| 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 | 69.9 | Low | 90.3 | Very high | 209 Ų | 209 | 110.1 Ų | 110.1 | 100% | 1.03 | 61% | 0.609 | S | S | * | * | 0 | -12.4 | 0 | -63.6 | -161.9 | 133.2 | 0 | 0 | 114.3 | S4 | M1-S4 PolarHBondContact O-OG 2.95Š| |||
| 2 | H | 82.3 | Confident | 90.6 | Very high | 144 Ų | 144 | 110.3 Ų | 110.3 | 67% | 0.667 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -81.1 | -31.2 | 178.2 | -64.8 | -71.1 | 0 | 0 | 0 | 114.1 | S4 Q5 L6 | H2-S4 PolarHBondContact O-N 2.88Å; H2-Q5 WeakPolarHBondContact O-CB 3.5Å; H2-Q5 PolarHBondContact O-N 3.01Å; H2-Q5 VanDerWaalsContact O-N 3.15Å; H2-L6 WeakPolarHBondContact O-CG 3.24Å; H2-L6 PolarHBondContact O-N 3.44Å |
| 3 | L | 90.8 | Very high | 90.8 | Very high | 141 Ų | 141 | 110.6 Ų | 110.6 | 74% | 0.738 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -59.6 | -43.3 | 178.5 | -76.4 | 153.9 | 0 | 0 | 0 | 112.9 | Q5 L6 L7 | L3-Q5 VanDerWaalsContact C-N 3.3Å; L3-Q5 PolarHBondContact O-N 2.84Å; L3-L6 PolarHBondContact O-N 2.76Å; L3-L7 WeakPolarHBondContact O-CB 2.83Å; L3-L7 PolarHBondContact O-N 3.32Å |
| 4 | S | 92.3 | Very high | 90.9 | Very high | 79 Ų | 79 | 108.2 Ų | 108.2 | 55% | 0.552 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.7 | -35.9 | 176.5 | 53.1 | 0 | 0 | 0 | 0 | 112.2 | M1 H2 A8 | M1-S4 PolarHBondContact O-OG 2.95Å; H2-S4 PolarHBondContact O-N 2.88Å; S4-A8 WeakPolarHBondContact O-CB 3.04Å; S4-A8 PolarHBondContact O-N 2.99Å |
| 5 | Q | 91 | Very high | 90.9 | Very high | 121 Ų | 121 | 107.9 Ų | 107.9 | 57% | 0.565 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -71.6 | -40.5 | 179.1 | -164.5 | 167.9 | 11.7 | 0 | 0 | 111.4 | H2 L3 A8 C9 | H2-Q5 WeakPolarHBondContact O-CB 3.5Å; H2-Q5 PolarHBondContact O-N 3.01Å; H2-Q5 VanDerWaalsContact O-N 3.15Å; L3-Q5 VanDerWaalsContact C-N 3.3Å; L3-Q5 PolarHBondContact O-N 2.84Å; Q5-A8 PolarHBondContact O-N 3.12Å; Q5-C9 WeakPolarHBondContact O-CB 3.31Å; Q5-C9 PolarHBondContact O-N 2.74Å; Q5-C9 PolarHBondContact O-SG 2.87Å |
| 6 | L | 94.8 | Very high | 90.6 | Very high | 117 Ų | 117 | 108.9 Ų | 108.9 | 61% | 0.613 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -63 | -43.3 | 173.9 | -68.5 | 172 | 0 | 0 | 0 | 111.7 | H2 L3 C9 A10 | H2-L6 WeakPolarHBondContact O-CG 3.24Å; H2-L6 PolarHBondContact O-N 3.44Å; L3-L6 PolarHBondContact O-N 2.76Å; L6-C9 PolarHBondContact O-N 3.09Å; L6-A10 WeakPolarHBondContact O-CB 3.48Å; L6-A10 PolarHBondContact O-N 3.06Å |
| 7 | L | 95.1 | Very high | 90.1 | Very high | 116 Ų | 116 | 108.3 Ų | 108.3 | 61% | 0.607 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -60.6 | -46.1 | 174.7 | -99.3 | 157.5 | 0 | 0 | 0 | 112 | L3 C9 A10 L11 | L3-L7 WeakPolarHBondContact O-CB 2.83Å; L3-L7 PolarHBondContact O-N 3.32Å; L7-C9 PolarHBondContact O-N 3.11Å; L7-A10 PolarHBondContact O-N 3.09Å; L7-L11 WeakPolarHBondContact O-CB 3.26Å; L7-L11 PolarHBondContact O-N 3.04Å |
| 8 | A | 94 | Very high | 89.6 | Confident | 60 Ų | 60 | 109.3 Ų | 109.3 | 50% | 0.496 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -62.1 | -42.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S4 Q5 L12 | S4-A8 WeakPolarHBondContact O-CB 3.04Å; S4-A8 PolarHBondContact O-N 2.99Å; Q5-A8 PolarHBondContact O-N 3.12Å; A8-L12 WeakPolarHBondContact O-CB 3.33Å; A8-L12 PolarHBondContact O-N 3.36Å |
| 9 | C | 93.3 | Very high | 88.8 | Confident | 68 Ų | 68 | 114.1 Ų | 114.1 | 46% | 0.459 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.1 | -44.7 | 176.3 | -73.9 | 0 | 0 | 0 | 0 | 112.3 | Q5 L6 L7 L12 L13 | Q5-C9 WeakPolarHBondContact O-CB 3.31Å; Q5-C9 PolarHBondContact O-N 2.74Å; Q5-C9 PolarHBondContact O-SG 2.87Å; L6-C9 PolarHBondContact O-N 3.09Å; L7-C9 PolarHBondContact O-N 3.11Å; C9-L12 PolarHBondContact O-N 2.98Å; C9-L13 WeakPolarHBondContact O-CG 3.26Å; C9-L13 PolarHBondContact O-N 2.94Å |
| 10 | A | 94.8 | Very high | 87.3 | Confident | 52 Ų | 52 | 113.5 Ų | 113.5 | 43% | 0.43 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -63.3 | -43.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L6 L7 L13 T14 | L6-A10 WeakPolarHBondContact O-CB 3.48Å; L6-A10 PolarHBondContact O-N 3.06Å; L7-A10 PolarHBondContact O-N 3.09Å; A10-L13 PolarHBondContact O-N 3.31Å; A10-T14 WeakPolarHBondContact O-CB 3.34Å; A10-T14 PolarHBondContact O-N 3.24Å; A10-T14 PolarHBondContact O-OG1 3Å |
| 11 | L | 95.3 | Very high | 85.6 | Confident | 104 Ų | 104 | 113.1 Ų | 113.1 | 55% | 0.545 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -59.9 | -45.2 | 174.1 | -108.8 | 151.9 | 0 | 0 | 0 | 112 | L7 T14 L15 | L7-L11 WeakPolarHBondContact O-CB 3.26Å; L7-L11 PolarHBondContact O-N 3.04Å; L11-T14 PolarHBondContact O-N 3.11Å; L11-L15 WeakPolarHBondContact O-CG 3.25Å; L11-L15 PolarHBondContact O-N 3.08Å |
| 12 | L | 93.9 | Very high | 84.7 | Confident | 112 Ų | 112 | 111.9 Ų | 111.9 | 59% | 0.586 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -63.3 | -43.8 | -179.7 | -172.9 | 64 | 0 | 0 | 0 | 112.1 | A8 C9 T14 L15 L16 | A8-L12 WeakPolarHBondContact O-CB 3.33Å; A8-L12 PolarHBondContact O-N 3.36Å; C9-L12 PolarHBondContact O-N 2.98Å; L12-T14 VanDerWaalsContact C-N 3.32Å; L12-T14 PolarHBondContact O-N 2.82Å; L12-L15 PolarHBondContact O-N 3.16Å; L12-L16 PolarHBondContact O-N 3.33Å |
| 13 | L | 92.4 | Very high | 83.1 | Confident | 115 Ų | 115 | 108.6 Ų | 108.6 | 60% | 0.602 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.2 | -37.9 | 176.1 | -70.9 | 171.6 | 0 | 0 | 0 | 112.2 | C9 A10 L16 S17 | C9-L13 WeakPolarHBondContact O-CG 3.26Å; C9-L13 PolarHBondContact O-N 2.94Å; A10-L13 PolarHBondContact O-N 3.31Å; L13-L16 PolarHBondContact O-N 3.38Å; L13-S17 WeakPolarHBondContact O-CB 3.41Å; L13-S17 PolarHBondContact O-N 3.07Å; L13-S17 PolarHBondContact O-OG 2.99Å |
