| 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 | 42.3 | Very low | 69.2 | Low | 234 Ų | 234 | 129.8 Ų | 129.8 | 100% | 1.153 | 68% | 0.679 | S | S | * | * | 0 | 118.4 | 0 | -71.7 | 176.1 | -177.3 | 0 | 0 | 107.3 | V3 | M1-V3 PolarHBondContact O-N 3.41Š| |||
| 2 | L | 51.5 | Low | 70.6 | Confident | 167 Ų | 167 | 127.6 Ų | 127.6 | 87% | 0.874 | 66% | 0.66 | S | S | * | * | trans | -72 | 98 | -176 | -167 | 76.1 | 0 | 0 | 0 | 108.5 | K4 | L2-K4 VanDerWaalsContact C-N 3.27Å; L2-K4 PolarHBondContact O-N 3.25Å | ||
| 3 | V | 56 | Low | 71.8 | Confident | 136 Ų | 136 | 123.5 Ų | 123.5 | 82% | 0.824 | 64% | 0.639 | S | S | * | * | trans | -71.4 | 91.2 | 172.3 | -177.4 | 0 | 0 | 0 | 0 | 106.5 | M1 S5 | M1-V3 PolarHBondContact O-N 3.41Å; V3-S5 PolarHBondContact O-N 3.01Å; V3-S5 VanDerWaalsContact O-N 3.08Å | ||
| 4 | K | 63.4 | Low | 72.8 | Confident | 168 Ų | 168 | 126.2 Ų | 126.2 | 73% | 0.73 | 64% | 0.639 | S | S | * | * | trans | -73.3 | 100.9 | 175.3 | -156.5 | 171 | 175.3 | -170 | 0 | 106 | L2 N6 | L2-K4 VanDerWaalsContact C-N 3.27Å; L2-K4 PolarHBondContact O-N 3.25Å; K4-N6 VanDerWaalsContact C-N 3.27Å; K4-N6 PolarHBondContact O-N 3.29Å | ||
| 5 | S | 65.3 | Low | 73.7 | Confident | 99 Ų | 99 | 132.3 Ų | 132.3 | 69% | 0.692 | 65% | 0.651 | S | S | * | * | trans | -60 | 92.9 | 172.9 | 49.3 | 0 | 0 | 0 | 0 | 107.9 | V3 S7 | V3-S5 PolarHBondContact O-N 3.01Å; V3-S5 VanDerWaalsContact O-N 3.08Å; S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.25Å | ||
| 6 | N | 68.5 | Low | 74.6 | Confident | 127 Ų | 127 | 134.9 Ų | 134.9 | 68% | 0.679 | 65% | 0.652 | S | S | * | * | trans | -72.1 | 90.3 | -176.8 | -163.9 | 12.7 | 0 | 0 | 0 | 108 | K4 | K4-N6 VanDerWaalsContact C-N 3.27Å; K4-N6 PolarHBondContact O-N 3.29Å | ||
| 7 | S | 79.6 | Confident | 75.2 | Confident | 61 Ų | 61 | 134.4 Ų | 134.4 | 43% | 0.427 | 65% | 0.648 | S | S | . | * | trans | -73.4 | 152.7 | 177.5 | 176 | 0 | 0 | 0 | 0 | 109.9 | S5 Y9 D10 S11 | S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.25Å; S7-Y9 PolarHBondContact O-N 2.94Å; S7-Y9 VanDerWaalsContact O-N 3.12Å; S7-Y9 PolarHBondContact OG-N 3.32Å; S7-D10 PolarHBondContact N-OD2 3.42Å; S7-D10 WeakPolarHBondContact O-CB 3.47Å; S7-D10 PolarHBondContact O-N 3.31Å; S7-S11 PolarHBondContact O-N 3.22Å | ||
| 8 | E | 83 | Confident | 75.8 | Confident | 177 Ų | 177 | 133.4 Ų | 133.4 | 83% | 0.827 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -51.9 | -33.3 | 168 | -64.7 | 175.6 | 177.5 | 0 | 0 | 111.1 | S11 F12 | E8-S11 WeakPolarHBondContact O-CB 3.44Å; E8-S11 PolarHBondContact O-N 3.12Å; E8-F12 PolarHBondContact O-N 3.46Å |
| 9 | Y | 82 | Confident | 76.1 | Confident | 147 Ų | 147 | 135.2 Ų | 135.2 | 58% | 0.576 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -67.4 | -35.1 | 175.6 | -170.2 | -105.8 | 0 | 0 | 0 | 113.3 | S7 S11 F12 L13 | S7-Y9 PolarHBondContact O-N 2.94Å; S7-Y9 VanDerWaalsContact O-N 3.12Å; S7-Y9 PolarHBondContact OG-N 3.32Å; Y9-S11 VanDerWaalsContact C-N 3.32Å; Y9-F12 HydrophobicContact CE2-CD1 4.35Å; Y9-F12 WeakPolarHBondContact O-CB 3.38Å; Y9-F12 PolarHBondContact O-N 2.99Å; Y9-L13 HydrophobicContact CD1-CD1 4.07Å; Y9-L13 HydrophobicContact CD1-CG 4.33Å; Y9-L13 HydrophobicContact CE1-CD1 3.7Å; Y9-L13 HydrophobicContact CE1-CD2 4.36Å; Y9-L13 HydrophobicContact CE1-CG 4.01Å; Y9-L13 WeakPolarHBondContact O-CG 3.23Å; Y9-L13 PolarHBondContact O-N 2.89Å |
| 10 | D | 83.4 | Confident | 76.5 | Confident | 60 Ų | 60 | 133.7 Ų | 133.7 | 32% | 0.321 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -67.7 | -36.7 | 175 | -73.4 | -38.6 | 0 | 0 | 0 | 111.2 | S7 F12 L13 Y14 | S7-D10 PolarHBondContact N-OD2 3.42Å; S7-D10 WeakPolarHBondContact O-CB 3.47Å; S7-D10 PolarHBondContact O-N 3.31Å; D10-F12 VanDerWaalsContact C-N 3.34Å; D10-L13 PolarHBondContact O-N 3.22Å; D10-Y14 WeakPolarHBondContact O-CB 3.45Å; D10-Y14 PolarHBondContact O-N 3.04Å |
| 11 | S | 85.9 | Confident | 76.7 | Confident | 52 Ų | 52 | 131.8 Ų | 131.8 | 36% | 0.364 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -62.9 | -42.7 | 173.5 | -62.9 | 0 | 0 | 0 | 0 | 111.1 | S7 E8 Y9 L13 Y14 W15 | S7-S11 PolarHBondContact O-N 3.22Å; E8-S11 WeakPolarHBondContact O-CB 3.44Å; E8-S11 PolarHBondContact O-N 3.12Å; Y9-S11 VanDerWaalsContact C-N 3.32Å; S11-L13 PolarHBondContact O-N 3.48Å; S11-Y14 WeakPolarHBondContact O-CB 3.4Å; S11-Y14 PolarHBondContact O-N 3.3Å; S11-W15 PolarHBondContact O-N 3.07Å; S11-W15 VanDerWaalsContact O-N 3.14Å |
| 12 | F | 86.5 | Confident | 78.4 | Confident | 103 Ų | 103 | 125.4 Ų | 125.4 | 45% | 0.452 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -61.8 | -42.1 | 174.8 | 175.4 | -103.5 | 0 | 0 | 0 | 112.6 | E8 Y9 D10 W15 R16 | E8-F12 PolarHBondContact O-N 3.46Å; Y9-F12 HydrophobicContact CE2-CD1 4.35Å; Y9-F12 WeakPolarHBondContact O-CB 3.38Å; Y9-F12 PolarHBondContact O-N 2.99Å; D10-F12 VanDerWaalsContact C-N 3.34Å; F12-W15 PolarHBondContact O-N 3.45Å; F12-R16 HydrophobicContact CE1-CG 4.48Å; F12-R16 HydrophobicContact CE2-CG 4.47Å; F12-R16 HydrophobicContact CZ-CG 4.36Å; F12-R16 WeakPolarHBondContact O-CG 3.16Å; F12-R16 PolarHBondContact O-N 3.4Å |
