| 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 | Low | 63.8 | Low | 228 Ų | 228 | 146.4 Ų | 146.4 | 100% | 1.123 | 80% | 0.798 | S | S | * | * | 0 | 128.4 | 0 | -72.3 | -168.3 | 160 | 0 | 0 | 108.6 | |||||
| 2 | P | 53.4 | Low | 64.7 | Low | 132 Ų | 132 | 151.3 Ų | 151.3 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | trans | -86.3 | 128.5 | 175.9 | 33.3 | -26.7 | 0 | 0 | 0 | 109.4 | ||||
| 3 | L | 58.8 | Low | 65.6 | Low | 140 Ų | 140 | 149.6 Ų | 149.6 | 73% | 0.733 | 81% | 0.805 | S | S | * | * | trans | -124.8 | 109.9 | 175.5 | -72.1 | 173.2 | 0 | 0 | 0 | 108 | ||||
| 4 | F | 60.7 | Low | 66.4 | Low | 200 Ų | 200 | 146.6 Ų | 146.6 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | S | Bend | trans | 82.2 | 101.5 | 167.2 | -49.6 | -71.9 | 0 | 0 | 0 | 118.9 | ||
| 5 | G | 58.3 | Low | 66.8 | Low | 69 Ų | 69 | 145.1 Ų | 145.1 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | 94.4 | 73.4 | 126.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | T7 | G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 2.79Å; G5-T7 VanDerWaalsContact O-N 3.09Å | |||
| 6 | N | 60.7 | Low | 67.3 | Low | 164 Ų | 164 | 150.2 Ų | 150.2 | 88% | 0.877 | 80% | 0.802 | S | S | * | * | trans | -72.5 | 94.3 | 151.2 | -171.2 | 25.5 | 0 | 0 | 0 | 107.6 | F8 | N6-F8 PolarHBondContact O-N 3.31Š| ||
| 7 | T | 65.4 | Low | 67.2 | Low | 115 Ų | 115 | 154.3 Ų | 154.3 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | trans | -66.7 | 99.7 | 172 | 3.5 | 0 | 0 | 0 | 0 | 107.6 | G5 S9 | G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 2.79Å; G5-T7 VanDerWaalsContact O-N 3.09Å; T7-S9 VanDerWaalsContact C-N 3.33Å; T7-S9 PolarHBondContact O-N 3.3Å; T7-S9 PolarHBondContact O-OG 3.31Å | ||
| 8 | F | 72.1 | Confident | 67 | Low | 177 Ų | 177 | 150.6 Ų | 150.6 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -49.4 | 101.5 | 167.3 | 179.8 | -109.4 | 0 | 0 | 0 | 108.3 | N6 P10 | N6-F8 PolarHBondContact O-N 3.31Å; F8-P10 HydrophobicContact CD1-CG 3.93Å; F8-P10 HydrophobicContact CE1-CB 3.94Å; F8-P10 HydrophobicContact CE1-CG 3.49Å; F8-P10 VanDerWaalsContact CE1-CG 3.49Å; F8-P10 HydrophobicContact CE2-CB 4.4Å; F8-P10 HydrophobicContact CZ-CB 3.82Å; F8-P10 HydrophobicContact CZ-CG 3.93Å; F8-P10 WeakPolarHBondContact O-CD 3.33Å | ||
| 9 | S | 71.3 | Confident | 66.6 | Low | 100 Ų | 100 | 146.8 Ų | 146.8 | 70% | 0.699 | 79% | 0.792 | S | S | * | * | trans | -117.3 | 69.6 | -177 | 33.2 | 0 | 0 | 0 | 0 | 107.1 | T7 K11 | T7-S9 VanDerWaalsContact C-N 3.33Å; T7-S9 PolarHBondContact O-N 3.3Å; T7-S9 PolarHBondContact O-OG 3.31Å; S9-K11 PolarHBondContact O-N 3.48Å | ||
| 10 | P | 75.3 | Confident | 66.5 | Low | 83 Ų | 83 | 143.5 Ų | 143.5 | 54% | 0.539 | 78% | 0.78 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 130.7 | -178 | 26 | -33.8 | 0 | 0 | 0 | 108.3 | F8 K12 | F8-P10 HydrophobicContact CD1-CG 3.93Å; F8-P10 HydrophobicContact CE1-CB 3.94Å; F8-P10 HydrophobicContact CE1-CG 3.49Å; F8-P10 VanDerWaalsContact CE1-CG 3.49Å; F8-P10 HydrophobicContact CE2-CB 4.4Å; F8-P10 HydrophobicContact CZ-CB 3.82Å; F8-P10 HydrophobicContact CZ-CG 3.93Å; F8-P10 WeakPolarHBondContact O-CD 3.33Å; P10-K12 PolarHBondContact O-N 2.95Å |
| 11 | K | 76.3 | Confident | 66.1 | Low | 202 Ų | 202 | 144.8 Ų | 144.8 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 138.4 | 177 | -64.9 | -175.8 | 179.2 | -178.8 | 0 | 108.9 | S9 T13 | S9-K11 PolarHBondContact O-N 3.48Å; K11-T13 PolarHBondContact O-N 3.49Å; K11-T13 VanDerWaalsContact O-N 3.09Å |
| 12 | K | 73.9 | Confident | 66.9 | Low | 205 Ų | 205 | 136.1 Ų | 136.1 | 89% | 0.891 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 121 | 175.3 | -70.8 | -82.6 | -176.3 | 173.8 | 0 | 108.3 | P10 | P10-K12 PolarHBondContact O-N 2.95Š|
| 13 | T | 76.4 | Confident | 67.6 | Low | 130 Ų | 130 | 135.3 Ų | 135.3 | 80% | 0.798 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 130.5 | 179.1 | 33.5 | 0 | 0 | 0 | 0 | 108.9 | K11 | K11-T13 PolarHBondContact O-N 3.49Å; K11-T13 VanDerWaalsContact O-N 3.09Å |
| 14 | P | 77.1 | Confident | 68.2 | Low | 108 Ų | 108 | 132.5 Ų | 132.5 | 70% | 0.701 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 146.1 | 177.7 | -22.9 | 31.8 | 0 | 0 | 0 | 110.6 | R16 | P14-R16 PolarHBondContact O-N 3.29Š|
| 15 | P | 72.8 | Confident | 68.7 | Low | 124 Ų | 124 | 130.2 Ų | 130.2 | 81% | 0.805 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 127.6 | 172.5 | -22 | 31.4 | 0 | 0 | 0 | 109.4 | K17 | P15-K17 PolarHBondContact O-N 2.95Š|
| 16 | R | 74.1 | Confident | 69.7 | Low | 226 Ų | 226 | 133.4 Ų | 133.4 | 85% | 0.853 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 126.4 | 175.2 | -70.8 | -176 | -173.5 | 169.3 | 2.1 | 107.9 | P14 S18 | P14-R16 PolarHBondContact O-N 3.29Å; R16-S18 PolarHBondContact O-N 3.33Å |
| 17 | K | 66 | Low | 70.6 | Confident | 220 Ų | 220 | 128.6 Ų | 128.6 | 96% | 0.957 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -67 | -15.3 | 179 | -64.9 | -172.2 | -179 | -176.7 | 0 | 113.3 | P15 | P15-K17 PolarHBondContact O-N 2.95Š|
| 18 | S | 62.9 | Low | 71.7 | Confident | 88 Ų | 88 | 127 Ų | 127 | 62% | 0.615 | 67% | 0.674 | S | S | * | * | trans | -109.7 | 105.2 | 169.2 | 47.1 | 0 | 0 | 0 | 0 | 109 | R16 | R16-S18 PolarHBondContact O-N 3.33Š| ||
| 19 | A | 60.9 | Low | 72.3 | Confident | 78 Ų | 78 | 127.6 Ų | 127.6 | 65% | 0.645 | 67% | 0.671 | S | S | * | * | trans | -57.8 | 155 | 146.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | L21 | A19-L21 PolarHBondContact O-N 3.49Š| ||
| 20 | S | 63.6 | Low | 73 | Confident | 80 Ų | 80 | 125.8 Ų | 125.8 | 56% | 0.559 | 66% | 0.659 | S | S | * | * | trans | -27.2 | 136.3 | 171.7 | 178.5 | 0 | 0 | 0 | 0 | 112.7 | S22 | S20-S22 VanDerWaalsContact CB-OG 3.31Å; S20-S22 WeakPolarHBondContact CB-OG 3.38Å; S20-S22 CarbonylContact O-C 3.59Å; S20-S22 PolarHBondContact O-N 2.94Å; S20-S22 VanDerWaalsContact OG-CB 3.28Å; S20-S22 WeakPolarHBondContact OG-CB 3.47Å; S20-S22 PolarHBondContact OG-N 3.32Å; S20-S22 VanDerWaalsContact OG-N 3.11Å; S20-S22 PolarHBondContact OG-OG 3.06Å | ||
| 21 | L | 59 | Low | 73.4 | Confident | 172 Ų | 172 | 123.8 Ų | 123.8 | 90% | 0.901 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -57.2 | -6.4 | 169.6 | -66.9 | -179.7 | 0 | 0 | 0 | 112.5 | A19 N23 | A19-L21 PolarHBondContact O-N 3.49Å; L21-N23 PolarHBondContact O-N 2.94Å; L21-N23 VanDerWaalsContact O-N 3.16Å |
| 22 | S | 65.5 | Low | 73.8 | Confident | 46 Ų | 46 | 120.2 Ų | 120.2 | 32% | 0.322 | 63% | 0.626 | S | S | . | * | trans | -68.2 | 107 | 166.1 | 75.1 | 0 | 0 | 0 | 0 | 110.6 | S20 L24 | S20-S22 VanDerWaalsContact CB-OG 3.31Å; S20-S22 WeakPolarHBondContact CB-OG 3.38Å; S20-S22 CarbonylContact O-C 3.59Å; S20-S22 PolarHBondContact O-N 2.94Å; S20-S22 VanDerWaalsContact OG-CB 3.28Å; S20-S22 WeakPolarHBondContact OG-CB 3.47Å; S20-S22 PolarHBondContact OG-N 3.32Å; S20-S22 VanDerWaalsContact OG-N 3.11Å; S20-S22 PolarHBondContact OG-OG 3.06Å; S22-L24 PolarHBondContact O-N 3.45Å | ||
| 23 | N | 68.5 | Low | 74.3 | Confident | 114 Ų | 114 | 114.9 Ų | 114.9 | 61% | 0.61 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -66.6 | 17 | 164.2 | -65.5 | -42.9 | 0 | 0 | 0 | 113.1 | L21 H25 L26 | L21-N23 PolarHBondContact O-N 2.94Å; L21-N23 VanDerWaalsContact O-N 3.16Å; N23-H25 PolarHBondContact O-N 3.44Å; N23-L26 HydrophobicContact CB-CD1 4.44Å; N23-L26 HydrophobicContact CB-CD2 4.37Å; N23-L26 WeakPolarHBondContact O-CB 3.47Å; N23-L26 PolarHBondContact O-N 3.45Å |