| 14 | T | 92.6 | Very high | 80.7 | Confident | 77 Ų | 77 | 111.1 Ų | 111.1 | 47% | 0.472 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65 | -45.8 | 176.5 | -54.7 | 0 | 0 | 0 | 0 | 110.5 | A10 L11 L12 L16 S17 L18 | A10-T14 WeakPolarHBondContact O-CB 3.34Å; A10-T14 PolarHBondContact O-N 3.24Å; A10-T14 PolarHBondContact O-OG1 3Å; L11-T14 PolarHBondContact O-N 3.11Å; L12-T14 VanDerWaalsContact C-N 3.32Å; L12-T14 PolarHBondContact O-N 2.82Å; T14-L16 VanDerWaalsContact C-N 3.34Å; T14-L16 PolarHBondContact O-N 2.85Å; T14-S17 PolarHBondContact O-N 3.12Å; T14-L18 HydrophobicContact CG2-CD1 4.02Å; T14-L18 WeakPolarHBondContact O-CB 3.35Å; T14-L18 WeakPolarHBondContact O-CD1 3.42Å; T14-L18 PolarHBondContact O-N 3.25Å |
| 15 | L | 90.4 | Very high | 78.7 | Confident | 104 Ų | 104 | 113.8 Ų | 113.8 | 55% | 0.545 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -63.5 | -37 | 176 | -71.4 | 171.1 | 0 | 0 | 0 | 112.8 | L11 L12 S17 R19 | L11-L15 WeakPolarHBondContact O-CG 3.25Å; L11-L15 PolarHBondContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 3.16Å; L15-S17 VanDerWaalsContact C-N 3.3Å; L15-R19 WeakPolarHBondContact O-CG 3.29Å; L15-R19 PolarHBondContact O-N 2.99Å |
| 16 | L | 87 | Confident | 76.6 | Confident | 123 Ų | 123 | 111.2 Ų | 111.2 | 64% | 0.644 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -67.5 | -32.2 | 175.5 | -128.6 | 75.1 | 0 | 0 | 0 | 112.5 | L12 L13 T14 | L12-L16 PolarHBondContact O-N 3.33Å; L13-L16 PolarHBondContact O-N 3.38Å; T14-L16 VanDerWaalsContact C-N 3.34Å; T14-L16 PolarHBondContact O-N 2.85Å |
| 17 | S | 81.1 | Confident | 74 | Confident | 99 Ų | 99 | 110 Ų | 110 | 69% | 0.692 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -81.9 | -31.2 | 179.1 | -53.4 | 0 | 0 | 0 | 0 | 112.2 | L13 T14 L15 | L13-S17 WeakPolarHBondContact O-CB 3.41Å; L13-S17 PolarHBondContact O-N 3.07Å; L13-S17 PolarHBondContact O-OG 2.99Å; T14-S17 PolarHBondContact O-N 3.12Å; L15-S17 VanDerWaalsContact C-N 3.3Å |
| 18 | L | 82.4 | Confident | 71.9 | Confident | 126 Ų | 126 | 109.5 Ų | 109.5 | 66% | 0.66 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -79.5 | -16.9 | 174.6 | -97.6 | 69 | 0 | 0 | 0 | 113 | T14 P20 | T14-L18 HydrophobicContact CG2-CD1 4.02Å; T14-L18 WeakPolarHBondContact O-CB 3.35Å; T14-L18 WeakPolarHBondContact O-CD1 3.42Å; T14-L18 PolarHBondContact O-N 3.25Å; L18-P20 WeakPolarHBondContact O-CD 3.47Å; L18-P20 VanDerWaalsContact O-N 3.07Å |
| 19 | R | 74.8 | Confident | 69.5 | Low | 200 Ų | 200 | 112.8 Ų | 112.8 | 76% | 0.755 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -63.5 | 106.1 | 166.6 | -83.8 | -78.7 | -174.6 | 151.2 | 0.4 | 106.7 | L15 S21 | L15-R19 WeakPolarHBondContact O-CG 3.29Å; L15-R19 PolarHBondContact O-N 2.99Å; R19-S21 PolarHBondContact O-N 3.39Å |
| 20 | P | 57.5 | Low | 66.8 | Low | 103 Ų | 103 | 119.1 Ų | 119.1 | 67% | 0.669 | 69% | 0.685 | S | S | * | * | trans | -61.3 | 114.4 | 174.5 | -11.7 | 28.9 | 0 | 0 | 0 | 105 | L18 E22 | L18-P20 WeakPolarHBondContact O-CD 3.47Å; L18-P20 VanDerWaalsContact O-N 3.07Å; P20-E22 PolarHBondContact O-N 2.92Å | ||
| 21 | S | 51.8 | Low | 64.3 | Low | 106 Ų | 106 | 122.8 Ų | 122.8 | 74% | 0.741 | 70% | 0.702 | S | S | * | * | trans | -60.5 | 98.6 | 161.5 | -176.1 | 0 | 0 | 0 | 0 | 104.5 | R19 A23 | R19-S21 PolarHBondContact O-N 3.39Å; S21-A23 PolarHBondContact O-N 3.46Å | ||
| 22 | E | 51.2 | Low | 62.3 | Low | 182 Ų | 182 | 122.6 Ų | 122.6 | 85% | 0.85 | 71% | 0.707 | S | S | * | * | trans | -64.7 | 57.7 | 170.5 | -78.4 | -84.9 | 104.5 | 0 | 0 | 109 | P20 K24 | P20-E22 PolarHBondContact O-N 2.92Å; E22-K24 PolarHBondContact O-N 3.39Å | ||
| 23 | A | 49.3 | Very low | 59.4 | Low | 76 Ų | 76 | 128.8 Ų | 128.8 | 63% | 0.628 | 72% | 0.722 | S | S | * | * | trans | -83.5 | 91.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 106.1 | S21 | S21-A23 PolarHBondContact O-N 3.46Š| ||
| 24 | K | 40.6 | Very low | 56.6 | Low | 194 Ų | 194 | 129.8 Ų | 129.8 | 84% | 0.843 | 73% | 0.733 | S | S | * | * | trans | -22.9 | 112 | 164.7 | -164.9 | 94 | 175.9 | 179.2 | 0 | 112.4 | E22 G26 | E22-K24 PolarHBondContact O-N 3.39Å; K24-G26 PolarHBondContact O-N 2.82Å | ||
| 25 | P | 50.6 | Low | 55 | Low | 134 Ų | 134 | 131.5 Ų | 131.5 | 87% | 0.87 | 75% | 0.746 | S | S | * | * | trans | -79.7 | 99.4 | 169.1 | 4.7 | 11 | 0 | 0 | 0 | 108.1 | ||||
| 26 | G | 45.8 | Very low | 52.5 | Low | 67 Ų | 67 | 132.9 Ų | 132.9 | 69% | 0.691 | 76% | 0.761 | S | S | * | * | trans | -125.3 | 98 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | K24 | K24-G26 PolarHBondContact O-N 2.82Š| ||
| 27 | A | 40.6 | Very low | 49.6 | Very low | 92 Ų | 92 | 130.2 Ų | 130.2 | 76% | 0.76 | 76% | 0.763 | S | S | * | * | trans | 89 | 131.3 | 155.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 28 | P | 51.4 | Low | 47.3 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 69% | 0.688 | 77% | 0.771 | S | S | * | * | trans | -82.8 | 139.7 | 176.3 | 33.7 | -32.8 | 0 | 0 | 0 | 111.5 | K30 | P28-K30 PolarHBondContact O-N 3.33Å; P28-K30 VanDerWaalsContact O-N 3.15Å | ||
| 29 | P | 42.2 | Very low | 45 | Very low | 129 Ų | 129 | 135.9 Ų | 135.9 | 84% | 0.838 | 78% | 0.775 | S | S | * | * | trans | -77.7 | 103.9 | 168.4 | 28.8 | -29.6 | 0 | 0 | 0 | 110 | V31 | P29-V31 PolarHBondContact O-N 3.39Š| ||
