| 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 | 50.8 | Low | 69.6 | Low | 239 Ų | 239 | 138.3 Ų | 138.3 | 100% | 1.177 | 69% | 0.693 | S | S | * | * | 0 | 66.6 | 0 | -65.4 | 178.2 | 175.3 | 0 | 0 | 111.6 | R3 | M1-R3 PolarHBondContact O-N 2.99Š| |||
| 2 | T | 66.1 | Low | 70.4 | Confident | 133 Ų | 133 | 139.5 Ų | 139.5 | 82% | 0.816 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 13.6 | -175.3 | -160.5 | 0 | 0 | 0 | 0 | 115.3 | ||
| 3 | R | 66.9 | Low | 71.1 | Confident | 225 Ų | 225 | 139.2 Ų | 139.2 | 85% | 0.849 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.7 | -4.7 | -171.5 | -142 | 172.2 | 177.7 | 121.2 | -3 | 114.2 | M1 | M1-R3 PolarHBondContact O-N 2.99Š|
| 4 | G | 63.6 | Low | 71.4 | Confident | 45 Ų | 45 | 135.9 Ų | 135.9 | 46% | 0.464 | 67% | 0.667 | S | S | . | * | S | Bend | trans | -85.3 | -35.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115 | Q6 K7 | G4-Q6 VanDerWaalsContact C-N 3.31Å; G4-Q6 PolarHBondContact O-N 3.01Å; G4-K7 PolarHBondContact O-N 3.11Å |
| 5 | Q | 71.1 | Confident | 71.8 | Confident | 155 Ų | 155 | 133.5 Ų | 133.5 | 72% | 0.724 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -69.8 | -28.2 | -171.8 | -61.7 | -167.5 | 89.9 | 0 | 0 | 113.2 | K7 L8 Q9 | Q5-K7 PolarHBondContact O-N 3.2Å; Q5-L8 PolarHBondContact O-N 2.8Å; Q5-Q9 PolarHBondContact O-N 3.39Å |
| 6 | Q | 70 | Confident | 72 | Confident | 149 Ų | 149 | 133.6 Ų | 133.6 | 70% | 0.696 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -66.7 | -36.8 | -177.8 | -134.5 | 175.1 | -4.7 | 0 | 0 | 112.3 | G4 A10 | G4-Q6 VanDerWaalsContact C-N 3.31Å; G4-Q6 PolarHBondContact O-N 3.01Å; Q6-A10 PolarHBondContact O-N 3.43Å |
| 7 | K | 71.7 | Confident | 72.1 | Confident | 159 Ų | 159 | 134.6 Ų | 134.6 | 69% | 0.691 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -69.9 | -41.2 | 177.3 | -82.2 | -170 | -176.8 | -175.6 | 0 | 112.4 | G4 Q5 Q9 A10 Q11 | G4-K7 PolarHBondContact O-N 3.11Å; Q5-K7 PolarHBondContact O-N 3.2Å; K7-Q9 VanDerWaalsContact C-N 3.34Å; K7-Q9 PolarHBondContact O-N 3.45Å; K7-A10 PolarHBondContact O-N 3.43Å; K7-Q11 PolarHBondContact O-N 2.8Å |
| 8 | L | 75 | Confident | 72 | Confident | 123 Ų | 123 | 132.1 Ų | 132.1 | 64% | 0.644 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -62.3 | -43.7 | 178.8 | -74.1 | 169.8 | 0 | 0 | 0 | 111.1 | Q5 A10 Q11 Q12 | Q5-L8 PolarHBondContact O-N 2.8Å; L8-A10 VanDerWaalsContact C-N 3.34Å; L8-A10 PolarHBondContact O-N 2.76Å; L8-Q11 PolarHBondContact O-N 3.28Å; L8-Q12 WeakPolarHBondContact O-CB 3.4Å; L8-Q12 PolarHBondContact O-N 3.3Å |
| 9 | Q | 76.1 | Confident | 71.8 | Confident | 103 Ų | 103 | 130.4 Ų | 130.4 | 48% | 0.481 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -64.9 | -37.1 | 177.9 | -161.8 | -177.1 | 77.5 | 0 | 0 | 112.4 | Q5 K7 R13 | Q5-Q9 PolarHBondContact O-N 3.39Å; K7-Q9 VanDerWaalsContact C-N 3.34Å; K7-Q9 PolarHBondContact O-N 3.45Å; Q9-R13 WeakPolarHBondContact O-CG 3.33Å; Q9-R13 PolarHBondContact O-N 3.12Å; Q9-R13 VanDerWaalsContact O-N 3.12Å |
| 10 | A | 76.5 | Confident | 71.4 | Confident | 52 Ų | 52 | 128.7 Ų | 128.7 | 43% | 0.43 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -66.3 | -45.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q6 K7 L8 Q12 R13 N14 | Q6-A10 PolarHBondContact O-N 3.43Å; K7-A10 PolarHBondContact O-N 3.43Å; L8-A10 VanDerWaalsContact C-N 3.34Å; L8-A10 PolarHBondContact O-N 2.76Å; A10-Q12 PolarHBondContact O-N 3.26Å; A10-R13 PolarHBondContact O-N 3.41Å; A10-N14 PolarHBondContact O-N 2.88Å |
| 11 | Q | 78.2 | Confident | 71 | Confident | 138 Ų | 138 | 125.3 Ų | 125.3 | 65% | 0.645 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.7 | -42.7 | 176.7 | -74.4 | -172 | 43.7 | 0 | 0 | 111.6 | K7 L8 R13 N14 L15 | K7-Q11 PolarHBondContact O-N 2.8Å; L8-Q11 PolarHBondContact O-N 3.28Å; Q11-R13 VanDerWaalsContact C-N 3.34Å; Q11-R13 PolarHBondContact O-N 3.34Å; Q11-N14 PolarHBondContact O-N 2.8Å; Q11-L15 WeakPolarHBondContact O-CB 3.19Å; Q11-L15 PolarHBondContact O-N 3.31Å |
| 12 | Q | 78.8 | Confident | 71.4 | Confident | 153 Ų | 153 | 120.5 Ų | 120.5 | 72% | 0.715 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63 | -40.8 | -179.9 | -153.5 | 178.1 | 77.2 | 0 | 0 | 111.7 | L8 A10 K16 | L8-Q12 WeakPolarHBondContact O-CB 3.4Å; L8-Q12 PolarHBondContact O-N 3.3Å; A10-Q12 PolarHBondContact O-N 3.26Å; Q12-K16 WeakPolarHBondContact O-CB 3.49Å; Q12-K16 PolarHBondContact O-N 2.92Å |
| 13 | R | 79.2 | Confident | 70.8 | Confident | 136 Ų | 136 | 121.2 Ų | 121.2 | 51% | 0.513 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.9 | -43.3 | 174.1 | -75.9 | -168.8 | -78.1 | -117.4 | -3 | 112.9 | Q9 A10 Q11 K16 K17 | Q9-R13 WeakPolarHBondContact O-CG 3.33Å; Q9-R13 PolarHBondContact O-N 3.12Å; Q9-R13 VanDerWaalsContact O-N 3.12Å; A10-R13 PolarHBondContact O-N 3.41Å; Q11-R13 VanDerWaalsContact C-N 3.34Å; Q11-R13 PolarHBondContact O-N 3.34Å; R13-K16 PolarHBondContact O-N 3.39Å; R13-K17 WeakPolarHBondContact O-CG 3.14Å; R13-K17 PolarHBondContact O-N 3.07Å |
