| 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 | 45.4 | Very low | 50.4 | Low | 241 Ų | 241 | 162.5 Ų | 162.5 | 100% | 1.187 | 83% | 0.833 | S | S | * | * | 0 | 112.2 | 0 | -76.9 | -170.4 | 174.5 | 0 | 0 | 108.4 | |||||
| 2 | Q | 43.5 | Very low | 50 | Low | 195 Ų | 195 | 163.4 Ų | 163.4 | 91% | 0.911 | 83% | 0.831 | S | S | * | * | trans | -78.7 | 123.7 | 177.2 | -65.8 | 171.7 | 0.4 | 0 | 0 | 107.5 | E4 | Q2-E4 PolarHBondContact O-N 3.4Š| ||
| 3 | K | 50.8 | Low | 50.3 | Low | 168 Ų | 168 | 159.2 Ų | 159.2 | 73% | 0.73 | 83% | 0.825 | S | S | * | * | trans | -84.6 | 108.3 | 176.3 | -75 | -179.5 | 177.3 | -177.6 | 0 | 107.8 | Y5 | K3-Y5 HydrophobicContact CB-CE2 4.1Å; K3-Y5 WeakPolarHBondContact O-CD2 3.05Å; K3-Y5 PolarHBondContact O-N 3.29Å | ||
| 4 | E | 56.4 | Low | 50.2 | Low | 188 Ų | 188 | 157.5 Ų | 157.5 | 88% | 0.879 | 82% | 0.818 | S | S | * | * | trans | -69.5 | 111.4 | 170.8 | -60.8 | -164.9 | 176.4 | 0 | 0 | 108.8 | Q2 S6 | Q2-E4 PolarHBondContact O-N 3.4Å; E4-S6 PolarHBondContact O-N 2.69Å | ||
| 5 | Y | 53.9 | Low | 50.3 | Low | 186 Ų | 186 | 154.8 Ų | 154.8 | 73% | 0.729 | 81% | 0.814 | S | S | * | * | trans | -88.3 | 104.3 | 172.4 | -71.6 | -85.6 | 0 | 0 | 0 | 108.3 | K3 S7 | K3-Y5 HydrophobicContact CB-CE2 4.1Å; K3-Y5 WeakPolarHBondContact O-CD2 3.05Å; K3-Y5 PolarHBondContact O-N 3.29Å; Y5-S7 PolarHBondContact O-N 2.79Å; Y5-S7 VanDerWaalsContact O-N 3.12Å | ||
| 6 | S | 55.9 | Low | 50.4 | Low | 122 Ų | 122 | 150.1 Ų | 150.1 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -62.6 | 107.4 | 168.2 | -77.3 | 0 | 0 | 0 | 0 | 110.4 | E4 | E4-S6 PolarHBondContact O-N 2.69Š| ||
| 7 | S | 54.8 | Low | 50.6 | Low | 120 Ų | 120 | 151.8 Ų | 151.8 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -98.7 | 94.4 | 170.4 | 43.8 | 0 | 0 | 0 | 0 | 109.9 | Y5 | Y5-S7 PolarHBondContact O-N 2.79Å; Y5-S7 VanDerWaalsContact O-N 3.12Å | ||
| 8 | S | 53.6 | Low | 51 | Low | 98 Ų | 98 | 148.4 Ų | 148.4 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | trans | -149.6 | 67.2 | 166.8 | 54.8 | 0 | 0 | 0 | 0 | 112.1 | L10 | S8-L10 PolarHBondContact O-N 2.8Š| ||
| 9 | I | 51.3 | Low | 51.5 | Low | 150 Ų | 150 | 145.9 Ų | 145.9 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | -94.9 | 87.7 | 155.1 | -58.2 | 172.2 | 0 | 0 | 0 | 105.8 | H11 | I9-H11 VanDerWaalsContact C-N 3.25Å; I9-H11 PolarHBondContact O-N 2.74Å | ||
| 10 | L | 42.2 | Very low | 52 | Low | 156 Ų | 156 | 146.9 Ų | 146.9 | 82% | 0.817 | 78% | 0.775 | S | S | * | * | trans | -60.5 | 90.9 | 163.7 | -87.1 | 154 | 0 | 0 | 0 | 107.3 | S8 Q12 | S8-L10 PolarHBondContact O-N 2.8Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.8Å | ||
| 11 | H | 46.3 | Very low | 52.8 | Low | 164 Ų | 164 | 148.8 Ų | 148.8 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -65.1 | 101.6 | 159.7 | -80.8 | 163.1 | 0 | 0 | 0 | 106.8 | I9 S13 | I9-H11 VanDerWaalsContact C-N 3.25Å; I9-H11 PolarHBondContact O-N 2.74Å; H11-S13 PolarHBondContact O-N 2.73Å | ||
| 12 | Q | 46.6 | Very low | 54 | Low | 173 Ų | 173 | 147.4 Ų | 147.4 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | trans | -56.3 | 96 | 162.5 | -78 | 167.4 | -4.6 | 0 | 0 | 107.1 | L10 N14 | L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.8Å; Q12-N14 PolarHBondContact O-N 2.67Å | ||
| 13 | S | 53.4 | Low | 55.7 | Low | 108 Ų | 108 | 143.6 Ų | 143.6 | 76% | 0.755 | 76% | 0.755 | S | S | * | * | trans | -66.5 | 90.2 | 164.7 | 45.4 | 0 | 0 | 0 | 0 | 106 | H11 P15 | H11-S13 PolarHBondContact O-N 2.73Å; S13-P15 WeakPolarHBondContact O-CD 3.06Å | ||
