.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S59 S65 | S59-A61 VanDerWaalsContact C-N 3.33Å; S59-A61 PolarHBondContact O-N 2.73Å; A61-S65 WeakPolarHBondContact O-CB 3.18Å; A61-S65 PolarHBondContact O-N 3.5Å |
| 62 | E | 74.1 | Confident | 73.3 | Confident | 131 Ų | 131 | 113.3 Ų | 113.3 | 61% | 0.612 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.8 | -47 | 176.5 | -171.6 | 171.6 | -175.8 | 0 | 0 | 111.2 | S58 S59 L64 S65 D66 | S58-E62 PolarHBondContact O-N 2.81Å; S59-E62 PolarHBondContact O-N 3.47Å; E62-L64 VanDerWaalsContact C-N 3.34Å; E62-L64 PolarHBondContact O-N 3.4Å; E62-S65 WeakPolarHBondContact O-CB 3.4Å; E62-S65 PolarHBondContact O-N 3.01Å; E62-S65 VanDerWaalsContact O-N 3.11Å; E62-S65 PolarHBondContact O-OG 2.93Å; E62-D66 PolarHBondContact O-N 2.95Å |
| 63 | E | 77.9 | Confident | 75.9 | Confident | 136 Ų | 136 | 107.4 Ų | 107.4 | 64% | 0.636 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -61.1 | -40.5 | 176.1 | -72.6 | -177.9 | -170.9 | 0 | 0 | 112.4 | S59 S65 D66 C67 | S59-E63 WeakPolarHBondContact O-CG 3.26Å; S59-E63 PolarHBondContact O-N 2.97Å; E63-S65 VanDerWaalsContact C-N 3.33Å; E63-D66 PolarHBondContact O-N 3.27Å; E63-C67 PolarHBondContact O-N 2.79Å |
| 64 | L | 86.4 | Confident | 78.3 | Confident | 113 Ų | 113 | 104.1 Ų | 104.1 | 59% | 0.592 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.9 | -39.2 | 174.4 | -74.3 | 172.7 | 0 | 0 | 0 | 111.9 | E60 E62 C67 L68 | E60-L64 WeakPolarHBondContact O-CB 3.44Å; E60-L64 WeakPolarHBondContact O-CG 3.46Å; E60-L64 PolarHBondContact O-N 2.9Å; E62-L64 VanDerWaalsContact C-N 3.34Å; E62-L64 PolarHBondContact O-N 3.4Å; L64-C67 PolarHBondContact O-N 3.3Å; L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.18Å; L64-L68 PolarHBondContact O-N 2.95Å |
| 65 | S | 86.7 | Confident | 80.6 | Confident | 60 Ų | 60 | 102.3 Ų | 102.3 | 42% | 0.42 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.1 | -40.4 | 178.8 | 77.9 | 0 | 0 | 0 | 0 | 112.5 | A61 E62 E63 L68 H69 | A61-S65 WeakPolarHBondContact O-CB 3.18Å; A61-S65 PolarHBondContact O-N 3.5Å; E62-S65 WeakPolarHBondContact O-CB 3.4Å; E62-S65 PolarHBondContact O-N 3.01Å; E62-S65 VanDerWaalsContact O-N 3.11Å; E62-S65 PolarHBondContact O-OG 2.93Å; E63-S65 VanDerWaalsContact C-N 3.33Å; S65-L68 PolarHBondContact O-N 3.17Å; S65-H69 PolarHBondContact O-N 3.34Å |
| 66 | D | 89.8 | Confident | 82.4 | Confident | 96 Ų | 96 | 104.5 Ų | 104.5 | 51% | 0.513 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.2 | -40.5 | 175.3 | -94.3 | 4.9 | 0 | 0 | 0 | 111.9 | E62 E63 H69 R70 | E62-D66 PolarHBondContact O-N 2.95Å; E63-D66 PolarHBondContact O-N 3.27Å; D66-H69 PolarHBondContact O-N 2.95Å; D66-R70 VanDerWaalsContact O-CG 3.32Å; D66-R70 WeakPolarHBondContact O-CG 3.47Å; D66-R70 PolarHBondContact O-N 3.15Å |
| 67 | C | 92.1 | Very high | 84.3 | Confident | 84 Ų | 84 | 105.7 Ų | 105.7 | 57% | 0.568 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.1 | -45.6 | 174.4 | -103.1 | 0 | 0 | 0 | 0 | 112 | E63 L64 R70 L71 | E63-C67 PolarHBondContact O-N 2.79Å; L64-C67 PolarHBondContact O-N 3.3Å; C67-R70 PolarHBondContact O-N 2.97Å; C67-L71 WeakPolarHBondContact O-CB 3.35Å; C67-L71 PolarHBondContact O-N 2.99Å |