| 14 | N | 76.1 | Confident | 70.2 | Confident | 93 Ų | 93 | 117.5 Ų | 117.5 | 50% | 0.497 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -68.7 | -38.4 | -179.8 | -162.6 | 62.1 | 0 | 0 | 0 | 112 | A10 Q11 K17 Q18 | A10-N14 PolarHBondContact O-N 2.88Å; Q11-N14 PolarHBondContact O-N 2.8Å; N14-K17 PolarHBondContact O-N 2.9Å; N14-Q18 PolarHBondContact ND2-NE2 2.95Å; N14-Q18 VanDerWaalsContact ND2-NE2 3.18Å; N14-Q18 WeakPolarHBondContact O-CB 3.21Å; N14-Q18 WeakPolarHBondContact O-CG 3.28Å; N14-Q18 PolarHBondContact O-N 3.11Å |
| 15 | L | 77.2 | Confident | 69.6 | Low | 99 Ų | 99 | 118.7 Ų | 118.7 | 52% | 0.518 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66 | -40.3 | 176.5 | -158.3 | 73.4 | 0 | 0 | 0 | 111 | Q11 Q18 Q19 | Q11-L15 WeakPolarHBondContact O-CB 3.19Å; Q11-L15 PolarHBondContact O-N 3.31Å; L15-Q18 PolarHBondContact O-N 2.84Å; L15-Q19 WeakPolarHBondContact O-CB 3.01Å; L15-Q19 WeakPolarHBondContact O-CG 3.09Å; L15-Q19 PolarHBondContact O-N 3.4Å |
| 16 | K | 75.3 | Confident | 68.6 | Low | 136 Ų | 136 | 118.3 Ų | 118.3 | 59% | 0.591 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.4 | -45.3 | 176.4 | -167.7 | 171.3 | 176 | -165.4 | 0 | 112.2 | Q12 R13 Q18 Q19 E20 | Q12-K16 WeakPolarHBondContact O-CB 3.49Å; Q12-K16 PolarHBondContact O-N 2.92Å; R13-K16 PolarHBondContact O-N 3.39Å; K16-Q18 PolarHBondContact O-N 3.46Å; K16-Q19 PolarHBondContact O-N 2.84Å; K16-E20 WeakPolarHBondContact CG-OE2 3.38Å; K16-E20 PolarHBondContact O-N 3.48Å |
| 17 | K | 73.5 | Confident | 67.7 | Low | 151 Ų | 151 | 118.3 Ų | 118.3 | 66% | 0.657 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -59.4 | -43 | 173.4 | -74.8 | -174.9 | 178.4 | -167.1 | 0 | 112.6 | R13 N14 Q19 E20 A21 | R13-K17 WeakPolarHBondContact O-CG 3.14Å; R13-K17 PolarHBondContact O-N 3.07Å; N14-K17 PolarHBondContact O-N 2.9Å; K17-Q19 VanDerWaalsContact C-N 3.35Å; K17-E20 PolarHBondContact O-N 3.42Å; K17-A21 VanDerWaalsContact O-CB 3.27Å; K17-A21 WeakPolarHBondContact O-CB 3.19Å; K17-A21 PolarHBondContact O-N 2.84Å |
| 18 | Q | 69.7 | Low | 66.7 | Low | 89 Ų | 89 | 115.5 Ų | 115.5 | 42% | 0.416 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.8 | -35.6 | 176.9 | -76 | -177.5 | 100.3 | 0 | 0 | 112.4 | N14 L15 K16 K22 | N14-Q18 PolarHBondContact ND2-NE2 2.95Å; N14-Q18 VanDerWaalsContact ND2-NE2 3.18Å; N14-Q18 WeakPolarHBondContact O-CB 3.21Å; N14-Q18 WeakPolarHBondContact O-CG 3.28Å; N14-Q18 PolarHBondContact O-N 3.11Å; L15-Q18 PolarHBondContact O-N 2.84Å; K16-Q18 PolarHBondContact O-N 3.46Å; Q18-K22 VanDerWaalsContact O-CB 3.28Å; Q18-K22 WeakPolarHBondContact O-CB 3.32Å; Q18-K22 VanDerWaalsContact O-CG 3.22Å; Q18-K22 WeakPolarHBondContact O-CG 3.42Å; Q18-K22 PolarHBondContact O-N 3.42Å |
| 19 | Q | 69.1 | Low | 65.5 | Low | 99 Ų | 99 | 116.1 Ų | 116.1 | 46% | 0.463 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.2 | -42.6 | 174.3 | -74.8 | 178.9 | 45.7 | 0 | 0 | 111.6 | L15 K16 K17 K22 K23 | L15-Q19 WeakPolarHBondContact O-CB 3.01Å; L15-Q19 WeakPolarHBondContact O-CG 3.09Å; L15-Q19 PolarHBondContact O-N 3.4Å; K16-Q19 PolarHBondContact O-N 2.84Å; K17-Q19 VanDerWaalsContact C-N 3.35Å; Q19-K22 PolarHBondContact O-N 3.17Å; Q19-K23 WeakPolarHBondContact O-CB 3.46Å; Q19-K23 VanDerWaalsContact O-CG 3.24Å; Q19-K23 WeakPolarHBondContact O-CG 3.45Å; Q19-K23 PolarHBondContact O-N 3.49Å |
| 20 | E | 64.2 | Low | 64.3 | Low | 96 Ų | 96 | 119.3 Ų | 119.3 | 45% | 0.449 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.8 | -44.2 | 175.3 | -73.8 | 177.8 | 88.6 | 0 | 0 | 111.5 | K16 K17 K22 K23 Q24 | K16-E20 WeakPolarHBondContact CG-OE2 3.38Å; K16-E20 PolarHBondContact O-N 3.48Å; K17-E20 PolarHBondContact O-N 3.42Å; E20-K22 PolarHBondContact O-N 2.89Å; E20-K23 PolarHBondContact O-N 3Å; E20-Q24 PolarHBondContact O-N 3.39Å |
| 21 | A | 62.3 | Low | 63 | Low | 58 Ų | 58 | 119.5 Ų | 119.5 | 48% | 0.479 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.3 | -40.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K17 S25 | K17-A21 VanDerWaalsContact O-CB 3.27Å; K17-A21 WeakPolarHBondContact O-CB 3.19Å; K17-A21 PolarHBondContact O-N 2.84Å; A21-S25 WeakPolarHBondContact O-CB 3.38Å; A21-S25 PolarHBondContact O-N 2.81Å |