| 24 | L | 71.1 | Confident | 74.6 | Confident | 81 Ų | 81 | 114.5 Ų | 114.5 | 42% | 0.424 | 60% | 0.596 | S | S | . | * | G | 310 helix | trans | -57.2 | -31.8 | -179.1 | -121.9 | 107.3 | 0 | 0 | 0 | 113 | S22 L26 L27 L36 | S22-L24 PolarHBondContact O-N 3.45Å; L24-L26 VanDerWaalsContact C-N 3.28Å; L24-L27 PolarHBondContact O-N 3.19Å; L24-L36 HydrophobicContact CD1-CD1 3.97Å; L24-L36 HydrophobicContact CD2-CD1 3.53Å; L24-L36 HydrophobicContact CG-CD1 3.69Å |
| 25 | H | 70.9 | Confident | 74.7 | Confident | 152 Ų | 152 | 115 Ų | 115 | 70% | 0.704 | 59% | 0.589 | S | S | * | * | G | 310 helix | trans | -76.3 | -13.4 | 177.1 | -68.3 | -70.7 | 0 | 0 | 0 | 113.6 | N23 | N23-H25 PolarHBondContact O-N 3.44Š|
| 26 | L | 79.5 | Confident | 75.2 | Confident | 137 Ų | 137 | 113.7 Ų | 113.7 | 72% | 0.717 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -85.3 | -17 | 175.3 | -76.8 | 65 | 0 | 0 | 0 | 111.6 | N23 L24 | N23-L26 HydrophobicContact CB-CD1 4.44Å; N23-L26 HydrophobicContact CB-CD2 4.37Å; N23-L26 WeakPolarHBondContact O-CB 3.47Å; N23-L26 PolarHBondContact O-N 3.45Å; L24-L26 VanDerWaalsContact C-N 3.28Å |
| 27 | L | 81.2 | Confident | 75.6 | Confident | 62 Ų | 62 | 104 Ų | 104 | 33% | 0.325 | 55% | 0.545 | S | S | . | . | S | Bend | trans | -67.6 | 133.4 | 172.6 | -62.1 | 175.2 | 0 | 0 | 0 | 108.9 | L24 T31 R32 | L24-L27 PolarHBondContact O-N 3.19Å; L27-T31 HydrophobicContact CD2-CG2 4.13Å; L27-R32 HydrophobicContact CB-CB 4.45Å |
| 28 | D | 87.8 | Confident | 76.3 | Confident | 81 Ų | 81 | 101.4 Ų | 101.4 | 43% | 0.433 | 54% | 0.541 | S | S | . | . | trans | -65.5 | 161.3 | 171.2 | 73.8 | -60.8 | 0 | 0 | 0 | 110 | S30 T31 R32 | D28-S30 PolarHBondContact O-N 3.43Å; D28-S30 WeakPolarHBondContact OD2-CB 3.43Å; D28-S30 PolarHBondContact OD2-N 2.94Å; D28-S30 PolarHBondContact OD2-OG 3.02Å; D28-T31 PolarHBondContact O-N 3.39Å; D28-T31 WeakPolarHBondContact OD1-CB 3.42Å; D28-T31 PolarHBondContact OD1-OG1 3.39Å; D28-R32 PolarHBondContact O-N 3.11Å; D28-R32 VanDerWaalsContact O-N 3.09Å | ||
| 29 | R | 84.4 | Confident | 77.4 | Confident | 190 Ų | 190 | 105.7 Ų | 105.7 | 72% | 0.717 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -55.9 | -38.9 | -174.3 | -177.7 | 179.2 | 175 | -164.5 | -3.9 | 112.4 | E33 | R29-E33 IonicContact CZ-OE1 3.43Å; R29-E33 IonicContact NE-OE1 2.81Å; R29-E33 PolarHBondContact NE-OE1 3.31Å; R29-E33 IonicContact NH2-OE1 3.17Å; R29-E33 PolarHBondContact NH2-OE1 3.02Å; R29-E33 WeakPolarHBondContact O-CG 3.26Å; R29-E33 PolarHBondContact O-N 2.94Å; R29-E33 VanDerWaalsContact O-N 3.11Å |
| 30 | S | 85.7 | Confident | 78.2 | Confident | 63 Ų | 63 | 108.1 Ų | 108.1 | 44% | 0.441 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.4 | -47.7 | -175.1 | 75.6 | 0 | 0 | 0 | 0 | 111.9 | D28 R32 E33 I34 | D28-S30 PolarHBondContact O-N 3.43Å; D28-S30 WeakPolarHBondContact OD2-CB 3.43Å; D28-S30 PolarHBondContact OD2-N 2.94Å; D28-S30 PolarHBondContact OD2-OG 3.02Å; S30-R32 VanDerWaalsContact C-N 3.3Å; S30-R32 PolarHBondContact O-N 3.48Å; S30-E33 PolarHBondContact O-N 3.19Å; S30-I34 WeakPolarHBondContact O-CG1 3.46Å; S30-I34 PolarHBondContact O-N 3.44Å |
| 31 | T | 84.4 | Confident | 79.2 | Confident | 41 Ų | 41 | 106.8 Ų | 106.8 | 25% | 0.252 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.2 | -40.2 | 176.5 | -54.4 | 0 | 0 | 0 | 0 | 111.4 | L27 D28 E33 I34 E35 | L27-T31 HydrophobicContact CD2-CG2 4.13Å; D28-T31 PolarHBondContact O-N 3.39Å; D28-T31 WeakPolarHBondContact OD1-CB 3.42Å; D28-T31 PolarHBondContact OD1-OG1 3.39Å; T31-E33 PolarHBondContact O-N 2.99Å; T31-I34 PolarHBondContact O-N 2.99Å; T31-E35 HydrophobicContact CG2-CG 4.18Å; T31-E35 WeakPolarHBondContact O-CB 3.42Å; T31-E35 PolarHBondContact O-N 3.25Å |
| 32 | R | 84.6 | Confident | 80.5 | Confident | 127 Ų | 127 | 102.3 Ų | 102.3 | 48% | 0.479 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -40.3 | 177.8 | -162.6 | -175.6 | 86.5 | 175.8 | 6.5 | 112.7 | L27 D28 S30 L36 G37 | L27-R32 HydrophobicContact CB-CB 4.45Å; D28-R32 PolarHBondContact O-N 3.11Å; D28-R32 VanDerWaalsContact O-N 3.09Å; S30-R32 VanDerWaalsContact C-N 3.3Å; S30-R32 PolarHBondContact O-N 3.48Å; R32-L36 CarbonylContact O-C 3.41Å; R32-L36 WeakPolarHBondContact O-CA 3.49Å; R32-L36 WeakPolarHBondContact O-CB 3.4Å; R32-L36 PolarHBondContact O-N 3.26Å; R32-G37 PolarHBondContact O-N 3.1Å |
| 33 | E | 83.9 | Confident | 81.6 | Confident | 93 Ų | 93 | 101.9 Ų | 101.9 | 44% | 0.435 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.5 | -34.5 | 177.8 | -75.7 | 174.1 | -176.4 | 0 | 0 | 111.7 | R29 S30 T31 G37 | R29-E33 IonicContact CZ-OE1 3.43Å; R29-E33 IonicContact NE-OE1 2.81Å; R29-E33 PolarHBondContact NE-OE1 3.31Å; R29-E33 IonicContact NH2-OE1 3.17Å; R29-E33 PolarHBondContact NH2-OE1 3.02Å; R29-E33 WeakPolarHBondContact O-CG 3.26Å; R29-E33 PolarHBondContact O-N 2.94Å; R29-E33 VanDerWaalsContact O-N 3.11Å; S30-E33 PolarHBondContact O-N 3.19Å; T31-E33 PolarHBondContact O-N 2.99Å; E33-G37 WeakPolarHBondContact O-CA 3.36Å; E33-G37 PolarHBondContact O-N 2.99Å |
| 34 | I | 82.5 | Confident | 82.6 | Confident | 121 Ų | 121 | 101.1 Ų | 101.1 | 62% | 0.621 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -74 | -48.1 | 178.2 | -66.1 | 165.2 | 0 | 0 | 0 | 111.9 | S30 T31 Y40 | S30-I34 WeakPolarHBondContact O-CG1 3.46Å; S30-I34 PolarHBondContact O-N 3.44Å; T31-I34 PolarHBondContact O-N 2.99Å; I34-Y40 WeakPolarHBondContact O-CB 3.48Å |
| 35 | E | 80.1 | Confident | 83.3 | Confident | 118 Ų | 118 | 100.7 Ų | 100.7 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -83.3 | -33.8 | -172.4 | -66.9 | -174.9 | 173.1 | 0 | 0 | 113.5 | T31 | T31-E35 HydrophobicContact CG2-CG 4.18Å; T31-E35 WeakPolarHBondContact O-CB 3.42Å; T31-E35 PolarHBondContact O-N 3.25Å |
| 36 | L | 81.6 | Confident | 84.1 | Confident | 98 Ų | 98 | 99.4 Ų | 99.4 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -128.6 | 3.5 | -169 | -55.2 | 173.9 | 0 | 0 | 0 | 112.7 | L24 R32 | L24-L36 HydrophobicContact CD1-CD1 3.97Å; L24-L36 HydrophobicContact CD2-CD1 3.53Å; L24-L36 HydrophobicContact CG-CD1 3.69Å; R32-L36 CarbonylContact O-C 3.41Å; R32-L36 WeakPolarHBondContact O-CA 3.49Å; R32-L36 WeakPolarHBondContact O-CB 3.4Å; R32-L36 PolarHBondContact O-N 3.26Å |
| 37 | G | 82.4 | Confident | 84.4 | Confident | 21 Ų | 21 | 98 Ų | 98 | 22% | 0.216 | 51% | 0.506 | C | S | . | . | S | Bend | trans | -78.2 | 173.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | R32 E33 E39 Y40 | R32-G37 PolarHBondContact O-N 3.1Å; E33-G37 WeakPolarHBondContact O-CA 3.36Å; E33-G37 PolarHBondContact O-N 2.99Å; G37-E39 PolarHBondContact O-N 3.31Å; G37-Y40 VanDerWaalsContact O-CD1 3.31Å; G37-Y40 WeakPolarHBondContact O-CD1 3.42Å; G37-Y40 PolarHBondContact O-N 2.69Å |
| 38 | L | 81.9 | Confident | 84.4 | Confident | 167 Ų | 167 | 99.9 Ų | 99.9 | 87% | 0.874 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -26.4 | 176.1 | -113.3 | 69.8 | 0 | 0 | 0 | 112.7 | Y40 | L38-Y40 VanDerWaalsContact C-N 3.32Å; L38-Y40 PolarHBondContact O-N 3.48Å |
| 39 | E | 85 | Confident | 84 | Confident | 177 Ų | 177 | 100 Ų | 100 | 83% | 0.827 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 21.9 | -176.2 | -57.1 | -60.4 | 152.2 | 0 | 0 | 112.9 | G37 G41 | G37-E39 PolarHBondContact O-N 3.31Å; E39-G41 PolarHBondContact O-N 2.92Å |
| 40 | Y | 78.8 | Confident | 83.8 | Confident | 130 Ų | 130 | 93.8 Ų | 93.8 | 51% | 0.51 | 53% | 0.53 | S | S | . | . | trans | -66.5 | -6.9 | -179.2 | 80 | -79.8 | 0 | 0 | 0 | 113.9 | I34 G37 L38 P43 | I34-Y40 WeakPolarHBondContact O-CB 3.48Å; G37-Y40 VanDerWaalsContact O-CD1 3.31Å; G37-Y40 WeakPolarHBondContact O-CD1 3.42Å; G37-Y40 PolarHBondContact O-N 2.69Å; L38-Y40 VanDerWaalsContact C-N 3.32Å; L38-Y40 PolarHBondContact O-N 3.48Å; Y40-P43 HydrophobicContact CE2-CB 4.35Å; Y40-P43 HydrophobicContact CE2-CG 3.91Å | ||