| 30 | K | 37.2 | Very low | 43.1 | Very low | 200 Ų | 200 | 133.6 Ų | 133.6 | 87% | 0.87 | 78% | 0.777 | S | S | * | * | trans | -66.7 | 120.6 | 160.3 | -73.8 | 178.5 | 177.6 | 178 | 0 | 109.1 | P28 | P28-K30 PolarHBondContact O-N 3.33Å; P28-K30 VanDerWaalsContact O-N 3.15Å | ||
| 31 | V | 42.3 | Very low | 41.9 | Very low | 130 Ų | 130 | 133.4 Ų | 133.4 | 79% | 0.788 | 78% | 0.784 | S | S | * | * | trans | -66.7 | 167.6 | 154.6 | 179.3 | 0 | 0 | 0 | 0 | 108.1 | P29 | P29-V31 PolarHBondContact O-N 3.39Š| ||
| 32 | P | 53.1 | Low | 40.9 | Very low | 100 Ų | 100 | 135 Ų | 135 | 65% | 0.649 | 78% | 0.78 | S | S | * | * | cis | -127 | 164.3 | -25.1 | 27 | -8.1 | 0 | 0 | 0 | 114.1 | ||||
| 33 | R | 34.1 | Very low | 40.2 | Very low | 241 Ų | 241 | 132.1 Ų | 132.1 | 91% | 0.909 | 78% | 0.777 | S | S | * | * | trans | 164.8 | 139.9 | 132.8 | -90.2 | 177.1 | -167.6 | 118.9 | -1.9 | 112.5 | ||||
| 34 | T | 33.1 | Very low | 39.6 | Very low | 136 Ų | 136 | 136.3 Ų | 136.3 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -80.1 | -166.8 | -177.4 | 47.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 35 | P | 58.7 | Low | 39.4 | Very low | 114 Ų | 114 | 131.9 Ų | 131.9 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | -110.8 | 172.8 | -103.5 | 33.9 | -12.1 | 0 | 0 | 0 | 113.7 | |||||
| 36 | P | 38.1 | Very low | 38.8 | Very low | 133 Ų | 133 | 130.9 Ų | 130.9 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | -150.7 | 147.4 | 105.9 | 35 | -16.1 | 0 | 0 | 0 | 112.3 | |||||
| 37 | G | 26.8 | Very low | 38.1 | Very low | 66 Ų | 66 | 131.5 Ų | 131.5 | 68% | 0.68 | 79% | 0.793 | S | S | * | * | 119 | 131.3 | 68.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 38 | E | 32.3 | Very low | 37.8 | Very low | 186 Ų | 186 | 131.2 Ų | 131.2 | 87% | 0.869 | 80% | 0.799 | S | S | * | * | trans | 72.4 | 139.1 | 167.3 | -81.2 | 164.9 | 92.7 | 0 | 0 | 118.6 | ||||
| 39 | E | 33.3 | Very low | 36.9 | Very low | 159 Ų | 159 | 129.8 Ų | 129.8 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | cis | -165.4 | 139.3 | 1.6 | -161 | -165.7 | 72.1 | 0 | 0 | 108.3 | ||||
| 40 | L | 35.8 | Very low | 36.9 | Very low | 151 Ų | 151 | 133.2 Ų | 133.2 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | 27.9 | 114.1 | 144.3 | -159.2 | 73.8 | 0 | 0 | 0 | 121.5 | ||||
| 41 | A | 31.2 | Very low | 37.2 | Very low | 99 Ų | 99 | 133.6 Ų | 133.6 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -164.3 | 110.6 | 132.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 42 | E | 31.1 | Very low | 37.5 | Very low | 139 Ų | 139 | 136.8 Ų | 136.8 | 65% | 0.65 | 81% | 0.813 | S | S | * | * | trans | -63 | 155.1 | 167.1 | -140.3 | -165.7 | 77 | 0 | 0 | 110.9 | Q44 | E42-Q44 HydrophobicContact CG-CG 4.23Å; E42-Q44 WeakPolarHBondContact OE1-CG 3.34Å; E42-Q44 PolarHBondContact OE1-N 3.3Å; E42-Q44 VanDerWaalsContact OE1-N 3.08Å | ||
| 43 | P | 36 | Very low | 36.8 | Very low | 123 Ų | 123 | 135.3 Ų | 135.3 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | -138.3 | 130.6 | 94 | 25.9 | -7.9 | 0 | 0 | 0 | 113.7 | |||||
| 44 | Q | 37.8 | Very low | 37.1 | Very low | 163 Ų | 163 | 131 Ų | 131 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | -63.4 | 133.6 | 160.1 | -77.7 | -179.1 | -2.6 | 0 | 0 | 110.6 | E42 | E42-Q44 HydrophobicContact CG-CG 4.23Å; E42-Q44 WeakPolarHBondContact OE1-CG 3.34Å; E42-Q44 PolarHBondContact OE1-N 3.3Å; E42-Q44 VanDerWaalsContact OE1-N 3.08Å | ||
| 45 | A | 35.2 | Very low | 37.7 | Very low | 101 Ų | 101 | 134.6 Ų | 134.6 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | -134.6 | 124.9 | 152.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 46 | A | 38.7 | Very low | 36.7 | Very low | 114 Ų | 114 | 133.7 Ų | 133.7 | 94% | 0.942 | 82% | 0.818 | S | S | * | * | trans | -62.2 | 147.7 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 47 | G | 32.2 | Very low | 37.5 | Very low | 79 Ų | 79 | 133.8 Ų | 133.8 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | trans | -178 | 82.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 48 | G | 32.6 | Very low | 38.1 | Very low | 86 Ų | 86 | 134.3 Ų | 134.3 | 89% | 0.887 | 82% | 0.824 | S | S | * | * | trans | -65.9 | 169.5 | -170.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 49 | G | 34.1 | Very low | 39 | Very low | 76 Ų | 76 | 129.8 Ų | 129.8 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | trans | 147.9 | 65.3 | 167.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | K51 | G49-K51 PolarHBondContact O-N 3.01Š| ||
| 50 | Q | 41.1 | Very low | 39.7 | Very low | 201 Ų | 201 | 124.9 Ų | 124.9 | 94% | 0.939 | 82% | 0.819 | S | S | * | * | trans | -59.1 | 119.3 | 161 | -70.4 | 175.2 | 16.3 | 0 | 0 | 108.4 | ||||
| 51 | K | 43.5 | Very low | 40.4 | Very low | 208 Ų | 208 | 120.5 Ų | 120.5 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | trans | -121.5 | 93.2 | 157.4 | -126 | -173.1 | -177.6 | -175 | 0 | 109.4 | G49 | G49-K51 PolarHBondContact O-N 3.01Š| ||
| 52 | K | 48.1 | Very low | 41.6 | Very low | 197 Ų | 197 | 120.2 Ų | 120.2 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | trans | -38.2 | 131 | 153.6 | -178.5 | 179.3 | 179.1 | -172.6 | 0 | 110.4 | ||||
| 53 | G | 39.9 | Very low | 42.8 | Very low | 70 Ų | 70 | 119.1 Ų | 119.1 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | -170.9 | 107 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 54 | D | 40.4 | Very low | 43.9 | Very low | 149 Ų | 149 | 119.3 Ų | 119.3 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -47.6 | 158.4 | -169.6 | -67.8 | -89.9 | 0 | 0 | 0 | 119.4 | ||||