| 68 | L | 92.1 | Very high | 86.2 | Confident | 118 Ų | 118 | 104 Ų | 104 | 62% | 0.618 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -62.8 | -42.7 | 177.9 | -72 | 172.6 | 0 | 0 | 0 | 111.7 | L64 S65 R70 L71 D72 | L64-L68 VanDerWaalsContact O-CG 3.31Å; L64-L68 WeakPolarHBondContact O-CG 3.18Å; L64-L68 PolarHBondContact O-N 2.95Å; S65-L68 PolarHBondContact O-N 3.17Å; L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 3.43Å; L68-L71 PolarHBondContact O-N 3.08Å; L68-D72 PolarHBondContact O-N 3.46Å |
| 69 | H | 94.7 | Very high | 87.7 | Confident | 137 Ų | 137 | 102.4 Ų | 102.4 | 63% | 0.634 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63 | -40.6 | 176.9 | -179.6 | -92.3 | 0 | 0 | 0 | 112.2 | S65 D66 D72 S73 | S65-H69 PolarHBondContact O-N 3.34Å; D66-H69 PolarHBondContact O-N 2.95Å; H69-D72 PolarHBondContact O-N 3.24Å; H69-S73 WeakPolarHBondContact O-CB 3.35Å; H69-S73 PolarHBondContact O-N 3.35Å |
| 70 | R | 95.4 | Very high | 89 | Confident | 187 Ų | 187 | 102.7 Ų | 102.7 | 71% | 0.706 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.3 | -40 | 174.9 | -74.1 | 176 | 175 | -160.6 | 1.1 | 112.2 | D66 C67 L68 S73 L74 | D66-R70 VanDerWaalsContact O-CG 3.32Å; D66-R70 WeakPolarHBondContact O-CG 3.47Å; D66-R70 PolarHBondContact O-N 3.15Å; C67-R70 PolarHBondContact O-N 2.97Å; L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 3.43Å; R70-S73 PolarHBondContact O-N 3.31Å; R70-L74 WeakPolarHBondContact O-CB 3.39Å; R70-L74 PolarHBondContact O-N 3.07Å |
| 71 | L | 95.9 | Very high | 89.9 | Confident | 106 Ų | 106 | 101.5 Ų | 101.5 | 56% | 0.555 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.2 | -42.9 | 178 | -172.7 | 146.6 | 0 | 0 | 0 | 111.4 | C67 L68 L74 T75 | C67-L71 WeakPolarHBondContact O-CB 3.35Å; C67-L71 PolarHBondContact O-N 2.99Å; L68-L71 PolarHBondContact O-N 3.08Å; L71-L74 PolarHBondContact O-N 3.04Å; L71-T75 WeakPolarHBondContact O-CB 3.32Å; L71-T75 PolarHBondContact O-N 3.02Å; L71-T75 PolarHBondContact O-OG1 2.67Å |
| 72 | D | 94.1 | Very high | 90.3 | Very high | 114 Ų | 114 | 105.8 Ų | 105.8 | 61% | 0.61 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.6 | -43.3 | 178 | -158 | 36.3 | 0 | 0 | 0 | 111.3 | L68 H69 L74 T75 H76 | L68-D72 PolarHBondContact O-N 3.46Å; H69-D72 PolarHBondContact O-N 3.24Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 3.01Å; D72-T75 PolarHBondContact O-N 3.4Å; D72-H76 WeakPolarHBondContact O-CB 3.35Å; D72-H76 PolarHBondContact O-N 3.45Å |
| 73 | S | 95.9 | Very high | 90.4 | Very high | 61 Ų | 61 | 107.4 Ų | 107.4 | 43% | 0.427 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.8 | -41.7 | 173.4 | -172 | 0 | 0 | 0 | 0 | 112.7 | H69 R70 K77 | H69-S73 WeakPolarHBondContact O-CB 3.35Å; H69-S73 PolarHBondContact O-N 3.35Å; R70-S73 PolarHBondContact O-N 3.31Å; S73-K77 WeakPolarHBondContact O-CG 3.46Å; S73-K77 PolarHBondContact O-N 2.95Å; S73-K77 VanDerWaalsContact O-N 3.13Å |