| 41 | G | 84.8 | Confident | 83.9 | Confident | 51 Ų | 51 | 92.4 Ų | 92.4 | 53% | 0.526 | 52% | 0.52 | S | S | . | . | trans | 76.8 | -152.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | E39 | E39-G41 PolarHBondContact O-N 2.92Š| ||
| 42 | T | 85.4 | Confident | 84.1 | Confident | 78 Ų | 78 | 91.4 Ų | 91.4 | 48% | 0.479 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -74.4 | 130.6 | 178.6 | -55.9 | 0 | 0 | 0 | 0 | 110 | T44 F54 | T42-T44 PolarHBondContact O-N 2.91Å; T42-F54 WeakPolarHBondContact CG2-O 3.44Å |
| 43 | P | 88.2 | Confident | 84.4 | Confident | 38 Ų | 38 | 88.1 Ų | 88.1 | 25% | 0.247 | 50% | 0.503 | C | S | . | . | trans | -55 | 130.4 | 177.7 | -22.2 | 28.5 | 0 | 0 | 0 | 112.5 | Y40 F54 W59 | Y40-P43 HydrophobicContact CE2-CB 4.35Å; Y40-P43 HydrophobicContact CE2-CG 3.91Å; P43-F54 HydrophobicContact CB-CB 3.95Å; P43-F54 HydrophobicContact CG-CB 4.18Å; P43-F54 HydrophobicContact CG-CD1 4.49Å; P43-F54 PolarHBondContact O-N 2.95Å; P43-W59 HydrophobicContact CB-CH2 3.85Å; P43-W59 HydrophobicContact CB-CZ3 4.36Å; P43-W59 WeakPolarHBondContact O-CZ3 3.47Å | ||
| 44 | T | 89.3 | Confident | 84.5 | Confident | 98 Ų | 98 | 87.3 Ų | 87.3 | 60% | 0.601 | 50% | 0.498 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 147.8 | 174.2 | 60.4 | 0 | 0 | 0 | 0 | 111.4 | T42 L52 K53 | T42-T44 PolarHBondContact O-N 2.91Å; T44-L52 CarbonylContact C-O 3.6Å; T44-L52 WeakPolarHBondContact CA-O 3.48Å; T44-K53 HydrophobicContact CG2-CB 4.44Å |
| 45 | M | 87.8 | Confident | 84.7 | Confident | 71 Ų | 71 | 85 Ų | 85 | 35% | 0.35 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.8 | 131.8 | 179.7 | 175.2 | 171.3 | 68.1 | 0 | 0 | 110.7 | L47 S51 L52 W59 | M45-L47 HydrophobicContact CE-CD2 4.46Å; M45-L47 HydrophobicContact CG-CB 4.42Å; M45-S51 CarbonylContact O-C 3.54Å; M45-L52 HydrophobicContact CB-CB 4.41Å; M45-L52 HydrophobicContact CE-CD1 3.41Å; M45-L52 VanDerWaalsContact CE-CD1 3.41Å; M45-L52 PolarHBondContact N-O 2.95Å; M45-L52 WeakPolarHBondContact O-CB 3.49Å; M45-L52 PolarHBondContact O-N 3.07Å; M45-W59 HydrophobicContact CB-CE3 4.33Å; M45-W59 HydrophobicContact CB-CH2 4.08Å; M45-W59 HydrophobicContact CB-CZ3 3.8Å; M45-W59 HydrophobicContact CE-CD2 4.45Å |
| 46 | N | 87.1 | Confident | 85 | Confident | 126 Ų | 126 | 87.4 Ų | 87.4 | 67% | 0.674 | 50% | 0.501 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 111.7 | 170.2 | -69.4 | -34.4 | 0 | 0 | 0 | 109.7 | Q50 S51 | N46-Q50 CarbonylContact C-O 3.53Å; N46-Q50 VanDerWaalsContact CA-O 3.27Å; N46-Q50 WeakPolarHBondContact CA-O 3.39Å; N46-S51 VanDerWaalsContact OD1-CA 3.29Å; N46-S51 WeakPolarHBondContact OD1-CA 3.37Å; N46-S51 WeakPolarHBondContact OD1-CB 3.41Å; N46-S51 PolarHBondContact OD1-OG 3.31Å |
| 47 | L | 84.8 | Confident | 85.2 | Confident | 106 Ų | 106 | 85.3 Ų | 85.3 | 56% | 0.555 | 50% | 0.504 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 126.6 | 179.1 | -173.6 | 65.6 | 0 | 0 | 0 | 109.9 | M45 G49 Q50 L52 | M45-L47 HydrophobicContact CE-CD2 4.46Å; M45-L47 HydrophobicContact CG-CB 4.42Å; L47-G49 PolarHBondContact O-N 3.12Å; L47-G49 VanDerWaalsContact O-N 3.14Å; L47-Q50 PolarHBondContact N-O 3.36Å; L47-Q50 WeakPolarHBondContact O-CB 3.3Å; L47-Q50 PolarHBondContact O-N 2.96Å; L47-L52 HydrophobicContact CB-CD1 4.38Å |
| 48 | A | 81.3 | Confident | 85.3 | Confident | 102 Ų | 102 | 91.1 Ų | 91.1 | 84% | 0.843 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.9 | 35.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q50 | A48-Q50 VanDerWaalsContact C-N 3.29Å; A48-Q50 PolarHBondContact O-N 3.26Å |
| 49 | G | 80.9 | Confident | 85.6 | Confident | 84 Ų | 84 | 88.9 Ų | 88.9 | 87% | 0.866 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.7 | 7.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | L47 | L47-G49 PolarHBondContact O-N 3.12Å; L47-G49 VanDerWaalsContact O-N 3.14Å |
| 50 | Q | 80.3 | Confident | 85.5 | Confident | 60 Ų | 60 | 83.3 Ų | 83.3 | 28% | 0.28 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 133 | 174 | -58.2 | -176.3 | -4 | 0 | 0 | 110.1 | N46 L47 A48 S65 | N46-Q50 CarbonylContact C-O 3.53Å; N46-Q50 VanDerWaalsContact CA-O 3.27Å; N46-Q50 WeakPolarHBondContact CA-O 3.39Å; L47-Q50 PolarHBondContact N-O 3.36Å; L47-Q50 WeakPolarHBondContact O-CB 3.3Å; L47-Q50 PolarHBondContact O-N 2.96Å; A48-Q50 VanDerWaalsContact C-N 3.29Å; A48-Q50 PolarHBondContact O-N 3.26Å; Q50-S65 PolarHBondContact NE2-O 3.39Å |
| 51 | S | 86.1 | Confident | 85.7 | Confident | 33 Ų | 33 | 77.7 Ų | 77.7 | 23% | 0.231 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 129.7 | 170.8 | -152.3 | 0 | 0 | 0 | 0 | 110.4 | M45 N46 A61 E62 | M45-S51 CarbonylContact O-C 3.54Å; N46-S51 VanDerWaalsContact OD1-CA 3.29Å; N46-S51 WeakPolarHBondContact OD1-CA 3.37Å; N46-S51 WeakPolarHBondContact OD1-CB 3.41Å; N46-S51 PolarHBondContact OD1-OG 3.31Å; S51-A61 CarbonylContact O-C 3.59Å; S51-A61 WeakPolarHBondContact O-CA 3.24Å; S51-E62 PolarHBondContact O-N 2.82Å |
| 52 | L | 89.4 | Confident | 85.3 | Confident | 20 Ų | 20 | 80.9 Ų | 80.9 | 11% | 0.105 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 138.4 | -178.3 | -63.3 | 156.1 | 0 | 0 | 0 | 108.5 | T44 M45 L47 W59 V60 A61 | T44-L52 CarbonylContact C-O 3.6Å; T44-L52 WeakPolarHBondContact CA-O 3.48Å; M45-L52 HydrophobicContact CB-CB 4.41Å; M45-L52 HydrophobicContact CE-CD1 3.41Å; M45-L52 VanDerWaalsContact CE-CD1 3.41Å; M45-L52 PolarHBondContact N-O 2.95Å; M45-L52 WeakPolarHBondContact O-CB 3.49Å; M45-L52 PolarHBondContact O-N 3.07Å; L47-L52 HydrophobicContact CB-CD1 4.38Å; L52-W59 HydrophobicContact CB-CE3 3.95Å; L52-V60 CarbonylContact C-O 3.6Å; L52-V60 WeakPolarHBondContact CA-O 3.36Å; L52-A61 HydrophobicContact CD2-CB 4.03Å |
| 53 | K | 90.6 | Very high | 84.2 | Confident | 59 Ų | 59 | 83.4 Ų | 83.4 | 26% | 0.257 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 141.3 | 173.5 | 60.4 | 179.8 | -174 | 157.8 | 0 | 110 | T44 E55 V60 | T44-K53 HydrophobicContact CG2-CB 4.44Å; K53-E55 HydrophobicContact CD-CG 4.22Å; K53-E55 VanDerWaalsContact CD-OE1 3.26Å; K53-E55 WeakPolarHBondContact CD-OE1 3.41Å; K53-E55 WeakPolarHBondContact CE-OE1 3.3Å; K53-E55 WeakPolarHBondContact CE-OE2 3.21Å; K53-E55 HydrophobicContact CG-CG 4.2Å; K53-E55 IonicContact NZ-OE1 2.7Å; K53-E55 PolarHBondContact NZ-OE1 3.49Å; K53-E55 IonicContact NZ-OE2 2.91Å; K53-E55 PolarHBondContact NZ-OE2 3.42Å; K53-V60 HydrophobicContact CG-CB 4.34Å; K53-V60 WeakPolarHBondContact CG-O 3.39Å; K53-V60 PolarHBondContact N-O 2.97Å; K53-V60 PolarHBondContact O-N 2.96Å |
| 54 | F | 87.2 | Confident | 82.7 | Confident | 76 Ų | 76 | 85.1 Ų | 85.1 | 33% | 0.333 | 51% | 0.51 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.6 | 106.1 | 179.5 | -172.5 | -103.4 | 0 | 0 | 0 | 111.1 | T42 P43 G57 Q58 W59 | T42-F54 WeakPolarHBondContact CG2-O 3.44Å; P43-F54 HydrophobicContact CB-CB 3.95Å; P43-F54 HydrophobicContact CG-CB 4.18Å; P43-F54 HydrophobicContact CG-CD1 4.49Å; P43-F54 PolarHBondContact O-N 2.95Å; F54-G57 VanDerWaalsContact CE2-C 3.45Å; F54-G57 VanDerWaalsContact CZ-CA 3.45Å; F54-Q58 CarbonylContact C-O 3.52Å; F54-Q58 WeakPolarHBondContact CA-O 3.34Å; F54-W59 HydrophobicContact CB-CD2 4.26Å; F54-W59 HydrophobicContact CB-CE3 3.96Å; F54-W59 HydrophobicContact CB-CH2 4.13Å; F54-W59 HydrophobicContact CB-CZ2 4.4Å; F54-W59 HydrophobicContact CB-CZ3 3.89Å; F54-W59 AromaticContact CD2-CD2 3.98Å; F54-W59 HydrophobicContact CD2-CD2 3.98Å; F54-W59 AromaticContact CD2-CE2 3.86Å; F54-W59 HydrophobicContact CD2-CG 4.18Å; F54-W59 HydrophobicContact CD2-CZ2 4.32Å; F54-W59 AromaticContact CD2-NE1 3.94Å |