| 55 | K | 44.9 | Very low | 45.3 | Very low | 212 Ų | 212 | 119.8 Ų | 119.8 | 92% | 0.922 | 80% | 0.8 | S | S | * | * | trans | -45.1 | 143.7 | 176.1 | -85.1 | 177.2 | 165.7 | 179.5 | 0 | 114.5 | ||||
| 56 | A | 38.3 | Very low | 47.2 | Very low | 96 Ų | 96 | 116.3 Ų | 116.3 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | -138.3 | 142.9 | 140.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 57 | P | 54.7 | Low | 49.1 | Very low | 135 Ų | 135 | 114.8 Ų | 114.8 | 88% | 0.877 | 75% | 0.749 | S | S | * | * | trans | -89.4 | 155.4 | -172 | 37 | -32.4 | 0 | 0 | 0 | 111 | ||||
| 58 | G | 40 | Very low | 51.4 | Low | 77 Ų | 77 | 120.3 Ų | 120.3 | 79% | 0.794 | 75% | 0.745 | S | S | * | * | trans | 132.6 | 123.6 | 163.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 59 | G | 49.4 | Very low | 53.8 | Low | 90 Ų | 90 | 119.3 Ų | 119.3 | 93% | 0.928 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -61.9 | 157.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 60 | G | 48.8 | Very low | 56.1 | Low | 57 Ų | 57 | 124.1 Ų | 124.1 | 59% | 0.588 | 72% | 0.719 | S | S | * | * | trans | 135.4 | 3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | A62 | G60-A62 PolarHBondContact O-N 2.88Š| ||
| 61 | G | 51.3 | Low | 58.2 | Low | 59 Ų | 59 | 119.7 Ų | 119.7 | 61% | 0.608 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -76.9 | -6 | -165.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||
| 62 | A | 55.6 | Low | 60.2 | Low | 92 Ų | 92 | 113.7 Ų | 113.7 | 76% | 0.76 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -78.6 | -36 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113 | G60 | G60-A62 PolarHBondContact O-N 2.88Å |
| 63 | N | 55.6 | Low | 61.9 | Low | 117 Ų | 117 | 112.7 Ų | 112.7 | 63% | 0.626 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -79.8 | -39.7 | -177.9 | -99.2 | -73.1 | 0 | 0 | 0 | 112.9 | K65 G66 D67 | N63-K65 VanDerWaalsContact C-N 3.32Å; N63-K65 PolarHBondContact O-N 2.89Å; N63-G66 CarbonylContact O-C 3.59Å; N63-G66 WeakPolarHBondContact O-CA 3.46Å; N63-G66 PolarHBondContact O-N 3.33Å; N63-G66 VanDerWaalsContact O-N 3.09Å; N63-D67 WeakPolarHBondContact O-CB 3.29Å; N63-D67 PolarHBondContact O-N 3.03Å |
| 64 | L | 60.6 | Low | 63.9 | Low | 127 Ų | 127 | 114.6 Ų | 114.6 | 67% | 0.665 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -61.7 | -36 | -174.8 | -68.2 | 168.6 | 0 | 0 | 0 | 113.7 | R68 | L64-R68 WeakPolarHBondContact O-CB 3.29Å; L64-R68 PolarHBondContact O-N 2.82Å |
| 65 | K | 66.4 | Low | 66 | Low | 173 Ų | 173 | 112.6 Ų | 112.6 | 75% | 0.752 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -75.2 | -34.6 | 177.8 | -167.1 | 144.1 | 178.5 | 178.5 | 0 | 111.8 | N63 S69 | N63-K65 VanDerWaalsContact C-N 3.32Å; N63-K65 PolarHBondContact O-N 2.89Å; K65-S69 WeakPolarHBondContact O-CB 3.26Å; K65-S69 PolarHBondContact O-N 3.13Å; K65-S69 VanDerWaalsContact O-N 3.1Å; K65-S69 PolarHBondContact O-OG 2.94Å |
| 66 | G | 75.2 | Confident | 67.7 | Low | 27 Ų | 27 | 109.9 Ų | 109.9 | 28% | 0.278 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -64.9 | -51.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | N63 R68 S69 R70 | N63-G66 CarbonylContact O-C 3.59Å; N63-G66 WeakPolarHBondContact O-CA 3.46Å; N63-G66 PolarHBondContact O-N 3.33Å; N63-G66 VanDerWaalsContact O-N 3.09Å; G66-R68 PolarHBondContact O-N 3.13Å; G66-S69 PolarHBondContact O-N 3.35Å; G66-S69 VanDerWaalsContact O-N 3.1Å; G66-S69 PolarHBondContact O-OG 3.48Å; G66-R70 WeakPolarHBondContact O-CG 3.23Å; G66-R70 PolarHBondContact O-N 3.35Å |
| 67 | D | 78.2 | Confident | 69.9 | Low | 82 Ų | 82 | 109.9 Ų | 109.9 | 44% | 0.439 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -61.6 | -42.4 | 178.8 | -72.5 | -33.5 | 0 | 0 | 0 | 112.1 | N63 S69 R70 L71 | N63-D67 WeakPolarHBondContact O-CB 3.29Å; N63-D67 PolarHBondContact O-N 3.03Å; D67-S69 VanDerWaalsContact C-N 3.3Å; D67-S69 PolarHBondContact O-N 2.78Å; D67-R70 PolarHBondContact O-N 3.38Å; D67-L71 WeakPolarHBondContact O-CB 3.34Å; D67-L71 PolarHBondContact O-N 3.44Å |
| 68 | R | 80.9 | Confident | 71.2 | Confident | 195 Ų | 195 | 108 Ų | 108 | 74% | 0.736 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64.4 | -35.7 | 175.1 | -168.7 | 173.9 | -178.3 | 179.4 | 0.8 | 112.2 | L64 G66 L72 | L64-R68 WeakPolarHBondContact O-CB 3.29Å; L64-R68 PolarHBondContact O-N 2.82Å; G66-R68 PolarHBondContact O-N 3.13Å; R68-L72 VanDerWaalsContact O-CB 3.24Å; R68-L72 WeakPolarHBondContact O-CB 3.5Å; R68-L72 PolarHBondContact O-N 3.31Å |
| 69 | S | 81.9 | Confident | 73.2 | Confident | 65 Ų | 65 | 108.4 Ų | 108.4 | 46% | 0.455 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -70.3 | -35.9 | 175.9 | 75.7 | 0 | 0 | 0 | 0 | 112.4 | K65 G66 D67 R73 | K65-S69 WeakPolarHBondContact O-CB 3.26Å; K65-S69 PolarHBondContact O-N 3.13Å; K65-S69 VanDerWaalsContact O-N 3.1Å; K65-S69 PolarHBondContact O-OG 2.94Å; G66-S69 PolarHBondContact O-N 3.35Å; G66-S69 VanDerWaalsContact O-N 3.1Å; G66-S69 PolarHBondContact O-OG 3.48Å; D67-S69 VanDerWaalsContact C-N 3.3Å; D67-S69 PolarHBondContact O-N 2.78Å; S69-R73 WeakPolarHBondContact O-CG 3.47Å; S69-R73 PolarHBondContact O-N 3.3Å |
| 70 | R | 83.9 | Confident | 74.8 | Confident | 177 Ų | 177 | 111.9 Ų | 111.9 | 67% | 0.668 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.7 | -48.7 | 174.5 | -72.4 | 179.1 | 176.1 | -161 | -1.1 | 111.4 | G66 D67 L72 R73 D74 | G66-R70 WeakPolarHBondContact O-CG 3.23Å; G66-R70 PolarHBondContact O-N 3.35Å; D67-R70 PolarHBondContact O-N 3.38Å; R70-L72 VanDerWaalsContact C-N 3.27Å; R70-L72 PolarHBondContact O-N 2.99Å; R70-R73 CarbonylContact O-C 3.6Å; R70-R73 WeakPolarHBondContact O-CA 3.34Å; R70-R73 WeakPolarHBondContact O-CB 3.32Å; R70-R73 PolarHBondContact O-N 3.15Å; R70-D74 PolarHBondContact O-N 2.84Å |