| 13 | L | 86 | Confident | 79.8 | Confident | 74 Ų | 74 | 121.8 Ų | 121.8 | 39% | 0.387 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -64.4 | -42.3 | 176.1 | -70.7 | -179.2 | 0 | 0 | 0 | 111.9 | Y9 D10 S11 W15 R16 Q17 | Y9-L13 HydrophobicContact CD1-CD1 4.07Å; Y9-L13 HydrophobicContact CD1-CG 4.33Å; Y9-L13 HydrophobicContact CE1-CD1 3.7Å; Y9-L13 HydrophobicContact CE1-CD2 4.36Å; Y9-L13 HydrophobicContact CE1-CG 4.01Å; Y9-L13 WeakPolarHBondContact O-CG 3.23Å; Y9-L13 PolarHBondContact O-N 2.89Å; D10-L13 PolarHBondContact O-N 3.22Å; S11-L13 PolarHBondContact O-N 3.48Å; L13-W15 VanDerWaalsContact C-N 3.27Å; L13-W15 PolarHBondContact O-N 2.81Å; L13-R16 CarbonylContact O-C 3.52Å; L13-R16 WeakPolarHBondContact O-CA 3.46Å; L13-R16 PolarHBondContact O-N 2.95Å; L13-Q17 VanDerWaalsContact O-CG 3.29Å; L13-Q17 WeakPolarHBondContact O-CG 3.32Å; L13-Q17 PolarHBondContact O-N 3.46Å; L13-Q17 VanDerWaalsContact O-N 3.11Å |
| 14 | Y | 85.6 | Confident | 80.7 | Confident | 162 Ų | 162 | 120.7 Ų | 120.7 | 64% | 0.635 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -54.2 | -44.3 | 175.3 | 176.2 | -110 | 0 | 0 | 0 | 111.5 | D10 S11 R16 Q17 | D10-Y14 WeakPolarHBondContact O-CB 3.45Å; D10-Y14 PolarHBondContact O-N 3.04Å; S11-Y14 WeakPolarHBondContact O-CB 3.4Å; S11-Y14 PolarHBondContact O-N 3.3Å; Y14-R16 PolarHBondContact O-N 3.28Å; Y14-Q17 WeakPolarHBondContact O-CB 3.36Å; Y14-Q17 PolarHBondContact O-N 3.48Å |
| 15 | W | 86 | Confident | 81.3 | Confident | 217 Ų | 217 | 115.8 Ų | 115.8 | 82% | 0.822 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -72.2 | -18.4 | 179.9 | -74.8 | 45.6 | 0 | 0 | 0 | 113.5 | S11 F12 L13 | S11-W15 PolarHBondContact O-N 3.07Å; S11-W15 VanDerWaalsContact O-N 3.14Å; F12-W15 PolarHBondContact O-N 3.45Å; L13-W15 VanDerWaalsContact C-N 3.27Å; L13-W15 PolarHBondContact O-N 2.81Å |
| 16 | R | 88.6 | Confident | 81.7 | Confident | 175 Ų | 175 | 117.6 Ų | 117.6 | 66% | 0.66 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -2.1 | 176.1 | -70.1 | -173.5 | 67.1 | -177.1 | 3.8 | 113.3 | F12 L13 Y14 | F12-R16 HydrophobicContact CE1-CG 4.48Å; F12-R16 HydrophobicContact CE2-CG 4.47Å; F12-R16 HydrophobicContact CZ-CG 4.36Å; F12-R16 WeakPolarHBondContact O-CG 3.16Å; F12-R16 PolarHBondContact O-N 3.4Å; L13-R16 CarbonylContact O-C 3.52Å; L13-R16 WeakPolarHBondContact O-CA 3.46Å; L13-R16 PolarHBondContact O-N 2.95Å; Y14-R16 PolarHBondContact O-N 3.28Å |
| 17 | Q | 85.6 | Confident | 81.8 | Confident | 125 Ų | 125 | 114.9 Ų | 114.9 | 58% | 0.584 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -66.2 | 143 | 176.5 | -63.6 | -165.9 | -94.5 | 0 | 0 | 110 | L13 Y14 I19 | L13-Q17 VanDerWaalsContact O-CG 3.29Å; L13-Q17 WeakPolarHBondContact O-CG 3.32Å; L13-Q17 PolarHBondContact O-N 3.46Å; L13-Q17 VanDerWaalsContact O-N 3.11Å; Y14-Q17 WeakPolarHBondContact O-CB 3.36Å; Y14-Q17 PolarHBondContact O-N 3.48Å; Q17-I19 PolarHBondContact O-N 3.05Å |
| 18 | P | 85.2 | Confident | 81.5 | Confident | 118 Ų | 118 | 117.7 Ų | 117.7 | 77% | 0.766 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 139.2 | 172.8 | 26.1 | -33.2 | 0 | 0 | 0 | 109.5 | S20 | P18-S20 PolarHBondContact O-N 3.28Š|
| 19 | I | 82.4 | Confident | 81.1 | Confident | 167 Ų | 167 | 116.7 Ų | 116.7 | 86% | 0.856 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 124.3 | 174.8 | -57.8 | 171.1 | 0 | 0 | 0 | 107.4 | Q17 A21 | Q17-I19 PolarHBondContact O-N 3.05Å; I19-A21 PolarHBondContact O-N 3.5Å |
| 20 | S | 82.6 | Confident | 80.6 | Confident | 105 Ų | 105 | 115.8 Ų | 115.8 | 73% | 0.734 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 135.8 | 173.2 | -62.5 | 0 | 0 | 0 | 0 | 109.5 | P18 P22 | P18-S20 PolarHBondContact O-N 3.28Å; S20-P22 WeakPolarHBondContact O-CD 3.23Å |
| 21 | A | 82 | Confident | 79.9 | Confident | 93 Ų | 93 | 115.6 Ų | 115.6 | 77% | 0.769 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 125.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | I19 | I19-A21 PolarHBondContact O-N 3.5Š|
| 22 | P | 77.3 | Confident | 78.9 | Confident | 100 Ų | 100 | 117.1 Ų | 117.1 | 65% | 0.649 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 140.4 | 175.6 | 26.9 | -33 | 0 | 0 | 0 | 109.2 | S20 L24 | S20-P22 WeakPolarHBondContact O-CD 3.23Å; P22-L24 HydrophobicContact CG-CD2 4.44Å; P22-L24 PolarHBondContact O-N 3.35Å |
| 23 | D | 81.3 | Confident | 77.7 | Confident | 92 Ų | 92 | 115 Ų | 115 | 49% | 0.492 | 62% | 0.615 | S | S | . | * | trans | -70.6 | 112 | 170.5 | -169.8 | -9.6 | 0 | 0 | 0 | 108.6 | S25 E26 | D23-S25 PolarHBondContact O-N 3.03Å; D23-S25 WeakPolarHBondContact OD1-CB 3.39Å; D23-S25 PolarHBondContact OD1-N 2.93Å; D23-S25 PolarHBondContact OD1-OG 3.45Å; D23-S25 PolarHBondContact OD2-OG 3Å; D23-S25 VanDerWaalsContact OD2-OG 3.05Å; D23-E26 HydrophobicContact CB-CG 4.35Å | ||