| 55 | E | 86 | Confident | 80.9 | Confident | 71 Ų | 71 | 83.6 Ų | 83.6 | 33% | 0.332 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.9 | 136.5 | -178.5 | -67.6 | -176.2 | 164.9 | 0 | 0 | 110.4 | K53 G57 Q58 V60 | K53-E55 HydrophobicContact CD-CG 4.22Å; K53-E55 VanDerWaalsContact CD-OE1 3.26Å; K53-E55 WeakPolarHBondContact CD-OE1 3.41Å; K53-E55 WeakPolarHBondContact CE-OE1 3.3Å; K53-E55 WeakPolarHBondContact CE-OE2 3.21Å; K53-E55 HydrophobicContact CG-CG 4.2Å; K53-E55 IonicContact NZ-OE1 2.7Å; K53-E55 PolarHBondContact NZ-OE1 3.49Å; K53-E55 IonicContact NZ-OE2 2.91Å; K53-E55 PolarHBondContact NZ-OE2 3.42Å; E55-G57 PolarHBondContact O-N 3.49Å; E55-G57 VanDerWaalsContact O-N 3.11Å; E55-Q58 PolarHBondContact N-O 3.17Å; E55-Q58 PolarHBondContact O-N 3.34Å; E55-Q58 VanDerWaalsContact O-O 3.04Å; E55-V60 HydrophobicContact CB-CG2 4.38Å |
| 56 | N | 85.5 | Confident | 79.3 | Confident | 169 Ų | 169 | 85 Ų | 85 | 90% | 0.904 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 33.7 | 177.4 | -56.7 | -40.9 | 0 | 0 | 0 | 114.8 | ||
| 57 | G | 86.6 | Confident | 77.9 | Confident | 55 Ų | 55 | 84.7 Ų | 84.7 | 57% | 0.567 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.7 | 6.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | F54 E55 | F54-G57 VanDerWaalsContact CE2-C 3.45Å; F54-G57 VanDerWaalsContact CZ-CA 3.45Å; E55-G57 PolarHBondContact O-N 3.49Å; E55-G57 VanDerWaalsContact O-N 3.11Å |
| 58 | Q | 85 | Confident | 76.7 | Confident | 142 Ų | 142 | 81.9 Ų | 81.9 | 66% | 0.664 | 51% | 0.507 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 149.3 | -177.9 | -61.8 | -177.3 | -2.7 | 0 | 0 | 111.4 | F54 E55 | F54-Q58 CarbonylContact C-O 3.52Å; F54-Q58 WeakPolarHBondContact CA-O 3.34Å; E55-Q58 PolarHBondContact N-O 3.17Å; E55-Q58 PolarHBondContact O-N 3.34Å; E55-Q58 VanDerWaalsContact O-O 3.04Å |
| 59 | W | 86.9 | Confident | 76.1 | Confident | 121 Ų | 121 | 80.8 Ų | 80.8 | 46% | 0.458 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.7 | 116.9 | 169.4 | -69.9 | 101 | 0 | 0 | 0 | 109.3 | P43 M45 L52 F54 | P43-W59 HydrophobicContact CB-CH2 3.85Å; P43-W59 HydrophobicContact CB-CZ3 4.36Å; P43-W59 WeakPolarHBondContact O-CZ3 3.47Å; M45-W59 HydrophobicContact CB-CE3 4.33Å; M45-W59 HydrophobicContact CB-CH2 4.08Å; M45-W59 HydrophobicContact CB-CZ3 3.8Å; M45-W59 HydrophobicContact CE-CD2 4.45Å; L52-W59 HydrophobicContact CB-CE3 3.95Å; F54-W59 HydrophobicContact CB-CD2 4.26Å; F54-W59 HydrophobicContact CB-CE3 3.96Å; F54-W59 HydrophobicContact CB-CH2 4.13Å; F54-W59 HydrophobicContact CB-CZ2 4.4Å; F54-W59 HydrophobicContact CB-CZ3 3.89Å; F54-W59 AromaticContact CD2-CD2 3.98Å; F54-W59 HydrophobicContact CD2-CD2 3.98Å; F54-W59 AromaticContact CD2-CE2 3.86Å; F54-W59 HydrophobicContact CD2-CG 4.18Å; F54-W59 HydrophobicContact CD2-CZ2 4.32Å; F54-W59 AromaticContact CD2-NE1 3.94Å |
| 60 | V | 84.6 | Confident | 75.6 | Confident | 59 Ų | 59 | 85.4 Ų | 85.4 | 36% | 0.358 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 133 | 180 | -173 | 0 | 0 | 0 | 0 | 108.1 | L52 K53 E55 E62 | L52-V60 CarbonylContact C-O 3.6Å; L52-V60 WeakPolarHBondContact CA-O 3.36Å; K53-V60 HydrophobicContact CG-CB 4.34Å; K53-V60 WeakPolarHBondContact CG-O 3.39Å; K53-V60 PolarHBondContact N-O 2.97Å; K53-V60 PolarHBondContact O-N 2.96Å; E55-V60 HydrophobicContact CB-CG2 4.38Å; V60-E62 PolarHBondContact O-N 2.96Å |
| 61 | A | 82.5 | Confident | 75.5 | Confident | 13 Ų | 13 | 90.9 Ų | 90.9 | 11% | 0.107 | 50% | 0.497 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 135.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | S51 L52 S63 F66 | S51-A61 CarbonylContact O-C 3.59Å; S51-A61 WeakPolarHBondContact O-CA 3.24Å; L52-A61 HydrophobicContact CD2-CB 4.03Å; A61-S63 PolarHBondContact O-N 3.16Å; A61-F66 HydrophobicContact CB-CD2 3.87Å; A61-F66 HydrophobicContact CB-CE2 3.13Å; A61-F66 HydrophobicContact CB-CZ 3.75Å |
| 62 | E | 75.9 | Confident | 75.3 | Confident | 118 Ų | 118 | 95 Ų | 95 | 55% | 0.551 | 51% | 0.512 | S | S | * | . | trans | -61.6 | 122.6 | 165.2 | -156.4 | 171.6 | -151.9 | 0 | 0 | 107 | S51 V60 G64 | S51-E62 PolarHBondContact O-N 2.82Å; V60-E62 PolarHBondContact O-N 2.96Å; E62-G64 PolarHBondContact O-N 3.37Å | ||
| 63 | S | 62.6 | Low | 75 | Confident | 131 Ų | 131 | 98.3 Ų | 98.3 | 92% | 0.916 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -49 | 100 | -160.6 | -54.6 | 0 | 0 | 0 | 0 | 112.5 | A61 | A61-S63 PolarHBondContact O-N 3.16Š|
| 64 | G | 56.4 | Low | 74.9 | Confident | 73 Ų | 73 | 100.4 Ų | 100.4 | 75% | 0.753 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -167.1 | -29.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | E62 | E62-G64 PolarHBondContact O-N 3.37Š|
| 65 | S | 50.8 | Low | 75.2 | Confident | 67 Ų | 67 | 105.5 Ų | 105.5 | 47% | 0.469 | 56% | 0.556 | S | S | . | * | trans | -157.8 | 59.7 | -169.8 | -169.2 | 0 | 0 | 0 | 0 | 116.9 | Q50 | Q50-S65 PolarHBondContact NE2-O 3.39Š| ||
| 66 | F | 55.5 | Low | 75.6 | Confident | 100 Ų | 100 | 106.8 Ų | 106.8 | 44% | 0.439 | 57% | 0.565 | S | S | . | * | trans | -119.8 | 88.4 | 161.5 | -67.8 | -66.9 | 0 | 0 | 0 | 111.8 | A61 G68 D69 R70 | A61-F66 HydrophobicContact CB-CD2 3.87Å; A61-F66 HydrophobicContact CB-CE2 3.13Å; A61-F66 HydrophobicContact CB-CZ 3.75Å; F66-G68 PolarHBondContact O-N 3.13Å; F66-D69 HydrophobicContact CB-CB 3.39Å; F66-D69 HydrophobicContact CG-CB 4.1Å; F66-R70 PolarHBondContact O-N 2.88Å; F66-R70 VanDerWaalsContact O-N 3.15Å | ||
| 67 | T | 57.2 | Low | 76.1 | Confident | 119 Ų | 119 | 107.1 Ų | 107.1 | 73% | 0.73 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66 | -25.4 | 170.2 | 50.9 | 0 | 0 | 0 | 0 | 112.4 | ||
| 68 | G | 59.5 | Low | 76.6 | Confident | 48 Ų | 48 | 111.2 Ų | 111.2 | 50% | 0.495 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -73.7 | -50.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | F66 R70 R71 E72 | F66-G68 PolarHBondContact O-N 3.13Å; G68-R70 VanDerWaalsContact C-N 3.33Å; G68-R70 PolarHBondContact O-N 3.36Å; G68-R71 PolarHBondContact O-N 2.7Å; G68-R71 VanDerWaalsContact O-N 3.12Å; G68-E72 PolarHBondContact O-N 3.37Å; G68-E72 VanDerWaalsContact O-N 3.08Å |
| 69 | D | 68.1 | Low | 77.2 | Confident | 79 Ų | 79 | 110.8 Ų | 110.8 | 42% | 0.422 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.6 | -39.1 | 178.5 | -172.5 | 22.6 | 0 | 0 | 0 | 111.7 | F66 R71 E72 M73 | F66-D69 HydrophobicContact CB-CB 3.39Å; F66-D69 HydrophobicContact CG-CB 4.1Å; D69-R71 VanDerWaalsContact C-N 3.3Å; D69-R71 PolarHBondContact O-N 2.96Å; D69-E72 PolarHBondContact O-N 2.97Å; D69-M73 WeakPolarHBondContact O-CB 3.39Å; D69-M73 PolarHBondContact O-N 3.3Å |
| 70 | R | 71.4 | Confident | 77.7 | Confident | 180 Ų | 180 | 109.4 Ų | 109.4 | 68% | 0.679 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.2 | -36.2 | 175.5 | -173.5 | 174.9 | 170.2 | -172.9 | -1.5 | 113 | F66 G68 Q74 | F66-R70 PolarHBondContact O-N 2.88Å; F66-R70 VanDerWaalsContact O-N 3.15Å; G68-R70 VanDerWaalsContact C-N 3.33Å; G68-R70 PolarHBondContact O-N 3.36Å; R70-Q74 WeakPolarHBondContact O-CB 3.39Å; R70-Q74 VanDerWaalsContact O-CG 3.26Å; R70-Q74 WeakPolarHBondContact O-CG 3.47Å; R70-Q74 PolarHBondContact O-N 2.96Å |
| 71 | R | 78.1 | Confident | 78.3 | Confident | 176 Ų | 176 | 111.8 Ų | 111.8 | 66% | 0.664 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73.2 | -42.3 | 177.6 | -74.2 | -178.1 | -177.5 | -128.7 | 1.7 | 111.4 | G68 D69 Q74 R75 | G68-R71 PolarHBondContact O-N 2.7Å; G68-R71 VanDerWaalsContact O-N 3.12Å; D69-R71 VanDerWaalsContact C-N 3.3Å; D69-R71 PolarHBondContact O-N 2.96Å; R71-Q74 PolarHBondContact O-N 3.31Å; R71-R75 WeakPolarHBondContact O-CG 3.39Å; R71-R75 PolarHBondContact O-N 3.04Å |
