| 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 | 52.9 | Low | 64 | Low | 234 Ų | 234 | 121.5 Ų | 121.5 | 100% | 1.153 | 73% | 0.731 | S | S | * | * | 0 | 102 | 0 | -158.8 | -175.8 | -117.9 | 0 | 0 | 106.4 | |||||
| 2 | V | 51.7 | Low | 65.8 | Low | 136 Ų | 136 | 120.3 Ų | 120.3 | 82% | 0.824 | 71% | 0.709 | S | S | * | * | trans | -84.8 | 113.2 | 179.6 | 174.3 | 0 | 0 | 0 | 0 | 106.8 | S4 | V2-S4 PolarHBondContact O-N 3.39Š| ||
| 3 | V | 53.1 | Low | 67.3 | Low | 131 Ų | 131 | 114 Ų | 114 | 79% | 0.794 | 68% | 0.678 | S | S | * | * | trans | -75.8 | 94.1 | 173.7 | 179.9 | 0 | 0 | 0 | 0 | 106.6 | A5 | V3-A5 PolarHBondContact O-N 3.3Š| ||
| 4 | S | 59.2 | Low | 68.8 | Low | 105 Ų | 105 | 114.4 Ų | 114.4 | 73% | 0.734 | 67% | 0.67 | S | S | * | * | trans | -65 | 105.3 | 166.1 | -72 | 0 | 0 | 0 | 0 | 107.6 | V2 G6 | V2-S4 PolarHBondContact O-N 3.39Å; S4-G6 PolarHBondContact O-N 3.06Å | ||
| 5 | A | 62.8 | Low | 70.3 | Confident | 97 Ų | 97 | 114.7 Ų | 114.7 | 80% | 0.802 | 66% | 0.664 | S | S | * | * | trans | -65.2 | 90.5 | 161.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | V3 | V3-A5 PolarHBondContact O-N 3.3Š| ||
| 6 | G | 63.9 | Low | 71.5 | Confident | 51 Ų | 51 | 110.9 Ų | 110.9 | 53% | 0.526 | 64% | 0.641 | S | S | . | * | trans | -55.4 | 154.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | S4 W8 | S4-G6 PolarHBondContact O-N 3.06Å; G6-W8 PolarHBondContact O-N 3.32Å; G6-W8 VanDerWaalsContact O-N 3.15Å | ||
| 7 | P | 65.3 | Low | 72.7 | Confident | 133 Ų | 133 | 110.3 Ų | 110.3 | 86% | 0.864 | 63% | 0.633 | S | S | * | * | trans | -52.5 | 128.4 | 177.6 | -3.7 | 10 | 0 | 0 | 0 | 108.3 | S9 | P7-S9 PolarHBondContact O-N 2.95Š| ||
| 8 | W | 63.1 | Low | 73.9 | Confident | 148 Ų | 148 | 110.3 Ų | 110.3 | 56% | 0.561 | 63% | 0.63 | S | S | * | * | trans | -45.7 | 130.6 | 174.9 | -152.7 | -60.7 | 0 | 0 | 0 | 108.4 | G6 S10 K12 N16 | G6-W8 PolarHBondContact O-N 3.32Å; G6-W8 VanDerWaalsContact O-N 3.15Å; W8-S10 PolarHBondContact O-N 2.97Å; W8-K12 HydrophobicContact CZ2-CD 4.3Å; W8-K12 VanDerWaalsContact NE1-CE 3.26Å; W8-N16 WeakPolarHBondContact CZ2-ND2 3.12Å | ||
| 9 | S | 73.3 | Confident | 74.9 | Confident | 71 Ų | 71 | 110.9 Ų | 110.9 | 50% | 0.497 | 63% | 0.627 | S | S | . | * | trans | -53.7 | 136.5 | -178.6 | 60.1 | 0 | 0 | 0 | 0 | 109.7 | P7 E11 K12 A13 | P7-S9 PolarHBondContact O-N 2.95Å; S9-E11 PolarHBondContact O-N 3.14Å; S9-E11 VanDerWaalsContact O-N 3.11Å; S9-K12 PolarHBondContact O-N 3.23Å; S9-K12 WeakPolarHBondContact OG-CB 3.04Å; S9-A13 PolarHBondContact O-N 3.22Å; S9-A13 VanDerWaalsContact O-N 3.08Å | ||
| 10 | S | 76.6 | Confident | 75.9 | Confident | 88 Ų | 88 | 110.3 Ų | 110.3 | 62% | 0.615 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -50.9 | -41.1 | -174.5 | 55.2 | 0 | 0 | 0 | 0 | 111.9 | W8 K12 A13 E14 | W8-S10 PolarHBondContact O-N 2.97Å; S10-K12 PolarHBondContact O-N 3.49Å; S10-A13 WeakPolarHBondContact O-CB 3.45Å; S10-A13 PolarHBondContact O-N 2.89Å; S10-A13 VanDerWaalsContact O-N 3.13Å; S10-E14 WeakPolarHBondContact O-CG 3.41Å; S10-E14 PolarHBondContact O-N 3.46Å |
| 11 | E | 82.1 | Confident | 76.8 | Confident | 143 Ų | 143 | 108.6 Ų | 108.6 | 67% | 0.668 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -62.1 | -38.8 | 179.3 | -157 | 165.5 | -149.3 | 0 | 0 | 113.2 | S9 M15 | S9-E11 PolarHBondContact O-N 3.14Å; S9-E11 VanDerWaalsContact O-N 3.11Å; E11-M15 WeakPolarHBondContact O-CB 3.49Å; E11-M15 PolarHBondContact O-N 3.18Å |
| 12 | K | 85.2 | Confident | 78.8 | Confident | 107 Ų | 107 | 104.3 Ų | 104.3 | 47% | 0.465 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -79.3 | -22.6 | 177.5 | -166 | -171.2 | 162 | -163.3 | 0 | 111.5 | W8 S9 S10 N16 | W8-K12 HydrophobicContact CZ2-CD 4.3Å; W8-K12 VanDerWaalsContact NE1-CE 3.26Å; S9-K12 PolarHBondContact O-N 3.23Å; S9-K12 WeakPolarHBondContact OG-CB 3.04Å; S10-K12 PolarHBondContact O-N 3.49Å; K12-N16 PolarHBondContact O-N 2.96Å; K12-N16 PolarHBondContact O-ND2 3.12Å |
| 13 | A | 86.4 | Confident | 80.9 | Confident | 38 Ų | 38 | 101.2 Ų | 101.2 | 31% | 0.314 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -73.9 | -41.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S9 S10 N16 I17 | S9-A13 PolarHBondContact O-N 3.22Å; S9-A13 VanDerWaalsContact O-N 3.08Å; S10-A13 WeakPolarHBondContact O-CB 3.45Å; S10-A13 PolarHBondContact O-N 2.89Å; S10-A13 VanDerWaalsContact O-N 3.13Å; A13-N16 PolarHBondContact O-N 3.02Å; A13-I17 WeakPolarHBondContact O-CG1 3.41Å; A13-I17 PolarHBondContact O-N 3.45Å; A13-I17 VanDerWaalsContact O-N 3.1Å |
| 14 | E | 87.4 | Confident | 83 | Confident | 120 Ų | 120 | 99 Ų | 99 | 56% | 0.561 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.7 | -42.4 | 176.2 | -74.2 | 171.5 | -158 | 0 | 0 | 112.1 | S10 N16 I17 L18 | S10-E14 WeakPolarHBondContact O-CG 3.41Å; S10-E14 PolarHBondContact O-N 3.46Å; E14-N16 PolarHBondContact O-N 3.43Å; E14-I17 PolarHBondContact O-N 3.04Å; E14-L18 PolarHBondContact O-N 3.35Å |