| 71 | L | 85.4 | Confident | 76.5 | Confident | 108 Ų | 108 | 111.3 Ų | 111.3 | 57% | 0.565 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -55.2 | -45.5 | 174 | -161.1 | -167.1 | 0 | 0 | 0 | 110.7 | D67 R73 D74 L75 | D67-L71 WeakPolarHBondContact O-CB 3.34Å; D67-L71 PolarHBondContact O-N 3.44Å; L71-R73 VanDerWaalsContact C-N 3.27Å; L71-R73 PolarHBondContact O-N 3.23Å; L71-D74 PolarHBondContact O-N 3Å; L71-L75 HydrophobicContact CD2-CB 4.36Å; L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 PolarHBondContact O-N 2.94Å |
| 72 | L | 83.6 | Confident | 78 | Confident | 83 Ų | 83 | 117.5 Ų | 117.5 | 44% | 0.435 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -69.5 | -25.7 | -179.4 | -165.7 | 146.2 | 0 | 0 | 0 | 112.5 | R68 R70 R76 | R68-L72 VanDerWaalsContact O-CB 3.24Å; R68-L72 WeakPolarHBondContact O-CB 3.5Å; R68-L72 PolarHBondContact O-N 3.31Å; R70-L72 VanDerWaalsContact C-N 3.27Å; R70-L72 PolarHBondContact O-N 2.99Å; L72-R76 VanDerWaalsContact CD2-CZ 3.49Å; L72-R76 WeakPolarHBondContact O-CB 3.31Å; L72-R76 WeakPolarHBondContact O-CG 3.4Å; L72-R76 PolarHBondContact O-N 3.41Å |
| 73 | R | 84.2 | Confident | 79.3 | Confident | 176 Ų | 176 | 115.2 Ų | 115.2 | 66% | 0.664 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -73.1 | -44.8 | 169 | -64.1 | -125.9 | -167.5 | -158.3 | 3.9 | 111 | S69 R70 L71 R76 V77 | S69-R73 WeakPolarHBondContact O-CG 3.47Å; S69-R73 PolarHBondContact O-N 3.3Å; R70-R73 CarbonylContact O-C 3.6Å; R70-R73 WeakPolarHBondContact O-CA 3.34Å; R70-R73 WeakPolarHBondContact O-CB 3.32Å; R70-R73 PolarHBondContact O-N 3.15Å; L71-R73 VanDerWaalsContact C-N 3.27Å; L71-R73 PolarHBondContact O-N 3.23Å; R73-R76 CarbonylContact O-C 3.54Å; R73-R76 WeakPolarHBondContact O-CA 3.49Å; R73-R76 WeakPolarHBondContact O-CB 3.46Å; R73-R76 PolarHBondContact O-N 3.42Å; R73-R76 VanDerWaalsContact O-N 3.13Å; R73-V77 WeakPolarHBondContact O-CG2 3.41Å; R73-V77 PolarHBondContact O-N 3.46Å |
| 74 | D | 82.3 | Confident | 80.7 | Confident | 109 Ų | 109 | 112.3 Ų | 112.3 | 58% | 0.583 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -62.9 | -44.4 | -180 | -73 | -8.9 | 0 | 0 | 0 | 111.2 | R70 L71 R76 V77 D78 | R70-D74 PolarHBondContact O-N 2.84Å; L71-D74 PolarHBondContact O-N 3Å; D74-R76 VanDerWaalsContact C-N 3.28Å; D74-R76 PolarHBondContact O-N 3.08Å; D74-V77 PolarHBondContact O-N 3.05Å; D74-V77 VanDerWaalsContact O-N 3.13Å; D74-D78 VanDerWaalsContact O-CB 3.31Å; D74-D78 WeakPolarHBondContact O-CB 3.38Å; D74-D78 PolarHBondContact O-N 2.97Å |
| 75 | L | 84.6 | Confident | 81.6 | Confident | 107 Ų | 107 | 113.8 Ų | 113.8 | 56% | 0.56 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.9 | -35.6 | 174.9 | -169.6 | 64.2 | 0 | 0 | 0 | 111.9 | L71 T79 | L71-L75 HydrophobicContact CD2-CB 4.36Å; L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 PolarHBondContact O-N 2.94Å; L75-T79 WeakPolarHBondContact O-CB 3.35Å; L75-T79 VanDerWaalsContact O-CG2 3.26Å; L75-T79 WeakPolarHBondContact O-CG2 3.47Å; L75-T79 PolarHBondContact O-N 3Å |
| 76 | R | 80.1 | Confident | 82.3 | Confident | 156 Ų | 156 | 107.9 Ų | 107.9 | 59% | 0.589 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.2 | -34 | 173.8 | -84.3 | -164.4 | -98.6 | 171.1 | -12.1 | 113.1 | L72 R73 D74 T79 K80 | L72-R76 VanDerWaalsContact CD2-CZ 3.49Å; L72-R76 WeakPolarHBondContact O-CB 3.31Å; L72-R76 WeakPolarHBondContact O-CG 3.4Å; L72-R76 PolarHBondContact O-N 3.41Å; R73-R76 CarbonylContact O-C 3.54Å; R73-R76 WeakPolarHBondContact O-CA 3.49Å; R73-R76 WeakPolarHBondContact O-CB 3.46Å; R73-R76 PolarHBondContact O-N 3.42Å; R73-R76 VanDerWaalsContact O-N 3.13Å; D74-R76 VanDerWaalsContact C-N 3.28Å; D74-R76 PolarHBondContact O-N 3.08Å; R76-T79 VanDerWaalsContact O-CG2 3.29Å; R76-T79 WeakPolarHBondContact O-CG2 3.42Å; R76-K80 VanDerWaalsContact O-CB 3.29Å; R76-K80 WeakPolarHBondContact O-CB 3.34Å; R76-K80 PolarHBondContact O-N 3.32Å |
| 77 | V | 85.1 | Confident | 82.6 | Confident | 96 Ų | 96 | 115.4 Ų | 115.4 | 58% | 0.582 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -73.9 | -41.9 | 175.8 | 169.6 | 0 | 0 | 0 | 0 | 110.1 | R73 D74 K80 S81 | R73-V77 WeakPolarHBondContact O-CG2 3.41Å; R73-V77 PolarHBondContact O-N 3.46Å; D74-V77 PolarHBondContact O-N 3.05Å; D74-V77 VanDerWaalsContact O-N 3.13Å; V77-K80 PolarHBondContact O-N 2.92Å; V77-S81 WeakPolarHBondContact O-CB 3.14Å; V77-S81 PolarHBondContact O-N 2.85Å; V77-S81 PolarHBondContact O-OG 3Å |
| 78 | D | 81.1 | Confident | 82.6 | Confident | 95 Ų | 95 | 115.7 Ų | 115.7 | 51% | 0.508 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.7 | -45.7 | 178.6 | -172.5 | -99.6 | 0 | 0 | 0 | 112.1 | D74 K80 S81 R82 | D74-D78 VanDerWaalsContact O-CB 3.31Å; D74-D78 WeakPolarHBondContact O-CB 3.38Å; D74-D78 PolarHBondContact O-N 2.97Å; D78-K80 VanDerWaalsContact C-N 3.32Å; D78-K80 PolarHBondContact O-N 3.27Å; D78-S81 PolarHBondContact O-N 3.2Å; D78-S81 PolarHBondContact O-OG 3.37Å; D78-R82 VanDerWaalsContact O-CB 3.23Å; D78-R82 WeakPolarHBondContact O-CB 3.41Å; D78-R82 PolarHBondContact O-N 3.49Å |
| 79 | T | 81.9 | Confident | 82.4 | Confident | 86 Ų | 86 | 112.6 Ų | 112.6 | 53% | 0.528 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 175.2 | -173 | 0 | 0 | 0 | 0 | 112.2 | L75 R76 A83 | L75-T79 WeakPolarHBondContact O-CB 3.35Å; L75-T79 VanDerWaalsContact O-CG2 3.26Å; L75-T79 WeakPolarHBondContact O-CG2 3.47Å; L75-T79 PolarHBondContact O-N 3Å; R76-T79 VanDerWaalsContact O-CG2 3.29Å; R76-T79 WeakPolarHBondContact O-CG2 3.42Å; T79-A83 WeakPolarHBondContact O-CB 3.47Å; T79-A83 PolarHBondContact O-N 3.35Å |