| 72 | E | 81.9 | Confident | 79.1 | Confident | 118 Ų | 118 | 116.1 Ų | 116.1 | 55% | 0.551 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.2 | -47.6 | 176.1 | -176.9 | 163.5 | -164.3 | 0 | 0 | 111 | G68 D69 Q74 R75 L76 | G68-E72 PolarHBondContact O-N 3.37Å; G68-E72 VanDerWaalsContact O-N 3.08Å; D69-E72 PolarHBondContact O-N 2.97Å; E72-Q74 VanDerWaalsContact C-N 3.3Å; E72-Q74 PolarHBondContact O-N 3.38Å; E72-R75 WeakPolarHBondContact O-CA 3.38Å; E72-R75 WeakPolarHBondContact O-CB 3.4Å; E72-R75 PolarHBondContact O-N 2.97Å; E72-L76 HydrophobicContact CG-CD1 3.78Å; E72-L76 VanDerWaalsContact O-CD1 3.28Å; E72-L76 WeakPolarHBondContact O-CD1 3.34Å; E72-L76 PolarHBondContact O-N 2.99Å |
| 73 | M | 83.4 | Confident | 80.2 | Confident | 91 Ų | 91 | 113.9 Ų | 113.9 | 45% | 0.448 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -57.9 | -40 | 174.3 | -174.3 | 171.4 | -70.6 | 0 | 0 | 112.5 | D69 L76 R77 | D69-M73 WeakPolarHBondContact O-CB 3.39Å; D69-M73 PolarHBondContact O-N 3.3Å; M73-L76 PolarHBondContact O-N 3.07Å; M73-R77 WeakPolarHBondContact O-CB 3.41Å; M73-R77 VanDerWaalsContact O-CG 3.31Å; M73-R77 WeakPolarHBondContact O-CG 3.45Å; M73-R77 PolarHBondContact O-N 3.02Å |
| 74 | Q | 87.9 | Confident | 81.9 | Confident | 103 Ų | 103 | 113.4 Ų | 113.4 | 48% | 0.481 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.1 | -39.3 | 173.5 | -81.6 | -178.1 | -13.8 | 0 | 0 | 112.8 | R70 R71 E72 K78 | R70-Q74 WeakPolarHBondContact O-CB 3.39Å; R70-Q74 VanDerWaalsContact O-CG 3.26Å; R70-Q74 WeakPolarHBondContact O-CG 3.47Å; R70-Q74 PolarHBondContact O-N 2.96Å; R71-Q74 PolarHBondContact O-N 3.31Å; E72-Q74 VanDerWaalsContact C-N 3.3Å; E72-Q74 PolarHBondContact O-N 3.38Å; Q74-K78 WeakPolarHBondContact O-CG 3.26Å; Q74-K78 PolarHBondContact O-N 3.23Å; Q74-K78 VanDerWaalsContact O-N 3.08Å |
| 75 | R | 93.5 | Very high | 83.9 | Confident | 183 Ų | 183 | 115.3 Ų | 115.3 | 69% | 0.691 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.6 | -45.2 | 175.4 | -73.3 | 173.9 | 177.7 | 174.3 | -1.8 | 111.3 | R71 E72 R77 K78 R79 | R71-R75 WeakPolarHBondContact O-CG 3.39Å; R71-R75 PolarHBondContact O-N 3.04Å; E72-R75 WeakPolarHBondContact O-CA 3.38Å; E72-R75 WeakPolarHBondContact O-CB 3.4Å; E72-R75 PolarHBondContact O-N 2.97Å; R75-R77 VanDerWaalsContact C-N 3.35Å; R75-R77 PolarHBondContact O-N 3.04Å; R75-K78 PolarHBondContact O-N 3.49Å; R75-R79 PolarHBondContact O-N 3.33Å |
| 76 | L | 94.6 | Very high | 86.1 | Confident | 97 Ų | 97 | 116.9 Ų | 116.9 | 51% | 0.508 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 176.7 | -93.9 | 73.5 | 0 | 0 | 0 | 111.3 | E72 M73 K78 R79 N80 | E72-L76 HydrophobicContact CG-CD1 3.78Å; E72-L76 VanDerWaalsContact O-CD1 3.28Å; E72-L76 WeakPolarHBondContact O-CD1 3.34Å; E72-L76 PolarHBondContact O-N 2.99Å; M73-L76 PolarHBondContact O-N 3.07Å; L76-K78 PolarHBondContact O-N 2.87Å; L76-R79 PolarHBondContact O-N 2.96Å; L76-N80 WeakPolarHBondContact O-CB 3.43Å; L76-N80 PolarHBondContact O-N 3.4Å |
| 77 | R | 95.3 | Very high | 88.2 | Confident | 176 Ų | 176 | 115.6 Ų | 115.6 | 66% | 0.664 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.2 | -46.9 | 175.4 | -78 | -178.3 | -179.1 | -162.7 | 1.2 | 112.2 | M73 R75 R79 N80 Q81 | M73-R77 WeakPolarHBondContact O-CB 3.41Å; M73-R77 VanDerWaalsContact O-CG 3.31Å; M73-R77 WeakPolarHBondContact O-CG 3.45Å; M73-R77 PolarHBondContact O-N 3.02Å; R75-R77 VanDerWaalsContact C-N 3.35Å; R75-R77 PolarHBondContact O-N 3.04Å; R77-R79 VanDerWaalsContact C-N 3.33Å; R77-R79 PolarHBondContact O-N 3.33Å; R77-N80 PolarHBondContact O-N 2.91Å; R77-Q81 PolarHBondContact O-N 3.27Å |
| 78 | K | 96.9 | Very high | 90.2 | Very high | 142 Ų | 142 | 114.5 Ų | 114.5 | 62% | 0.617 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.2 | -41.8 | 175.9 | -74.8 | -177.5 | 178 | -172 | 0 | 112 | Q74 R75 L76 Q81 Q82 | Q74-K78 WeakPolarHBondContact O-CG 3.26Å; Q74-K78 PolarHBondContact O-N 3.23Å; Q74-K78 VanDerWaalsContact O-N 3.08Å; R75-K78 PolarHBondContact O-N 3.49Å; L76-K78 PolarHBondContact O-N 2.87Å; K78-Q81 PolarHBondContact O-N 3.31Å; K78-Q82 WeakPolarHBondContact O-CG 3.43Å; K78-Q82 PolarHBondContact O-N 3.34Å |
| 79 | R | 97.4 | Very high | 92.1 | Very high | 133 Ų | 133 | 116.4 Ų | 116.4 | 50% | 0.502 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67 | -41.3 | 179.4 | -174.6 | 57.6 | -180 | 155.6 | 5.7 | 111.8 | R75 L76 R77 Q82 L83 | R75-R79 PolarHBondContact O-N 3.33Å; L76-R79 PolarHBondContact O-N 2.96Å; R77-R79 VanDerWaalsContact C-N 3.33Å; R77-R79 PolarHBondContact O-N 3.33Å; R79-Q82 PolarHBondContact O-N 3.04Å; R79-L83 HydrophobicContact CG-CD1 4.12Å; R79-L83 WeakPolarHBondContact O-CB 3.44Å; R79-L83 VanDerWaalsContact O-CG 3.28Å; R79-L83 WeakPolarHBondContact O-CG 3.28Å; R79-L83 PolarHBondContact O-N 3.03Å |
| 80 | N | 97.8 | Very high | 93.5 | Very high | 91 Ų | 91 | 116.8 Ų | 116.8 | 49% | 0.487 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -46.2 | 174.4 | -99.8 | -43 | 0 | 0 | 0 | 111.5 | L76 R77 Q82 L83 E84 | L76-N80 WeakPolarHBondContact O-CB 3.43Å; L76-N80 PolarHBondContact O-N 3.4Å; R77-N80 PolarHBondContact O-N 2.91Å; N80-Q82 VanDerWaalsContact C-N 3.33Å; N80-Q82 PolarHBondContact O-N 2.96Å; N80-L83 PolarHBondContact O-N 3.38Å; N80-L83 VanDerWaalsContact O-N 3.12Å; N80-E84 WeakPolarHBondContact O-CG 3.48Å; N80-E84 PolarHBondContact O-N 3.37Å |
| 81 | Q | 98.3 | Very high | 94.8 | Very high | 110 Ų | 110 | 115.6 Ų | 115.6 | 51% | 0.514 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.9 | -45.7 | 176.8 | -176.1 | 178 | 8.6 | 0 | 0 | 112 | R77 K78 L83 E84 E85 | R77-Q81 PolarHBondContact O-N 3.27Å; K78-Q81 PolarHBondContact O-N 3.31Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.93Å; Q81-E84 PolarHBondContact O-N 3.38Å; Q81-E85 PolarHBondContact NE2-OE1 3.43Å; Q81-E85 WeakPolarHBondContact O-CG 3.5Å; Q81-E85 PolarHBondContact O-N 3.44Å |
| 82 | Q | 98.4 | Very high | 95.8 | Very high | 103 Ų | 103 | 111.9 Ų | 111.9 | 48% | 0.481 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.2 | -41.1 | 175.9 | -73.5 | 174.9 | -7.4 | 0 | 0 | 112.5 | K78 R79 N80 E85 E86 | K78-Q82 WeakPolarHBondContact O-CG 3.43Å; K78-Q82 PolarHBondContact O-N 3.34Å; R79-Q82 PolarHBondContact O-N 3.04Å; N80-Q82 VanDerWaalsContact C-N 3.33Å; N80-Q82 PolarHBondContact O-N 2.96Å; Q82-E85 PolarHBondContact O-N 2.96Å; Q82-E86 WeakPolarHBondContact O-CB 3.35Å; Q82-E86 PolarHBondContact O-N 3.37Å |
| 83 | L | 98.6 | Very high | 96.6 | Very high | 72 Ų | 72 | 111.4 Ų | 111.4 | 38% | 0.377 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.1 | -37.5 | 178.2 | -74 | 170.5 | 0 | 0 | 0 | 111.7 | R79 N80 Q81 N87 | R79-L83 HydrophobicContact CG-CD1 4.12Å; R79-L83 WeakPolarHBondContact O-CB 3.44Å; R79-L83 VanDerWaalsContact O-CG 3.28Å; R79-L83 WeakPolarHBondContact O-CG 3.28Å; R79-L83 PolarHBondContact O-N 3.03Å; N80-L83 PolarHBondContact O-N 3.38Å; N80-L83 VanDerWaalsContact O-N 3.12Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.93Å; L83-N87 VanDerWaalsContact O-CB 3.28Å; L83-N87 WeakPolarHBondContact O-CB 3.28Å; L83-N87 PolarHBondContact O-N 3.38Å |
| 84 | E | 98.5 | Very high | 97.3 | Very high | 121 Ų | 121 | 110.9 Ų | 110.9 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.3 | -44.2 | 174.3 | -75 | 175.4 | -179.7 | 0 | 0 | 111.5 | N80 Q81 N87 N88 | N80-E84 WeakPolarHBondContact O-CG 3.48Å; N80-E84 PolarHBondContact O-N 3.37Å; Q81-E84 PolarHBondContact O-N 3.38Å; E84-N87 PolarHBondContact O-N 3.43Å; E84-N88 WeakPolarHBondContact O-CB 3.38Å; E84-N88 VanDerWaalsContact O-CG 3.23Å; E84-N88 PolarHBondContact O-N 2.98Å; E84-N88 PolarHBondContact O-ND2 3.29Å |
| 85 | E | 98.4 | Very high | 97.8 | Very high | 113 Ų | 113 | 110.2 Ų | 110.2 | 53% | 0.528 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.7 | -44.6 | 175.4 | -73.2 | 170.8 | -169.4 | 0 | 0 | 111.7 | Q81 Q82 N88 L89 | Q81-E85 PolarHBondContact NE2-OE1 3.43Å; Q81-E85 WeakPolarHBondContact O-CG 3.5Å; Q81-E85 PolarHBondContact O-N 3.44Å; Q82-E85 PolarHBondContact O-N 2.96Å; E85-N88 PolarHBondContact O-N 2.93Å; E85-L89 WeakPolarHBondContact O-CB 3.41Å; E85-L89 PolarHBondContact O-N 3.48Å |