| 24 | L | 75.1 | Confident | 76.6 | Confident | 112 Ų | 112 | 119.9 Ų | 119.9 | 59% | 0.586 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -13.1 | -177.1 | -61.9 | 177.8 | 0 | 0 | 0 | 112.4 | P22 E26 L27 T33 | P22-L24 HydrophobicContact CG-CD2 4.44Å; P22-L24 PolarHBondContact O-N 3.35Å; L24-E26 VanDerWaalsContact C-N 3.32Å; L24-L27 PolarHBondContact O-N 3.28Å; L24-T33 WeakPolarHBondContact O-CG2 3.37Å |
| 25 | S | 75.4 | Confident | 75.3 | Confident | 66 Ų | 66 | 117 Ų | 117 | 46% | 0.462 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.6 | -35 | 175.7 | 67.2 | 0 | 0 | 0 | 0 | 111.8 | D23 L27 E28 | D23-S25 PolarHBondContact O-N 3.03Å; D23-S25 WeakPolarHBondContact OD1-CB 3.39Å; D23-S25 PolarHBondContact OD1-N 2.93Å; D23-S25 PolarHBondContact OD1-OG 3.45Å; D23-S25 PolarHBondContact OD2-OG 3Å; D23-S25 VanDerWaalsContact OD2-OG 3.05Å; S25-L27 PolarHBondContact O-N 2.97Å; S25-E28 VanDerWaalsContact O-CB 3.23Å; S25-E28 WeakPolarHBondContact O-CB 3.43Å; S25-E28 PolarHBondContact O-N 3.47Å |
| 26 | E | 74 | Confident | 74.3 | Confident | 137 Ų | 137 | 115.3 Ų | 115.3 | 64% | 0.64 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -24.6 | 175.4 | -60.3 | -178.9 | -174.9 | 0 | 0 | 112.9 | D23 L24 E28 | D23-E26 HydrophobicContact CB-CG 4.35Å; L24-E26 VanDerWaalsContact C-N 3.32Å; E26-E28 VanDerWaalsContact C-N 3.35Å |
| 27 | L | 70.3 | Confident | 72.6 | Confident | 69 Ų | 69 | 112.6 Ų | 112.6 | 36% | 0.361 | 64% | 0.641 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.8 | -9.1 | 177.2 | -113.7 | 71 | 0 | 0 | 0 | 113.2 | L24 S25 L30 G31 V32 T33 | L24-L27 PolarHBondContact O-N 3.28Å; S25-L27 PolarHBondContact O-N 2.97Å; L27-L30 HydrophobicContact CD1-CD1 4.14Å; L27-L30 HydrophobicContact CG-CD1 4.32Å; L27-L30 PolarHBondContact O-N 2.89Å; L27-G31 PolarHBondContact O-N 3.04Å; L27-V32 HydrophobicContact CD2-CB 4.02Å; L27-V32 HydrophobicContact CD2-CG1 3.95Å; L27-V32 HydrophobicContact CG-CB 4.26Å; L27-V32 PolarHBondContact O-N 3.48Å; L27-T33 HydrophobicContact CB-CG2 3.88Å |
| 28 | E | 74.4 | Confident | 71.2 | Confident | 121 Ų | 121 | 112.7 Ų | 112.7 | 57% | 0.565 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | -39.9 | 178.4 | -172 | 165.6 | -164.2 | 0 | 0 | 111.1 | S25 E26 L30 G31 T33 | S25-E28 VanDerWaalsContact O-CB 3.23Å; S25-E28 WeakPolarHBondContact O-CB 3.43Å; S25-E28 PolarHBondContact O-N 3.47Å; E26-E28 VanDerWaalsContact C-N 3.35Å; E28-L30 PolarHBondContact O-N 2.96Å; E28-G31 PolarHBondContact O-N 2.81Å; E28-T33 HydrophobicContact CB-CG2 4.21Å |
| 29 | D | 74.3 | Confident | 69.5 | Low | 155 Ų | 155 | 116.2 Ų | 116.2 | 83% | 0.829 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63 | -26.6 | 175.5 | -67.6 | -16.9 | 0 | 0 | 0 | 112.5 | G31 | D29-G31 VanDerWaalsContact C-N 3.35Š|
| 30 | L | 71.2 | Confident | 68 | Low | 128 Ų | 128 | 117.3 Ų | 117.3 | 67% | 0.67 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -3.5 | 177.8 | -65.2 | 167.2 | 0 | 0 | 0 | 112.9 | L27 E28 V32 | L27-L30 HydrophobicContact CD1-CD1 4.14Å; L27-L30 HydrophobicContact CG-CD1 4.32Å; L27-L30 PolarHBondContact O-N 2.89Å; E28-L30 PolarHBondContact O-N 2.96Å; L30-V32 HydrophobicContact CB-CG2 3.91Å; L30-V32 PolarHBondContact O-N 3.25Å |
| 31 | G | 67.9 | Low | 66.5 | Low | 56 Ų | 56 | 117.4 Ų | 117.4 | 58% | 0.577 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.3 | 11.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L27 E28 D29 | L27-G31 PolarHBondContact O-N 3.04Å; E28-G31 PolarHBondContact O-N 2.81Å; D29-G31 VanDerWaalsContact C-N 3.35Å |
| 32 | V | 64.3 | Low | 65.3 | Low | 85 Ų | 85 | 122 Ų | 122 | 52% | 0.515 | 66% | 0.655 | S | S | . | * | trans | -84.7 | -20.3 | -173.1 | -175.1 | 0 | 0 | 0 | 0 | 112.5 | L27 L30 K34 | L27-V32 HydrophobicContact CD2-CB 4.02Å; L27-V32 HydrophobicContact CD2-CG1 3.95Å; L27-V32 HydrophobicContact CG-CB 4.26Å; L27-V32 PolarHBondContact O-N 3.48Å; L30-V32 HydrophobicContact CB-CG2 3.91Å; L30-V32 PolarHBondContact O-N 3.25Å; V32-K34 VanDerWaalsContact C-N 3.26Å; V32-K34 PolarHBondContact O-N 3.24Å; V32-K34 VanDerWaalsContact O-N 3.15Å | ||
| 33 | T | 61.4 | Low | 64.4 | Low | 59 Ų | 59 | 126.6 Ų | 126.6 | 36% | 0.362 | 66% | 0.664 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.8 | -11.6 | -169.4 | 58.1 | 0 | 0 | 0 | 0 | 115.3 | L24 L27 E28 S35 | L24-T33 WeakPolarHBondContact O-CG2 3.37Å; L27-T33 HydrophobicContact CB-CG2 3.88Å; E28-T33 HydrophobicContact CB-CG2 4.21Å; T33-S35 PolarHBondContact O-N 3.06Å |
| 34 | K | 63.1 | Low | 63.2 | Low | 176 Ų | 176 | 124.2 Ų | 124.2 | 77% | 0.765 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 6.7 | -173.8 | -60.1 | -79.8 | -176 | -177 | 0 | 114.3 | V32 K36 | V32-K34 VanDerWaalsContact C-N 3.26Å; V32-K34 PolarHBondContact O-N 3.24Å; V32-K34 VanDerWaalsContact O-N 3.15Å; K34-K36 PolarHBondContact O-N 3.29Å |