| 14 | N | 49.1 | Very low | 57.3 | Low | 136 Ų | 136 | 145.6 Ų | 145.6 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | -58 | 112.2 | 165.7 | -83.6 | -16.9 | 0 | 0 | 0 | 106.4 | Q12 S16 | Q12-N14 PolarHBondContact O-N 2.67Å; N14-S16 PolarHBondContact O-N 2.92Å | ||
| 15 | P | 51.9 | Low | 58.7 | Low | 117 Ų | 117 | 140.2 Ų | 140.2 | 76% | 0.76 | 74% | 0.741 | S | S | * | * | trans | -79.5 | 66 | 171.2 | 32.7 | -22.6 | 0 | 0 | 0 | 105.2 | S13 H17 | S13-P15 WeakPolarHBondContact O-CD 3.06Å; P15-H17 PolarHBondContact O-N 2.82Å | ||
| 16 | S | 50.8 | Low | 60.5 | Low | 80 Ų | 80 | 134.1 Ų | 134.1 | 56% | 0.559 | 73% | 0.725 | S | S | * | * | trans | -68.4 | 84 | 162 | -179.1 | 0 | 0 | 0 | 0 | 104.5 | N14 N18 | N14-S16 PolarHBondContact O-N 2.92Å; S16-N18 PolarHBondContact O-N 2.91Å; S16-N18 PolarHBondContact OG-ND2 3.31Å; S16-N18 PolarHBondContact OG-OD1 3.27Å | ||
| 17 | H | 54.5 | Low | 62.3 | Low | 178 Ų | 178 | 133 Ų | 133 | 82% | 0.824 | 72% | 0.715 | S | S | * | * | trans | -65.7 | 62.7 | 167.8 | -148 | -76.6 | 0 | 0 | 0 | 106.1 | P15 S19 | P15-H17 PolarHBondContact O-N 2.82Å; H17-S19 PolarHBondContact O-N 3.49Å | ||
| 18 | N | 58.1 | Low | 64.1 | Low | 92 Ų | 92 | 135 Ų | 135 | 49% | 0.492 | 71% | 0.711 | S | S | . | * | trans | -59.8 | 100.4 | 165.9 | -86.1 | -28.8 | 0 | 0 | 0 | 102.7 | S16 F20 | S16-N18 PolarHBondContact O-N 2.91Å; S16-N18 PolarHBondContact OG-ND2 3.31Å; S16-N18 PolarHBondContact OG-OD1 3.27Å; N18-F20 HydrophobicContact CB-CD1 4.29Å; N18-F20 HydrophobicContact CB-CD2 3.81Å; N18-F20 HydrophobicContact CB-CE1 3.93Å; N18-F20 HydrophobicContact CB-CE2 3.41Å; N18-F20 VanDerWaalsContact CB-CE2 3.41Å; N18-F20 HydrophobicContact CB-CG 4.24Å; N18-F20 HydrophobicContact CB-CZ 3.48Å; N18-F20 VanDerWaalsContact CB-CZ 3.48Å; N18-F20 WeakPolarHBondContact O-CD2 3.44Å; N18-F20 PolarHBondContact O-N 2.96Å | ||
| 19 | S | 59.6 | Low | 65.8 | Low | 100 Ų | 100 | 136.1 Ų | 136.1 | 70% | 0.699 | 70% | 0.703 | S | S | * | * | trans | -62 | 77.7 | 164.3 | 57.7 | 0 | 0 | 0 | 0 | 105.3 | H17 K21 | H17-S19 PolarHBondContact O-N 3.49Å; S19-K21 PolarHBondContact O-N 2.92Å | ||
| 20 | F | 62.5 | Low | 67.8 | Low | 165 Ų | 165 | 132.4 Ų | 132.4 | 72% | 0.724 | 68% | 0.684 | S | S | * | * | trans | -62.5 | 99.8 | 172.6 | -67.6 | -74.8 | 0 | 0 | 0 | 103.8 | N18 K22 | N18-F20 HydrophobicContact CB-CD1 4.29Å; N18-F20 HydrophobicContact CB-CD2 3.81Å; N18-F20 HydrophobicContact CB-CE1 3.93Å; N18-F20 HydrophobicContact CB-CE2 3.41Å; N18-F20 VanDerWaalsContact CB-CE2 3.41Å; N18-F20 HydrophobicContact CB-CG 4.24Å; N18-F20 HydrophobicContact CB-CZ 3.48Å; N18-F20 VanDerWaalsContact CB-CZ 3.48Å; N18-F20 WeakPolarHBondContact O-CD2 3.44Å; N18-F20 PolarHBondContact O-N 2.96Å; F20-K22 PolarHBondContact O-N 3.36Å | ||
| 21 | K | 68.5 | Low | 70.3 | Confident | 188 Ų | 188 | 129.8 Ų | 129.8 | 82% | 0.817 | 67% | 0.671 | S | S | * | * | trans | -49.2 | 115.6 | 165.5 | -74.2 | -176.3 | 179.1 | 179.2 | 0 | 104.4 | S19 T23 | S19-K21 PolarHBondContact O-N 2.92Å; K21-T23 PolarHBondContact O-N 3.46Å | ||
| 22 | K | 71.6 | Confident | 72.2 | Confident | 212 Ų | 212 | 129.4 Ų | 129.4 | 92% | 0.922 | 67% | 0.667 | S | S | * | * | trans | -63.8 | 90.9 | -178 | -70.5 | 179.7 | 179.5 | 178.9 | 0 | 107.3 | F20 K24 | F20-K22 PolarHBondContact O-N 3.36Å; K22-K24 PolarHBondContact O-N 2.88Å | ||
| 23 | T | 78.6 | Confident | 74.1 | Confident | 115 Ų | 115 | 124.7 Ų | 124.7 | 71% | 0.706 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 118.5 | 175.4 | 52.8 | 0 | 0 | 0 | 0 | 107.3 | K21 L25 | K21-T23 PolarHBondContact O-N 3.46Å; T23-L25 PolarHBondContact O-N 3.39Å |