| 22 | K | 58 | Low | 61.8 | Low | 138 Ų | 138 | 115.2 Ų | 115.2 | 60% | 0.6 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.6 | -37.2 | 173.6 | -76.4 | 176.7 | -165.7 | -66.9 | 0 | 111.7 | Q18 Q19 E20 M26 | Q18-K22 VanDerWaalsContact O-CB 3.28Å; Q18-K22 WeakPolarHBondContact O-CB 3.32Å; Q18-K22 VanDerWaalsContact O-CG 3.22Å; Q18-K22 WeakPolarHBondContact O-CG 3.42Å; Q18-K22 PolarHBondContact O-N 3.42Å; Q19-K22 PolarHBondContact O-N 3.17Å; E20-K22 PolarHBondContact O-N 2.89Å; K22-M26 WeakPolarHBondContact O-CB 3.46Å; K22-M26 WeakPolarHBondContact O-CG 3.47Å; K22-M26 PolarHBondContact O-N 3.29Å |
| 23 | K | 54.1 | Low | 60.5 | Low | 149 Ų | 149 | 111.1 Ų | 111.1 | 65% | 0.648 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.8 | -44.2 | 176.4 | -76.3 | -178.3 | -178.1 | -157.9 | 0 | 111.4 | Q19 E20 H27 | Q19-K23 WeakPolarHBondContact O-CB 3.46Å; Q19-K23 VanDerWaalsContact O-CG 3.24Å; Q19-K23 WeakPolarHBondContact O-CG 3.45Å; Q19-K23 PolarHBondContact O-N 3.49Å; E20-K23 PolarHBondContact O-N 3Å; K23-H27 WeakPolarHBondContact O-CB 3.4Å; K23-H27 PolarHBondContact O-N 2.83Å |
| 24 | Q | 54.1 | Low | 59.1 | Low | 147 Ų | 147 | 112.3 Ų | 112.3 | 69% | 0.687 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.9 | -40.1 | 175.7 | -78.8 | 173.6 | -100.6 | 0 | 0 | 112.2 | E20 | E20-Q24 PolarHBondContact O-N 3.39Å |
| 25 | S | 51.7 | Low | 58 | Low | 69 Ų | 69 | 117.2 Ų | 117.2 | 48% | 0.483 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -73.8 | -31.8 | 177.1 | 178.9 | 0 | 0 | 0 | 0 | 113.1 | A21 H29 | A21-S25 WeakPolarHBondContact O-CB 3.38Å; A21-S25 PolarHBondContact O-N 2.81Å; S25-H29 PolarHBondContact O-CD2 3.46Å |
| 26 | M | 50.4 | Low | 57.1 | Low | 147 Ų | 147 | 117.1 Ų | 117.1 | 72% | 0.724 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -77.3 | -26.6 | 175.4 | -77.8 | -76.2 | 168.1 | 0 | 0 | 113 | K22 D28 | K22-M26 WeakPolarHBondContact O-CB 3.46Å; K22-M26 WeakPolarHBondContact O-CG 3.47Å; K22-M26 PolarHBondContact O-N 3.29Å; M26-D28 VanDerWaalsContact C-N 3.32Å; M26-D28 PolarHBondContact O-N 3.32Å |
| 27 | H | 49.7 | Very low | 56.4 | Low | 150 Ų | 150 | 115.8 Ų | 115.8 | 69% | 0.694 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -76 | -17.8 | -179.9 | -141.8 | 92.5 | 0 | 0 | 0 | 113.5 | K23 | K23-H27 WeakPolarHBondContact O-CB 3.4Å; K23-H27 PolarHBondContact O-N 2.83Å |
| 28 | D | 51.9 | Low | 56.5 | Low | 99 Ų | 99 | 113.1 Ų | 113.1 | 53% | 0.529 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -88.3 | -21.1 | -177.9 | -157 | -123.4 | 0 | 0 | 0 | 113.8 | M26 | M26-D28 VanDerWaalsContact C-N 3.32Å; M26-D28 PolarHBondContact O-N 3.32Å |
| 29 | H | 50.2 | Low | 56.9 | Low | 136 Ų | 136 | 111.7 Ų | 111.7 | 63% | 0.63 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -95.5 | -17.8 | -173.5 | -61.8 | -51.2 | 0 | 0 | 0 | 115.5 | S25 | S25-H29 PolarHBondContact O-CD2 3.46Å |
| 30 | K | 50.7 | Low | 57.5 | Low | 171 Ų | 171 | 111.7 Ų | 111.7 | 74% | 0.743 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -110.2 | -23.9 | -175.7 | -146 | -177.3 | -170.2 | -165.9 | 0 | 114.5 | ||
| 31 | A | 49.3 | Very low | 58.5 | Low | 56 Ų | 56 | 107.1 Ų | 107.1 | 46% | 0.463 | 57% | 0.565 | S | S | . | * | S | Bend | trans | -76.9 | -32.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A33 Q34 | A31-A33 PolarHBondContact O-N 3.26Å; A31-Q34 PolarHBondContact O-N 3.4Å |
| 32 | A | 51.3 | Low | 59.5 | Low | 48 Ų | 48 | 107.5 Ų | 107.5 | 40% | 0.397 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.2 | -18.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q34 | A32-Q34 PolarHBondContact O-N 2.95Š|
| 33 | A | 52.2 | Low | 60.9 | Low | 67 Ų | 67 | 104.3 Ų | 104.3 | 55% | 0.554 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -10.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | A31 | A31-A33 PolarHBondContact O-N 3.26Š|
| 34 | Q | 51.1 | Low | 62.5 | Low | 160 Ų | 160 | 100.3 Ų | 100.3 | 75% | 0.748 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -110.7 | 68 | -174.1 | -65.7 | -176.7 | 97.4 | 0 | 0 | 111.3 | A31 A32 | A31-Q34 PolarHBondContact O-N 3.4Å; A32-Q34 PolarHBondContact O-N 2.95Å |
| 35 | K | 51.1 | Low | 63.9 | Low | 196 Ų | 196 | 102.4 Ų | 102.4 | 85% | 0.852 | 55% | 0.545 | S | S | * | . | S | Bend | trans | 153.8 | 104.9 | 137.3 | -81.7 | 168.1 | -177.6 | -157 | 0 | 111.7 | ||
| 36 | A | 58.7 | Low | 65.4 | Low | 97 Ų | 97 | 100.3 Ų | 100.3 | 80% | 0.802 | 53% | 0.534 | S | S | * | . | S | Bend | trans | 93.6 | 10.1 | 132.5 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||
| 37 | L | 60.5 | Low | 66.9 | Low | 109 Ų | 109 | 100.1 Ų | 100.1 | 57% | 0.571 | 53% | 0.532 | S | S | * | . | trans | -146.3 | 98.8 | 163.3 | -69.9 | 168.1 | 0 | 0 | 0 | 110.1 | Y39 | L37-Y39 HydrophobicContact CB-CE1 4.48Å; L37-Y39 HydrophobicContact CB-CE2 4.01Å; L37-Y39 WeakPolarHBondContact CD1-OH 3.42Å; L37-Y39 PolarHBondContact O-N 2.78Å | ||