| 15 | M | 91.1 | Very high | 84.8 | Confident | 118 Ų | 118 | 103.1 Ų | 103.1 | 58% | 0.581 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.3 | -42.9 | 176.7 | -160.5 | -176.8 | -40 | 0 | 0 | 112.3 | E11 I17 L18 E19 | E11-M15 WeakPolarHBondContact O-CB 3.49Å; E11-M15 PolarHBondContact O-N 3.18Å; M15-I17 VanDerWaalsContact C-N 3.31Å; M15-I17 PolarHBondContact O-N 2.64Å; M15-L18 PolarHBondContact O-N 3.45Å; M15-E19 PolarHBondContact O-N 3.49Å |
| 16 | N | 89.6 | Confident | 86.4 | Confident | 55 Ų | 55 | 102.2 Ų | 102.2 | 29% | 0.294 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.9 | -38.9 | 174.9 | -73.9 | -12.8 | 0 | 0 | 0 | 111.9 | W8 K12 A13 E14 L18 I20 | W8-N16 WeakPolarHBondContact CZ2-ND2 3.12Å; K12-N16 PolarHBondContact O-N 2.96Å; K12-N16 PolarHBondContact O-ND2 3.12Å; A13-N16 PolarHBondContact O-N 3.02Å; E14-N16 PolarHBondContact O-N 3.43Å; N16-L18 VanDerWaalsContact C-N 3.34Å; N16-I20 WeakPolarHBondContact O-CB 3.38Å; N16-I20 WeakPolarHBondContact O-CD1 3.47Å; N16-I20 VanDerWaalsContact O-CG1 3.23Å; N16-I20 WeakPolarHBondContact O-CG1 3.46Å; N16-I20 PolarHBondContact O-N 3.29Å |
| 17 | I | 92.7 | Very high | 88 | Confident | 100 Ų | 100 | 104.7 Ų | 104.7 | 51% | 0.513 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.1 | -38.7 | 177.6 | -69.6 | 165.4 | 0 | 0 | 0 | 110.9 | A13 E14 M15 N21 | A13-I17 WeakPolarHBondContact O-CG1 3.41Å; A13-I17 PolarHBondContact O-N 3.45Å; A13-I17 VanDerWaalsContact O-N 3.1Å; E14-I17 PolarHBondContact O-N 3.04Å; M15-I17 VanDerWaalsContact C-N 3.31Å; M15-I17 PolarHBondContact O-N 2.64Å; I17-N21 WeakPolarHBondContact O-CB 2.93Å; I17-N21 PolarHBondContact O-N 2.87Å; I17-N21 PolarHBondContact O-ND2 3.43Å |
| 18 | L | 94.6 | Very high | 89.5 | Confident | 110 Ų | 110 | 103 Ų | 103 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.6 | -47.4 | 176.4 | -74.9 | 170.2 | 0 | 0 | 0 | 111.5 | E14 M15 N16 I20 N21 E22 | E14-L18 PolarHBondContact O-N 3.35Å; M15-L18 PolarHBondContact O-N 3.45Å; N16-L18 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.45Å; L18-N21 PolarHBondContact O-N 2.99Å; L18-N21 VanDerWaalsContact O-N 3.11Å; L18-E22 WeakPolarHBondContact O-CG 3.28Å; L18-E22 PolarHBondContact O-N 3.03Å |
| 19 | E | 92.9 | Very high | 91.1 | Very high | 122 Ų | 122 | 98.6 Ų | 98.6 | 57% | 0.57 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.6 | -44.4 | 177.9 | -172.1 | 179.1 | -174.2 | 0 | 0 | 111.8 | M15 N21 E22 T23 | M15-E19 PolarHBondContact O-N 3.49Å; E19-N21 VanDerWaalsContact C-N 3.34Å; E19-N21 PolarHBondContact O-N 3.38Å; E19-E22 PolarHBondContact O-N 3.46Å; E19-T23 WeakPolarHBondContact O-CG2 3.36Å; E19-T23 PolarHBondContact O-N 3.19Å; E19-T23 VanDerWaalsContact O-N 3.09Å; E19-T23 PolarHBondContact O-OG1 3.42Å |
| 20 | I | 94.6 | Very high | 92.3 | Very high | 98 Ų | 98 | 100.4 Ų | 100.4 | 50% | 0.503 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | 175 | -68.2 | 166.7 | 0 | 0 | 0 | 110.8 | N16 L18 E22 T23 L24 | N16-I20 WeakPolarHBondContact O-CB 3.38Å; N16-I20 WeakPolarHBondContact O-CD1 3.47Å; N16-I20 VanDerWaalsContact O-CG1 3.23Å; N16-I20 WeakPolarHBondContact O-CG1 3.46Å; N16-I20 PolarHBondContact O-N 3.29Å; L18-I20 PolarHBondContact O-N 3.45Å; I20-E22 PolarHBondContact O-N 2.9Å; I20-T23 PolarHBondContact O-N 3.04Å; I20-T23 PolarHBondContact O-OG1 3.28Å; I20-L24 HydrophobicContact CG2-CD1 3.69Å; I20-L24 HydrophobicContact CG2-CG 4.19Å; I20-L24 WeakPolarHBondContact O-CB 3.47Å; I20-L24 VanDerWaalsContact O-CG 3.27Å; I20-L24 WeakPolarHBondContact O-CG 3.46Å; I20-L24 PolarHBondContact O-N 3Å |
| 21 | N | 94.7 | Very high | 93.2 | Very high | 75 Ų | 75 | 102.2 Ų | 102.2 | 40% | 0.401 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.1 | -39.4 | 178.1 | -88.6 | -54.2 | 0 | 0 | 0 | 112.8 | I17 L18 E19 T23 L24 R25 | I17-N21 WeakPolarHBondContact O-CB 2.93Å; I17-N21 PolarHBondContact O-N 2.87Å; I17-N21 PolarHBondContact O-ND2 3.43Å; L18-N21 PolarHBondContact O-N 2.99Å; L18-N21 VanDerWaalsContact O-N 3.11Å; E19-N21 VanDerWaalsContact C-N 3.34Å; E19-N21 PolarHBondContact O-N 3.38Å; N21-T23 VanDerWaalsContact C-N 3.29Å; N21-T23 PolarHBondContact O-N 3.49Å; N21-L24 PolarHBondContact O-N 3.31Å; N21-R25 WeakPolarHBondContact O-CG 3.45Å; N21-R25 PolarHBondContact O-N 3.41Å; N21-R25 VanDerWaalsContact O-N 3.11Å |
| 22 | E | 95.4 | Very high | 94 | Very high | 145 Ų | 145 | 100.8 Ų | 100.8 | 68% | 0.678 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.8 | -36 | 177 | -74.6 | -173.3 | 166.1 | 0 | 0 | 112 | L18 E19 I20 P26 | L18-E22 WeakPolarHBondContact O-CG 3.28Å; L18-E22 PolarHBondContact O-N 3.03Å; E19-E22 PolarHBondContact O-N 3.46Å; I20-E22 PolarHBondContact O-N 2.9Å; E22-P26 WeakPolarHBondContact O-CD 3.4Å |
| 23 | T | 95.6 | Very high | 94.6 | Very high | 70 Ų | 70 | 99.7 Ų | 99.7 | 43% | 0.429 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -77.3 | -31.7 | 176.2 | 61 | 0 | 0 | 0 | 0 | 113.5 | E19 I20 N21 P26 Q27 | E19-T23 WeakPolarHBondContact O-CG2 3.36Å; E19-T23 PolarHBondContact O-N 3.19Å; E19-T23 VanDerWaalsContact O-N 3.09Å; E19-T23 PolarHBondContact O-OG1 3.42Å; I20-T23 PolarHBondContact O-N 3.04Å; I20-T23 PolarHBondContact O-OG1 3.28Å; N21-T23 VanDerWaalsContact C-N 3.29Å; N21-T23 PolarHBondContact O-N 3.49Å; T23-P26 WeakPolarHBondContact O-CD 3.44Å; T23-P26 WeakPolarHBondContact O-CG 3.41Å; T23-Q27 WeakPolarHBondContact O-CG 3.34Å; T23-Q27 PolarHBondContact O-NE2 3.18Å |