| 24 | K | 83.6 | Confident | 75.8 | Confident | 210 Ų | 210 | 123.6 Ų | 123.6 | 91% | 0.913 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 125.4 | 171.8 | -165.9 | 174.1 | -176.8 | 179.6 | 0 | 108.2 | K22 | K22-K24 PolarHBondContact O-N 2.88Š|
| 25 | L | 85.8 | Confident | 77.6 | Confident | 75 Ų | 75 | 122.7 Ų | 122.7 | 39% | 0.393 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -73.8 | 145.2 | 176.9 | -71.8 | 155.8 | 0 | 0 | 0 | 109.7 | T23 K29 I30 | T23-L25 PolarHBondContact O-N 3.39Å; L25-K29 HydrophobicContact CD2-CB 4.42Å; L25-K29 HydrophobicContact CD2-CD 3.46Å; L25-K29 VanDerWaalsContact CD2-CD 3.46Å; L25-K29 HydrophobicContact CD2-CG 3.87Å; L25-I30 HydrophobicContact CB-CD1 4.16Å; L25-I30 HydrophobicContact CB-CG1 3.83Å |
| 26 | S | 91.8 | Very high | 78.9 | Confident | 57 Ų | 57 | 126.8 Ų | 126.8 | 40% | 0.399 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -68.7 | 150.2 | 170.3 | 67.3 | 0 | 0 | 0 | 0 | 110.5 | Q28 K29 I30 | S26-Q28 PolarHBondContact O-N 3.1Å; S26-K29 PolarHBondContact O-N 3.06Å; S26-K29 PolarHBondContact OG-N 3.5Å; S26-I30 PolarHBondContact O-N 3.23Å; S26-I30 VanDerWaalsContact O-N 3.1Å |
| 27 | P | 93.2 | Very high | 80.3 | Confident | 99 Ų | 99 | 129.4 Ų | 129.4 | 64% | 0.643 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -54.4 | -38.6 | 176.6 | -27.1 | 35 | 0 | 0 | 0 | 113.3 | K29 I30 N31 | P27-K29 VanDerWaalsContact C-N 3.34Å; P27-K29 PolarHBondContact O-N 3.09Å; P27-I30 PolarHBondContact O-N 2.94Å; P27-N31 PolarHBondContact O-N 3.12Å |
| 28 | Q | 93.2 | Very high | 81.6 | Confident | 163 Ų | 163 | 125.5 Ų | 125.5 | 76% | 0.762 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.6 | -42.1 | 177 | -68.4 | 174.4 | -16.6 | 0 | 0 | 112.4 | S26 I30 N31 K32 | S26-Q28 PolarHBondContact O-N 3.1Å; Q28-I30 VanDerWaalsContact C-N 3.35Å; Q28-N31 PolarHBondContact O-N 3.29Å; Q28-K32 PolarHBondContact O-N 2.84Å |
| 29 | K | 90.3 | Very high | 82.5 | Confident | 120 Ų | 120 | 125.8 Ų | 125.8 | 52% | 0.522 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -69.6 | -36.1 | 178.8 | -170.6 | 164.3 | 172.9 | -178.6 | 0 | 111.4 | L25 S26 P27 K32 I33 | L25-K29 HydrophobicContact CD2-CB 4.42Å; L25-K29 HydrophobicContact CD2-CD 3.46Å; L25-K29 VanDerWaalsContact CD2-CD 3.46Å; L25-K29 HydrophobicContact CD2-CG 3.87Å; S26-K29 PolarHBondContact O-N 3.06Å; S26-K29 PolarHBondContact OG-N 3.5Å; P27-K29 VanDerWaalsContact C-N 3.34Å; P27-K29 PolarHBondContact O-N 3.09Å; K29-K32 PolarHBondContact O-N 3.07Å; K29-I33 HydrophobicContact CG-CD1 4.33Å; K29-I33 WeakPolarHBondContact O-CD1 3.43Å; K29-I33 VanDerWaalsContact O-CG1 3.27Å; K29-I33 WeakPolarHBondContact O-CG1 3.38Å; K29-I33 PolarHBondContact O-N 3.09Å; K29-I33 VanDerWaalsContact O-N 3.09Å |
| 30 | I | 93.2 | Very high | 82.8 | Confident | 72 Ų | 72 | 128.9 Ų | 128.9 | 37% | 0.369 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.4 | -49.4 | 173.8 | -65.2 | 169.2 | 0 | 0 | 0 | 110.1 | L25 S26 P27 Q28 K32 I33 I34 | L25-I30 HydrophobicContact CB-CD1 4.16Å; L25-I30 HydrophobicContact CB-CG1 3.83Å; S26-I30 PolarHBondContact O-N 3.23Å; S26-I30 VanDerWaalsContact O-N 3.1Å; P27-I30 PolarHBondContact O-N 2.94Å; Q28-I30 VanDerWaalsContact C-N 3.35Å; I30-K32 VanDerWaalsContact C-N 3.31Å; I30-K32 PolarHBondContact O-N 2.61Å; I30-I33 WeakPolarHBondContact O-CB 3.27Å; I30-I33 PolarHBondContact O-N 3.06Å; I30-I34 HydrophobicContact CG2-CD1 3.76Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.47Å; I30-I34 PolarHBondContact O-N 3.43Å |