| 38 | V | 75.4 | Confident | 68.4 | Low | 94 Ų | 94 | 93.6 Ų | 93.6 | 57% | 0.57 | 50% | 0.502 | S | S | * | . | trans | -82.4 | 111.4 | 168.6 | 176.5 | 0 | 0 | 0 | 0 | 107.2 | Q40 Q47 | V38-Q40 PolarHBondContact O-N 3.23Å; V38-Q47 HydrophobicContact CG1-CB 3.42Å; V38-Q47 VanDerWaalsContact CG1-CB 3.42Å; V38-Q47 HydrophobicContact CG1-CG 3.56Å | ||
| 39 | Y | 78.5 | Confident | 69.8 | Low | 60 Ų | 60 | 91.8 Ų | 91.8 | 24% | 0.235 | 50% | 0.495 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 119 | 175.9 | -61.6 | -80.1 | 0 | 0 | 0 | 109.5 | L37 M48 L51 | L37-Y39 HydrophobicContact CB-CE1 4.48Å; L37-Y39 HydrophobicContact CB-CE2 4.01Å; L37-Y39 WeakPolarHBondContact CD1-OH 3.42Å; L37-Y39 PolarHBondContact O-N 2.78Å; Y39-M48 PolarHBondContact N-O 3.47Å; Y39-M48 PolarHBondContact O-N 2.88Å; Y39-L51 HydrophobicContact CD1-CD2 3.48Å; Y39-L51 VanDerWaalsContact CD1-CD2 3.48Å; Y39-L51 HydrophobicContact CD1-CG 4.35Å; Y39-L51 HydrophobicContact CD2-CD2 4.15Å; Y39-L51 HydrophobicContact CD2-CG 4.32Å; Y39-L51 HydrophobicContact CE1-CD1 4.46Å; Y39-L51 HydrophobicContact CE1-CD2 3.17Å; Y39-L51 HydrophobicContact CE1-CG 3.75Å; Y39-L51 HydrophobicContact CE2-CB 4.49Å; Y39-L51 HydrophobicContact CE2-CD2 3.88Å; Y39-L51 HydrophobicContact CE2-CG 3.69Å; Y39-L51 HydrophobicContact CG-CD2 3.96Å; Y39-L51 WeakPolarHBondContact OH-CG 3.38Å |
| 40 | Q | 82.8 | Confident | 71 | Confident | 99 Ų | 99 | 88.1 Ų | 88.1 | 46% | 0.463 | 48% | 0.48 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 124.9 | 178.3 | 178.5 | 164.2 | 61.7 | 0 | 0 | 110.9 | V38 V42 R45 G46 Y54 | V38-Q40 PolarHBondContact O-N 3.23Å; Q40-V42 PolarHBondContact O-N 3.32Å; Q40-R45 HydrophobicContact CG-CB 4.34Å; Q40-R45 PolarHBondContact NE2-O 3.1Å; Q40-G46 CarbonylContact C-O 3.46Å; Q40-G46 WeakPolarHBondContact CA-O 3.22Å; Q40-Y54 WeakPolarHBondContact O-CE2 3.12Å |
| 41 | C | 85.4 | Confident | 72.4 | Confident | 0 Ų | 0 | 83.5 Ų | 83.5 | 0% | 0 | 46% | 0.464 | C | S | . | . | P | Polyproline II helix | trans | -63.5 | 122.9 | 173.4 | -174 | 0 | 0 | 0 | 0 | 110.8 | V43 C44 R45 G46 M48 Y54 H57 | C41-V43 PolarHBondContact O-N 3.02Å; C41-V43 PolarHBondContact SG-N 3.5Å; C41-V43 VanDerWaalsContact SG-N 3.45Å; C41-C44 VanDerWaalsContact CB-SG 3.58Å; C41-R45 WeakPolarHBondContact O-CA 3.35Å; C41-R45 PolarHBondContact O-N 3.43Å; C41-G46 PolarHBondContact N-O 3.25Å; C41-M48 HydrophobicContact CB-CE 4.03Å; C41-Y54 VanDerWaalsContact CA-CE2 3.48Å; C41-Y54 HydrophobicContact CB-CE2 4.2Å; C41-H57 PolarHBondContact SG-NE2 3.49Å |
| 42 | V | 83.3 | Confident | 73.8 | Confident | 65 Ų | 65 | 87 Ų | 87 | 39% | 0.394 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -21.8 | 176.5 | -55.3 | 0 | 0 | 0 | 0 | 113.1 | Q40 P68 E70 | Q40-V42 PolarHBondContact O-N 3.32Å; V42-P68 HydrophobicContact CB-CB 4.48Å; V42-P68 HydrophobicContact CG1-CB 3.92Å; V42-P68 HydrophobicContact CG1-CG 4.05Å; V42-P68 HydrophobicContact CG2-CB 3.76Å; V42-P68 HydrophobicContact CG2-CG 3.73Å; V42-E70 HydrophobicContact CG1-CB 4.48Å; V42-E70 WeakPolarHBondContact CG1-OE1 3.46Å |
| 43 | V | 85.6 | Confident | 75.3 | Confident | 72 Ų | 72 | 87.7 Ų | 87.7 | 44% | 0.436 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | -46.7 | -174.9 | -172 | 0 | 0 | 0 | 0 | 111.6 | C41 F58 H62 A65 | C41-V43 PolarHBondContact O-N 3.02Å; C41-V43 PolarHBondContact SG-N 3.5Å; C41-V43 VanDerWaalsContact SG-N 3.45Å; V43-F58 HydrophobicContact CG2-CE2 3.77Å; V43-F58 HydrophobicContact CG2-CZ 4.37Å; V43-H62 WeakPolarHBondContact CG1-CE1 3.34Å; V43-H62 WeakPolarHBondContact CG1-ND1 3.36Å; V43-A65 HydrophobicContact CG2-CB 4.08Å |
| 44 | C | 88.8 | Confident | 76.7 | Confident | 65 Ų | 65 | 84.6 Ų | 84.6 | 44% | 0.439 | 44% | 0.442 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.7 | -1.1 | -177 | 70.3 | 0 | 0 | 0 | 0 | 114.6 | C41 G46 H57 | C41-C44 VanDerWaalsContact CB-SG 3.58Å; C44-G46 PolarHBondContact O-N 2.81Å; C44-G46 VanDerWaalsContact O-N 3.11Å; C44-H57 PolarHBondContact SG-CE1 2.84Å; C44-H57 PolarHBondContact SG-NE2 3.18Å |
| 45 | R | 83.8 | Confident | 78.2 | Confident | 190 Ų | 190 | 82 Ų | 82 | 72% | 0.717 | 43% | 0.43 | S | S | * | . | trans | 58.2 | 15 | -174.4 | -60.4 | -168.2 | -175.5 | -168 | 1.1 | 115.5 | Q40 C41 | Q40-R45 HydrophobicContact CG-CB 4.34Å; Q40-R45 PolarHBondContact NE2-O 3.1Å; C41-R45 WeakPolarHBondContact O-CA 3.35Å; C41-R45 PolarHBondContact O-N 3.43Å | ||
| 46 | G | 83.5 | Confident | 79.8 | Confident | 25 Ų | 25 | 79.1 Ų | 79.1 | 26% | 0.258 | 42% | 0.419 | S | S | . | . | trans | -59.7 | 140.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q40 C41 C44 M48 | Q40-G46 CarbonylContact C-O 3.46Å; Q40-G46 WeakPolarHBondContact CA-O 3.22Å; C41-G46 PolarHBondContact N-O 3.25Å; C44-G46 PolarHBondContact O-N 2.81Å; C44-G46 VanDerWaalsContact O-N 3.11Å; G46-M48 VanDerWaalsContact O-SD 3.42Å | ||