| 86 | E | 98.5 | Very high | 98.1 | Very high | 100 Ų | 100 | 105.5 Ų | 105.5 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 175.3 | -173 | 177.1 | -179.2 | 0 | 0 | 111.5 | Q82 N88 L89 L90 | Q82-E86 WeakPolarHBondContact O-CB 3.35Å; Q82-E86 PolarHBondContact O-N 3.37Å; E86-N88 PolarHBondContact O-N 3.29Å; E86-L89 PolarHBondContact O-N 2.93Å; E86-L90 HydrophobicContact CG-CD1 4.1Å; E86-L90 HydrophobicContact CG-CG 4.46Å; E86-L90 WeakPolarHBondContact O-CB 3.26Å; E86-L90 VanDerWaalsContact O-CG 3.26Å; E86-L90 WeakPolarHBondContact O-CG 3.39Å; E86-L90 PolarHBondContact O-N 3.45Å |
| 87 | N | 98.7 | Very high | 98.3 | Very high | 73 Ų | 73 | 105.4 Ų | 105.4 | 39% | 0.39 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 177.4 | -162.3 | -91.3 | 0 | 0 | 0 | 111.7 | L83 E84 L90 R91 | L83-N87 VanDerWaalsContact O-CB 3.28Å; L83-N87 WeakPolarHBondContact O-CB 3.28Å; L83-N87 PolarHBondContact O-N 3.38Å; E84-N87 PolarHBondContact O-N 3.43Å; N87-L90 PolarHBondContact O-N 2.9Å; N87-R91 WeakPolarHBondContact O-CG 3.28Å; N87-R91 PolarHBondContact O-N 3.49Å; N87-R91 VanDerWaalsContact OD1-CZ 3.24Å; N87-R91 PolarHBondContact OD1-NE 2.86Å; N87-R91 PolarHBondContact OD1-NH2 2.88Å |
| 88 | N | 98.7 | Very high | 98.5 | Very high | 95 Ų | 95 | 101.7 Ų | 101.7 | 51% | 0.508 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.3 | -42.8 | 176.9 | -70.7 | -24.7 | 0 | 0 | 0 | 111.7 | E84 E85 E86 R91 L92 | E84-N88 WeakPolarHBondContact O-CB 3.38Å; E84-N88 VanDerWaalsContact O-CG 3.23Å; E84-N88 PolarHBondContact O-N 2.98Å; E84-N88 PolarHBondContact O-ND2 3.29Å; E85-N88 PolarHBondContact O-N 2.93Å; E86-N88 PolarHBondContact O-N 3.29Å; N88-R91 PolarHBondContact O-N 3.08Å; N88-L92 PolarHBondContact O-N 3.23Å |
| 89 | L | 98.7 | Very high | 98.5 | Very high | 89 Ų | 89 | 100 Ų | 100 | 47% | 0.466 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.9 | -43 | 175.7 | 178.5 | 63.2 | 0 | 0 | 0 | 111.8 | E85 E86 L92 K93 | E85-L89 WeakPolarHBondContact O-CB 3.41Å; E85-L89 PolarHBondContact O-N 3.48Å; E86-L89 PolarHBondContact O-N 2.93Å; L89-L92 PolarHBondContact O-N 3.48Å; L89-K93 HydrophobicContact CG-CD 4.47Å; L89-K93 WeakPolarHBondContact O-CG 3.19Å; L89-K93 PolarHBondContact O-N 3.12Å |
| 90 | L | 98.8 | Very high | 98.6 | Very high | 87 Ų | 87 | 97.9 Ų | 97.9 | 46% | 0.455 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 178.1 | -74.1 | 171.3 | 0 | 0 | 0 | 111.5 | E86 N87 K93 V94 | E86-L90 HydrophobicContact CG-CD1 4.1Å; E86-L90 HydrophobicContact CG-CG 4.46Å; E86-L90 WeakPolarHBondContact O-CB 3.26Å; E86-L90 VanDerWaalsContact O-CG 3.26Å; E86-L90 WeakPolarHBondContact O-CG 3.39Å; E86-L90 PolarHBondContact O-N 3.45Å; N87-L90 PolarHBondContact O-N 2.9Å; L90-K93 PolarHBondContact O-N 2.86Å; L90-V94 WeakPolarHBondContact O-CG2 3.48Å; L90-V94 PolarHBondContact O-N 2.84Å |
| 91 | R | 98.7 | Very high | 98.6 | Very high | 155 Ų | 155 | 98.7 Ų | 98.7 | 59% | 0.585 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -58.5 | -49.9 | 173.7 | -74.1 | 176.6 | -179.2 | 175.9 | 2 | 111.5 | N87 N88 K93 V94 D95 | N87-R91 WeakPolarHBondContact O-CG 3.28Å; N87-R91 PolarHBondContact O-N 3.49Å; N87-R91 VanDerWaalsContact OD1-CZ 3.24Å; N87-R91 PolarHBondContact OD1-NE 2.86Å; N87-R91 PolarHBondContact OD1-NH2 2.88Å; N88-R91 PolarHBondContact O-N 3.08Å; R91-K93 VanDerWaalsContact C-N 3.29Å; R91-K93 PolarHBondContact O-N 3.05Å; R91-V94 WeakPolarHBondContact O-CB 3.31Å; R91-V94 PolarHBondContact O-N 3.01Å; R91-V94 VanDerWaalsContact O-N 3.07Å; R91-D95 PolarHBondContact O-N 3.02Å |
| 92 | L | 98.8 | Very high | 98.6 | Very high | 97 Ų | 97 | 96.9 Ų | 96.9 | 51% | 0.508 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.2 | -40 | 178.1 | -176.8 | 65.1 | 0 | 0 | 0 | 112.4 | N88 L89 V94 D95 I96 | N88-L92 PolarHBondContact O-N 3.23Å; L89-L92 PolarHBondContact O-N 3.48Å; L92-V94 VanDerWaalsContact C-N 3.35Å; L92-D95 PolarHBondContact O-N 3.38Å; L92-I96 HydrophobicContact CD1-CD1 4.27Å; L92-I96 HydrophobicContact CG-CD1 3.98Å; L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 2.93Å; L92-I96 PolarHBondContact O-N 2.96Å |
| 93 | K | 98.7 | Very high | 98.6 | Very high | 108 Ų | 108 | 97.5 Ų | 97.5 | 47% | 0.47 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 175.7 | -75.7 | 177.8 | 178.7 | -179.3 | 0 | 112.2 | L89 L90 R91 L97 | L89-K93 HydrophobicContact CG-CD 4.47Å; L89-K93 WeakPolarHBondContact O-CG 3.19Å; L89-K93 PolarHBondContact O-N 3.12Å; L90-K93 PolarHBondContact O-N 2.86Å; R91-K93 VanDerWaalsContact C-N 3.29Å; R91-K93 PolarHBondContact O-N 3.05Å; K93-L97 WeakPolarHBondContact O-CB 3.15Å; K93-L97 WeakPolarHBondContact O-CD1 3.39Å; K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 3.49Å |
| 94 | V | 98.8 | Very high | 98.6 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 49% | 0.485 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.4 | -45.3 | 176.8 | 169.5 | 0 | 0 | 0 | 0 | 110.3 | L90 R91 L92 I96 L97 L98 | L90-V94 WeakPolarHBondContact O-CG2 3.48Å; L90-V94 PolarHBondContact O-N 2.84Å; R91-V94 WeakPolarHBondContact O-CB 3.31Å; R91-V94 PolarHBondContact O-N 3.01Å; R91-V94 VanDerWaalsContact O-N 3.07Å; L92-V94 VanDerWaalsContact C-N 3.35Å; V94-I96 PolarHBondContact O-N 2.76Å; V94-L97 PolarHBondContact O-N 3.15Å; V94-L98 HydrophobicContact CG1-CD1 4.03Å; V94-L98 HydrophobicContact CG1-CG 4.42Å; V94-L98 WeakPolarHBondContact O-CG 3.08Å; V94-L98 PolarHBondContact O-N 3.12Å |
| 95 | D | 98.7 | Very high | 98.6 | Very high | 90 Ų | 90 | 95.8 Ų | 95.8 | 48% | 0.481 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.5 | -48.4 | 179.3 | -65.4 | -20.2 | 0 | 0 | 0 | 111.3 | R91 L92 L97 L98 D99 | R91-D95 PolarHBondContact O-N 3.02Å; L92-D95 PolarHBondContact O-N 3.38Å; D95-L97 VanDerWaalsContact C-N 3.32Å; D95-L97 PolarHBondContact O-N 3.31Å; D95-L98 WeakPolarHBondContact O-CB 3.26Å; D95-L98 PolarHBondContact O-N 3.41Å; D95-L98 VanDerWaalsContact O-N 3.16Å; D95-D99 PolarHBondContact O-N 3.28Å |
| 96 | I | 98.7 | Very high | 98.6 | Very high | 83 Ų | 83 | 92.9 Ų | 92.9 | 43% | 0.426 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 177 | -65.6 | 166.5 | 0 | 0 | 0 | 111.5 | L92 V94 L98 D99 M100 | L92-I96 HydrophobicContact CD1-CD1 4.27Å; L92-I96 HydrophobicContact CG-CD1 3.98Å; L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 2.93Å; L92-I96 PolarHBondContact O-N 2.96Å; V94-I96 PolarHBondContact O-N 2.76Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 2.7Å; I96-D99 PolarHBondContact O-N 2.91Å; I96-M100 HydrophobicContact CG2-CE 4.06Å; I96-M100 HydrophobicContact CG2-CG 4.46Å; I96-M100 HydrophobicContact CG2-SD 4.33Å; I96-M100 WeakPolarHBondContact O-CG 3.41Å; I96-M100 PolarHBondContact O-N 3.42Å |
| 97 | L | 98.8 | Very high | 98.6 | Very high | 96 Ų | 96 | 92.8 Ų | 92.8 | 50% | 0.503 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.7 | -37.8 | 177.4 | -77.5 | 166.4 | 0 | 0 | 0 | 111.8 | K93 V94 D95 M100 L101 | K93-L97 WeakPolarHBondContact O-CB 3.15Å; K93-L97 WeakPolarHBondContact O-CD1 3.39Å; K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 3.49Å; V94-L97 PolarHBondContact O-N 3.15Å; D95-L97 VanDerWaalsContact C-N 3.32Å; D95-L97 PolarHBondContact O-N 3.31Å; L97-M100 HydrophobicContact CD2-CE 3.57Å; L97-M100 HydrophobicContact CG-CE 4.21Å; L97-L101 WeakPolarHBondContact O-CB 3.29Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 3.27Å |