| 31 | N | 93.4 | Very high | 83 | Confident | 102 Ų | 102 | 124.2 Ų | 124.2 | 55% | 0.545 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -59.6 | -41.3 | 179.1 | -71 | -9 | 0 | 0 | 0 | 112.2 | P27 Q28 I33 I34 E35 | P27-N31 PolarHBondContact O-N 3.12Å; Q28-N31 PolarHBondContact O-N 3.29Å; N31-I33 VanDerWaalsContact C-N 3.31Å; N31-I33 PolarHBondContact O-N 3.42Å; N31-I34 PolarHBondContact O-N 3.49Å; N31-E35 WeakPolarHBondContact O-CB 3.33Å; N31-E35 PolarHBondContact O-N 3.24Å |
| 32 | K | 87.7 | Confident | 82.7 | Confident | 156 Ų | 156 | 123 Ų | 123 | 68% | 0.678 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -62.4 | -37.6 | 175.2 | -173.3 | 172.8 | -176 | 172.5 | 0 | 112.7 | Q28 K29 I30 R36 | Q28-K32 PolarHBondContact O-N 2.84Å; K29-K32 PolarHBondContact O-N 3.07Å; I30-K32 VanDerWaalsContact C-N 3.31Å; I30-K32 PolarHBondContact O-N 2.61Å; K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.1Å; K32-R36 VanDerWaalsContact O-N 3.11Å |
| 33 | I | 86 | Confident | 82.4 | Confident | 73 Ų | 73 | 118.2 Ų | 118.2 | 37% | 0.374 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.8 | -46 | 175.2 | -68.4 | 163.3 | 0 | 0 | 0 | 109.9 | K29 I30 N31 R36 L37 | K29-I33 HydrophobicContact CG-CD1 4.33Å; K29-I33 WeakPolarHBondContact O-CD1 3.43Å; K29-I33 VanDerWaalsContact O-CG1 3.27Å; K29-I33 WeakPolarHBondContact O-CG1 3.38Å; K29-I33 PolarHBondContact O-N 3.09Å; K29-I33 VanDerWaalsContact O-N 3.09Å; I30-I33 WeakPolarHBondContact O-CB 3.27Å; I30-I33 PolarHBondContact O-N 3.06Å; N31-I33 VanDerWaalsContact C-N 3.31Å; N31-I33 PolarHBondContact O-N 3.42Å; I33-R36 PolarHBondContact O-N 3.42Å; I33-L37 HydrophobicContact CG2-CD1 3.67Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.47Å; I33-L37 VanDerWaalsContact O-CG 3.27Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 2.93Å |
| 34 | I | 89 | Confident | 81.5 | Confident | 85 Ų | 85 | 118.9 Ų | 118.9 | 44% | 0.436 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -58.1 | -54.1 | 177.7 | -68.3 | 169.8 | 0 | 0 | 0 | 109.7 | I30 N31 R36 L37 T38 | I30-I34 HydrophobicContact CG2-CD1 3.76Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.47Å; I30-I34 PolarHBondContact O-N 3.43Å; N31-I34 PolarHBondContact O-N 3.49Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.43Å; I34-L37 CarbonylContact O-C 3.53Å; I34-L37 PolarHBondContact O-N 2.87Å; I34-T38 HydrophobicContact CG2-CG2 3.89Å; I34-T38 WeakPolarHBondContact O-CB 3.4Å; I34-T38 WeakPolarHBondContact O-CG2 3.37Å; I34-T38 PolarHBondContact O-N 3.05Å; I34-T38 PolarHBondContact O-OG1 3.35Å |
| 35 | E | 86.9 | Confident | 80 | Confident | 117 Ų | 117 | 109.8 Ų | 109.8 | 55% | 0.547 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -54.6 | -44.5 | 179.9 | -173.7 | -178.8 | -171.4 | 0 | 0 | 111.8 | N31 L37 T38 N39 | N31-E35 WeakPolarHBondContact O-CB 3.33Å; N31-E35 PolarHBondContact O-N 3.24Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å; E35-T38 WeakPolarHBondContact CA-OG1 3.33Å; E35-T38 PolarHBondContact O-OG1 3.05Å; E35-N39 WeakPolarHBondContact CG-ND2 3.27Å; E35-N39 WeakPolarHBondContact O-CB 3.49Å; E35-N39 VanDerWaalsContact O-CG 3.24Å; E35-N39 PolarHBondContact O-N 2.75Å; E35-N39 PolarHBondContact O-ND2 3.35Å |
| 36 | R | 78.9 | Confident | 78.6 | Confident | 204 Ų | 204 | 110.3 Ų | 110.3 | 77% | 0.77 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63 | -37 | 175.4 | 179.5 | -178.6 | 173.3 | -172.5 | -0.8 | 112.9 | K32 I33 I34 | K32-R36 WeakPolarHBondContact O-CB 3.48Å; K32-R36 PolarHBondContact O-N 3.1Å; K32-R36 VanDerWaalsContact O-N 3.11Å; I33-R36 PolarHBondContact O-N 3.42Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.43Å |