| 47 | Q | 81.8 | Confident | 81.2 | Confident | 143 Ų | 143 | 76.3 Ų | 76.3 | 67% | 0.668 | 39% | 0.389 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 120.5 | -178.6 | -76.2 | -176.3 | -20.8 | 0 | 0 | 109.7 | V38 | V38-Q47 HydrophobicContact CG1-CB 3.42Å; V38-Q47 VanDerWaalsContact CG1-CB 3.42Å; V38-Q47 HydrophobicContact CG1-CG 3.56Å |
| 48 | M | 81.6 | Confident | 82.4 | Confident | 13 Ų | 13 | 71.7 Ų | 71.7 | 6% | 0.064 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 136.3 | 179.3 | -70.1 | 80.3 | 83.5 | 0 | 0 | 110.2 | Y39 C41 G46 D50 T53 Y54 H57 | Y39-M48 PolarHBondContact N-O 3.47Å; Y39-M48 PolarHBondContact O-N 2.88Å; C41-M48 HydrophobicContact CB-CE 4.03Å; G46-M48 VanDerWaalsContact O-SD 3.42Å; M48-D50 PolarHBondContact O-N 2.85Å; M48-T53 HydrophobicContact CB-CG2 4.24Å; M48-T53 HydrophobicContact CG-CG2 3.94Å; M48-Y54 HydrophobicContact CE-CD1 4.36Å; M48-Y54 HydrophobicContact CE-CD2 3.09Å; M48-Y54 HydrophobicContact CE-CE2 3.68Å; M48-Y54 HydrophobicContact CE-CG 3.52Å; M48-H57 HydrophobicContact CE-CB 3.87Å; M48-H57 VanDerWaalsContact CE-CD2 3.42Å; M48-H57 WeakPolarHBondContact CE-CD2 3.39Å |
| 49 | P | 80.1 | Confident | 82.9 | Confident | 61 Ų | 61 | 73.6 Ų | 73.6 | 40% | 0.396 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -76.1 | -9 | -176.9 | 31.2 | -36.2 | 0 | 0 | 0 | 113.8 | ||
| 50 | D | 75.3 | Confident | 83.3 | Confident | 59 Ų | 59 | 76.8 Ų | 76.8 | 32% | 0.316 | 39% | 0.388 | S | S | . | . | S | Bend | trans | -154 | 148.6 | -171.6 | 176.1 | -101.1 | 0 | 0 | 0 | 112.1 | M48 K52 T53 Y54 | M48-D50 PolarHBondContact O-N 2.85Å; D50-K52 VanDerWaalsContact C-N 3.33Å; D50-K52 PolarHBondContact O-N 2.82Å; D50-K52 WeakPolarHBondContact OD1-CA 3.38Å; D50-K52 WeakPolarHBondContact OD1-CB 3.49Å; D50-K52 PolarHBondContact OD1-N 3.18Å; D50-T53 PolarHBondContact O-N 2.92Å; D50-Y54 PolarHBondContact O-N 3.19Å |
| 51 | L | 79.5 | Confident | 83.6 | Confident | 75 Ų | 75 | 78.4 Ų | 78.4 | 39% | 0.393 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.5 | -36.8 | -179.9 | -74.4 | 176.8 | 0 | 0 | 0 | 113.3 | Y39 Y54 Q55 L71 | Y39-L51 HydrophobicContact CD1-CD2 3.48Å; Y39-L51 VanDerWaalsContact CD1-CD2 3.48Å; Y39-L51 HydrophobicContact CD1-CG 4.35Å; Y39-L51 HydrophobicContact CD2-CD2 4.15Å; Y39-L51 HydrophobicContact CD2-CG 4.32Å; Y39-L51 HydrophobicContact CE1-CD1 4.46Å; Y39-L51 HydrophobicContact CE1-CD2 3.17Å; Y39-L51 HydrophobicContact CE1-CG 3.75Å; Y39-L51 HydrophobicContact CE2-CB 4.49Å; Y39-L51 HydrophobicContact CE2-CD2 3.88Å; Y39-L51 HydrophobicContact CE2-CG 3.69Å; Y39-L51 HydrophobicContact CG-CD2 3.96Å; Y39-L51 WeakPolarHBondContact OH-CG 3.38Å; L51-Y54 WeakPolarHBondContact O-CB 3.45Å; L51-Y54 PolarHBondContact O-N 3.39Å; L51-Q55 WeakPolarHBondContact O-CB 3.41Å; L51-Q55 PolarHBondContact O-N 2.94Å; L51-L71 HydrophobicContact CD2-CD2 3.87Å |
| 52 | K | 80 | Confident | 83.7 | Confident | 128 Ų | 128 | 80 Ų | 80 | 56% | 0.557 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -66.7 | -42 | 178.6 | -173.6 | -173.9 | 174.5 | -173.4 | 0 | 110.9 | D50 Y54 Q55 Q56 | D50-K52 VanDerWaalsContact C-N 3.33Å; D50-K52 PolarHBondContact O-N 2.82Å; D50-K52 WeakPolarHBondContact OD1-CA 3.38Å; D50-K52 WeakPolarHBondContact OD1-CB 3.49Å; D50-K52 PolarHBondContact OD1-N 3.18Å; K52-Y54 VanDerWaalsContact C-N 3.32Å; K52-Q55 PolarHBondContact O-N 3.43Å; K52-Q56 PolarHBondContact O-N 3.41Å |
| 53 | T | 81.5 | Confident | 83.6 | Confident | 63 Ų | 63 | 81.6 Ų | 81.6 | 39% | 0.387 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 174.8 | -56.9 | 0 | 0 | 0 | 0 | 110.3 | M48 D50 H57 | M48-T53 HydrophobicContact CB-CG2 4.24Å; M48-T53 HydrophobicContact CG-CG2 3.94Å; D50-T53 PolarHBondContact O-N 2.92Å; T53-H57 VanDerWaalsContact O-CB 3.22Å; T53-H57 WeakPolarHBondContact O-CB 3.44Å; T53-H57 PolarHBondContact O-N 3.43Å |
| 54 | Y | 82.1 | Confident | 83.2 | Confident | 3 Ų | 3 | 87.6 Ų | 87.6 | 1% | 0.012 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -59.7 | -49.6 | 173.8 | -174.2 | -66.7 | 0 | 0 | 0 | 111.7 | Q40 C41 M48 D50 L51 K52 Q56 H57 F58 P68 L71 | Q40-Y54 WeakPolarHBondContact O-CE2 3.12Å; C41-Y54 VanDerWaalsContact CA-CE2 3.48Å; C41-Y54 HydrophobicContact CB-CE2 4.2Å; M48-Y54 HydrophobicContact CE-CD1 4.36Å; M48-Y54 HydrophobicContact CE-CD2 3.09Å; M48-Y54 HydrophobicContact CE-CE2 3.68Å; M48-Y54 HydrophobicContact CE-CG 3.52Å; D50-Y54 PolarHBondContact O-N 3.19Å; L51-Y54 WeakPolarHBondContact O-CB 3.45Å; L51-Y54 PolarHBondContact O-N 3.39Å; K52-Y54 VanDerWaalsContact C-N 3.32Å; Y54-Q56 PolarHBondContact O-N 2.89Å; Y54-H57 WeakPolarHBondContact O-CB 