| 35 | S | 59.9 | Low | 62.8 | Low | 102 Ų | 102 | 123.3 Ų | 123.3 | 71% | 0.713 | 66% | 0.657 | S | S | * | * | trans | -71.9 | 99.2 | 173.1 | 71.1 | 0 | 0 | 0 | 0 | 109.2 | T33 | T33-S35 PolarHBondContact O-N 3.06Š| ||
| 36 | K | 63.6 | Low | 62.2 | Low | 181 Ų | 181 | 129.1 Ų | 129.1 | 79% | 0.787 | 67% | 0.674 | S | S | * | * | trans | -46.3 | 135.4 | 168.5 | -75.4 | 176 | 179.7 | 168.6 | 0 | 108.2 | K34 T38 | K34-K36 PolarHBondContact O-N 3.29Å; K36-T38 PolarHBondContact O-N 3.15Å | ||
| 37 | P | 54.2 | Low | 61.6 | Low | 118 Ų | 118 | 131.1 Ų | 131.1 | 77% | 0.766 | 68% | 0.68 | S | S | * | * | trans | -55.6 | 113.9 | 170.4 | 23.1 | -30.8 | 0 | 0 | 0 | 106.1 | K39 | P37-K39 PolarHBondContact O-N 3.05Š| ||
| 38 | T | 54.8 | Low | 61.4 | Low | 127 Ų | 127 | 133.1 Ų | 133.1 | 78% | 0.779 | 69% | 0.688 | S | S | * | * | trans | -62.7 | 93.7 | 170.1 | 53.8 | 0 | 0 | 0 | 0 | 104.5 | K36 K40 | K36-T38 PolarHBondContact O-N 3.15Å; T38-K40 PolarHBondContact O-N 3.49Å | ||
| 39 | K | 49.2 | Very low | 61 | Low | 191 Ų | 191 | 131.6 Ų | 131.6 | 83% | 0.83 | 68% | 0.684 | S | S | * | * | trans | -42.1 | 118.3 | 161.2 | -73.2 | -175.9 | 178 | 179 | 0 | 103.8 | P37 S41 | P37-K39 PolarHBondContact O-N 3.05Å; K39-S41 PolarHBondContact O-N 2.7Å | ||
| 40 | K | 51.8 | Low | 60.9 | Low | 191 Ų | 191 | 127 Ų | 127 | 83% | 0.83 | 67% | 0.668 | S | S | * | * | trans | -55.4 | 90.6 | -177.6 | -66.4 | -168.1 | -176.4 | -177.4 | 0 | 107.6 | T38 K42 | T38-K40 PolarHBondContact O-N 3.49Å; K40-K42 PolarHBondContact O-N 3.01Å | ||
| 41 | S | 50.6 | Low | 60.9 | Low | 107 Ų | 107 | 123.7 Ų | 123.7 | 75% | 0.748 | 66% | 0.658 | S | S | * | * | trans | -74.6 | 83.7 | 169.6 | 49.4 | 0 | 0 | 0 | 0 | 104.2 | K39 K43 | K39-S41 PolarHBondContact O-N 2.7Å; S41-K43 PolarHBondContact O-N 3.26Å | ||
| 42 | K | 56.7 | Low | 61.1 | Low | 188 Ų | 188 | 125.7 Ų | 125.7 | 82% | 0.817 | 66% | 0.655 | S | S | * | * | trans | -61.4 | 86.7 | 163.9 | -72.6 | -176.8 | 179.6 | 177.9 | 0 | 106.8 | K40 | K40-K42 PolarHBondContact O-N 3.01Š| ||
| 43 | K | 58 | Low | 61.6 | Low | 197 Ų | 197 | 124 Ų | 124 | 86% | 0.857 | 65% | 0.65 | S | S | * | * | trans | 180 | 53.5 | 157.3 | -98.9 | 167.1 | -168.4 | -172.2 | 0 | 110.1 | S41 T45 | S41-K43 PolarHBondContact O-N 3.26Å; K43-T45 PolarHBondContact O-N 2.97Å | ||
| 44 | A | 56.9 | Low | 62.3 | Low | 42 Ų | 42 | 128 Ų | 128 | 35% | 0.347 | 66% | 0.662 | S | S | . | * | trans | -75.1 | 117.1 | 152.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | N49 | A44-N49 VanDerWaalsContact CB-OD1 3.26Å; A44-N49 WeakPolarHBondContact CB-OD1 3.47Å; A44-N49 PolarHBondContact O-ND2 3.05Å; A44-N49 VanDerWaalsContact O-ND2 3.11Å | ||
| 45 | T | 66.4 | Low | 62.7 | Low | 93 Ų | 93 | 125.7 Ų | 125.7 | 57% | 0.571 | 66% | 0.655 | S | S | * | * | trans | -58.1 | 144.2 | 178.1 | -42 | 0 | 0 | 0 | 0 | 109.3 | K43 K47 Q48 N49 | K43-T45 PolarHBondContact O-N 2.97Å; T45-K47 PolarHBondContact O-N 3.18Å; T45-Q48 PolarHBondContact O-N 3.37Å; T45-N49 PolarHBondContact O-N 3.15Å | ||
| 46 | K | 62.1 | Low | 63.2 | Low | 188 Ų | 188 | 129.1 Ų | 129.1 | 82% | 0.817 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -44.2 | -33.8 | -177.6 | -171.2 | 176.8 | -180 | 177.7 | 0 | 114 | A50 | K46-A50 WeakPolarHBondContact O-CB 3.06Å; K46-A50 PolarHBondContact O-N 3.39Å; K46-A50 VanDerWaalsContact O-N 3.1Å |
| 47 | K | 63.1 | Low | 63.6 | Low | 179 Ų | 179 | 127.8 Ų | 127.8 | 78% | 0.778 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -68.4 | -40 | 176.1 | -69.4 | -174.1 | 176.6 | -177.6 | 0 | 114.3 | T45 A50 A51 | T45-K47 PolarHBondContact O-N 3.18Å; K47-A50 PolarHBondContact O-N 3.1Å; K47-A51 PolarHBondContact O-N 3.11Å |
| 48 | Q | 64.9 | Low | 64.4 | Low | 112 Ų | 112 | 126.8 Ų | 126.8 | 52% | 0.523 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69.9 | -43.2 | 178.2 | -70.2 | 177.9 | -8.5 | 0 | 0 | 110.8 | T45 A50 A51 L52 | T45-Q48 PolarHBondContact O-N 3.37Å; Q48-A50 VanDerWaalsContact C-N 3.3Å; Q48-A50 PolarHBondContact O-N 3.45Å; Q48-A51 PolarHBondContact O-N 3.32Å; Q48-L52 WeakPolarHBondContact O-CD1 3.37Å; Q48-L52 PolarHBondContact O-N 2.88Å |
| 49 | N | 66.3 | Low | 65.2 | Low | 88 Ų | 88 | 126.3 Ų | 126.3 | 47% | 0.471 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -62.8 | -37 | 174.6 | -71.8 | -35 | 0 | 0 | 0 | 112.4 | A44 T45 A53 | A44-N49 VanDerWaalsContact CB-OD1 3.26Å; A44-N49 WeakPolarHBondContact CB-OD1 3.47Å; A44-N49 PolarHBondContact O-ND2 3.05Å; A44-N49 VanDerWaalsContact O-ND2 3.11Å; T45-N49 PolarHBondContact O-N 3.15Å; N49-A53 WeakPolarHBondContact O-CB 3.43Å; N49-A53 PolarHBondContact O-N 3.46Å |