| 80 | K | 84.3 | Confident | 81.7 | Confident | 162 Ų | 162 | 117.2 Ų | 117.2 | 70% | 0.704 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -71.1 | -39.7 | 179 | -173.7 | 170.4 | -179.4 | 177.1 | 0 | 111.9 | R76 V77 D78 A83 A84 | R76-K80 VanDerWaalsContact O-CB 3.29Å; R76-K80 WeakPolarHBondContact O-CB 3.34Å; R76-K80 PolarHBondContact O-N 3.32Å; V77-K80 PolarHBondContact O-N 2.92Å; D78-K80 VanDerWaalsContact C-N 3.32Å; D78-K80 PolarHBondContact O-N 3.27Å; K80-A83 PolarHBondContact O-N 3.04Å; K80-A84 WeakPolarHBondContact O-CB 3.43Å; K80-A84 PolarHBondContact O-N 2.71Å |
| 81 | S | 84.6 | Confident | 80.7 | Confident | 45 Ų | 45 | 115.9 Ų | 115.9 | 32% | 0.315 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.3 | -43.8 | 175.7 | 72.5 | 0 | 0 | 0 | 0 | 110.2 | V77 D78 A83 A84 W85 | V77-S81 WeakPolarHBondContact O-CB 3.14Å; V77-S81 PolarHBondContact O-N 2.85Å; V77-S81 PolarHBondContact O-OG 3Å; D78-S81 PolarHBondContact O-N 3.2Å; D78-S81 PolarHBondContact O-OG 3.37Å; S81-A83 VanDerWaalsContact C-N 3.33Å; S81-A83 PolarHBondContact O-N 3.3Å; S81-A84 PolarHBondContact O-N 2.98Å; S81-A84 VanDerWaalsContact O-N 3.12Å; S81-W85 PolarHBondContact O-N 2.93Å |
| 82 | R | 82.8 | Confident | 79.5 | Confident | 190 Ų | 190 | 117 Ų | 117 | 72% | 0.717 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -59.8 | -41.7 | 176 | -165 | 175.1 | -147.7 | -102.7 | 1 | 112.1 | D78 A86 | D78-R82 VanDerWaalsContact O-CB 3.23Å; D78-R82 WeakPolarHBondContact O-CB 3.41Å; D78-R82 PolarHBondContact O-N 3.49Å; R82-A86 WeakPolarHBondContact O-CB 3.48Å; R82-A86 PolarHBondContact O-N 3.03Å |
| 83 | A | 82.3 | Confident | 78.4 | Confident | 44 Ų | 44 | 117.3 Ų | 117.3 | 36% | 0.364 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.1 | -37.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T79 K80 S81 R87 | T79-A83 WeakPolarHBondContact O-CB 3.47Å; T79-A83 PolarHBondContact O-N 3.35Å; K80-A83 PolarHBondContact O-N 3.04Å; S81-A83 VanDerWaalsContact C-N 3.33Å; S81-A83 PolarHBondContact O-N 3.3Å; A83-R87 WeakPolarHBondContact O-CG 3.24Å; A83-R87 PolarHBondContact O-N 3.04Å |
| 84 | A | 85.4 | Confident | 77.1 | Confident | 55 Ų | 55 | 115.2 Ų | 115.2 | 46% | 0.455 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.7 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | K80 S81 R87 L88 | K80-A84 WeakPolarHBondContact O-CB 3.43Å; K80-A84 PolarHBondContact O-N 2.71Å; S81-A84 PolarHBondContact O-N 2.98Å; S81-A84 VanDerWaalsContact O-N 3.12Å; A84-R87 PolarHBondContact O-N 2.76Å; A84-L88 PolarHBondContact O-N 3.37Å |
| 85 | W | 78.6 | Confident | 75.9 | Confident | 159 Ų | 159 | 114.3 Ų | 114.3 | 60% | 0.602 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.8 | -39.5 | 174.8 | -77.9 | 113.6 | 0 | 0 | 0 | 112.4 | S81 R87 L88 L89 | S81-W85 PolarHBondContact O-N 2.93Å; W85-R87 VanDerWaalsContact C-N 3.29Å; W85-R87 PolarHBondContact O-N 3.19Å; W85-L88 HydrophobicContact CE3-CD2 3.8Å; W85-L88 HydrophobicContact CH2-CD2 4.48Å; W85-L88 HydrophobicContact CZ3-CD2 3.59Å; W85-L88 PolarHBondContact O-N 3.03Å; W85-L89 WeakPolarHBondContact O-CB 3.39Å; W85-L89 VanDerWaalsContact O-CG 3.29Å; W85-L89 WeakPolarHBondContact O-CG 3.44Å; W85-L89 PolarHBondContact O-N 2.88Å |
| 86 | A | 81.4 | Confident | 74.8 | Confident | 48 Ų | 48 | 120 Ų | 120 | 40% | 0.397 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -59.3 | -40.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | R82 H90 | R82-A86 WeakPolarHBondContact O-CB 3.48Å; R82-A86 PolarHBondContact O-N 3.03Å; A86-H90 WeakPolarHBondContact O-CB 3.41Å; A86-H90 PolarHBondContact O-CD2 2.92Å; A86-H90 PolarHBondContact O-N 2.85Å |
| 87 | R | 81.1 | Confident | 73.7 | Confident | 186 Ų | 186 | 121.6 Ų | 121.6 | 70% | 0.702 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -66.2 | -46.5 | 174.7 | -67.7 | 173.8 | -169.1 | 169.1 | 1.8 | 111.7 | A83 A84 W85 L89 H90 E91 | A83-R87 WeakPolarHBondContact O-CG 3.24Å; A83-R87 PolarHBondContact O-N 3.04Å; A84-R87 PolarHBondContact O-N 2.76Å; W85-R87 VanDerWaalsContact C-N 3.29Å; W85-R87 PolarHBondContact O-N 3.19Å; R87-L89 VanDerWaalsContact C-N 3.27Å; R87-L89 PolarHBondContact O-N 3.44Å; R87-H90 CarbonylContact O-C 3.55Å; R87-H90 PolarHBondContact O-N 3.4Å; R87-H90 VanDerWaalsContact O-N 3.16Å; R87-E91 WeakPolarHBondContact O-CB 3.36Å; R87-E91 PolarHBondContact O-N 3Å |
| 88 | L | 79.2 | Confident | 72.3 | Confident | 88 Ų | 88 | 127.3 Ų | 127.3 | 46% | 0.461 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -60.2 | -38.2 | 179.2 | -176.5 | 63.3 | 0 | 0 | 0 | 112.5 | A84 W85 | A84-L88 PolarHBondContact O-N 3.37Å; W85-L88 HydrophobicContact CE3-CD2 3.8Å; W85-L88 HydrophobicContact CH2-CD2 4.48Å; W85-L88 HydrophobicContact CZ3-CD2 3.59Å; W85-L88 PolarHBondContact O-N 3.03Å |
| 89 | L | 76.3 | Confident | 71 | Confident | 130 Ų | 130 | 132 Ų | 132 | 68% | 0.681 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -73.7 | -35.4 | 176.8 | -67.2 | 173.8 | 0 | 0 | 0 | 112.3 | W85 R87 E91 | W85-L89 WeakPolarHBondContact O-CB 3.39Å; W85-L89 VanDerWaalsContact O-CG 3.29Å; W85-L89 WeakPolarHBondContact O-CG 3.44Å; W85-L89 PolarHBondContact O-N 2.88Å; R87-L89 VanDerWaalsContact C-N 3.27Å; R87-L89 PolarHBondContact O-N 3.44Å; L89-E91 VanDerWaalsContact C-N 3.34Å |