3.01Å; Y54-H57 PolarHBondContact O-N 3.04Å; Y54-H57 VanDerWaalsContact O-N 3.17Å; Y54-F58 HydrophobicContact CD1-CB 4.38Å; Y54-F58 HydrophobicContact CE1-CB 4.02Å; Y54-F58 AromaticContact CE1-CD2 3.86Å; Y54-F58 HydrophobicContact CE1-CD2 3.86Å; Y54-F58 HydrophobicContact CE1-CG 4.21Å; Y54-F58 WeakPolarHBondContact O-CB 3.47Å; Y54-F58 PolarHBondContact O-N 3.04Å; Y54-P68 WeakPolarHBondContact OH-CG 3.45Å; Y54-L71 HydrophobicContact CD1-CD1 3.4Å; Y54-L71 HydrophobicContact CD1-CD2 3.18Å; Y54-L71 HydrophobicContact CD1-CG 3.77Å; Y54-L71 HydrophobicContact CD2-CD2 3.89Å; Y54-L71 HydrophobicContact CE1-CD1 2.88Å; Y54-L71 HydrophobicContact CE1-CD2 3.47Å; Y54-L71 VanDerWaalsContact CE1-CD2 3.47Å; Y54-L71 HydrophobicContact CE1-CG 3.49Å; Y54-L71 VanDerWaalsContact CE1-CG 3.49Å; Y54-L71 HydrophobicContact CE2-CD1 4.5Å; Y54-L71 HydrophobicContact CE2-CD2 3.98Å; Y54-L71 HydrophobicContact CE2-CG 4.32Å; Y54-L71 HydrophobicContact CG-CD1 4.48Å; Y54-L71 HydrophobicContact CG-CD2 3.5Å; Y54-L71 HydrophobicContact CG-CG 4.44Å; Y54-L71 VanDerWaalsContact CZ-CD1 3.5Å |
| 55 | Q | 83.6 | Confident | 82.5 | Confident | 106 Ų | 106 | 86.1 Ų | 86.1 | 50% | 0.495 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.2 | -48.7 | -178.7 | -176.8 | 176.9 | 75.2 | 0 | 0 | 111 | L51 K52 H57 F58 E59 | L51-Q55 WeakPolarHBondContact O-CB 3.41Å; L51-Q55 PolarHBondContact O-N 2.94Å; K52-Q55 PolarHBondContact O-N 3.43Å; Q55-H57 VanDerWaalsContact C-N 3.32Å; Q55-H57 PolarHBondContact O-N 2.85Å; Q55-F58 PolarHBondContact O-N 3.26Å; Q55-F58 VanDerWaalsContact O-N 3.11Å; Q55-E59 PolarHBondContact O-N 3Å |
| 56 | Q | 84.8 | Confident | 81.9 | Confident | 134 Ų | 134 | 82.6 Ų | 82.6 | 63% | 0.626 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.8 | -42 | 174.1 | -80.4 | -154.2 | -30.8 | 0 | 0 | 112.6 | K52 Y54 F58 N60 | K52-Q56 PolarHBondContact O-N 3.41Å; Y54-Q56 PolarHBondContact O-N 2.89Å; Q56-F58 VanDerWaalsContact C-N 3.28Å; Q56-F58 PolarHBondContact O-N 3.42Å; Q56-N60 WeakPolarHBondContact O-CB 3.21Å; Q56-N60 PolarHBondContact O-N 3.5Å |
| 57 | H | 87.7 | Confident | 81.1 | Confident | 38 Ų | 38 | 87.6 Ų | 87.6 | 18% | 0.176 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -58.1 | -44.3 | 175.1 | 163.9 | 93.1 | 0 | 0 | 0 | 110.9 | C41 C44 M48 T53 Y54 Q55 N60 K61 H62 | C41-H57 PolarHBondContact SG-NE2 3.49Å; C44-H57 PolarHBondContact SG-CE1 2.84Å; C44-H57 PolarHBondContact SG-NE2 3.18Å; M48-H57 HydrophobicContact CE-CB 3.87Å; M48-H57 VanDerWaalsContact CE-CD2 3.42Å; M48-H57 WeakPolarHBondContact CE-CD2 3.39Å; T53-H57 VanDerWaalsContact O-CB 3.22Å; T53-H57 WeakPolarHBondContact O-CB 3.44Å; T53-H57 PolarHBondContact O-N 3.43Å; Y54-H57 WeakPolarHBondContact O-CB 3.01Å; Y54-H57 PolarHBondContact O-N 3.04Å; Y54-H57 VanDerWaalsContact O-N 3.17Å; Q55-H57 VanDerWaalsContact C-N 3.32Å; Q55-H57 PolarHBondContact O-N 2.85Å; H57-N60 PolarHBondContact O-N 2.89Å; H57-K61 WeakPolarHBondContact O-CA 3.12Å; H57-K61 WeakPolarHBondContact O-CB 3.34Å; H57-K61 WeakPolarHBondContact O-CG 3.22Å; H57-K61 PolarHBondContact O-N 3.39Å; H57-H62 AromaticContact NE2-CD2 3.59Å; H57-H62 AromaticContact NE2-NE2 3.43Å; H57-H62 PolarHBondContact NE2-NE2 3.42Å |
| 58 | F | 85.7 | Confident | 80.4 | Confident | 12 Ų | 12 | 81.7 Ų | 81.7 | 5% | 0.053 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -68.6 | -46.4 | -177.4 | -158 | -92.5 | 0 | 0 | 0 | 111.9 | V43 Y54 Q55 Q56 N60 H62 A65 P66 M67 P68 | V43-F58 HydrophobicContact CG2-CE2 3.77Å; V43-F58 HydrophobicContact CG2-CZ 4.37Å; Y54-F58 HydrophobicContact CD1-CB 4.38Å; Y54-F58 HydrophobicContact CE1-CB 4.02Å; Y54-F58 AromaticContact CE1-CD2 3.86Å; Y54-F58 HydrophobicContact CE1-CD2 3.86Å; Y54-F58 HydrophobicContact CE1-CG 4.21Å; Y54-F58 WeakPolarHBondContact O-CB 3.47Å; Y54-F58 PolarHBondContact O-N 3.04Å; Q55-F58 PolarHBondContact O-N 3.26Å; Q55-F58 VanDerWaalsContact O-N 3.11Å; Q56-F58 VanDerWaalsContact C-N 3.28Å; Q56-F58 PolarHBondContact O-N 3.42Å; F58-N60 VanDerWaalsContact C-N 3.31Å; F58-N60 PolarHBondContact O-N 3.03Å; F58-H62 HydrophobicContact CD2-CB 4.21Å; F58-H62 HydrophobicContact CE1-CB 4.47Å; F58-H62 HydrophobicContact CE2-CB 4.19Å; F58-H62 HydrophobicContact CG-CB 4.38Å; F58-H62 HydrophobicContact CZ-CB 4.32Å; F58-H62 CarbonylContact O-C 3.54Å; F58-H62 WeakPolarHBondContact O-CA 3.28Å; F58-H62 WeakPolarHBondContact O-CB 3.24Å; F58-H62 PolarHBondContact O-N 3.12Å; F58-A65 HydrophobicContact CE1-CB 4.01Å; F58-A65 WeakPolarHBondContact CE1-O 3.43Å; F58-A65 HydrophobicContact CE2-CB 4.23Å; F58-A65 HydrophobicContact CZ-CB 3.47Å; F58-A65 VanDerWaalsContact CZ-CB 3.47Å; F58-P66 VanDerWaalsContact CZ-O 3.28Å; F58-P66 WeakPolarHBondContact CZ-O 3.19Å; F58-M67 HydrophobicContact CD1-CB 4.49Å; F58-M67 VanDerWaalsContact CE1-CA 3.42Å; F58-M67 HydrophobicContact CE1-CB 4.13Å; F58-P68 HydrophobicContact CE2-CG 4.33Å |