| 50 | A | 71.9 | Confident | 66.3 | Low | 60 Ų | 60 | 123.3 Ų | 123.3 | 50% | 0.496 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -66.7 | -39.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | K46 K47 Q48 A53 K54 | K46-A50 WeakPolarHBondContact O-CB 3.06Å; K46-A50 PolarHBondContact O-N 3.39Å; K46-A50 VanDerWaalsContact O-N 3.1Å; K47-A50 PolarHBondContact O-N 3.1Å; Q48-A50 VanDerWaalsContact C-N 3.3Å; Q48-A50 PolarHBondContact O-N 3.45Å; A50-A53 PolarHBondContact O-N 3.4Å; A50-K54 WeakPolarHBondContact O-CB 3.22Å; A50-K54 PolarHBondContact O-N 2.94Å |
| 51 | A | 72.7 | Confident | 67.3 | Low | 57 Ų | 57 | 117.2 Ų | 117.2 | 47% | 0.471 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -66 | -45.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | K47 Q48 A53 K54 Q55 | K47-A51 PolarHBondContact O-N 3.11Å; Q48-A51 PolarHBondContact O-N 3.32Å; A51-A53 PolarHBondContact O-N 3.2Å; A51-K54 PolarHBondContact O-N 2.85Å; A51-Q55 WeakPolarHBondContact O-CG 3.1Å; A51-Q55 PolarHBondContact O-N 2.62Å |
| 52 | L | 71.6 | Confident | 68.5 | Low | 98 Ų | 98 | 118.4 Ų | 118.4 | 51% | 0.513 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.8 | -38.9 | 175.1 | -86.5 | 91.4 | 0 | 0 | 0 | 112.2 | Q48 K54 Q55 R56 | Q48-L52 WeakPolarHBondContact O-CD1 3.37Å; Q48-L52 PolarHBondContact O-N 2.88Å; L52-K54 VanDerWaalsContact C-N 3.34Å; L52-Q55 PolarHBondContact O-N 2.77Å; L52-R56 WeakPolarHBondContact O-CB 3.35Å; L52-R56 WeakPolarHBondContact O-CG 3.21Å; L52-R56 PolarHBondContact O-N 2.85Å |
| 53 | A | 74 | Confident | 69.2 | Low | 50 Ų | 50 | 114.6 Ų | 114.6 | 41% | 0.413 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66 | -36.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | N49 A50 A51 K57 | N49-A53 WeakPolarHBondContact O-CB 3.43Å; N49-A53 PolarHBondContact O-N 3.46Å; A50-A53 PolarHBondContact O-N 3.4Å; A51-A53 PolarHBondContact O-N 3.2Å; A53-K57 WeakPolarHBondContact O-CG 3.36Å; A53-K57 PolarHBondContact O-N 3.38Å |
| 54 | K | 75.6 | Confident | 69.9 | Low | 142 Ų | 142 | 109.7 Ų | 109.7 | 62% | 0.617 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.8 | -43.1 | 176.1 | -166 | 177.5 | -178.3 | -176.2 | 0 | 111.6 | A50 A51 L52 K57 Q58 | A50-K54 WeakPolarHBondContact O-CB 3.22Å; A50-K54 PolarHBondContact O-N 2.94Å; A51-K54 PolarHBondContact O-N 2.85Å; L52-K54 VanDerWaalsContact C-N 3.34Å; K54-K57 PolarHBondContact O-N 3.21Å; K54-Q58 WeakPolarHBondContact O-CG 3.26Å; K54-Q58 PolarHBondContact O-N 2.91Å |
| 55 | Q | 71.7 | Confident | 70.4 | Confident | 129 Ų | 129 | 114.6 Ų | 114.6 | 60% | 0.603 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63.6 | -42 | 175.4 | -71.3 | -119.1 | -58.4 | 0 | 0 | 112.3 | A51 L52 K57 Q58 Q59 | A51-Q55 WeakPolarHBondContact O-CG 3.1Å; A51-Q55 PolarHBondContact O-N 2.62Å; L52-Q55 PolarHBondContact O-N 2.77Å; Q55-K57 PolarHBondContact O-N 2.67Å; Q55-Q58 PolarHBondContact O-N 3.39Å; Q55-Q59 PolarHBondContact O-N 3.29Å |
| 56 | R | 70.4 | Confident | 70.6 | Confident | 173 Ų | 173 | 118.3 Ų | 118.3 | 65% | 0.653 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.4 | -42.1 | 174.7 | -76.6 | -178.2 | -173.3 | 179.9 | 1 | 112.5 | L52 Q58 Q59 E60 | L52-R56 WeakPolarHBondContact O-CB 3.35Å; L52-R56 WeakPolarHBondContact O-CG 3.21Å; L52-R56 PolarHBondContact O-N 2.85Å; R56-Q58 VanDerWaalsContact C-N 3.32Å; R56-Q58 PolarHBondContact O-N 2.71Å; R56-Q59 PolarHBondContact O-N 3.24Å; R56-E60 VanDerWaalsContact O-CB 3.23Å; R56-E60 WeakPolarHBondContact O-CB 3.41Å; R56-E60 PolarHBondContact O-N 3.46Å |
| 57 | K | 72.3 | Confident | 71.2 | Confident | 153 Ų | 153 | 111.4 Ų | 111.4 | 67% | 0.665 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.3 | -35.5 | 176.2 | -77.7 | -174.3 | 176.7 | -167.1 | 0 | 113 | A53 K54 Q55 A61 | A53-K57 WeakPolarHBondContact O-CG 3.36Å; A53-K57 PolarHBondContact O-N 3.38Å; K54-K57 PolarHBondContact O-N 3.21Å; Q55-K57 PolarHBondContact O-N 2.67Å; K57-A61 WeakPolarHBondContact O-CB 3.25Å; K57-A61 PolarHBondContact O-N 3.41Å |
| 58 | Q | 71.8 | Confident | 71.4 | Confident | 97 Ų | 97 | 108.1 Ų | 108.1 | 45% | 0.453 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.2 | -47.7 | 175.6 | -73.6 | 175.7 | -42.8 | 0 | 0 | 111 | K54 Q55 R56 E60 A61 E62 | K54-Q58 WeakPolarHBondContact O-CG 3.26Å; K54-Q58 PolarHBondContact O-N 2.91Å; Q55-Q58 PolarHBondContact O-N 3.39Å; R56-Q58 VanDerWaalsContact C-N 3.32Å; R56-Q58 PolarHBondContact O-N 2.71Å; Q58-E60 VanDerWaalsContact C-N 3.35Å; Q58-E60 PolarHBondContact O-N 3.06Å; Q58-A61 PolarHBondContact O-N 2.97Å; Q58-E62 WeakPolarHBondContact O-CG 3.38Å; Q58-E62 PolarHBondContact O-N 3.2Å |
| 59 | Q | 71.2 | Confident | 71.5 | Confident | 118 Ų | 118 | 109.1 Ų | 109.1 | 55% | 0.551 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -61.4 | -41.3 | 174.2 | -87.7 | -178.3 | -12.9 | 0 | 0 | 112.7 | Q55 R56 A61 E62 L63 | Q55-Q59 PolarHBondContact O-N 3.29Å; R56-Q59 PolarHBondContact O-N 3.24Å; Q59-A61 VanDerWaalsContact C-N 3.33Å; Q59-A61 PolarHBondContact O-N 3.48Å; Q59-E62 PolarHBondContact O-N 3.2Å; Q59-L63 WeakPolarHBondContact O-CB 3.4Å; Q59-L63 WeakPolarHBondContact O-CD1 3.5Å; Q59-L63 WeakPolarHBondContact O-CG 3.47Å; Q59-L63 PolarHBondContact O-N 3.13Å |