| 24 | L | 96.8 | Very high | 95.1 | Very high | 86 Ų | 86 | 101.4 Ų | 101.4 | 45% | 0.45 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -76.4 | -33 | -179.5 | -74 | 176 | 0 | 0 | 0 | 113.3 | I20 N21 Q27 L28 | I20-L24 HydrophobicContact CG2-CD1 3.69Å; I20-L24 HydrophobicContact CG2-CG 4.19Å; I20-L24 WeakPolarHBondContact O-CB 3.47Å; I20-L24 VanDerWaalsContact O-CG 3.27Å; I20-L24 WeakPolarHBondContact O-CG 3.46Å; I20-L24 PolarHBondContact O-N 3Å; N21-L24 PolarHBondContact O-N 3.31Å; L24-Q27 PolarHBondContact O-N 2.99Å; L24-L28 WeakPolarHBondContact O-CB 3.33Å; L24-L28 PolarHBondContact O-N 2.92Å |
| 25 | R | 96.4 | Very high | 95.6 | Very high | 191 Ų | 191 | 102.6 Ų | 102.6 | 72% | 0.721 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -55.3 | -51.9 | 178.5 | -79.9 | 179 | 179.8 | -164.4 | 2.6 | 114.1 | N21 L28 A29 | N21-R25 WeakPolarHBondContact O-CG 3.45Å; N21-R25 PolarHBondContact O-N 3.41Å; N21-R25 VanDerWaalsContact O-N 3.11Å; R25-L28 PolarHBondContact O-N 3.12Å; R25-A29 PolarHBondContact O-N 3.4Å; R25-A29 VanDerWaalsContact O-N 3.08Å |
| 26 | P | 96.4 | Very high | 95.9 | Very high | 78 Ų | 78 | 103.1 Ų | 103.1 | 51% | 0.506 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.4 | -39.5 | 177.9 | 24.7 | -32.8 | 0 | 0 | 0 | 111.9 | E22 T23 L28 A29 E30 | E22-P26 WeakPolarHBondContact O-CD 3.4Å; T23-P26 WeakPolarHBondContact O-CD 3.44Å; T23-P26 WeakPolarHBondContact O-CG 3.41Å; P26-L28 VanDerWaalsContact C-N 3.31Å; P26-L28 PolarHBondContact O-N 2.96Å; P26-A29 WeakPolarHBondContact O-CB 3.5Å; P26-A29 PolarHBondContact O-N 2.9Å; P26-A29 VanDerWaalsContact O-N 3.15Å; P26-E30 WeakPolarHBondContact O-CB 3.37Å; P26-E30 PolarHBondContact O-N 2.88Å |
| 27 | Q | 97 | Very high | 96.3 | Very high | 102 Ų | 102 | 103.7 Ų | 103.7 | 48% | 0.477 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -42.1 | 175.8 | -70.5 | 179.6 | 58.4 | 0 | 0 | 111.7 | T23 L24 E30 K31 | T23-Q27 WeakPolarHBondContact O-CG 3.34Å; T23-Q27 PolarHBondContact O-NE2 3.18Å; L24-Q27 PolarHBondContact O-N 2.99Å; Q27-E30 PolarHBondContact O-N 3.45Å; Q27-K31 WeakPolarHBondContact O-CB 3.49Å; Q27-K31 VanDerWaalsContact O-CG 3.23Å; Q27-K31 WeakPolarHBondContact O-CG 3.46Å; Q27-K31 PolarHBondContact O-N 3.24Å |
| 28 | L | 97.4 | Very high | 96.5 | Very high | 98 Ų | 98 | 104.6 Ų | 104.6 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -41.5 | 176.5 | -178.6 | 61.6 | 0 | 0 | 0 | 111.7 | L24 R25 P26 E30 K31 K32 | L24-L28 WeakPolarHBondContact O-CB 3.33Å; L24-L28 PolarHBondContact O-N 2.92Å; R25-L28 PolarHBondContact O-N 3.12Å; P26-L28 VanDerWaalsContact C-N 3.31Å; P26-L28 PolarHBondContact O-N 2.96Å; L28-E30 VanDerWaalsContact C-N 3.35Å; L28-K31 PolarHBondContact O-N 3.06Å; L28-K32 HydrophobicContact CG-CD 4.4Å; L28-K32 WeakPolarHBondContact O-CB 3.38Å; L28-K32 VanDerWaalsContact O-CG 3.31Å; L28-K32 WeakPolarHBondContact O-CG 3.34Å; L28-K32 PolarHBondContact O-N 2.78Å |
| 29 | A | 96.7 | Very high | 96.6 | Very high | 56 Ų | 56 | 105 Ų | 105 | 46% | 0.463 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | R25 P26 K32 Q33 | R25-A29 PolarHBondContact O-N 3.4Å; R25-A29 VanDerWaalsContact O-N 3.08Å; P26-A29 WeakPolarHBondContact O-CB 3.5Å; P26-A29 PolarHBondContact O-N 2.9Å; P26-A29 VanDerWaalsContact O-N 3.15Å; A29-K32 PolarHBondContact O-N 2.93Å; A29-Q33 PolarHBondContact O-N 3.41Å |
| 30 | E | 97.8 | Very high | 96.8 | Very high | 109 Ų | 109 | 104.8 Ų | 104.8 | 51% | 0.509 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.7 | -49.3 | 176 | -168.8 | -168.8 | 164.1 | 0 | 0 | 111.3 | P26 Q27 L28 K32 Q33 Q34 | P26-E30 WeakPolarHBondContact O-CB 3.37Å; P26-E30 PolarHBondContact O-N 2.88Å; Q27-E30 PolarHBondContact O-N 3.45Å; L28-E30 VanDerWaalsContact C-N 3.35Å; E30-K32 VanDerWaalsContact C-N 3.32Å; E30-K32 PolarHBondContact O-N 3.04Å; E30-Q33 WeakPolarHBondContact O-CB 3.49Å; E30-Q33 PolarHBondContact O-N 3.04Å; E30-Q34 WeakPolarHBondContact O-CG 3.47Å; E30-Q34 PolarHBondContact O-N 3.44Å; E30-Q34 PolarHBondContact OE1-NE2 3.34Å |
| 31 | K | 97.2 | Very high | 96.9 | Very high | 125 Ų | 125 | 106.9 Ų | 106.9 | 54% | 0.543 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.4 | -38.7 | 179.1 | -68.2 | -71 | 163.6 | -162.7 | 0 | 112.2 | Q27 L28 Q33 Q34 F35 | Q27-K31 WeakPolarHBondContact O-CB 3.49Å; Q27-K31 VanDerWaalsContact O-CG 3.23Å; Q27-K31 WeakPolarHBondContact O-CG 3.46Å; Q27-K31 PolarHBondContact O-N 3.24Å; L28-K31 PolarHBondContact O-N 3.06Å; K31-Q33 VanDerWaalsContact C-N 3.31Å; K31-Q33 PolarHBondContact O-N 3.48Å; K31-Q34 PolarHBondContact O-N 2.93Å; K31-F35 WeakPolarHBondContact O-CB 3.34Å; K31-F35 PolarHBondContact O-N 3.4Å |