| 90 | H | 68.3 | Low | 69.7 | Low | 161 Ų | 161 | 130.6 Ų | 130.6 | 75% | 0.745 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -74.5 | -21.3 | 173.7 | -92.9 | -80.4 | 0 | 0 | 0 | 113.9 | A86 R87 H92 P93 | A86-H90 WeakPolarHBondContact O-CB 3.41Å; A86-H90 PolarHBondContact O-CD2 2.92Å; A86-H90 PolarHBondContact O-N 2.85Å; R87-H90 CarbonylContact O-C 3.55Å; R87-H90 PolarHBondContact O-N 3.4Å; R87-H90 VanDerWaalsContact O-N 3.16Å; H90-H92 VanDerWaalsContact C-N 3.28Å; H90-P93 WeakPolarHBondContact O-CD 3.38Å |
| 91 | E | 61.5 | Low | 68.4 | Low | 150 Ų | 150 | 127.8 Ų | 127.8 | 70% | 0.701 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -75.5 | -16.7 | 177.6 | -157.5 | 79.2 | 158.4 | 0 | 0 | 112.2 | R87 L89 P93 | R87-E91 WeakPolarHBondContact O-CB 3.36Å; R87-E91 PolarHBondContact O-N 3Å; L89-E91 VanDerWaalsContact C-N 3.34Å; E91-P93 VanDerWaalsContact O-CD 3.26Å; E91-P93 WeakPolarHBondContact O-CD 3.45Å |
| 92 | H | 61 | Low | 67.2 | Low | 131 Ų | 131 | 131.4 Ų | 131.4 | 61% | 0.606 | 66% | 0.662 | S | S | * | * | trans | -114.1 | 52.2 | 179.7 | -75.9 | -75.8 | 0 | 0 | 0 | 115.5 | H90 N94 | H90-H92 VanDerWaalsContact C-N 3.28Å; H92-N94 PolarHBondContact O-N 2.91Å; H92-N94 VanDerWaalsContact O-N 3.11Å | ||
| 93 | P | 60.3 | Low | 66.2 | Low | 89 Ų | 89 | 131.9 Ų | 131.9 | 58% | 0.578 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | -6.9 | 173.2 | 29.2 | -28.5 | 0 | 0 | 0 | 112.5 | H90 E91 | H90-P93 WeakPolarHBondContact O-CD 3.38Å; E91-P93 VanDerWaalsContact O-CD 3.26Å; E91-P93 WeakPolarHBondContact O-CD 3.45Å |
| 94 | N | 57.3 | Low | 65.2 | Low | 132 Ų | 132 | 139 Ų | 139 | 71% | 0.706 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.1 | 32.2 | -164.1 | -74.8 | -51.3 | 0 | 0 | 0 | 116.1 | H92 R96 | H92-N94 PolarHBondContact O-N 2.91Å; H92-N94 VanDerWaalsContact O-N 3.11Å; N94-R96 PolarHBondContact O-N 3.24Å |
| 95 | A | 56.9 | Low | 64 | Low | 90 Ų | 90 | 139.7 Ų | 139.7 | 74% | 0.744 | 71% | 0.705 | S | S | * | * | trans | -66.9 | 5.8 | 161.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K97 | A95-K97 PolarHBondContact O-N 2.65Å; A95-K97 VanDerWaalsContact O-N 3.08Å | ||
| 96 | R | 60.8 | Low | 62.9 | Low | 226 Ų | 226 | 140 Ų | 140 | 85% | 0.853 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | 34.5 | -175.7 | -145.8 | -172.9 | -82 | 167.5 | -6.4 | 113.8 | N94 | N94-R96 PolarHBondContact O-N 3.24Š|
| 97 | K | 57.6 | Low | 61.7 | Low | 190 Ų | 190 | 142.3 Ų | 142.3 | 83% | 0.826 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.1 | 39.5 | 173 | -64.9 | -165.7 | -176.3 | -179.2 | 0 | 113.6 | A95 K99 | A95-K97 PolarHBondContact O-N 2.65Å; A95-K97 VanDerWaalsContact O-N 3.08Å; K97-K99 PolarHBondContact O-N 3.44Å |
| 98 | Y | 55.8 | Low | 60.6 | Low | 216 Ų | 216 | 144.1 Ų | 144.1 | 85% | 0.847 | 74% | 0.744 | S | S | * | * | trans | -77.9 | 67.5 | 144.9 | -164.2 | -102.7 | 0 | 0 | 0 | 107.9 | G100 | Y98-G100 PolarHBondContact O-N 3.1Å; Y98-G100 VanDerWaalsContact O-N 3.09Å | ||
| 99 | K | 53.1 | Low | 59.6 | Low | 193 Ų | 193 | 142.8 Ų | 142.8 | 84% | 0.839 | 75% | 0.752 | S | S | * | * | trans | -68.9 | 106.7 | 173.9 | -173.7 | 177.6 | -178.1 | -170.1 | 0 | 105.7 | K97 A101 | K97-K99 PolarHBondContact O-N 3.44Å; K99-A101 PolarHBondContact O-N 3.1Å; K99-A101 VanDerWaalsContact O-N 3.11Å | ||
| 100 | G | 55.7 | Low | 58.7 | Low | 57 Ų | 57 | 138.5 Ų | 138.5 | 59% | 0.588 | 73% | 0.732 | S | S | * | * | trans | -42.1 | 117.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y98 N102 | Y98-G100 PolarHBondContact O-N 3.1Å; Y98-G100 VanDerWaalsContact O-N 3.09Å; G100-N102 PolarHBondContact O-N 3.39Å | ||
| 101 | A | 56.3 | Low | 58.3 | Low | 103 Ų | 103 | 137.1 Ų | 137.1 | 85% | 0.851 | 72% | 0.724 | S | S | * | * | trans | -72.6 | 58.7 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109 | K99 | K99-A101 PolarHBondContact O-N 3.1Å; K99-A101 VanDerWaalsContact O-N 3.11Å | ||
| 102 | N | 59.9 | Low | 58.2 | Low | 121 Ų | 121 | 133.3 Ų | 133.3 | 65% | 0.647 | 73% | 0.725 | S | S | * | * | trans | -94.4 | 89.3 | 158.3 | -175.4 | 4.6 | 0 | 0 | 0 | 106.9 | G100 K104 | G100-N102 PolarHBondContact O-N 3.39Å; N102-K104 PolarHBondContact OD1-N 3.44Å | ||
| 103 | K | 60.7 | Low | 58 | Low | 201 Ų | 201 | 133.4 Ų | 133.4 | 87% | 0.874 | 73% | 0.73 | S | S | * | * | trans | -111.2 | 67.5 | 155.6 | -73.4 | -161.6 | 178.5 | -166.5 | 0 | 108.4 | ||||
| 104 | K | 61.6 | Low | 57.9 | Low | 193 Ų | 193 | 139.4 Ų | 139.4 | 84% | 0.839 | 75% | 0.746 | S | S | * | * | trans | -77.1 | 112 | 152.2 | -72.8 | -173.7 | 178.6 | -173.2 | 0 | 107.8 | N102 | N102-K104 PolarHBondContact OD1-N 3.44Š| ||
| 105 | G | 60 | Low | 57.9 | Low | 70 Ų | 70 | 138.9 Ų | 138.9 | 72% | 0.722 | 74% | 0.743 | S | S | * | * | trans | 86.7 | 100.5 | 151.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 106 | L | 55.7 | Low | 58 | Low | 166 Ų | 166 | 141.7 Ų | 141.7 | 87% | 0.869 | 75% | 0.745 | S | S | * | * | trans | -163 | 76.7 | 134.1 | -152.5 | 67.4 | 0 | 0 | 0 | 107.6 | ||||
| 107 | S | 56.8 | Low | 58 | Low | 96 Ų | 96 | 138.5 Ų | 138.5 | 67% | 0.671 | 73% | 0.733 | S | S | * | * | 48 | 106.7 | 104.1 | 67.4 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 108 | K | 58.6 | Low | 58.1 | Low | 223 Ų | 223 | 137.4 Ų | 137.4 | 97% | 0.97 | 74% | 0.735 | S | S | * | * | trans | 45.2 | 85 | 159.3 | -73.5 | 174.3 | 173.5 | 175.6 | 0 | 115.4 | ||||
| 109 | G | 56.8 | Low | 58.1 | Low | 61 Ų | 61 | 130.7 Ų | 130.7 | 63% | 0.629 | 73% | 0.732 | S | S | * | * | trans | -156.4 | 100 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | F111 | G109-F111 PolarHBondContact O-N 3Å; G109-F111 VanDerWaalsContact O-N 3.09Å | ||