| 60 | E | 71.9 | Confident | 71.4 | Confident | 128 Ų | 128 | 109.5 Ų | 109.5 | 60% | 0.598 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -62.2 | -43.3 | 177.9 | -170.9 | 174.1 | -168.7 | 0 | 0 | 110.6 | R56 Q58 E62 L63 L64 | R56-E60 VanDerWaalsContact O-CB 3.23Å; R56-E60 WeakPolarHBondContact O-CB 3.41Å; R56-E60 PolarHBondContact O-N 3.46Å; Q58-E60 VanDerWaalsContact C-N 3.35Å; Q58-E60 PolarHBondContact O-N 3.06Å; E60-E62 PolarHBondContact O-N 3.48Å; E60-L63 CarbonylContact O-C 3.58Å; E60-L63 PolarHBondContact O-N 3.18Å; E60-L64 WeakPolarHBondContact O-CG 3.48Å; E60-L64 PolarHBondContact O-N 3.24Å |
| 61 | A | 72.6 | Confident | 71.1 | Confident | 62 Ų | 62 | 115 Ų | 115 | 51% | 0.512 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.5 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | K57 Q58 Q59 L64 | K57-A61 WeakPolarHBondContact O-CB 3.25Å; K57-A61 PolarHBondContact O-N 3.41Å; Q58-A61 PolarHBondContact O-N 2.97Å; Q59-A61 VanDerWaalsContact C-N 3.33Å; Q59-A61 PolarHBondContact O-N 3.48Å; A61-L64 WeakPolarHBondContact O-CB 3.37Å; A61-L64 PolarHBondContact O-N 3.36Å |
| 62 | E | 76.1 | Confident | 70.9 | Confident | 133 Ų | 133 | 119.5 Ų | 119.5 | 62% | 0.621 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.6 | -34.1 | 174.4 | -70.8 | 168.6 | -163.3 | 0 | 0 | 111.9 | Q58 Q59 E60 L64 Y66 | Q58-E62 WeakPolarHBondContact O-CG 3.38Å; Q58-E62 PolarHBondContact O-N 3.2Å; Q59-E62 PolarHBondContact O-N 3.2Å; E60-E62 PolarHBondContact O-N 3.48Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-Y66 WeakPolarHBondContact O-CD2 3.29Å |
| 63 | L | 71.8 | Confident | 70.9 | Confident | 107 Ų | 107 | 123.6 Ų | 123.6 | 56% | 0.56 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -80 | -11.5 | 178.1 | -67.2 | 168.4 | 0 | 0 | 0 | 113.3 | Q59 E60 E65 Y66 T67 | Q59-L63 WeakPolarHBondContact O-CB 3.4Å; Q59-L63 WeakPolarHBondContact O-CD1 3.5Å; Q59-L63 WeakPolarHBondContact O-CG 3.47Å; Q59-L63 PolarHBondContact O-N 3.13Å; E60-L63 CarbonylContact O-C 3.58Å; E60-L63 PolarHBondContact O-N 3.18Å; L63-E65 PolarHBondContact O-N 3.46Å; L63-Y66 PolarHBondContact O-N 3.36Å; L63-Y66 VanDerWaalsContact O-N 3.12Å; L63-T67 PolarHBondContact O-N 3.14Å |
| 64 | L | 71.8 | Confident | 70.8 | Confident | 95 Ų | 95 | 129.7 Ų | 129.7 | 50% | 0.497 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.7 | -23.2 | 173.3 | -76 | 175.6 | 0 | 0 | 0 | 112.8 | E60 A61 E62 Y66 T67 N70 | E60-L64 WeakPolarHBondContact O-CG 3.48Å; E60-L64 PolarHBondContact O-N 3.24Å; A61-L64 WeakPolarHBondContact O-CB 3.37Å; A61-L64 PolarHBondContact O-N 3.36Å; E62-L64 VanDerWaalsContact C-N 3.32Å; L64-Y66 VanDerWaalsContact C-N 3.33Å; L64-T67 HydrophobicContact CD2-CG2 4.23Å; L64-T67 WeakPolarHBondContact O-CG2 3.46Å; L64-N70 PolarHBondContact O-ND2 3.38Å |
| 65 | E | 69.1 | Low | 70.7 | Confident | 144 Ų | 144 | 128.2 Ų | 128.2 | 67% | 0.673 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -28.7 | 175.1 | -168.6 | 173.3 | -179.5 | 0 | 0 | 111.8 | L63 | L63-E65 PolarHBondContact O-N 3.46Š|
| 66 | Y | 70.9 | Confident | 70.9 | Confident | 172 Ų | 172 | 129.8 Ų | 129.8 | 68% | 0.675 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -99.5 | -0.5 | -175.5 | -55.9 | -80 | 0 | 0 | 0 | 113.7 | E62 L63 L64 T68 | E62-Y66 WeakPolarHBondContact O-CD2 3.29Å; L63-Y66 PolarHBondContact O-N 3.36Å; L63-Y66 VanDerWaalsContact O-N 3.12Å; L64-Y66 VanDerWaalsContact C-N 3.33Å; Y66-T68 PolarHBondContact O-N 3.34Å |
| 67 | T | 73.1 | Confident | 71.1 | Confident | 42 Ų | 42 | 126.4 Ų | 126.4 | 26% | 0.258 | 61% | 0.611 | S | S | . | * | trans | -80.7 | 110.5 | 176.9 | 175.6 | 0 | 0 | 0 | 0 | 111 | L63 L64 F69 N70 | L63-T67 PolarHBondContact O-N 3.14Å; L64-T67 HydrophobicContact CD2-CG2 4.23Å; L64-T67 WeakPolarHBondContact O-CG2 3.46Å; T67-F69 PolarHBondContact O-N 3.11Å; T67-F69 WeakPolarHBondContact OG1-CB 3.33Å; T67-F69 PolarHBondContact OG1-N 3.4Å; T67-F69 VanDerWaalsContact OG1-N 3.15Å; T67-N70 WeakPolarHBondContact CG2-ND2 3.41Å; T67-N70 PolarHBondContact O-N 3.46Å | ||
| 68 | T | 68.6 | Low | 71.3 | Confident | 110 Ų | 110 | 124.5 Ų | 124.5 | 68% | 0.675 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -60 | -14.2 | 168.8 | -45.5 | 0 | 0 | 0 | 0 | 112 | Y66 N70 Y71 W72 | Y66-T68 PolarHBondContact O-N 3.34Å; T68-N70 PolarHBondContact O-N 3.31Å; T68-Y71 PolarHBondContact O-N 3.21Å; T68-W72 PolarHBondContact O-N 3.28Å |