| 32 | K | 97.8 | Very high | 97 | Very high | 114 Ų | 114 | 106.4 Ų | 106.4 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.4 | -41.6 | 172.6 | -79 | 176.8 | 178.3 | 179 | 0 | 111.7 | L28 A29 E30 F35 R36 | L28-K32 HydrophobicContact CG-CD 4.4Å; L28-K32 WeakPolarHBondContact O-CB 3.38Å; L28-K32 VanDerWaalsContact O-CG 3.31Å; L28-K32 WeakPolarHBondContact O-CG 3.34Å; L28-K32 PolarHBondContact O-N 2.78Å; A29-K32 PolarHBondContact O-N 2.93Å; E30-K32 VanDerWaalsContact C-N 3.32Å; E30-K32 PolarHBondContact O-N 3.04Å; K32-F35 PolarHBondContact O-N 3.22Å; K32-R36 PolarHBondContact O-N 3.35Å; K32-R36 VanDerWaalsContact O-N 3.13Å |
| 33 | Q | 97.8 | Very high | 97.1 | Very high | 83 Ų | 83 | 105 Ų | 105 | 39% | 0.388 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.9 | -43 | 177.2 | -169.9 | 59 | 28.7 | 0 | 0 | 112 | A29 E30 K31 F35 R36 N37 | A29-Q33 PolarHBondContact O-N 3.41Å; E30-Q33 WeakPolarHBondContact O-CB 3.49Å; E30-Q33 PolarHBondContact O-N 3.04Å; K31-Q33 VanDerWaalsContact C-N 3.31Å; K31-Q33 PolarHBondContact O-N 3.48Å; Q33-F35 VanDerWaalsContact C-N 3.28Å; Q33-F35 PolarHBondContact O-N 3.49Å; Q33-R36 PolarHBondContact O-N 3.24Å; Q33-R36 VanDerWaalsContact OE1-NE 3.07Å; Q33-N37 PolarHBondContact NE2-OD1 3.39Å; Q33-N37 VanDerWaalsContact NE2-OD1 3.08Å; Q33-N37 PolarHBondContact O-N 3Å; Q33-N37 PolarHBondContact O-OD1 3.22Å |
| 34 | Q | 98.1 | Very high | 97.1 | Very high | 75 Ų | 75 | 107.2 Ų | 107.2 | 35% | 0.35 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -57.2 | -42.9 | 174.7 | -71.9 | 177.9 | -4.6 | 0 | 0 | 111.3 | E30 K31 N37 L38 | E30-Q34 WeakPolarHBondContact O-CG 3.47Å; E30-Q34 PolarHBondContact O-N 3.44Å; E30-Q34 PolarHBondContact OE1-NE2 3.34Å; K31-Q34 PolarHBondContact O-N 2.93Å; Q34-N37 PolarHBondContact O-N 2.92Å; Q34-L38 WeakPolarHBondContact O-CD1 3.42Å; Q34-L38 PolarHBondContact O-N 3.29Å |
| 35 | F | 97.7 | Very high | 97.1 | Very high | 145 Ų | 145 | 108 Ų | 108 | 64% | 0.636 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63 | -43.2 | 177.3 | -173.5 | -100.1 | 0 | 0 | 0 | 112.6 | K31 K32 Q33 L38 K39 | K31-F35 WeakPolarHBondContact O-CB 3.34Å; K31-F35 PolarHBondContact O-N 3.4Å; K32-F35 PolarHBondContact O-N 3.22Å; Q33-F35 VanDerWaalsContact C-N 3.28Å; Q33-F35 PolarHBondContact O-N 3.49Å; F35-L38 PolarHBondContact O-N 3.01Å; F35-K39 WeakPolarHBondContact O-CB 3.49Å; F35-K39 PolarHBondContact O-N 3.05Å |
| 36 | R | 97.4 | Very high | 97.2 | Very high | 129 Ų | 129 | 104.5 Ų | 104.5 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.6 | -47.9 | 174.2 | -76.5 | -171.4 | -76.6 | -107.5 | 3 | 111.8 | K32 Q33 L38 K39 E40 | K32-R36 PolarHBondContact O-N 3.35Å; K32-R36 VanDerWaalsContact O-N 3.13Å; Q33-R36 PolarHBondContact O-N 3.24Å; Q33-R36 VanDerWaalsContact OE1-NE 3.07Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.27Å; R36-K39 WeakPolarHBondContact O-CB 3.11Å; R36-K39 PolarHBondContact O-N 2.93Å; R36-K39 VanDerWaalsContact O-N 3.16Å; R36-E40 PolarHBondContact O-N 3.21Å |
| 37 | N | 97.2 | Very high | 97.2 | Very high | 67 Ų | 67 | 105.4 Ų | 105.4 | 36% | 0.358 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.6 | -40.7 | 178.6 | -67.8 | -0.1 | 0 | 0 | 0 | 112 | Q33 Q34 E40 K41 | Q33-N37 PolarHBondContact NE2-OD1 3.39Å; Q33-N37 VanDerWaalsContact NE2-OD1 3.08Å; Q33-N37 PolarHBondContact O-N 3Å; Q33-N37 PolarHBondContact O-OD1 3.22Å; Q34-N37 PolarHBondContact O-N 2.92Å; N37-E40 PolarHBondContact O-N 3.43Å; N37-K41 WeakPolarHBondContact O-CG 3.49Å; N37-K41 PolarHBondContact O-N 3.03Å |
| 38 | L | 97.4 | Very high | 97.2 | Very high | 118 Ų | 118 | 103.2 Ų | 103.2 | 62% | 0.618 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.7 | -42.4 | 175.5 | -106.9 | 75.5 | 0 | 0 | 0 | 111.7 | Q34 F35 R36 K41 C42 | Q34-L38 WeakPolarHBondContact O-CD1 3.42Å; Q34-L38 PolarHBondContact O-N 3.29Å; F35-L38 PolarHBondContact O-N 3.01Å; R36-L38 VanDerWaalsContact C-N 3.33Å; R36-L38 PolarHBondContact O-N 3.27Å; L38-K41 PolarHBondContact O-N 2.83Å; L38-C42 WeakPolarHBondContact O-CB 3.36Å; L38-C42 PolarHBondContact O-N 3.3Å |
| 39 | K | 97.3 | Very high | 97.1 | Very high | 118 Ų | 118 | 100.1 Ų | 100.1 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.8 | -45.7 | 178.5 | -176.5 | 172 | 177.9 | 177.2 | 0 | 111 | F35 R36 C42 F43 | F35-K39 WeakPolarHBondContact O-CB 3.49Å; F35-K39 PolarHBondContact O-N 3.05Å; R36-K39 WeakPolarHBondContact O-CB 3.11Å; R36-K39 PolarHBondContact O-N 2.93Å; R36-K39 VanDerWaalsContact O-N 3.16Å; K39-C42 WeakPolarHBondContact O-CB 3.45Å; K39-C42 PolarHBondContact O-N 3.31Å; K39-F43 HydrophobicContact CD-CE2 4.16Å; K39-F43 HydrophobicContact CG-CD2 3.9Å; K39-F43 HydrophobicContact CG-CE2 3.53Å; K39-F43 WeakPolarHBondContact O-CD2 3.35Å; K39-F43 PolarHBondContact O-N 2.85Å |
| 40 | E | 96.5 | Very high | 97.1 | Very high | 118 Ų | 118 | 103 Ų | 103 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.5 | -47.9 | 175.1 | -72.5 | 173.8 | -169.3 | 0 | 0 | 112.3 | R36 N37 C42 F43 L44 | R36-E40 PolarHBondContact O-N 3.21Å; N37-E40 PolarHBondContact O-N 3.43Å; E40-C42 VanDerWaalsContact C-N 3.29Å; E40-C42 PolarHBondContact O-N 3.41Å; E40-F43 PolarHBondContact O-N 3.48Å; E40-L44 WeakPolarHBondContact O-CG 3.36Å; E40-L44 PolarHBondContact O-N 3.46Å |