| 98 | L | 98.8 | Very high | 98.6 | Very high | 98 Ų | 98 | 92.6 Ų | 92.6 | 51% | 0.513 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.1 | -42.1 | 174.9 | -72.5 | 172.7 | 0 | 0 | 0 | 111.5 | V94 D95 I96 L101 S102 | V94-L98 HydrophobicContact CG1-CD1 4.03Å; V94-L98 HydrophobicContact CG1-CG 4.42Å; V94-L98 WeakPolarHBondContact O-CG 3.08Å; V94-L98 PolarHBondContact O-N 3.12Å; D95-L98 WeakPolarHBondContact O-CB 3.26Å; D95-L98 PolarHBondContact O-N 3.41Å; D95-L98 VanDerWaalsContact O-N 3.16Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 2.7Å; L98-L101 PolarHBondContact O-N 2.82Å; L98-S102 WeakPolarHBondContact O-CB 3.47Å; L98-S102 PolarHBondContact O-N 2.83Å; L98-S102 PolarHBondContact O-OG 3.11Å |
| 99 | D | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 93.4 Ų | 93.4 | 57% | 0.567 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -59.8 | -50.5 | 175.3 | -71.9 | -16.9 | 0 | 0 | 0 | 110.9 | D95 I96 L101 S102 E103 | D95-D99 PolarHBondContact O-N 3.28Å; I96-D99 PolarHBondContact O-N 2.91Å; D99-L101 VanDerWaalsContact C-N 3.33Å; D99-L101 PolarHBondContact O-N 3.24Å; D99-S102 PolarHBondContact O-N 3.41Å; D99-S102 VanDerWaalsContact O-N 3.13Å; D99-S102 PolarHBondContact O-OG 2.88Å; D99-E103 PolarHBondContact O-N 3.39Å |
| 100 | M | 98.6 | Very high | 98.5 | Very high | 89 Ų | 89 | 94.3 Ų | 94.3 | 44% | 0.438 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -38.9 | 178.4 | -69.6 | -173.3 | -56.6 | 0 | 0 | 112.8 | I96 L97 T104 | I96-M100 HydrophobicContact CG2-CE 4.06Å; I96-M100 HydrophobicContact CG2-CG 4.46Å; I96-M100 HydrophobicContact CG2-SD 4.33Å; I96-M100 WeakPolarHBondContact O-CG 3.41Å; I96-M100 PolarHBondContact O-N 3.42Å; L97-M100 HydrophobicContact CD2-CE 3.57Å; L97-M100 HydrophobicContact CG-CE 4.21Å; M100-T104 WeakPolarHBondContact O-CB 3.21Å; M100-T104 PolarHBondContact O-N 3.4Å; M100-T104 PolarHBondContact O-OG1 3.08Å |
| 101 | L | 98.7 | Very high | 98.4 | Very high | 108 Ų | 108 | 96 Ų | 96 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65 | -41.2 | 175.1 | -79.2 | 169.7 | 0 | 0 | 0 | 111.3 | L97 L98 D99 T105 | L97-L101 WeakPolarHBondContact O-CB 3.29Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 3.27Å; L98-L101 PolarHBondContact O-N 2.82Å; D99-L101 VanDerWaalsContact C-N 3.33Å; D99-L101 PolarHBondContact O-N 3.24Å; L101-T105 VanDerWaalsContact O-CB 3.3Å; L101-T105 WeakPolarHBondContact O-CB 3.14Å; L101-T105 PolarHBondContact O-N 2.77Å; L101-T105 PolarHBondContact O-OG1 2.78Å |
| 102 | S | 98.4 | Very high | 98.3 | Very high | 71 Ų | 71 | 93.9 Ų | 93.9 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.7 | -41.4 | 177.8 | 77.1 | 0 | 0 | 0 | 0 | 112.1 | L98 D99 T105 A106 | L98-S102 WeakPolarHBondContact O-CB 3.47Å; L98-S102 PolarHBondContact O-N 2.83Å; L98-S102 PolarHBondContact O-OG 3.11Å; D99-S102 PolarHBondContact O-N 3.41Å; D99-S102 VanDerWaalsContact O-N 3.13Å; D99-S102 PolarHBondContact O-OG 2.88Å; S102-T105 PolarHBondContact O-N 2.99Å; S102-A106 WeakPolarHBondContact O-CB 3.44Å; S102-A106 PolarHBondContact O-N 2.81Å |
| 103 | E | 98.4 | Very high | 98.2 | Very high | 117 Ų | 117 | 95.1 Ų | 95.1 | 55% | 0.547 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.9 | -51.6 | 175.2 | -177 | 173.6 | -149.3 | 0 | 0 | 110.9 | D99 T105 A106 E107 | D99-E103 PolarHBondContact O-N 3.39Å; E103-T105 VanDerWaalsContact C-N 3.25Å; E103-T105 PolarHBondContact O-N 2.77Å; E103-A106 PolarHBondContact O-N 3.32Å; E103-A106 VanDerWaalsContact O-N 3.12Å; E103-E107 WeakPolarHBondContact O-CG 3.45Å; E103-E107 PolarHBondContact O-N 2.88Å |
| 104 | T | 98.3 | Very high | 98.1 | Very high | 84 Ų | 84 | 95.6 Ų | 95.6 | 52% | 0.515 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.1 | -38.2 | 178.1 | -55.2 | 0 | 0 | 0 | 0 | 111.8 | M100 S108 | M100-T104 WeakPolarHBondContact O-CB 3.21Å; M100-T104 PolarHBondContact O-N 3.4Å; M100-T104 PolarHBondContact O-OG1 3.08Å; T104-S108 WeakPolarHBondContact O-CB 3.48Å; T104-S108 PolarHBondContact O-N 3.28Å |
| 105 | T | 98.4 | Very high | 98 | Very high | 73 Ų | 73 | 97.4 Ų | 97.4 | 45% | 0.448 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.9 | -42 | 178.3 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | L101 S102 E103 S108 H109 | L101-T105 VanDerWaalsContact O-CB 3.3Å; L101-T105 WeakPolarHBondContact O-CB 3.14Å; L101-T105 PolarHBondContact O-N 2.77Å; L101-T105 PolarHBondContact O-OG1 2.78Å; S102-T105 PolarHBondContact O-N 2.99Å; E103-T105 VanDerWaalsContact C-N 3.25Å; E103-T105 PolarHBondContact O-N 2.77Å; T105-S108 PolarHBondContact O-N 3.07Å; T105-H109 PolarHBondContact O-CD2 2.77Å; T105-H109 PolarHBondContact O-N 3.06Å; T105-H109 VanDerWaalsContact O-N 3.07Å |
| 106 | A | 98.3 | Very high | 97.8 | Very high | 52 Ų | 52 | 98.5 Ų | 98.5 | 43% | 0.43 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.9 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S102 E103 S108 H109 L110 | S102-A106 WeakPolarHBondContact O-CB 3.44Å; S102-A106 PolarHBondContact O-N 2.81Å; E103-A106 PolarHBondContact O-N 3.32Å; E103-A106 VanDerWaalsContact O-N 3.12Å; A106-S108 PolarHBondContact O-N 3.5Å; A106-H109 PolarHBondContact O-N 3.36Å; A106-L110 WeakPolarHBondContact O-CG 3.31Å; A106-L110 PolarHBondContact O-N 3.47Å |
| 107 | E | 97.9 | Very high | 97.7 | Very high | 98 Ų | 98 | 99.1 Ų | 99.1 | 46% | 0.458 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.5 | -45 | 174.6 | -71.8 | -173.4 | 163.7 | 0 | 0 | 111.9 | E103 H109 L110 M111 | E103-E107 WeakPolarHBondContact O-CG 3.45Å; E103-E107 PolarHBondContact O-N 2.88Å; E107-H109 VanDerWaalsContact C-N 3.32Å; E107-H109 PolarHBondContact O-N 3.17Å; E107-L110 PolarHBondContact O-N 2.93Å; E107-M111 WeakPolarHBondContact O-CG 3.27Å; E107-M111 PolarHBondContact O-N 2.91Å |
| 108 | S | 97.9 | Very high | 97.4 | Very high | 69 Ų | 69 | 100.5 Ų | 100.5 | 48% | 0.483 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.1 | -42.4 | 177.8 | -173.4 | 0 | 0 | 0 | 0 | 111.9 | T104 T105 A106 M111 E112 | T104-S108 WeakPolarHBondContact O-CB 3.48Å; T104-S108 PolarHBondContact O-N 3.28Å; T105-S108 PolarHBondContact O-N 3.07Å; A106-S108 PolarHBondContact O-N 3.5Å; S108-M111 PolarHBondContact O-N 2.56Å; S108-E112 WeakPolarHBondContact O-CB 3.35Å; S108-E112 PolarHBondContact O-N 3.45Å |
| 109 | H | 98.1 | Very high | 97.2 | Very high | 111 Ų | 111 | 101.3 Ų | 101.3 | 51% | 0.514 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.3 | -35.6 | 177.4 | -75.3 | -48 | 0 | 0 | 0 | 112.6 | T105 A106 E107 E112 K113 | T105-H109 PolarHBondContact O-CD2 2.77Å; T105-H109 PolarHBondContact O-N 3.06Å; T105-H109 VanDerWaalsContact O-N 3.07Å; A106-H109 PolarHBondContact O-N 3.36Å; E107-H109 VanDerWaalsContact C-N 3.32Å; E107-H109 PolarHBondContact O-N 3.17Å; H109-E112 IonicContact ND1-OE2 3.77Å; H109-K113 WeakPolarHBondContact O-CB 3.48Å; H109-K113 PolarHBondContact O-N 3.18Å; H109-K113 VanDerWaalsContact O-N 3.1Å |
| 110 | L | 97.8 | Very high | 96.9 | Very high | 109 Ų | 109 | 100 Ų | 100 | 57% | 0.571 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.3 | -47.6 | 173.9 | -73.6 | 171 | 0 | 0 | 0 | 111.2 | A106 E107 E112 K113 E114 | A106-L110 WeakPolarHBondContact O-CG 3.31Å; A106-L110 PolarHBondContact O-N 3.47Å; E107-L110 PolarHBondContact O-N 2.93Å; L110-E112 VanDerWaalsContact C-N 3.34Å; L110-E112 PolarHBondContact O-N 3.14Å; L110-K113 PolarHBondContact O-N 3.09Å; L110-E114 WeakPolarHBondContact O-CG 3.49Å; L110-E114 PolarHBondContact O-N 3.45Å |
| 111 | M | 97 | Very high | 96.4 | Very high | 122 Ų | 122 | 100.9 Ų | 100.9 | 60% | 0.601 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.7 | -41.1 | 177.4 | -69.7 | -176.1 | -174.1 | 0 | 0 | 112.3 | E107 S108 K113 E114 L115 | E107-M111 WeakPolarHBondContact O-CG 3.27Å; E107-M111 PolarHBondContact O-N 2.91Å; S108-M111 PolarHBondContact O-N 2.56Å; M111-K113 VanDerWaalsContact C-N 3.34Å; M111-K113 PolarHBondContact O-N 3.27Å; M111-E114 PolarHBondContact O-N 2.93Å; M111-L115 WeakPolarHBondContact O-CB 3.2Å; M111-L115 PolarHBondContact O-N 3.38Å |