| 69 | F | 66.9 | Low | 71.7 | Confident | 133 Ų | 133 | 125 Ų | 125 | 58% | 0.583 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -71.1 | -0.2 | 175.6 | -147.1 | -95.3 | 0 | 0 | 0 | 114 | T67 W72 | T67-F69 PolarHBondContact O-N 3.11Å; T67-F69 WeakPolarHBondContact OG1-CB 3.33Å; T67-F69 PolarHBondContact OG1-N 3.4Å; T67-F69 VanDerWaalsContact OG1-N 3.15Å; F69-W72 AromaticContact CD1-CE2 3.77Å; F69-W72 AromaticContact CD1-CZ2 3.98Å; F69-W72 HydrophobicContact CD1-CZ2 3.98Å; F69-W72 AromaticContact CD1-NE1 3.26Å; F69-W72 VanDerWaalsContact CD1-NE1 3.26Å; F69-W72 HydrophobicContact CD2-CD2 4.48Å; F69-W72 AromaticContact CD2-NE1 3.88Å; F69-W72 AromaticContact CE1-CE2 3.52Å; F69-W72 HydrophobicContact CE1-CH2 4.24Å; F69-W72 AromaticContact CE1-CZ2 3.24Å; F69-W72 HydrophobicContact CE1-CZ2 3.24Å; F69-W72 AromaticContact CE1-NE1 3.52Å; F69-W72 HydrophobicContact CE2-CD2 4.32Å; F69-W72 AromaticContact CE2-CE2 3.82Å; F69-W72 HydrophobicContact CE2-CH2 4.35Å; F69-W72 AromaticContact CE2-CZ2 3.86Å; F69-W72 HydrophobicContact CE2-CZ2 3.86Å; F69-W72 AromaticContact CG-CD1 3.96Å; F69-W72 AromaticContact CG-NE1 3.47Å; F69-W72 HydrophobicContact CZ-CD2 4.43Å; F69-W72 AromaticContact CZ-CE2 3.54Å; F69-W72 AromaticContact CZ-CH2 3.77Å; F69-W72 HydrophobicContact CZ-CH2 3.77Å; F69-W72 AromaticContact CZ-CZ2 3.16Å; F69-W72 HydrophobicContact CZ-CZ2 3.16Å; F69-W72 AromaticContact CZ-NE1 3.93Å; F69-W72 PolarHBondContact O-NE1 3.38Å |
| 70 | N | 62.8 | Low | 72.3 | Confident | 97 Ų | 97 | 124.3 Ų | 124.3 | 52% | 0.519 | 62% | 0.622 | S | S | . | * | G | 310 helix | trans | -92.1 | -17.8 | 164.5 | -70.5 | -30.5 | 0 | 0 | 0 | 112.6 | L64 T67 T68 | L64-N70 PolarHBondContact O-ND2 3.38Å; T67-N70 WeakPolarHBondContact CG2-ND2 3.41Å; T67-N70 PolarHBondContact O-N 3.46Å; T68-N70 PolarHBondContact O-N 3.31Å |
| 71 | Y | 65.6 | Low | 72.7 | Confident | 174 Ų | 174 | 124 Ų | 124 | 68% | 0.682 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | -10.7 | -171.5 | -56.2 | -82.8 | 0 | 0 | 0 | 113.8 | T68 R73 | T68-Y71 PolarHBondContact O-N 3.21Å; Y71-R73 PolarHBondContact O-N 2.83Å |
| 72 | W | 70 | Confident | 73 | Confident | 153 Ų | 153 | 126.1 Ų | 126.1 | 58% | 0.58 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -72 | -10.8 | 173.6 | 73.3 | -56.9 | 0 | 0 | 0 | 114 | T68 F69 | T68-W72 PolarHBondContact O-N 3.28Å; F69-W72 AromaticContact CD1-CE2 3.77Å; F69-W72 AromaticContact CD1-CZ2 3.98Å; F69-W72 HydrophobicContact CD1-CZ2 3.98Å; F69-W72 AromaticContact CD1-NE1 3.26Å; F69-W72 VanDerWaalsContact CD1-NE1 3.26Å; F69-W72 HydrophobicContact CD2-CD2 4.48Å; F69-W72 AromaticContact CD2-NE1 3.88Å; F69-W72 AromaticContact CE1-CE2 3.52Å; F69-W72 HydrophobicContact CE1-CH2 4.24Å; F69-W72 AromaticContact CE1-CZ2 3.24Å; F69-W72 HydrophobicContact CE1-CZ2 3.24Å; F69-W72 AromaticContact CE1-NE1 3.52Å; F69-W72 HydrophobicContact CE2-CD2 4.32Å; F69-W72 AromaticContact CE2-CE2 3.82Å; F69-W72 HydrophobicContact CE2-CH2 4.35Å; F69-W72 AromaticContact CE2-CZ2 3.86Å; F69-W72 HydrophobicContact CE2-CZ2 3.86Å; F69-W72 AromaticContact CG-CD1 3.96Å; F69-W72 AromaticContact CG-NE1 3.47Å; F69-W72 HydrophobicContact CZ-CD2 4.43Å; F69-W72 AromaticContact CZ-CE2 3.54Å; F69-W72 AromaticContact CZ-CH2 3.77Å; F69-W72 HydrophobicContact CZ-CH2 3.77Å; F69-W72 AromaticContact CZ-CZ2 3.16Å; F69-W72 HydrophobicContact CZ-CZ2 3.16Å; F69-W72 AromaticContact CZ-NE1 3.93Å; F69-W72 PolarHBondContact O-NE1 3.38Å |
| 73 | R | 70.9 | Confident | 73 | Confident | 184 Ų | 184 | 123.1 Ų | 123.1 | 69% | 0.694 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -107.2 | 129.6 | 171.5 | -68.6 | -129.6 | -87.7 | -166.5 | -6.6 | 108.8 | Y71 | Y71-R73 PolarHBondContact O-N 2.83Š|
| 74 | E | 71.6 | Confident | 73.3 | Confident | 177 Ų | 177 | 123.4 Ų | 123.4 | 83% | 0.827 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 133.4 | 169.7 | -169.1 | 170.1 | -159.2 | 0 | 0 | 108.5 | I76 | E74-I76 PolarHBondContact O-N 3.12Š|
| 75 | P | 73.6 | Confident | 73.6 | Confident | 112 Ų | 112 | 123.9 Ų | 123.9 | 73% | 0.727 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 130.1 | 176.7 | -25.8 | 33.8 | 0 | 0 | 0 | 109.6 | P77 | P75-P77 VanDerWaalsContact O-CD 3.25Å; P75-P77 WeakPolarHBondContact O-CD 3.43Å; P75-P77 VanDerWaalsContact O-N 3.1Å |
| 76 | I | 76.4 | Confident | 74 | Confident | 161 Ų | 161 | 123.1 Ų | 123.1 | 83% | 0.826 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 118.5 | 175 | -60.3 | 175.4 | 0 | 0 | 0 | 106.3 | E74 S78 | E74-I76 PolarHBondContact O-N 3.12Å; I76-S78 PolarHBondContact O-N 2.91Å |
| 77 | P | 74.8 | Confident | 74.1 | Confident | 102 Ų | 102 | 121.9 Ų | 121.9 | 66% | 0.662 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 131.8 | 178.2 | -14.3 | 24.3 | 0 | 0 | 0 | 108.5 | P75 I79 | P75-P77 VanDerWaalsContact O-CD 3.25Å; P75-P77 WeakPolarHBondContact O-CD 3.43Å; P75-P77 VanDerWaalsContact O-N 3.1Å; P77-I79 PolarHBondContact O-N 3.2Å |
| 78 | S | 76.8 | Confident | 73.3 | Confident | 113 Ų | 113 | 130.1 Ų | 130.1 | 79% | 0.79 | 66% | 0.66 | S | S | * | * | trans | -67.6 | 106 | 167.2 | 54.4 | 0 | 0 | 0 | 0 | 107.4 | I76 D80 | I76-S78 PolarHBondContact O-N 2.91Å; S78-D80 PolarHBondContact O-N 3.3Å | ||