| 37 | L | 79.1 | Confident | 76.7 | Confident | 134 Ų | 134 | 111 Ų | 111 | 70% | 0.702 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -86 | -25.2 | -176.6 | -68.4 | 177.4 | 0 | 0 | 0 | 113 | I33 I34 E35 | I33-L37 HydrophobicContact CG2-CD1 3.67Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.47Å; I33-L37 VanDerWaalsContact O-CG 3.27Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 2.93Å; I34-L37 CarbonylContact O-C 3.53Å; I34-L37 PolarHBondContact O-N 2.87Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å |
| 38 | T | 83.8 | Confident | 74.9 | Confident | 96 Ų | 96 | 112.7 Ų | 112.7 | 59% | 0.589 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -85.2 | -32.7 | 176 | 54.1 | 0 | 0 | 0 | 0 | 112 | I34 E35 Y40 | I34-T38 HydrophobicContact CG2-CG2 3.89Å; I34-T38 WeakPolarHBondContact O-CB 3.4Å; I34-T38 WeakPolarHBondContact O-CG2 3.37Å; I34-T38 PolarHBondContact O-N 3.05Å; I34-T38 PolarHBondContact O-OG1 3.35Å; E35-T38 WeakPolarHBondContact CA-OG1 3.33Å; E35-T38 PolarHBondContact O-OG1 3.05Å; T38-Y40 PolarHBondContact O-N 3.11Å |
| 39 | N | 75.8 | Confident | 73.1 | Confident | 99 Ų | 99 | 107.6 Ų | 107.6 | 53% | 0.529 | 54% | 0.54 | S | S | . | . | S | Bend | trans | -88.2 | 95.4 | 177.3 | -62.5 | -22.8 | 0 | 0 | 0 | 109.2 | E35 D41 | E35-N39 WeakPolarHBondContact CG-ND2 3.27Å; E35-N39 WeakPolarHBondContact O-CB 3.49Å; E35-N39 VanDerWaalsContact O-CG 3.24Å; E35-N39 PolarHBondContact O-N 2.75Å; E35-N39 PolarHBondContact O-ND2 3.35Å; N39-D41 PolarHBondContact O-N 3.29Å; N39-D41 VanDerWaalsContact O-N 3.16Å |
| 40 | Y | 66.9 | Low | 71.5 | Confident | 165 Ų | 165 | 104.5 Ų | 104.5 | 65% | 0.647 | 53% | 0.53 | S | S | * | . | trans | -71.5 | 107.1 | 169.5 | 177.9 | -105.8 | 0 | 0 | 0 | 109.6 | T38 K42 | T38-Y40 PolarHBondContact O-N 3.11Å; Y40-K42 HydrophobicContact CD1-CB 4.48Å; Y40-K42 HydrophobicContact CE1-CB 3.67Å | ||
| 41 | D | 66.8 | Low | 69.9 | Low | 66 Ų | 66 | 106.6 Ų | 106.6 | 35% | 0.353 | 55% | 0.551 | S | S | . | * | trans | -95.6 | 110.2 | 164.1 | -171.8 | -20.5 | 0 | 0 | 0 | 108.6 | N39 T43 I44 G45 | N39-D41 PolarHBondContact O-N 3.29Å; N39-D41 VanDerWaalsContact O-N 3.16Å; D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 PolarHBondContact O-N 3.44Å; D41-T43 VanDerWaalsContact O-N 3.08Å; D41-T43 WeakPolarHBondContact OD1-CA 3.43Å; D41-T43 WeakPolarHBondContact OD1-CB 3.41Å; D41-T43 PolarHBondContact OD1-N 2.94Å; D41-T43 PolarHBondContact OD1-OG1 2.96Å; D41-T43 PolarHBondContact OD2-OG1 3.27Å; D41-I44 HydrophobicContact CB-CB 3.96Å; D41-I44 HydrophobicContact CB-CD1 4.1Å; D41-I44 HydrophobicContact CB-CG1 4.03Å; D41-I44 CarbonylContact O-C 3.31Å; D41-I44 VanDerWaalsContact O-C 3.31Å; D41-I44 PolarHBondContact O-N 3.35Å; D41-I44 WeakPolarHBondContact OD2-CD1 3.43Å; D41-I44 VanDerWaalsContact OD2-CG1 3.29Å; D41-I44 WeakPolarHBondContact OD2-CG1 3.25Å; D41-G45 PolarHBondContact O-N 2.83Å | ||
| 42 | K | 61.4 | Low | 68.6 | Low | 164 Ų | 164 | 106 Ų | 106 | 71% | 0.713 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -23.8 | 176 | 65.7 | -178.9 | -179.8 | 178 | 0 | 113.2 | Y40 | Y40-K42 HydrophobicContact CD1-CB 4.48Å; Y40-K42 HydrophobicContact CE1-CB 3.67Å |
| 43 | T | 64 | Low | 68 | Low | 110 Ų | 110 | 103 Ų | 103 | 68% | 0.675 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | -20.3 | 178.2 | 74.4 | 0 | 0 | 0 | 0 | 112.7 | D41 | D41-T43 VanDerWaalsContact CG-OG1 3.24Å; D41-T43 PolarHBondContact O-N 3.44Å; D41-T43 VanDerWaalsContact O-N 3.08Å; D41-T43 WeakPolarHBondContact OD1-CA 3.43Å; D41-T43 WeakPolarHBondContact OD1-CB 3.41Å; D41-T43 PolarHBondContact OD1-N 2.94Å; D41-T43 PolarHBondContact OD1-OG1 2.96Å; D41-T43 PolarHBondContact OD2-OG1 3.27Å |