| 41 | K | 96.9 | Very high | 97 | Very high | 143 Ų | 143 | 102.4 Ų | 102.4 | 62% | 0.622 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60 | -39 | 176.8 | -73.9 | 179.4 | 179.3 | -175.3 | 0 | 112.7 | N37 L38 L44 T45 | N37-K41 WeakPolarHBondContact O-CG 3.49Å; N37-K41 PolarHBondContact O-N 3.03Å; L38-K41 PolarHBondContact O-N 2.83Å; K41-L44 PolarHBondContact O-N 3.08Å; K41-T45 WeakPolarHBondContact O-CB 3.47Å; K41-T45 PolarHBondContact O-N 2.98Å; K41-T45 PolarHBondContact O-OG1 2.93Å |
| 42 | C | 96.9 | Very high | 96.9 | Very high | 65 Ų | 65 | 98.5 Ų | 98.5 | 44% | 0.439 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -48.4 | 176.2 | -174 | 0 | 0 | 0 | 0 | 110.6 | L38 K39 E40 L44 T45 Q46 | L38-C42 WeakPolarHBondContact O-CB 3.36Å; L38-C42 PolarHBondContact O-N 3.3Å; K39-C42 WeakPolarHBondContact O-CB 3.45Å; K39-C42 PolarHBondContact O-N 3.31Å; E40-C42 VanDerWaalsContact C-N 3.29Å; E40-C42 PolarHBondContact O-N 3.41Å; C42-L44 PolarHBondContact O-N 3.36Å; C42-T45 PolarHBondContact O-N 3.2Å; C42-Q46 WeakPolarHBondContact O-CG 3.41Å; C42-Q46 PolarHBondContact O-N 3.36Å |
| 43 | F | 96.3 | Very high | 96.7 | Very high | 115 Ų | 115 | 98 Ų | 98 | 50% | 0.504 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -43.7 | 176.9 | -79.2 | -61.5 | 0 | 0 | 0 | 113 | K39 E40 T45 Q46 L47 | K39-F43 HydrophobicContact CD-CE2 4.16Å; K39-F43 HydrophobicContact CG-CD2 3.9Å; K39-F43 HydrophobicContact CG-CE2 3.53Å; K39-F43 WeakPolarHBondContact O-CD2 3.35Å; K39-F43 PolarHBondContact O-N 2.85Å; E40-F43 PolarHBondContact O-N 3.48Å; F43-T45 VanDerWaalsContact C-N 3.31Å; F43-T45 PolarHBondContact O-N 3.39Å; F43-Q46 PolarHBondContact O-N 2.91Å; F43-L47 WeakPolarHBondContact O-CB 3.5Å; F43-L47 PolarHBondContact O-N 2.89Å |
| 44 | L | 96.9 | Very high | 96.4 | Very high | 116 Ų | 116 | 98.9 Ų | 98.9 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.3 | -41.9 | 177.3 | -71.5 | 173.3 | 0 | 0 | 0 | 111.7 | E40 K41 C42 L47 A48 | E40-L44 WeakPolarHBondContact O-CG 3.36Å; E40-L44 PolarHBondContact O-N 3.46Å; K41-L44 PolarHBondContact O-N 3.08Å; C42-L44 PolarHBondContact O-N 3.36Å; L44-L47 PolarHBondContact O-N 3.4Å; L44-A48 WeakPolarHBondContact O-CB 3.5Å; L44-A48 PolarHBondContact O-N 3.16Å |
| 45 | T | 96.9 | Very high | 96 | Very high | 103 Ų | 103 | 100.7 Ų | 100.7 | 63% | 0.632 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.3 | -44 | 176.4 | -55.3 | 0 | 0 | 0 | 0 | 111.7 | K41 C42 F43 A48 G49 | K41-T45 WeakPolarHBondContact O-CB 3.47Å; K41-T45 PolarHBondContact O-N 2.98Å; K41-T45 PolarHBondContact O-OG1 2.93Å; C42-T45 PolarHBondContact O-N 3.2Å; F43-T45 VanDerWaalsContact C-N 3.31Å; F43-T45 PolarHBondContact O-N 3.39Å; T45-A48 PolarHBondContact O-N 3.13Å; T45-G49 PolarHBondContact O-N 2.88Å |
| 46 | Q | 96.9 | Very high | 95.7 | Very high | 118 Ų | 118 | 100.7 Ų | 100.7 | 55% | 0.551 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.5 | -44.2 | 176.4 | -73.3 | 177.5 | -1.9 | 0 | 0 | 111.7 | C42 F43 G49 F50 | C42-Q46 WeakPolarHBondContact O-CG 3.41Å; C42-Q46 PolarHBondContact O-N 3.36Å; F43-Q46 PolarHBondContact O-N 2.91Å; Q46-G49 PolarHBondContact O-N 3.32Å; Q46-F50 WeakPolarHBondContact O-CB 3.44Å; Q46-F50 PolarHBondContact O-N 2.96Å |
| 47 | L | 97.1 | Very high | 95.5 | Very high | 96 Ų | 96 | 102 Ų | 102 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 177.3 | -176 | 65.5 | 0 | 0 | 0 | 111.2 | F43 L44 G49 F50 L51 | F43-L47 WeakPolarHBondContact O-CB 3.5Å; F43-L47 PolarHBondContact O-N 2.89Å; L44-L47 PolarHBondContact O-N 3.4Å; L47-G49 VanDerWaalsContact C-N 3.33Å; L47-G49 PolarHBondContact O-N 3.35Å; L47-F50 WeakPolarHBondContact O-CB 3.41Å; L47-F50 PolarHBondContact O-N 3Å; L47-L51 HydrophobicContact CG-CD1 4.21Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 2.88Å |
| 48 | A | 96.9 | Very high | 95 | Very high | 57 Ų | 57 | 105.7 Ų | 105.7 | 47% | 0.471 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L44 T45 L51 A52 | L44-A48 WeakPolarHBondContact O-CB 3.5Å; L44-A48 PolarHBondContact O-N 3.16Å; T45-A48 PolarHBondContact O-N 3.13Å; A48-L51 PolarHBondContact O-N 3.39Å; A48-A52 WeakPolarHBondContact O-CB 3.31Å; A48-A52 PolarHBondContact O-N 2.96Å |
| 49 | G | 96.5 | Very high | 94.6 | Very high | 33 Ų | 33 | 105.5 Ų | 105.5 | 34% | 0.34 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62 | -42.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | T45 Q46 L47 A52 N53 | T45-G49 PolarHBondContact O-N 2.88Å; Q46-G49 PolarHBondContact O-N 3.32Å; L47-G49 VanDerWaalsContact C-N 3.33Å; L47-G49 PolarHBondContact O-N 3.35Å; G49-A52 PolarHBondContact O-N 3.42Å; G49-N53 WeakPolarHBondContact O-CB 3.42Å; G49-N53 VanDerWaalsContact O-CG 3.23Å; G49-N53 PolarHBondContact O-N 2.96Å; G49-N53 PolarHBondContact O-ND2 3.49Å |