| 59 | E | 85.7 | Confident | 79.6 | Confident | 135 Ų | 135 | 86.4 Ų | 86.4 | 63% | 0.631 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.3 | -35.3 | 176.1 | -66.5 | -162.6 | 106.9 | 0 | 0 | 112.6 | Q55 | Q55-E59 PolarHBondContact O-N 3Å |
| 60 | N | 87.3 | Confident | 78.7 | Confident | 126 Ų | 126 | 87.7 Ų | 87.7 | 67% | 0.674 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -85.3 | -39.4 | -176.1 | -157.4 | -93.3 | 0 | 0 | 0 | 113.4 | Q56 H57 F58 | Q56-N60 WeakPolarHBondContact O-CB 3.21Å; Q56-N60 PolarHBondContact O-N 3.5Å; H57-N60 PolarHBondContact O-N 2.89Å; F58-N60 VanDerWaalsContact C-N 3.31Å; F58-N60 PolarHBondContact O-N 3.03Å |
| 61 | K | 88.1 | Confident | 78 | Confident | 134 Ų | 134 | 87 Ų | 87 | 58% | 0.583 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -94.4 | -29.5 | -178.4 | -59.4 | -54.4 | -171.7 | -171.8 | 0 | 113.1 | H57 | H57-K61 WeakPolarHBondContact O-CA 3.12Å; H57-K61 WeakPolarHBondContact O-CB 3.34Å; H57-K61 WeakPolarHBondContact O-CG 3.22Å; H57-K61 PolarHBondContact O-N 3.39Å |
| 62 | H | 88.2 | Confident | 76.9 | Confident | 32 Ų | 32 | 88 Ų | 88 | 15% | 0.148 | 47% | 0.465 | C | S | . | . | trans | -129.6 | 51.9 | -173.3 | -53.4 | -55.8 | 0 | 0 | 0 | 112.6 | V43 H57 F58 K64 A65 | V43-H62 WeakPolarHBondContact CG1-CE1 3.34Å; V43-H62 WeakPolarHBondContact CG1-ND1 3.36Å; H57-H62 AromaticContact NE2-CD2 3.59Å; H57-H62 AromaticContact NE2-NE2 3.43Å; H57-H62 PolarHBondContact NE2-NE2 3.42Å; F58-H62 HydrophobicContact CD2-CB 4.21Å; F58-H62 HydrophobicContact CE1-CB 4.47Å; F58-H62 HydrophobicContact CE2-CB 4.19Å; F58-H62 HydrophobicContact CG-CB 4.38Å; F58-H62 HydrophobicContact CZ-CB 4.32Å; F58-H62 CarbonylContact O-C 3.54Å; F58-H62 WeakPolarHBondContact O-CA 3.28Å; F58-H62 WeakPolarHBondContact O-CB 3.24Å; F58-H62 PolarHBondContact O-N 3.12Å; H62-K64 PolarHBondContact O-N 3.05Å; H62-A65 HydrophobicContact CB-CB 3.78Å; H62-A65 PolarHBondContact O-N 3.29Å | ||
| 63 | P | 81.5 | Confident | 75.6 | Confident | 99 Ų | 99 | 84 Ų | 84 | 64% | 0.643 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -14.4 | -176.3 | 27.3 | -36.6 | 0 | 0 | 0 | 114.3 | ||
| 64 | K | 77.5 | Confident | 74.2 | Confident | 199 Ų | 199 | 86.5 Ų | 86.5 | 87% | 0.865 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.5 | -9.8 | 178.1 | -56.9 | -178.8 | -146.8 | -73.6 | 0 | 113.1 | H62 | H62-K64 PolarHBondContact O-N 3.05Š|
| 65 | A | 73.4 | Confident | 72.4 | Confident | 33 Ų | 33 | 90 Ų | 90 | 27% | 0.273 | 51% | 0.505 | S | S | . | . | S | Bend | trans | -79.1 | 139.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | V43 F58 H62 M67 | V43-A65 HydrophobicContact CG2-CB 4.08Å; F58-A65 HydrophobicContact CE1-CB 4.01Å; F58-A65 WeakPolarHBondContact CE1-O 3.43Å; F58-A65 HydrophobicContact CE2-CB 4.23Å; F58-A65 HydrophobicContact CZ-CB 3.47Å; F58-A65 VanDerWaalsContact CZ-CB 3.47Å; H62-A65 HydrophobicContact CB-CB 3.78Å; H62-A65 PolarHBondContact O-N 3.29Å; A65-M67 PolarHBondContact O-N 3.49Å |
| 66 | P | 70.9 | Confident | 70.5 | Confident | 117 Ų | 117 | 92.9 Ų | 92.9 | 76% | 0.76 | 52% | 0.518 | S | S | * | . | P | Polyproline II helix | trans | -66 | 128.4 | 169.9 | 27.6 | -32.1 | 0 | 0 | 0 | 108.6 | F58 P68 | F58-P66 VanDerWaalsContact CZ-O 3.28Å; F58-P66 WeakPolarHBondContact CZ-O 3.19Å; P66-P68 VanDerWaalsContact O-N 3.16Å |
| 67 | M | 67.3 | Low | 68.5 | Low | 130 Ų | 130 | 96 Ų | 96 | 64% | 0.64 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -52 | 121.2 | 175.9 | -178.4 | 163.1 | 44.6 | 0 | 0 | 109 | F58 A65 T69 L71 | F58-M67 HydrophobicContact CD1-CB 4.49Å; F58-M67 VanDerWaalsContact CE1-CA 3.42Å; F58-M67 HydrophobicContact CE1-CB 4.13Å; A65-M67 PolarHBondContact O-N 3.49Å; M67-T69 PolarHBondContact O-N 3.33Å; M67-L71 HydrophobicContact CG-CD1 3.95Å |
| 68 | P | 66.1 | Low | 67.5 | Low | 18 Ų | 18 | 99 Ų | 99 | 12% | 0.117 | 57% | 0.574 | C | S | . | * | P | Polyproline II helix | trans | -66.2 | 135.4 | -173.7 | 25.7 | -34.6 | 0 | 0 | 0 | 110.1 | V42 Y54 F58 P66 E70 L71 | V42-P68 HydrophobicContact CB-CB 4.48Å; V42-P68 HydrophobicContact CG1-CB 3.92Å; V42-P68 HydrophobicContact CG1-CG 4.05Å; V42-P68 HydrophobicContact CG2-CB 3.76Å; V42-P68 HydrophobicContact CG2-CG 3.73Å; Y54-P68 WeakPolarHBondContact OH-CG 3.45Å; F58-P68 HydrophobicContact CE2-CG 4.33Å; P66-P68 VanDerWaalsContact O-N 3.16Å; P68-E70 HydrophobicContact CB-CB 4.15Å; P68-E70 PolarHBondContact O-N 3.19Å; P68-E70 VanDerWaalsContact O-N 3.12Å; P68-L71 HydrophobicContact CG-CD1 3.58Å; P68-L71 HydrophobicContact CG-CG 4.08Å; P68-L71 WeakPolarHBondContact O-CB 3.27Å; P68-L71 PolarHBondContact O-N 3.47Å; P68-L71 VanDerWaalsContact O-N 3.07Å |