| 44 | I | 61.3 | Low | 67.6 | Low | 129 Ų | 129 | 103.4 Ų | 103.4 | 66% | 0.662 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -113.6 | 17.4 | 178 | -44.6 | 170.2 | 0 | 0 | 0 | 110.7 | D41 | D41-I44 HydrophobicContact CB-CB 3.96Å; D41-I44 HydrophobicContact CB-CD1 4.1Å; D41-I44 HydrophobicContact CB-CG1 4.03Å; D41-I44 CarbonylContact O-C 3.31Å; D41-I44 VanDerWaalsContact O-C 3.31Å; D41-I44 PolarHBondContact O-N 3.35Å; D41-I44 WeakPolarHBondContact OD2-CD1 3.43Å; D41-I44 VanDerWaalsContact OD2-CG1 3.29Å; D41-I44 WeakPolarHBondContact OD2-CG1 3.25Å |
| 45 | G | 52.5 | Low | 67.3 | Low | 19 Ų | 19 | 106.1 Ų | 106.1 | 20% | 0.196 | 54% | 0.539 | C | S | . | . | S | Bend | trans | -57 | 155.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | D41 P47 | D41-G45 PolarHBondContact O-N 2.83Å; G45-P47 VanDerWaalsContact O-N 3.11Å |
| 46 | P | 55.6 | Low | 67.1 | Low | 87 Ų | 87 | 105.4 Ų | 105.4 | 57% | 0.565 | 54% | 0.539 | S | S | * | . | trans | -50.2 | 129.6 | 165.9 | 21.4 | -28.5 | 0 | 0 | 0 | 106.5 | E48 S49 | P46-E48 PolarHBondContact O-N 3.25Å; P46-S49 PolarHBondContact O-N 2.95Å; P46-S49 PolarHBondContact O-OG 2.77Å | ||
| 47 | P | 52.6 | Low | 67.3 | Low | 70 Ų | 70 | 96.4 Ų | 96.4 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -10.2 | -167.1 | 23 | -34.6 | 0 | 0 | 0 | 113.2 | G45 Y63 | G45-P47 VanDerWaalsContact O-N 3.11Å; P47-Y63 VanDerWaalsContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CE1 3.18Å |
| 48 | E | 54.2 | Low | 67.8 | Low | 135 Ų | 135 | 99.8 Ų | 99.8 | 63% | 0.631 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -15.2 | 174.8 | -57.7 | -176.5 | -173 | 0 | 0 | 114.9 | P46 | P46-E48 PolarHBondContact O-N 3.25Š|
| 49 | S | 54.9 | Low | 67.7 | Low | 56 Ų | 56 | 97.9 Ų | 97.9 | 39% | 0.392 | 51% | 0.514 | S | S | . | . | trans | -96.1 | 11.1 | -177.1 | 86.1 | 0 | 0 | 0 | 0 | 114.4 | P46 S51 | P46-S49 PolarHBondContact O-N 2.95Å; P46-S49 PolarHBondContact O-OG 2.77Å; S49-S51 PolarHBondContact O-N 3.17Å | ||
| 50 | N | 57.1 | Low | 67.8 | Low | 55 Ų | 55 | 101.3 Ų | 101.3 | 29% | 0.294 | 52% | 0.519 | S | S | . | . | trans | -70 | 128.1 | 174.9 | -158.1 | 2.9 | 0 | 0 | 0 | 108.9 | E52 K53 | N50-E52 PolarHBondContact ND2-OE2 3.3Å; N50-E52 PolarHBondContact O-N 3.38Å; N50-E52 PolarHBondContact OD1-OE2 2.9Å; N50-K53 PolarHBondContact O-N 2.77Å; N50-K53 VanDerWaalsContact O-N 3.09Å | ||
| 51 | S | 60.5 | Low | 68.6 | Low | 117 Ų | 117 | 97.9 Ų | 97.9 | 82% | 0.818 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -18.2 | 177.9 | 46.5 | 0 | 0 | 0 | 0 | 112.5 | S49 K53 | S49-S51 PolarHBondContact O-N 3.17Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 2.83Å |
| 52 | E | 66.7 | Low | 69.2 | Low | 88 Ų | 88 | 99.4 Ų | 99.4 | 41% | 0.411 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 9.4 | 179.8 | -61.6 | 162.5 | 158.7 | 0 | 0 | 113.3 | N50 I54 P64 H65 | N50-E52 PolarHBondContact ND2-OE2 3.3Å; N50-E52 PolarHBondContact O-N 3.38Å; N50-E52 PolarHBondContact OD1-OE2 2.9Å; E52-I54 PolarHBondContact O-N 2.84Å; E52-P64 WeakPolarHBondContact O-CD 3.33Å; E52-H65 IonicContact OE1-CD2 3.59Å; E52-H65 IonicContact OE1-NE2 3.52Å; E52-H65 IonicContact OE2-CD2 3.3Å; E52-H65 PolarHBondContact OE2-CD2 2.96Å; E52-H65 IonicContact OE2-CG 3.93Å; E52-H65 IonicContact OE2-NE2 2.61Å; E52-H65 PolarHBondContact OE2-NE2 3.28Å |