| 79 | I | 79.8 | Confident | 73.6 | Confident | 109 Ų | 109 | 131.2 Ų | 131.2 | 56% | 0.559 | 66% | 0.659 | S | S | * | * | trans | -78 | 114.8 | 176.2 | -52.8 | 166.2 | 0 | 0 | 0 | 107 | P77 D83 F84 | P77-I79 PolarHBondContact O-N 3.2Å; I79-D83 HydrophobicContact CG2-CB 4.03Å; I79-F84 HydrophobicContact CB-CE2 4.14Å; I79-F84 HydrophobicContact CB-CZ 4.33Å; I79-F84 HydrophobicContact CG2-CD2 3.8Å; I79-F84 HydrophobicContact CG2-CE1 4.2Å; I79-F84 HydrophobicContact CG2-CE2 3.27Å; I79-F84 HydrophobicContact CG2-CG 4.47Å; I79-F84 HydrophobicContact CG2-CZ 3.51Å | ||
| 80 | D | 82.7 | Confident | 73.9 | Confident | 102 Ų | 102 | 131.1 Ų | 131.1 | 55% | 0.545 | 66% | 0.663 | S | S | . | * | trans | -86.9 | 159.6 | 174.4 | -165.5 | 10.8 | 0 | 0 | 0 | 110.5 | S78 L82 D83 F84 | S78-D80 PolarHBondContact O-N 3.3Å; D80-L82 PolarHBondContact O-N 3.32Å; D80-D83 PolarHBondContact N-OD2 2.91Å; D80-D83 WeakPolarHBondContact O-CB 3.48Å; D80-D83 PolarHBondContact O-N 3.32Å; D80-F84 WeakPolarHBondContact O-CD2 3.39Å; D80-F84 PolarHBondContact O-N 3.48Å | ||
| 81 | L | 80.6 | Confident | 74.6 | Confident | 123 Ų | 123 | 132.9 Ų | 132.9 | 64% | 0.644 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -57 | -31.4 | 174.8 | -174.8 | 61.3 | 0 | 0 | 0 | 111.7 | D83 F84 N85 | L81-D83 VanDerWaalsContact C-N 3.32Å; L81-D83 PolarHBondContact O-N 2.93Å; L81-F84 PolarHBondContact O-N 3.06Å; L81-N85 PolarHBondContact O-N 3.29Å; L81-N85 PolarHBondContact O-ND2 3.32Å; L81-N85 VanDerWaalsContact O-ND2 3.13Å |
| 82 | L | 78.6 | Confident | 75.1 | Confident | 106 Ų | 106 | 130.5 Ų | 130.5 | 56% | 0.555 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -62.9 | -36.8 | 174.9 | -171.7 | 62.2 | 0 | 0 | 0 | 112.3 | D80 F84 N85 L86 | D80-L82 PolarHBondContact O-N 3.32Å; L82-F84 VanDerWaalsContact C-N 3.33Å; L82-F84 PolarHBondContact O-N 2.92Å; L82-N85 PolarHBondContact O-N 3.08Å; L82-L86 HydrophobicContact CG-CD1 4.4Å; L82-L86 WeakPolarHBondContact O-CG 3.5Å; L82-L86 PolarHBondContact O-N 3.04Å |
| 83 | D | 76.9 | Confident | 75.4 | Confident | 69 Ų | 69 | 129.1 Ų | 129.1 | 37% | 0.369 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -66.8 | -36.6 | 178.7 | -59.9 | -37.6 | 0 | 0 | 0 | 111.4 | I79 D80 L81 N85 L86 L87 | I79-D83 HydrophobicContact CG2-CB 4.03Å; D80-D83 PolarHBondContact N-OD2 2.91Å; D80-D83 WeakPolarHBondContact O-CB 3.48Å; D80-D83 PolarHBondContact O-N 3.32Å; L81-D83 VanDerWaalsContact C-N 3.32Å; L81-D83 PolarHBondContact O-N 2.93Å; D83-N85 VanDerWaalsContact C-N 3.34Å; D83-L86 PolarHBondContact O-N 2.99Å; D83-L87 WeakPolarHBondContact O-CG 3.47Å; D83-L87 PolarHBondContact O-N 3.01Å |
| 84 | F | 77.8 | Confident | 75.7 | Confident | 114 Ų | 114 | 125.5 Ų | 125.5 | 50% | 0.5 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -66.2 | -35.9 | 173.7 | -70.6 | -73.9 | 0 | 0 | 0 | 112.7 | I79 D80 L81 L82 L86 L87 | I79-F84 HydrophobicContact CB-CE2 4.14Å; I79-F84 HydrophobicContact CB-CZ 4.33Å; I79-F84 HydrophobicContact CG2-CD2 3.8Å; I79-F84 HydrophobicContact CG2-CE1 4.2Å; I79-F84 HydrophobicContact CG2-CE2 3.27Å; I79-F84 HydrophobicContact CG2-CG 4.47Å; I79-F84 HydrophobicContact CG2-CZ 3.51Å; D80-F84 WeakPolarHBondContact O-CD2 3.39Å; D80-F84 PolarHBondContact O-N 3.48Å; L81-F84 PolarHBondContact O-N 3.06Å; L82-F84 VanDerWaalsContact C-N 3.33Å; L82-F84 PolarHBondContact O-N 2.92Å; F84-L86 VanDerWaalsContact C-N 3.29Å; F84-L86 PolarHBondContact O-N 3.21Å; F84-L87 PolarHBondContact O-N 3.25Å |
| 85 | N | 78.6 | Confident | 76 | Confident | 104 Ų | 104 | 121.8 Ų | 121.8 | 56% | 0.556 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.3 | -24.3 | 178.9 | -67.8 | -37 | 0 | 0 | 0 | 112.9 | L81 L82 D83 | L81-N85 PolarHBondContact O-N 3.29Å; L81-N85 PolarHBondContact O-ND2 3.32Å; L81-N85 VanDerWaalsContact O-ND2 3.13Å; L82-N85 PolarHBondContact O-N 3.08Å; D83-N85 VanDerWaalsContact C-N 3.34Å |
| 86 | L | 76.2 | Confident | 76.2 | Confident | 128 Ų | 128 | 122.5 Ų | 122.5 | 67% | 0.67 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -86.4 | -11.2 | 177.5 | -66.4 | 169.9 | 0 | 0 | 0 | 113.3 | L82 D83 F84 | L82-L86 HydrophobicContact CG-CD1 4.4Å; L82-L86 WeakPolarHBondContact O-CG 3.5Å; L82-L86 PolarHBondContact O-N 3.04Å; D83-L86 PolarHBondContact O-N 2.99Å; F84-L86 VanDerWaalsContact C-N 3.29Å; F84-L86 PolarHBondContact O-N 3.21Å |
| 87 | L | 73.9 | Confident | 76.1 | Confident | 146 Ų | 146 | 119.3 Ų | 119.3 | 76% | 0.764 | 65% | 0.646 | S | S | * | * | trans | -94.2 | 0.4 | 178 | -72.8 | 169.5 | 0 | 0 | 0 | 113.4 | D83 F84 | D83-L87 WeakPolarHBondContact O-CG 3.47Å; D83-L87 PolarHBondContact O-N 3.01Å; F84-L87 PolarHBondContact O-N 3.25Å | ||
| 88 | L | 57.2 | Low | 76.3 | Confident | 216 Ų | 216 | 120.9 Ų | 120.9 | 100% | 1.131 | 64% | 0.644 | S | S | * | * | trans | -100 | 0 | 174.3 | -128 | 91.1 | 0 | 0 | 0 | 111 |
Retrieved 88 of 88 residues in 226.1 ms
(Link to these results)