| 69 | T | 65.5 | Low | 66.6 | Low | 113 Ų | 113 | 103.5 Ų | 103.5 | 69% | 0.693 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -57.5 | -24.2 | 172.6 | -168 | 0 | 0 | 0 | 0 | 111.9 | M67 L71 A72 G73 | M67-T69 PolarHBondContact O-N 3.33Å; T69-L71 VanDerWaalsContact C-N 3.26Å; T69-L71 PolarHBondContact O-N 3.41Å; T69-A72 CarbonylContact O-C 3.01Å; T69-A72 WeakPolarHBondContact O-CA 3.33Å; T69-A72 WeakPolarHBondContact O-CB 3.49Å; T69-A72 PolarHBondContact O-N 3.43Å; T69-G73 PolarHBondContact O-N 3.21Å |
| 70 | E | 61.6 | Low | 65.5 | Low | 88 Ų | 88 | 101.8 Ų | 101.8 | 41% | 0.411 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -55.2 | -35.8 | 174.4 | -164.7 | 159.9 | 118.7 | 0 | 0 | 112 | V42 P68 E74 | V42-E70 HydrophobicContact CG1-CB 4.48Å; V42-E70 WeakPolarHBondContact CG1-OE1 3.46Å; P68-E70 HydrophobicContact CB-CB 4.15Å; P68-E70 PolarHBondContact O-N 3.19Å; P68-E70 VanDerWaalsContact O-N 3.12Å; E70-E74 WeakPolarHBondContact CA-OE2 3.47Å; E70-E74 HydrophobicContact CB-CB 4.32Å; E70-E74 HydrophobicContact CB-CG 4.34Å; E70-E74 WeakPolarHBondContact CB-OE2 3.37Å; E70-E74 HydrophobicContact CG-CB 3.66Å; E70-E74 VanDerWaalsContact CG-CD 3.45Å; E70-E74 HydrophobicContact CG-CG 3.97Å; E70-E74 WeakPolarHBondContact CG-OE2 3.46Å; E70-E74 WeakPolarHBondContact O-CA 3.4Å; E70-E74 WeakPolarHBondContact O-CB 3.46Å; E70-E74 PolarHBondContact O-N 2.94Å |
| 71 | L | 59.7 | Low | 64.2 | Low | 44 Ų | 44 | 100.4 Ų | 100.4 | 23% | 0.23 | 60% | 0.595 | C | S | . | * | H | α-helix | trans | -69 | -33.5 | 170.7 | -81.6 | 155.5 | 0 | 0 | 0 | 114.3 | L51 Y54 M67 P68 T69 | L51-L71 HydrophobicContact CD2-CD2 3.87Å; Y54-L71 HydrophobicContact CD1-CD1 3.4Å; Y54-L71 HydrophobicContact CD1-CD2 3.18Å; Y54-L71 HydrophobicContact CD1-CG 3.77Å; Y54-L71 HydrophobicContact CD2-CD2 3.89Å; Y54-L71 HydrophobicContact CE1-CD1 2.88Å; Y54-L71 HydrophobicContact CE1-CD2 3.47Å; Y54-L71 VanDerWaalsContact CE1-CD2 3.47Å; Y54-L71 HydrophobicContact CE1-CG 3.49Å; Y54-L71 VanDerWaalsContact CE1-CG 3.49Å; Y54-L71 HydrophobicContact CE2-CD1 4.5Å; Y54-L71 HydrophobicContact CE2-CD2 3.98Å; Y54-L71 HydrophobicContact CE2-CG 4.32Å; Y54-L71 HydrophobicContact CG-CD1 4.48Å; Y54-L71 HydrophobicContact CG-CD2 3.5Å; Y54-L71 HydrophobicContact CG-CG 4.44Å; Y54-L71 VanDerWaalsContact CZ-CD1 3.5Å; M67-L71 HydrophobicContact CG-CD1 3.95Å; P68-L71 HydrophobicContact CG-CD1 3.58Å; P68-L71 HydrophobicContact CG-CG 4.08Å; P68-L71 WeakPolarHBondContact O-CB 3.27Å; P68-L71 PolarHBondContact O-N 3.47Å; P68-L71 VanDerWaalsContact O-N 3.07Å; T69-L71 VanDerWaalsContact C-N 3.26Å; T69-L71 PolarHBondContact O-N 3.41Å |
| 72 | A | 56.4 | Low | 62.7 | Low | 95 Ų | 95 | 98.3 Ų | 98.3 | 79% | 0.785 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -83.9 | -16.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | T69 | T69-A72 CarbonylContact O-C 3.01Å; T69-A72 WeakPolarHBondContact O-CA 3.33Å; T69-A72 WeakPolarHBondContact O-CB 3.49Å; T69-A72 PolarHBondContact O-N 3.43Å |
| 73 | G | 53.4 | Low | 61.1 | Low | 45 Ų | 45 | 102.7 Ų | 102.7 | 46% | 0.464 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -143.6 | -11.6 | -167.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | T69 G75 | T69-G73 PolarHBondContact O-N 3.21Å; G73-G75 PolarHBondContact O-N 3.45Å |
| 74 | E | 51.3 | Low | 59.6 | Low | 116 Ų | 116 | 102.9 Ų | 102.9 | 54% | 0.542 | 63% | 0.625 | S | S | . | * | trans | -108.3 | 75.2 | -169.2 | -70.5 | -173.6 | 77.9 | 0 | 0 | 113.8 | E70 | E70-E74 WeakPolarHBondContact CA-OE2 3.47Å; E70-E74 HydrophobicContact CB-CB 4.32Å; E70-E74 HydrophobicContact CB-CG 4.34Å; E70-E74 WeakPolarHBondContact CB-OE2 3.37Å; E70-E74 HydrophobicContact CG-CB 3.66Å; E70-E74 VanDerWaalsContact CG-CD 3.45Å; E70-E74 HydrophobicContact CG-CG 3.97Å; E70-E74 WeakPolarHBondContact CG-OE2 3.46Å; E70-E74 WeakPolarHBondContact O-CA 3.4Å; E70-E74 WeakPolarHBondContact O-CB 3.46Å; E70-E74 PolarHBondContact O-N 2.94Å | ||
| 75 | G | 45.6 | Very low | 58.2 | Low | 77 Ų | 77 | 95.5 Ų | 95.5 | 79% | 0.794 | 61% | 0.606 | S | S | * | * | trans | -104.8 | 28.3 | 141.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | G73 | G73-G75 PolarHBondContact O-N 3.45Š| ||
| 76 | Q | 42.2 | Very low | 56.9 | Low | 166 Ų | 166 | 100.8 Ų | 100.8 | 78% | 0.776 | 63% | 0.634 | S | S | * | * | trans | -110.5 | 75.4 | -179.8 | -70.8 | -167.1 | -11.7 | 0 | 0 | 111.6 | ||||
| 77 | S | 43.5 | Very low | 55.7 | Low | 200 Ų | 200 | 99.3 Ų | 99.3 | 100% | 1.399 | 62% | 0.623 | S | S | * | * | trans | -167 | 0 | 143.6 | -76.8 | 0 | 0 | 0 | 0 | 109.5 |
Retrieved 77 of 77 residues in 164 ms
(Link to these results)