| 50 | F | 95.8 | Very high | 94.2 | Very high | 117 Ų | 117 | 107.4 Ų | 107.4 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.8 | -47.7 | 175.5 | 178.8 | -97.8 | 0 | 0 | 0 | 112 | Q46 L47 A52 N53 Q54 | Q46-F50 WeakPolarHBondContact O-CB 3.44Å; Q46-F50 PolarHBondContact O-N 2.96Å; L47-F50 WeakPolarHBondContact O-CB 3.41Å; L47-F50 PolarHBondContact O-N 3Å; F50-A52 PolarHBondContact O-N 3.15Å; F50-N53 PolarHBondContact O-N 3.47Å; F50-Q54 HydrophobicContact CD1-CG 4.31Å; F50-Q54 HydrophobicContact CE1-CG 3.89Å; F50-Q54 HydrophobicContact CE2-CG 4.49Å; F50-Q54 HydrophobicContact CZ-CG 3.99Å; F50-Q54 PolarHBondContact O-N 3.36Å |
| 51 | L | 95.4 | Very high | 93.9 | Very high | 96 Ų | 96 | 105.2 Ų | 105.2 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 178.4 | -70.5 | 172.7 | 0 | 0 | 0 | 111.9 | L47 A48 N53 Q54 Q55 | L47-L51 HydrophobicContact CG-CD1 4.21Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 2.88Å; A48-L51 PolarHBondContact O-N 3.39Å; L51-N53 VanDerWaalsContact C-N 3.3Å; L51-N53 PolarHBondContact O-N 3.37Å; L51-Q54 PolarHBondContact O-N 3.05Å; L51-Q55 PolarHBondContact O-N 2.84Å |
| 52 | A | 95 | Very high | 93.5 | Very high | 42 Ų | 42 | 102.9 Ų | 102.9 | 35% | 0.347 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A48 G49 F50 Q55 K56 | A48-A52 WeakPolarHBondContact O-CB 3.31Å; A48-A52 PolarHBondContact O-N 2.96Å; G49-A52 PolarHBondContact O-N 3.42Å; F50-A52 PolarHBondContact O-N 3.15Å; A52-Q55 PolarHBondContact O-N 3.46Å; A52-K56 WeakPolarHBondContact O-CG 3.38Å; A52-K56 PolarHBondContact O-N 3.08Å |
| 53 | N | 93.4 | Very high | 93.1 | Very high | 104 Ų | 104 | 103.3 Ų | 103.3 | 56% | 0.556 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66.6 | -41.7 | 175.7 | -71.9 | -20.4 | 0 | 0 | 0 | 112 | G49 F50 L51 K56 K57 | G49-N53 WeakPolarHBondContact O-CB 3.42Å; G49-N53 VanDerWaalsContact O-CG 3.23Å; G49-N53 PolarHBondContact O-N 2.96Å; G49-N53 PolarHBondContact O-ND2 3.49Å; F50-N53 PolarHBondContact O-N 3.47Å; L51-N53 VanDerWaalsContact C-N 3.3Å; L51-N53 PolarHBondContact O-N 3.37Å; N53-K56 PolarHBondContact O-N 3.48Å; N53-K57 PolarHBondContact O-N 2.92Å |
| 54 | Q | 91.8 | Very high | 93 | Very high | 102 Ų | 102 | 102.6 Ų | 102.6 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 174.6 | -74.6 | -160.9 | -33.8 | 0 | 0 | 112 | F50 L51 K56 K57 Y58 | F50-Q54 HydrophobicContact CD1-CG 4.31Å; F50-Q54 HydrophobicContact CE1-CG 3.89Å; F50-Q54 HydrophobicContact CE2-CG 4.49Å; F50-Q54 HydrophobicContact CZ-CG 3.99Å; F50-Q54 PolarHBondContact O-N 3.36Å; L51-Q54 PolarHBondContact O-N 3.05Å; Q54-K56 VanDerWaalsContact C-N 3.34Å; Q54-K56 PolarHBondContact O-N 3.38Å; Q54-K57 PolarHBondContact O-N 2.9Å; Q54-Y58 PolarHBondContact O-N 3.38Å |
| 55 | Q | 90.7 | Very high | 92.8 | Very high | 113 Ų | 113 | 101.2 Ų | 101.2 | 53% | 0.528 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 177.8 | -169 | -174.5 | 20.7 | 0 | 0 | 111.8 | L51 A52 Y58 K59 | L51-Q55 PolarHBondContact O-N 2.84Å; A52-Q55 PolarHBondContact O-N 3.46Å; Q55-Y58 PolarHBondContact O-N 3.06Å; Q55-K59 WeakPolarHBondContact O-CG 2.94Å; Q55-K59 PolarHBondContact O-N 3.34Å |
| 56 | K | 91.4 | Very high | 92.5 | Very high | 145 Ų | 145 | 101.1 Ų | 101.1 | 63% | 0.63 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.6 | -43.7 | 175.1 | -75.2 | 177.4 | -179.4 | 179.5 | 0 | 111.8 | A52 N53 Q54 K59 Y60 | A52-K56 WeakPolarHBondContact O-CG 3.38Å; A52-K56 PolarHBondContact O-N 3.08Å; N53-K56 PolarHBondContact O-N 3.48Å; Q54-K56 VanDerWaalsContact C-N 3.34Å; Q54-K56 PolarHBondContact O-N 3.38Å; K56-K59 PolarHBondContact O-N 2.87Å; K56-Y60 WeakPolarHBondContact O-CB 3.38Å; K56-Y60 PolarHBondContact O-N 3.06Å |
| 57 | K | 91.8 | Very high | 92.3 | Very high | 155 Ų | 155 | 100.4 Ų | 100.4 | 67% | 0.674 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.8 | -44.6 | 177.8 | -174 | 179.7 | 178.9 | -177.6 | 0 | 111.7 | N53 Q54 Y60 E61 | N53-K57 PolarHBondContact O-N 2.92Å; Q54-K57 PolarHBondContact O-N 2.9Å; K57-Y60 WeakPolarHBondContact O-CB 3.23Å; K57-Y60 PolarHBondContact O-N 3.33Å; K57-E61 PolarHBondContact O-N 3.48Å |
| 58 | Y | 86.6 | Confident | 92.1 | Very high | 146 Ų | 146 | 103 Ų | 103 | 57% | 0.573 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.2 | -49.3 | 178.4 | -178.3 | -101.1 | 0 | 0 | 0 | 111.9 | Q54 Q55 Y60 E61 E62 | Q54-Y58 PolarHBondContact O-N 3.38Å; Q55-Y58 PolarHBondContact O-N 3.06Å; Y58-Y60 VanDerWaalsContact C-N 3.26Å; Y58-Y60 PolarHBondContact O-N 2.87Å; Y58-E61 PolarHBondContact O-N 3.11Å; Y58-E61 VanDerWaalsContact O-N 3.12Å; Y58-E62 HydrophobicContact CD1-CG 4.27Å; Y58-E62 HydrophobicContact CE1-CG 3.79Å; Y58-E62 WeakPolarHBondContact CE1-OE1 3.45Å; Y58-E62 WeakPolarHBondContact CE1-OE2 3.43Å; Y58-E62 HydrophobicContact CE2-CG 4.39Å; Y58-E62 VanDerWaalsContact CZ-CD 3.48Å; Y58-E62 PolarHBondContact O-N 2.87Å; Y58-E62 PolarHBondContact OH-OE1 3Å |