| 74 | L | 94.8 | Very high | 89.4 | Confident | 107 Ų | 107 | 112.2 Ų | 112.2 | 56% | 0.56 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.9 | -44.7 | 177.1 | -177.4 | 61.8 | 0 | 0 | 0 | 111.4 | R70 L71 D72 H76 K77 V78 | R70-L74 WeakPolarHBondContact O-CB 3.39Å; R70-L74 PolarHBondContact O-N 3.07Å; L71-L74 PolarHBondContact O-N 3.04Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 3.01Å; L74-H76 PolarHBondContact O-N 2.77Å; L74-K77 WeakPolarHBondContact O-CB 3.31Å; L74-K77 PolarHBondContact O-N 3.07Å; L74-K77 VanDerWaalsContact O-N 3.13Å; L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3.11Å |
| 75 | T | 95.2 | Very high | 89.5 | Confident | 64 Ų | 64 | 112.2 Ų | 112.2 | 39% | 0.393 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.1 | -47.1 | 178.9 | -56.5 | 0 | 0 | 0 | 0 | 110.6 | L71 D72 K77 V78 D79 | L71-T75 WeakPolarHBondContact O-CB 3.32Å; L71-T75 PolarHBondContact O-N 3.02Å; L71-T75 PolarHBondContact O-OG1 2.67Å; D72-T75 PolarHBondContact O-N 3.4Å; T75-K77 VanDerWaalsContact C-N 3.28Å; T75-K77 PolarHBondContact O-N 3.06Å; T75-V78 PolarHBondContact O-N 2.93Å; T75-V78 VanDerWaalsContact O-N 3.13Å; T75-D79 PolarHBondContact O-N 3Å |
| 76 | H | 94 | Very high | 89.7 | Confident | 135 Ų | 135 | 114.9 Ų | 114.9 | 63% | 0.625 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -59.7 | -37.1 | 175.5 | -177.8 | -85.9 | 0 | 0 | 0 | 112.9 | D72 L74 S80 | D72-H76 WeakPolarHBondContact O-CB 3.35Å; D72-H76 PolarHBondContact O-N 3.45Å; L74-H76 PolarHBondContact O-N 2.77Å; H76-S80 WeakPolarHBondContact O-CB 3.42Å; H76-S80 PolarHBondContact O-N 3.46Å; H76-S80 VanDerWaalsContact O-N 3.08Å |
| 77 | K | 94.4 | Very high | 89.7 | Confident | 132 Ų | 132 | 116 Ų | 116 | 57% | 0.574 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68.3 | -39.2 | 175.8 | -74.6 | 174.5 | 64.7 | 179.5 | 0 | 112.3 | S73 L74 T75 S80 C81 | S73-K77 WeakPolarHBondContact O-CG 3.46Å; S73-K77 PolarHBondContact O-N 2.95Å; S73-K77 VanDerWaalsContact O-N 3.13Å; L74-K77 WeakPolarHBondContact O-CB 3.31Å; L74-K77 PolarHBondContact O-N 3.07Å; L74-K77 VanDerWaalsContact O-N 3.13Å; T75-K77 VanDerWaalsContact C-N 3.28Å; T75-K77 PolarHBondContact O-N 3.06Å; K77-S80 PolarHBondContact O-N 2.83Å; K77-C81 PolarHBondContact O-N 2.82Å; K77-C81 VanDerWaalsContact O-N 3.1Å; K77-C81 PolarHBondContact O-SG 2.81Å; K77-C81 VanDerWaalsContact O-SG 3.35Å |
| 78 | V | 94.8 | Very high | 89.5 | Confident | 70 Ų | 70 | 117.9 Ų | 117.9 | 42% | 0.424 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.2 | -49.6 | 176.2 | 171.9 | 0 | 0 | 0 | 0 | 110 | L74 T75 S80 C81 E82 | L74-V78 WeakPolarHBondContact O-CG2 3.45Å; L74-V78 PolarHBondContact O-N 3.11Å; T75-V78 PolarHBondContact O-N 2.93Å; T75-V78 VanDerWaalsContact O-N 3.13Å; V78-S80 VanDerWaalsContact C-N 3.26Å; V78-S80 PolarHBondContact O-N 2.83Å; V78-C81 WeakPolarHBondContact O-CA 3.2Å; V78-C81 WeakPolarHBondContact O-CB 3.38Å; V78-C81 PolarHBondContact O-N 2.77Å; V78-E82 HydrophobicContact CG1-CG 4.5Å; V78-E82 PolarHBondContact O-N 2.95Å |