| 110 | C | 59.2 | Low | 58.2 | Low | 40 Ų | 40 | 125.6 Ų | 125.6 | 27% | 0.27 | 72% | 0.72 | S | S | . | * | S | Bend | trans | -46.3 | -23.7 | 170.2 | 174.4 | 0 | 0 | 0 | 0 | 117.5 | L124 G125 C126 | C110-L124 PolarHBondContact SG-O 3.15Å; C110-L124 VanDerWaalsContact SG-O 3.32Å; C110-G125 WeakPolarHBondContact SG-CA 3.03Å; C110-C126 HydrophobicContact CB-CB 3.72Å; C110-C126 WeakPolarHBondContact CB-SG 3.49Å; C110-C126 WeakPolarHBondContact SG-CA 3.44Å; C110-C126 PolarHBondContact SG-N 3.46Å |
| 111 | F | 59.9 | Low | 58.1 | Low | 131 Ų | 131 | 131.8 Ų | 131.8 | 58% | 0.575 | 74% | 0.736 | S | S | * | * | trans | -143.4 | 82.7 | -176.6 | -79.2 | -76.8 | 0 | 0 | 0 | 108.1 | G109 S122 L124 | G109-F111 PolarHBondContact O-N 3Å; G109-F111 VanDerWaalsContact O-N 3.09Å; F111-S122 VanDerWaalsContact CE1-O 3.24Å; F111-S122 WeakPolarHBondContact CE1-O 3.41Å; F111-S122 WeakPolarHBondContact CZ-O 3.38Å; F111-L124 VanDerWaalsContact CE1-O 3.31Å; F111-L124 WeakPolarHBondContact CE1-O 3.43Å; F111-L124 WeakPolarHBondContact CE2-O 3.2Å; F111-L124 WeakPolarHBondContact CZ-O 3.47Å | ||
| 112 | G | 58.8 | Low | 58 | Low | 70 Ų | 70 | 129 Ų | 129 | 72% | 0.722 | 71% | 0.711 | S | S | * | * | trans | -96.4 | 0.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 113 | L | 57.1 | Low | 58 | Low | 134 Ų | 134 | 126.9 Ų | 126.9 | 70% | 0.702 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -151.5 | 115.3 | 175.5 | -154.6 | 67.5 | 0 | 0 | 0 | 109.4 | L115 | L113-L115 HydrophobicContact CD2-CD2 4.31Å; L113-L115 PolarHBondContact O-N 2.79Å |
| 114 | K | 57.1 | Low | 57.7 | Low | 214 Ų | 214 | 123.3 Ų | 123.3 | 93% | 0.93 | 71% | 0.707 | S | S | * | * | trans | -60.6 | 82.8 | 170.8 | -147.3 | 177.2 | -169.6 | 174.9 | 0 | 107.4 | D116 | K114-D116 PolarHBondContact O-N 3.28Å; K114-D116 VanDerWaalsContact O-N 3.12Å | ||
| 115 | L | 58 | Low | 57.2 | Low | 121 Ų | 121 | 116.6 Ų | 116.6 | 63% | 0.634 | 69% | 0.693 | S | S | * | * | trans | -70.7 | 104.8 | 168.7 | -70.1 | 179.1 | 0 | 0 | 0 | 105 | L113 R117 | L113-L115 HydrophobicContact CD2-CD2 4.31Å; L113-L115 PolarHBondContact O-N 2.79Å; L115-R117 PolarHBondContact O-N 2.71Å | ||
| 116 | D | 58.3 | Low | 56.8 | Low | 149 Ų | 149 | 121.3 Ų | 121.3 | 80% | 0.797 | 71% | 0.712 | S | S | * | * | trans | -63.2 | 78.9 | 166.6 | -171.9 | 53.1 | 0 | 0 | 0 | 107.9 | K114 | K114-D116 PolarHBondContact O-N 3.28Å; K114-D116 VanDerWaalsContact O-N 3.12Å | ||
| 117 | R | 61 | Low | 56.9 | Low | 159 Ų | 159 | 119.1 Ų | 119.1 | 60% | 0.6 | 71% | 0.705 | S | S | * | * | trans | -82.6 | 108.9 | 163.2 | -81.2 | -167.4 | 172.7 | 178.2 | -0.3 | 105.8 | L115 G119 | L115-R117 PolarHBondContact O-N 2.71Å; R117-G119 VanDerWaalsContact C-N 3.32Å; R117-G119 PolarHBondContact O-N 2.85Å | ||
| 118 | I | 59.5 | Low | 56.9 | Low | 167 Ų | 167 | 120.3 Ų | 120.3 | 86% | 0.856 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.8 | 104.7 | 154.5 | -66.4 | 165.3 | 0 | 0 | 0 | 106.6 | ||
| 119 | G | 56 | Low | 56.8 | Low | 76 Ų | 76 | 114.6 Ų | 114.6 | 78% | 0.784 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 104.8 | 0.5 | 158.6 | 0 | 0 | 0 | 0 | 0 | 120.5 | R117 | R117-G119 VanDerWaalsContact C-N 3.32Å; R117-G119 PolarHBondContact O-N 2.85Å |
| 120 | S | 54.9 | Low | 56.8 | Low | 86 Ų | 86 | 117.7 Ų | 117.7 | 60% | 0.601 | 70% | 0.695 | S | S | * | * | trans | -160 | 120.9 | 169.9 | -142.8 | 0 | 0 | 0 | 0 | 113.9 | S122 | S120-S122 PolarHBondContact O-N 3.24Š| ||
| 121 | M | 53.3 | Low | 56.6 | Low | 187 Ų | 187 | 122.6 Ų | 122.6 | 92% | 0.921 | 72% | 0.722 | S | S | * | * | trans | -61.4 | 102.6 | 170.6 | -65 | 176.5 | 63.5 | 0 | 0 | 108.6 | G123 | M121-G123 PolarHBondContact O-N 3.09Š| ||
| 122 | S | 55.2 | Low | 56.4 | Low | 45 Ų | 45 | 122 Ų | 122 | 32% | 0.315 | 73% | 0.732 | S | S | . | * | trans | -69.8 | 98.9 | 171.4 | 54.3 | 0 | 0 | 0 | 0 | 108.2 | F111 S120 L124 | F111-S122 VanDerWaalsContact CE1-O 3.24Å; F111-S122 WeakPolarHBondContact CE1-O 3.41Å; F111-S122 WeakPolarHBondContact CZ-O 3.38Å; S120-S122 PolarHBondContact O-N 3.24Å; S122-L124 PolarHBondContact O-N 3.3Å | ||
| 123 | G | 59.5 | Low | 56.2 | Low | 76 Ų | 76 | 125.7 Ų | 125.7 | 78% | 0.784 | 73% | 0.732 | S | S | * | * | trans | -69.5 | 60.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | M121 G125 | M121-G123 PolarHBondContact O-N 3.09Å; G123-G125 PolarHBondContact O-N 3.19Å | ||
| 124 | L | 54.7 | Low | 56.2 | Low | 126 Ų | 126 | 125.1 Ų | 125.1 | 66% | 0.66 | 74% | 0.735 | S | S | * | * | trans | -94.8 | 88.1 | 168.7 | -93.8 | 123.5 | 0 | 0 | 0 | 109.7 | C110 F111 S122 | C110-L124 PolarHBondContact SG-O 3.15Å; C110-L124 VanDerWaalsContact SG-O 3.32Å; F111-L124 VanDerWaalsContact CE1-O 3.31Å; F111-L124 WeakPolarHBondContact CE1-O 3.43Å; F111-L124 WeakPolarHBondContact CE2-O 3.2Å; F111-L124 WeakPolarHBondContact CZ-O 3.47Å; S122-L124 PolarHBondContact O-N 3.3Å | ||
| 125 | G | 51.3 | Low | 56.1 | Low | 52 Ų | 52 | 117.7 Ų | 117.7 | 54% | 0.536 | 72% | 0.718 | S | S | . | * | trans | -45 | 170.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | C110 G123 | C110-G125 WeakPolarHBondContact SG-CA 3.03Å; G123-G125 PolarHBondContact O-N 3.19Å | ||
| 126 | C | 51.5 | Low | 55.9 | Low | 168 Ų | 168 | 117.4 Ų | 117.4 | 100% | 1.135 | 73% | 0.726 | S | S | * | * | trans | -44.9 | 0 | -149.9 | -49.7 | 0 | 0 | 0 | 0 | 120.4 | C110 | C110-C126 HydrophobicContact CB-CB 3.72Å; C110-C126 WeakPolarHBondContact CB-SG 3.49Å; C110-C126 WeakPolarHBondContact SG-CA 3.44Å; C110-C126 PolarHBondContact SG-N 3.46Å |
Retrieved 126 of 126 residues in 414.8 ms
(Link to these results)