| 53 | K | 73.7 | Confident | 70 | Confident | 94 Ų | 94 | 93.3 Ų | 93.3 | 41% | 0.409 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 127.5 | 175.7 | 71.7 | -176.5 | -179.7 | -179.1 | 0 | 110.5 | N50 S51 Y61 E62 Y63 | N50-K53 PolarHBondContact O-N 2.77Å; N50-K53 VanDerWaalsContact O-N 3.09Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 2.83Å; K53-Y61 HydrophobicContact CB-CD1 4.29Å; K53-Y61 HydrophobicContact CD-CD1 3.8Å; K53-Y61 HydrophobicContact CD-CE1 4.06Å; K53-Y61 HydrophobicContact CD-CG 4.46Å; K53-Y61 HydrophobicContact CG-CD1 4.02Å; K53-Y61 HydrophobicContact CG-CE1 4.5Å; K53-E62 WeakPolarHBondContact CA-O 3.16Å; K53-Y63 HydrophobicContact CB-CD1 4Å; K53-Y63 HydrophobicContact CB-CE1 3.69Å |
| 54 | I | 78.6 | Confident | 70.2 | Confident | 82 Ų | 82 | 91.3 Ų | 91.3 | 42% | 0.421 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 120.4 | 175.8 | -53.8 | 172.1 | 0 | 0 | 0 | 107.3 | E52 L56 Y61 E62 P64 | E52-I54 PolarHBondContact O-N 2.84Å; I54-L56 HydrophobicContact CG2-CD2 4.27Å; I54-L56 PolarHBondContact O-N 2.92Å; I54-Y61 CarbonylContact O-C 3.53Å; I54-Y61 VanDerWaalsContact O-CA 3.28Å; I54-Y61 WeakPolarHBondContact O-CA 3.36Å; I54-E62 HydrophobicContact CB-CB 4.2Å; I54-E62 PolarHBondContact N-O 3.29Å; I54-E62 PolarHBondContact O-N 2.88Å; I54-P64 HydrophobicContact CD1-CG 3.8Å; I54-P64 HydrophobicContact CG1-CG 4.27Å |
| 55 | Y | 81.2 | Confident | 70.5 | Confident | 141 Ų | 141 | 91 Ų | 91 | 55% | 0.553 | 47% | 0.468 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 120.2 | 176.6 | -178.1 | -122.9 | 0 | 0 | 0 | 110.3 | G57 Y58 R60 Y61 | Y55-G57 VanDerWaalsContact CZ-CA 3.46Å; Y55-Y58 PolarHBondContact OH-N 2.85Å; Y55-R60 WeakPolarHBondContact CD2-O 3.05Å; Y55-Y61 AromaticContact CD2-CD1 3.92Å; Y55-Y61 HydrophobicContact CD2-CD1 3.92Å; Y55-Y61 AromaticContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE1 3.41Å; Y55-Y61 VanDerWaalsContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE2 4.21Å; Y55-Y61 AromaticContact CD2-CZ 3.57Å; Y55-Y61 HydrophobicContact CE2-CE1 4.29Å; Y55-Y61 HydrophobicContact CE2-CE2 4.44Å; Y55-Y61 AromaticContact CE2-CZ 3.99Å; Y55-Y61 HydrophobicContact CG-CE1 4.08Å |
| 56 | L | 84.5 | Confident | 71.1 | Confident | 102 Ų | 102 | 95.1 Ų | 95.1 | 53% | 0.534 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 1.9 | -178.7 | -60.6 | -179.5 | 0 | 0 | 0 | 113.2 | I54 R60 E62 | I54-L56 HydrophobicContact CG2-CD2 4.27Å; I54-L56 PolarHBondContact O-N 2.92Å; L56-R60 HydrophobicContact CB-CB 4.13Å; L56-R60 PolarHBondContact N-O 2.84Å; L56-E62 HydrophobicContact CD1-CB 3.93Å; L56-E62 HydrophobicContact CD2-CB 4.35Å; L56-E62 HydrophobicContact CG-CB 4.15Å |
| 57 | G | 81.7 | Confident | 71.3 | Confident | 15 Ų | 15 | 99.1 Ų | 99.1 | 16% | 0.155 | 49% | 0.486 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 90.5 | 163.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y55 G59 R60 | Y55-G57 VanDerWaalsContact CZ-CA 3.46Å; G57-G59 PolarHBondContact O-N 2.96Å; G57-R60 VanDerWaalsContact O-CB 3.25Å; G57-R60 WeakPolarHBondContact O-CB 3.49Å; G57-R60 WeakPolarHBondContact O-CG 3.29Å; G57-R60 PolarHBondContact O-N 2.79Å |
| 58 | Y | 90.8 | Very high | 71.7 | Confident | 205 Ų | 205 | 103.2 Ų | 103.2 | 80% | 0.804 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 37.6 | 176.5 | -53 | -81.2 | 0 | 0 | 0 | 114.2 | Y55 R60 | Y55-Y58 PolarHBondContact OH-N 2.85Å; Y58-R60 PolarHBondContact O-N 3.41Å |
| 59 | G | 80.9 | Confident | 71.6 | Confident | 56 Ų | 56 | 103.8 Ų | 103.8 | 58% | 0.577 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.7 | 11.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | G57 | G57-G59 PolarHBondContact O-N 2.96Š|