| 79 | D | 92.3 | Very high | 89.4 | Confident | 64 Ų | 64 | 117.9 Ų | 117.9 | 34% | 0.342 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -56.2 | -40.1 | 176.4 | -86.3 | 23.9 | 0 | 0 | 0 | 112.8 | T75 C81 E82 K83 | T75-D79 PolarHBondContact O-N 3Å; D79-C81 VanDerWaalsContact C-N 3.32Å; D79-E82 PolarHBondContact O-N 2.92Å; D79-K83 WeakPolarHBondContact O-CB 3.49Å; D79-K83 WeakPolarHBondContact O-CD 3.31Å; D79-K83 WeakPolarHBondContact O-CG 3.4Å; D79-K83 PolarHBondContact O-N 3.29Å; D79-K83 VanDerWaalsContact O-N 3.13Å; D79-K83 IonicContact OD2-NZ 3.75Å |
| 80 | S | 89.8 | Confident | 89 | Confident | 64 Ų | 64 | 116.6 Ų | 116.6 | 45% | 0.448 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.2 | -32.5 | 178 | -173.2 | 0 | 0 | 0 | 0 | 112.6 | H76 K77 V78 | H76-S80 WeakPolarHBondContact O-CB 3.42Å; H76-S80 PolarHBondContact O-N 3.46Å; H76-S80 VanDerWaalsContact O-N 3.08Å; K77-S80 PolarHBondContact O-N 2.83Å; V78-S80 VanDerWaalsContact C-N 3.26Å; V78-S80 PolarHBondContact O-N 2.83Å |
| 81 | C | 83.6 | Confident | 88.6 | Confident | 91 Ų | 91 | 111.6 Ų | 111.6 | 62% | 0.615 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -74.7 | -38.2 | 174 | -72.4 | 0 | 0 | 0 | 0 | 112.3 | K77 V78 D79 K83 K84 | K77-C81 PolarHBondContact O-N 2.82Å; K77-C81 VanDerWaalsContact O-N 3.1Å; K77-C81 PolarHBondContact O-SG 2.81Å; K77-C81 VanDerWaalsContact O-SG 3.35Å; V78-C81 WeakPolarHBondContact O-CA 3.2Å; V78-C81 WeakPolarHBondContact O-CB 3.38Å; V78-C81 PolarHBondContact O-N 2.77Å; D79-C81 VanDerWaalsContact C-N 3.32Å; C81-K83 VanDerWaalsContact C-N 3.3Å; C81-K83 PolarHBondContact O-N 3.48Å; C81-K84 PolarHBondContact O-N 3.03Å |
| 82 | E | 81.9 | Confident | 88 | Confident | 151 Ų | 151 | 112 Ų | 112 | 71% | 0.706 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.3 | -27.8 | 177.2 | -72.5 | -170.1 | 160.7 | 0 | 0 | 113.1 | V78 D79 K84 | V78-E82 HydrophobicContact CG1-CG 4.5Å; V78-E82 PolarHBondContact O-N 2.95Å; D79-E82 PolarHBondContact O-N 2.92Å; E82-K84 VanDerWaalsContact C-N 3.27Å; E82-K84 PolarHBondContact O-N 3.3Å |
| 83 | K | 77.4 | Confident | 87.5 | Confident | 165 Ų | 165 | 111.8 Ų | 111.8 | 72% | 0.717 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -0.8 | 178.3 | -70.4 | 167.7 | -172.1 | 162.1 | 0 | 113.8 | D79 C81 | D79-K83 WeakPolarHBondContact O-CB 3.49Å; D79-K83 WeakPolarHBondContact O-CD 3.31Å; D79-K83 WeakPolarHBondContact O-CG 3.4Å; D79-K83 PolarHBondContact O-N 3.29Å; D79-K83 VanDerWaalsContact O-N 3.13Å; D79-K83 IonicContact OD2-NZ 3.75Å; C81-K83 VanDerWaalsContact C-N 3.3Å; C81-K83 PolarHBondContact O-N 3.48Å |
| 84 | K | 55.8 | Low | 86.7 | Confident | 238 Ų | 238 | 116.5 Ų | 116.5 | 100% | 1.035 | 59% | 0.585 | S | S | * | * | trans | -104.5 | 0 | 177 | -89.8 | -175.6 | 164.8 | -168.5 | 0 | 111.4 | C81 E82 | C81-K84 PolarHBondContact O-N 3.03Å; E82-K84 VanDerWaalsContact C-N 3.27Å; E82-K84 PolarHBondContact O-N 3.3Å |
Retrieved 84 of 84 residues in 31.4 ms
(Link to these results)