| 59 | K | 89.1 | Confident | 91.9 | Very high | 114 Ų | 114 | 106.2 Ų | 106.2 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.7 | -38.3 | 175.3 | -72.9 | 179.6 | 177.5 | -177.6 | 0 | 112.8 | Q55 K56 C63 | Q55-K59 WeakPolarHBondContact O-CG 2.94Å; Q55-K59 PolarHBondContact O-N 3.34Å; K56-K59 PolarHBondContact O-N 2.87Å; K59-C63 WeakPolarHBondContact O-CB 3.38Å; K59-C63 PolarHBondContact O-N 3.41Å; K59-C63 PolarHBondContact O-SG 3.37Å; K59-C63 VanDerWaalsContact O-SG 3.41Å |
| 60 | Y | 89.8 | Confident | 91.5 | Very high | 158 Ų | 158 | 109.6 Ų | 109.6 | 62% | 0.62 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.2 | -44.2 | 176.8 | 178 | -97.1 | 0 | 0 | 0 | 111.9 | K56 K57 Y58 C63 K64 | K56-Y60 WeakPolarHBondContact O-CB 3.38Å; K56-Y60 PolarHBondContact O-N 3.06Å; K57-Y60 WeakPolarHBondContact O-CB 3.23Å; K57-Y60 PolarHBondContact O-N 3.33Å; Y58-Y60 VanDerWaalsContact C-N 3.26Å; Y58-Y60 PolarHBondContact O-N 2.87Å; Y60-C63 PolarHBondContact O-N 3.11Å; Y60-K64 HydrophobicContact CE1-CD 4.29Å; Y60-K64 WeakPolarHBondContact O-CB 3.45Å; Y60-K64 PolarHBondContact O-N 3.46Å |
| 61 | E | 90.5 | Very high | 91.3 | Very high | 72 Ų | 72 | 108.1 Ų | 108.1 | 34% | 0.336 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.8 | -41.3 | 179.2 | -153.3 | 66 | -158.9 | 0 | 0 | 111.4 | K57 Y58 C63 K64 D65 | K57-E61 PolarHBondContact O-N 3.48Å; Y58-E61 PolarHBondContact O-N 3.11Å; Y58-E61 VanDerWaalsContact O-N 3.12Å; E61-C63 PolarHBondContact O-N 3.37Å; E61-K64 WeakPolarHBondContact O-CB 3.39Å; E61-K64 PolarHBondContact O-N 3.33Å; E61-K64 IonicContact OE1-NZ 3.64Å; E61-K64 PolarHBondContact OE1-NZ 2.99Å; E61-K64 IonicContact OE2-NZ 2.78Å; E61-D65 PolarHBondContact O-N 3.23Å |
| 62 | E | 88.6 | Confident | 91.1 | Very high | 93 Ų | 93 | 111.9 Ų | 111.9 | 44% | 0.435 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58 | -46.9 | 173.3 | -74.3 | -173.4 | 143.9 | 0 | 0 | 112.3 | Y58 K64 D65 L66 | Y58-E62 HydrophobicContact CD1-CG 4.27Å; Y58-E62 HydrophobicContact CE1-CG 3.79Å; Y58-E62 WeakPolarHBondContact CE1-OE1 3.45Å; Y58-E62 WeakPolarHBondContact CE1-OE2 3.43Å; Y58-E62 HydrophobicContact CE2-CG 4.39Å; Y58-E62 VanDerWaalsContact CZ-CD 3.48Å; Y58-E62 PolarHBondContact O-N 2.87Å; Y58-E62 PolarHBondContact OH-OE1 3Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.09Å; E62-D65 PolarHBondContact O-N 3.45Å; E62-L66 WeakPolarHBondContact O-CB 3.44Å; E62-L66 PolarHBondContact O-N 3.06Å |
| 63 | C | 87.8 | Confident | 90.5 | Very high | 74 Ų | 74 | 112.3 Ų | 112.3 | 50% | 0.5 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -41.3 | 176.4 | -78.6 | 0 | 0 | 0 | 0 | 111.9 | K59 Y60 E61 L66 I67 | K59-C63 WeakPolarHBondContact O-CB 3.38Å; K59-C63 PolarHBondContact O-N 3.41Å; K59-C63 PolarHBondContact O-SG 3.37Å; K59-C63 VanDerWaalsContact O-SG 3.41Å; Y60-C63 PolarHBondContact O-N 3.11Å; E61-C63 PolarHBondContact O-N 3.37Å; C63-L66 PolarHBondContact O-N 3.03Å; C63-I67 VanDerWaalsContact O-CG1 3.28Å; C63-I67 WeakPolarHBondContact O-CG1 3.27Å; C63-I67 PolarHBondContact O-N 2.98Å |
| 64 | K | 93.3 | Very high | 89.7 | Confident | 100 Ų | 100 | 113.6 Ų | 113.6 | 44% | 0.435 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 178.9 | 177.1 | -177.9 | 162.8 | -149 | 0 | 111.7 | Y60 E61 E62 I67 K68 | Y60-K64 HydrophobicContact CE1-CD 4.29Å; Y60-K64 WeakPolarHBondContact O-CB 3.45Å; Y60-K64 PolarHBondContact O-N 3.46Å; E61-K64 WeakPolarHBondContact O-CB 3.39Å; E61-K64 PolarHBondContact O-N 3.33Å; E61-K64 IonicContact OE1-NZ 3.64Å; E61-K64 PolarHBondContact OE1-NZ 2.99Å; E61-K64 IonicContact OE2-NZ 2.78Å; E62-K64 VanDerWaalsContact C-N 3.31Å; E62-K64 PolarHBondContact O-N 3.09Å; K64-I67 PolarHBondContact O-N 3.1Å; K64-K68 WeakPolarHBondContact O-CB 3.37Å; K64-K68 PolarHBondContact O-N 3.39Å |
| 65 | D | 92.7 | Very high | 88.9 | Confident | 88 Ų | 88 | 118.9 Ų | 118.9 | 47% | 0.471 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.8 | -40.5 | 176.8 | -75.8 | -22.5 | 0 | 0 | 0 | 111.8 | E61 E62 K68 F69 | E61-D65 PolarHBondContact O-N 3.23Å; E62-D65 PolarHBondContact O-N 3.45Å; D65-K68 PolarHBondContact O-N 3.42Å; D65-F69 WeakPolarHBondContact O-CB 3.45Å; D65-F69 PolarHBondContact O-N 3.49Å |
| 66 | L | 92.4 | Very high | 87.7 | Confident | 101 Ų | 101 | 120.1 Ų | 120.1 | 53% | 0.529 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 174.8 | 179.9 | 63 | 0 | 0 | 0 | 111.7 | E62 C63 K68 F69 M70 | E62-L66 WeakPolarHBondContact O-CB 3.44Å; E62-L66 PolarHBondContact O-N 3.06Å; C63-L66 PolarHBondContact O-N 3.03Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.01Å; L66-F69 WeakPolarHBondContact O-CB 3.34Å; L66-F69 PolarHBondContact O-N 2.99Å; L66-M70 HydrophobicContact CD1-CG 4.47Å; L66-M70 HydrophobicContact CG-SD 4.43Å; L66-M70 WeakPolarHBondContact O-CG 3.23Å; L66-M70 PolarHBondContact O-N 3.33Å |
| 67 | I | 91.9 | Very high | 85.9 | Confident | 102 Ų | 102 | 124.7 Ų | 124.7 | 52% | 0.523 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -58.7 | -44.1 | 176.9 | -70.1 | 165.4 | 0 | 0 | 0 | 110.4 | C63 K64 F69 M70 L71 | C63-I67 VanDerWaalsContact O-CG1 3.28Å; C63-I67 WeakPolarHBondContact O-CG1 3.27Å; C63-I67 PolarHBondContact O-N 2.98Å; K64-I67 PolarHBondContact O-N 3.1Å; I67-F69 VanDerWaalsContact C-N 3.33Å; I67-F69 PolarHBondContact O-N 3.21Å; I67-M70 PolarHBondContact O-N 2.94Å; I67-L71 HydrophobicContact CG2-CD1 3.93Å; I67-L71 HydrophobicContact CG2-CG 4.39Å; I67-L71 WeakPolarHBondContact O-CG 3.45Å; I67-L71 PolarHBondContact O-N 3.38Å |