| 112 | E | 97.1 | Very high | 95.8 | Very high | 111 Ų | 111 | 99.6 Ų | 99.6 | 52% | 0.519 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.4 | -44.9 | 176.9 | -174.6 | 171.9 | -154.2 | 0 | 0 | 111.2 | S108 H109 L110 L115 E116 | S108-E112 WeakPolarHBondContact O-CB 3.35Å; S108-E112 PolarHBondContact O-N 3.45Å; H109-E112 IonicContact ND1-OE2 3.77Å; L110-E112 VanDerWaalsContact C-N 3.34Å; L110-E112 PolarHBondContact O-N 3.14Å; E112-L115 PolarHBondContact O-N 2.57Å; E112-E116 WeakPolarHBondContact O-CG 3.12Å; E112-E116 PolarHBondContact O-N 3.26Å |
| 113 | K | 97 | Very high | 95 | Very high | 122 Ų | 122 | 103.9 Ų | 103.9 | 53% | 0.53 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 176.8 | -173.6 | -175.8 | 175.5 | -169.5 | 0 | 112.5 | H109 L110 M111 L115 E116 E117 | H109-K113 WeakPolarHBondContact O-CB 3.48Å; H109-K113 PolarHBondContact O-N 3.18Å; H109-K113 VanDerWaalsContact O-N 3.1Å; L110-K113 PolarHBondContact O-N 3.09Å; M111-K113 VanDerWaalsContact C-N 3.34Å; M111-K113 PolarHBondContact O-N 3.27Å; K113-L115 VanDerWaalsContact C-N 3.28Å; K113-L115 PolarHBondContact O-N 3.05Å; K113-E116 PolarHBondContact O-N 3.37Å; K113-E117 VanDerWaalsContact CE-OE1 3.26Å; K113-E117 WeakPolarHBondContact CE-OE1 3.38Å; K113-E117 WeakPolarHBondContact O-CG 3.5Å; K113-E117 PolarHBondContact O-N 3.11Å |
| 114 | E | 96.4 | Very high | 94.1 | Very high | 119 Ų | 119 | 108.4 Ų | 108.4 | 56% | 0.556 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.5 | -40.4 | 176.8 | -72.6 | -179.8 | 175.3 | 0 | 0 | 111.7 | L110 M111 E117 L118 | L110-E114 WeakPolarHBondContact O-CG 3.49Å; L110-E114 PolarHBondContact O-N 3.45Å; M111-E114 PolarHBondContact O-N 2.93Å; E114-E117 PolarHBondContact O-N 2.81Å; E114-L118 WeakPolarHBondContact O-CG 3.31Å; E114-L118 PolarHBondContact O-N 3.18Å |
| 115 | L | 96.1 | Very high | 92.9 | Very high | 118 Ų | 118 | 115.3 Ų | 115.3 | 62% | 0.618 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.2 | -40.9 | 178 | -161.4 | 152.6 | 0 | 0 | 0 | 111.6 | M111 E112 K113 L118 K119 | M111-L115 WeakPolarHBondContact O-CB 3.2Å; M111-L115 PolarHBondContact O-N 3.38Å; E112-L115 PolarHBondContact O-N 2.57Å; K113-L115 VanDerWaalsContact C-N 3.28Å; K113-L115 PolarHBondContact O-N 3.05Å; L115-L118 PolarHBondContact O-N 2.9Å; L115-K119 WeakPolarHBondContact O-CB 3.5Å; L115-K119 PolarHBondContact O-N 3.22Å |
| 116 | E | 95.4 | Very high | 90.8 | Very high | 113 Ų | 113 | 123.5 Ų | 123.5 | 53% | 0.528 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -61.6 | -44.5 | 172.5 | -74.3 | -167.6 | 160.6 | 0 | 0 | 112.3 | E112 K113 K119 N120 | E112-E116 WeakPolarHBondContact O-CG 3.12Å; E112-E116 PolarHBondContact O-N 3.26Å; K113-E116 PolarHBondContact O-N 3.37Å; E116-K119 PolarHBondContact O-N 2.86Å; E116-N120 WeakPolarHBondContact O-CB 3.17Å; E116-N120 PolarHBondContact O-N 3.11Å; E116-N120 PolarHBondContact O-ND2 3.24Å |
| 117 | E | 95.1 | Very high | 90.4 | Very high | 95 Ų | 95 | 127.1 Ų | 127.1 | 44% | 0.444 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.3 | -45.2 | 177.5 | -73.7 | -179.1 | -172.4 | 0 | 0 | 111.6 | K113 E114 K119 N120 H121 | K113-E117 VanDerWaalsContact CE-OE1 3.26Å; K113-E117 WeakPolarHBondContact CE-OE1 3.38Å; K113-E117 WeakPolarHBondContact O-CG 3.5Å; K113-E117 PolarHBondContact O-N 3.11Å; E114-E117 PolarHBondContact O-N 2.81Å; E117-K119 PolarHBondContact O-N 3.17Å; E117-N120 PolarHBondContact O-N 3.47Å; E117-H121 PolarHBondContact O-N 2.92Å; E117-H121 PolarHBondContact O-ND1 3.41Å |
| 118 | L | 94 | Very high | 90 | Very high | 126 Ų | 126 | 128.6 Ų | 128.6 | 66% | 0.66 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -61.9 | -42.8 | 176 | -73.7 | 171.4 | 0 | 0 | 0 | 112.1 | E114 L115 N120 H121 S122 | E114-L118 WeakPolarHBondContact O-CG 3.31Å; E114-L118 PolarHBondContact O-N 3.18Å; L115-L118 PolarHBondContact O-N 2.9Å; L118-N120 VanDerWaalsContact C-N 3.32Å; L118-N120 PolarHBondContact O-N 3.16Å; L118-H121 PolarHBondContact O-N 3.24Å; L118-S122 WeakPolarHBondContact O-CB 3.34Å; L118-S122 PolarHBondContact O-N 3.09Å |
| 119 | K | 92.9 | Very high | 89.6 | Confident | 114 Ų | 114 | 131.9 Ų | 131.9 | 50% | 0.496 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.5 | -40.2 | 176.8 | -173.4 | 177.6 | -179.1 | 179.4 | 0 | 111.5 | L115 E116 E117 S122 R123 | L115-K119 WeakPolarHBondContact O-CB 3.5Å; L115-K119 PolarHBondContact O-N 3.22Å; E116-K119 PolarHBondContact O-N 2.86Å; E117-K119 PolarHBondContact O-N 3.17Å; K119-S122 PolarHBondContact O-N 3.25Å; K119-R123 WeakPolarHBondContact O-CG 3.28Å; K119-R123 PolarHBondContact O-N 2.8Å |
| 120 | N | 92.2 | Very high | 89.1 | Confident | 80 Ų | 80 | 133.1 Ų | 133.1 | 43% | 0.428 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67.9 | -40.2 | 176.9 | -70.8 | -26.1 | 0 | 0 | 0 | 112.1 | E116 E117 L118 R123 R124 | E116-N120 WeakPolarHBondContact O-CB 3.17Å; E116-N120 PolarHBondContact O-N 3.11Å; E116-N120 PolarHBondContact O-ND2 3.24Å; E117-N120 PolarHBondContact O-N 3.47Å; L118-N120 VanDerWaalsContact C-N 3.32Å; L118-N120 PolarHBondContact O-N 3.16Å; N120-R123 PolarHBondContact O-N 2.8Å; N120-R124 PolarHBondContact O-N 3.45Å; N120-R124 VanDerWaalsContact O-N 3.11Å |
| 121 | H | 89.4 | Confident | 88.6 | Confident | 107 Ų | 107 | 134.6 Ų | 134.6 | 50% | 0.495 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -64.1 | -42.5 | 174 | -79 | 87 | 0 | 0 | 0 | 112.6 | E117 L118 R124 R125 | E117-H121 PolarHBondContact O-N 2.92Å; E117-H121 PolarHBondContact O-ND1 3.41Å; L118-H121 PolarHBondContact O-N 3.24Å; H121-R124 PolarHBondContact O-N 3.2Å; H121-R125 PolarHBondContact O-N 2.95Å |
| 122 | S | 85.2 | Confident | 88 | Confident | 80 Ų | 80 | 135.5 Ų | 135.5 | 56% | 0.559 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62 | -42.5 | 176.2 | 179.6 | 0 | 0 | 0 | 0 | 112.1 | L118 K119 R124 R125 | L118-S122 WeakPolarHBondContact O-CB 3.34Å; L118-S122 PolarHBondContact O-N 3.09Å; K119-S122 PolarHBondContact O-N 3.25Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 2.87Å; S122-R125 PolarHBondContact O-N 3.09Å |
| 123 | R | 82.8 | Confident | 87.4 | Confident | 161 Ų | 161 | 137.2 Ų | 137.2 | 61% | 0.608 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.3 | -36 | 175.4 | -77 | 175 | 172.7 | 177.8 | -5.9 | 113.5 | K119 N120 R125 | K119-R123 WeakPolarHBondContact O-CG 3.28Å; K119-R123 PolarHBondContact O-N 2.8Å; N120-R123 PolarHBondContact O-N 2.8Å; R123-R125 VanDerWaalsContact C-N 3.31Å |
| 124 | R | 79 | Confident | 86.6 | Confident | 213 Ų | 213 | 138.4 Ų | 138.4 | 80% | 0.804 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -73 | -19.3 | 178.2 | -78.8 | 179.7 | 166.8 | 172 | -3 | 114.2 | N120 H121 S122 | N120-R124 PolarHBondContact O-N 3.45Å; N120-R124 VanDerWaalsContact O-N 3.11Å; H121-R124 PolarHBondContact O-N 3.2Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 2.87Å |
| 125 | R | 72.6 | Confident | 85.8 | Confident | 229 Ų | 229 | 140 Ų | 140 | 86% | 0.864 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | -7.7 | -179.3 | -74 | -171.2 | 173.6 | -172 | -0.1 | 114.1 | H121 S122 R123 | H121-R125 PolarHBondContact O-N 2.95Å; S122-R125 PolarHBondContact O-N 3.09Å; R123-R125 VanDerWaalsContact C-N 3.31Å |
| 126 | K | 54.9 | Low | 84.9 | Confident | 244 Ų | 244 | 142 Ų | 142 | 100% | 1.061 | 63% | 0.631 | S | S | * | * | trans | -94.9 | 0 | 170.3 | -100 | -176.9 | 174.4 | -178.9 | 0 | 110 |
Retrieved 126 of 126 residues in 172.4 ms
(Link to these results)