| 68 | K | 92.4 | Very high | 85.6 | Confident | 152 Ų | 152 | 123.2 Ų | 123.2 | 66% | 0.661 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.3 | -39.2 | 178.7 | -170.2 | 178.3 | -179.2 | -176.4 | 0 | 112.1 | K64 D65 L66 R72 | K64-K68 WeakPolarHBondContact O-CB 3.37Å; K64-K68 PolarHBondContact O-N 3.39Å; D65-K68 PolarHBondContact O-N 3.42Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.01Å; K68-R72 PolarHBondContact O-N 2.89Å |
| 69 | F | 92.3 | Very high | 85.6 | Confident | 124 Ų | 124 | 121.9 Ų | 121.9 | 54% | 0.544 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.4 | -47.6 | 174.8 | 178 | -103.6 | 0 | 0 | 0 | 111.6 | D65 L66 I67 R72 N73 | D65-F69 WeakPolarHBondContact O-CB 3.45Å; D65-F69 PolarHBondContact O-N 3.49Å; L66-F69 WeakPolarHBondContact O-CB 3.34Å; L66-F69 PolarHBondContact O-N 2.99Å; I67-F69 VanDerWaalsContact C-N 3.33Å; I67-F69 PolarHBondContact O-N 3.21Å; F69-R72 PolarHBondContact O-N 3.08Å; F69-N73 WeakPolarHBondContact CD1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 3.4Å; F69-N73 WeakPolarHBondContact CZ-ND2 3.44Å; F69-N73 PolarHBondContact O-N 3.13Å; F69-N73 VanDerWaalsContact O-N 3.12Å; F69-N73 PolarHBondContact O-ND2 2.87Å |
| 70 | M | 89.9 | Confident | 85.4 | Confident | 104 Ų | 104 | 122.4 Ų | 122.4 | 51% | 0.512 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.5 | -48.5 | 178.6 | -67.1 | -175.4 | 80.5 | 0 | 0 | 112 | L66 I67 R72 N73 E74 | L66-M70 HydrophobicContact CD1-CG 4.47Å; L66-M70 HydrophobicContact CG-SD 4.43Å; L66-M70 WeakPolarHBondContact O-CG 3.23Å; L66-M70 PolarHBondContact O-N 3.33Å; I67-M70 PolarHBondContact O-N 2.94Å; M70-R72 PolarHBondContact O-N 3.41Å; M70-N73 PolarHBondContact O-N 3.11Å; M70-N73 VanDerWaalsContact O-N 3.14Å; M70-E74 PolarHBondContact O-N 3.07Å |
| 71 | L | 91.4 | Very high | 85.1 | Confident | 85 Ų | 85 | 120.3 Ų | 120.3 | 45% | 0.445 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.7 | -30.9 | 177.8 | -72.5 | 173.2 | 0 | 0 | 0 | 113.3 | I67 R75 | I67-L71 HydrophobicContact CG2-CD1 3.93Å; I67-L71 HydrophobicContact CG2-CG 4.39Å; I67-L71 WeakPolarHBondContact O-CG 3.45Å; I67-L71 PolarHBondContact O-N 3.38Å; L71-R75 WeakPolarHBondContact O-CG 3.47Å |
| 72 | R | 89.8 | Confident | 84.8 | Confident | 175 Ų | 175 | 123.3 Ų | 123.3 | 66% | 0.66 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -72.1 | -41.8 | 177 | -166.4 | 179.8 | -150.9 | -135 | 3.6 | 111.2 | K68 F69 M70 R75 Q76 | K68-R72 PolarHBondContact O-N 2.89Å; F69-R72 PolarHBondContact O-N 3.08Å; M70-R72 PolarHBondContact O-N 3.41Å; R72-R75 PolarHBondContact O-N 3.29Å; R72-Q76 WeakPolarHBondContact O-CG 3.43Å |
| 73 | N | 82.8 | Confident | 84.5 | Confident | 52 Ų | 52 | 125.3 Ų | 125.3 | 28% | 0.278 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -69.7 | -39.3 | 180 | -64.4 | -20.6 | 0 | 0 | 0 | 111.4 | F69 M70 R75 Q76 F77 | F69-N73 WeakPolarHBondContact CD1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 3.4Å; F69-N73 WeakPolarHBondContact CZ-ND2 3.44Å; F69-N73 PolarHBondContact O-N 3.13Å; F69-N73 VanDerWaalsContact O-N 3.12Å; F69-N73 PolarHBondContact O-ND2 2.87Å; M70-N73 PolarHBondContact O-N 3.11Å; M70-N73 VanDerWaalsContact O-N 3.14Å; N73-R75 VanDerWaalsContact C-N 3.26Å; N73-R75 PolarHBondContact O-N 3.15Å; N73-Q76 PolarHBondContact O-N 3.33Å; N73-F77 WeakPolarHBondContact O-CD2 3.39Å |
| 74 | E | 77.4 | Confident | 84.3 | Confident | 131 Ų | 131 | 129 Ų | 129 | 61% | 0.612 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61 | -31.2 | 176.3 | -76.4 | -177.5 | 176.7 | 0 | 0 | 113.5 | M70 Q76 | M70-E74 PolarHBondContact O-N 3.07Å; E74-Q76 VanDerWaalsContact C-N 3.29Å; E74-Q76 PolarHBondContact O-N 3.04Å |
| 75 | R | 73.5 | Confident | 83.6 | Confident | 212 Ų | 212 | 131.2 Ų | 131.2 | 80% | 0.8 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -7.9 | 176.2 | -68.3 | -175.5 | -160 | -171.9 | 3.6 | 114.3 | L71 R72 N73 | L71-R75 WeakPolarHBondContact O-CG 3.47Å; R72-R75 PolarHBondContact O-N 3.29Å; N73-R75 VanDerWaalsContact C-N 3.26Å; N73-R75 PolarHBondContact O-N 3.15Å |
| 76 | Q | 66.5 | Low | 82.8 | Confident | 140 Ų | 140 | 134.8 Ų | 134.8 | 65% | 0.654 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -7.2 | 179.8 | -71.1 | -174 | -16.3 | 0 | 0 | 113 | R72 N73 E74 | R72-Q76 WeakPolarHBondContact O-CG 3.43Å; N73-Q76 PolarHBondContact O-N 3.33Å; E74-Q76 VanDerWaalsContact C-N 3.29Å; E74-Q76 PolarHBondContact O-N 3.04Å |
| 77 | F | 53.5 | Low | 81.9 | Confident | 240 Ų | 240 | 137.9 Ų | 137.9 | 100% | 1.053 | 61% | 0.613 | S | S | * | * | trans | -99.2 | 0 | 168 | -74.2 | -81.7 | 0 | 0 | 0 | 110.3 | N73 | N73-F77 WeakPolarHBondContact O-CD2 3.39Š|
Retrieved 77 of 77 residues in 48.8 ms
(Link to these results)