| 60 | R | 78.8 | Confident | 71.7 | Confident | 171 Ų | 171 | 106.8 Ų | 106.8 | 65% | 0.645 | 51% | 0.506 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 142.3 | 178.4 | -53.7 | -178.8 | -159.3 | -142.1 | 4.3 | 110.8 | Y55 L56 G57 Y58 | Y55-R60 WeakPolarHBondContact CD2-O 3.05Å; L56-R60 HydrophobicContact CB-CB 4.13Å; L56-R60 PolarHBondContact N-O 2.84Å; G57-R60 VanDerWaalsContact O-CB 3.25Å; G57-R60 WeakPolarHBondContact O-CB 3.49Å; G57-R60 WeakPolarHBondContact O-CG 3.29Å; G57-R60 PolarHBondContact O-N 2.79Å; Y58-R60 PolarHBondContact O-N 3.41Å |
| 61 | Y | 84 | Confident | 71.6 | Confident | 94 Ų | 94 | 110.3 Ų | 110.3 | 37% | 0.369 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 139.9 | 177.4 | -63.1 | -90.1 | 0 | 0 | 0 | 110.2 | K53 I54 Y55 | K53-Y61 HydrophobicContact CB-CD1 4.29Å; K53-Y61 HydrophobicContact CD-CD1 3.8Å; K53-Y61 HydrophobicContact CD-CE1 4.06Å; K53-Y61 HydrophobicContact CD-CG 4.46Å; K53-Y61 HydrophobicContact CG-CD1 4.02Å; K53-Y61 HydrophobicContact CG-CE1 4.5Å; I54-Y61 CarbonylContact O-C 3.53Å; I54-Y61 VanDerWaalsContact O-CA 3.28Å; I54-Y61 WeakPolarHBondContact O-CA 3.36Å; Y55-Y61 AromaticContact CD2-CD1 3.92Å; Y55-Y61 HydrophobicContact CD2-CD1 3.92Å; Y55-Y61 AromaticContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE1 3.41Å; Y55-Y61 VanDerWaalsContact CD2-CE1 3.41Å; Y55-Y61 HydrophobicContact CD2-CE2 4.21Å; Y55-Y61 AromaticContact CD2-CZ 3.57Å; Y55-Y61 HydrophobicContact CE2-CE1 4.29Å; Y55-Y61 HydrophobicContact CE2-CE2 4.44Å; Y55-Y61 AromaticContact CE2-CZ 3.99Å; Y55-Y61 HydrophobicContact CG-CE1 4.08Å |
| 62 | E | 78.7 | Confident | 71.6 | Confident | 98 Ų | 98 | 113.4 Ų | 113.4 | 46% | 0.458 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 143.8 | 167.6 | -169.5 | 173.4 | -173.2 | 0 | 0 | 110.2 | K53 I54 L56 | K53-E62 WeakPolarHBondContact CA-O 3.16Å; I54-E62 HydrophobicContact CB-CB 4.2Å; I54-E62 PolarHBondContact N-O 3.29Å; I54-E62 PolarHBondContact O-N 2.88Å; L56-E62 HydrophobicContact CD1-CB 3.93Å; L56-E62 HydrophobicContact CD2-CB 4.35Å; L56-E62 HydrophobicContact CG-CB 4.15Å |
| 63 | Y | 77.6 | Confident | 71.4 | Confident | 35 Ų | 35 | 113 Ų | 113 | 14% | 0.137 | 53% | 0.534 | C | S | . | . | trans | -125.5 | 88 | -178.3 | -59.6 | -82.2 | 0 | 0 | 0 | 109 | P47 K53 H65 R66 | P47-Y63 VanDerWaalsContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CD1 3.26Å; P47-Y63 WeakPolarHBondContact O-CE1 3.18Å; K53-Y63 HydrophobicContact CB-CD1 4Å; K53-Y63 HydrophobicContact CB-CE1 3.69Å; Y63-H65 PolarHBondContact O-N 3.16Å; Y63-H65 VanDerWaalsContact O-N 3.1Å; Y63-R66 WeakPolarHBondContact O-CB 3.28Å; Y63-R66 PolarHBondContact O-N 3.26Å | ||
| 64 | P | 69.4 | Low | 71.3 | Confident | 69 Ų | 69 | 115.4 Ų | 115.4 | 45% | 0.448 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -31 | -167.6 | -24.4 | 32.6 | 0 | 0 | 0 | 114.1 | E52 I54 | E52-P64 WeakPolarHBondContact O-CD 3.33Å; I54-P64 HydrophobicContact CD1-CG 3.8Å; I54-P64 HydrophobicContact CG1-CG 4.27Å |
| 65 | H | 67 | Low | 71.3 | Confident | 122 Ų | 122 | 120.8 Ų | 120.8 | 57% | 0.565 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | 1.4 | -177.6 | -57.6 | -83.2 | 0 | 0 | 0 | 113.9 | E52 Y63 K67 | E52-H65 IonicContact OE1-CD2 3.59Å; E52-H65 IonicContact OE1-NE2 3.52Å; E52-H65 IonicContact OE2-CD2 3.3Å; E52-H65 PolarHBondContact OE2-CD2 2.96Å; E52-H65 IonicContact OE2-CG 3.93Å; E52-H65 IonicContact OE2-NE2 2.61Å; E52-H65 PolarHBondContact OE2-NE2 3.28Å; Y63-H65 PolarHBondContact O-N 3.16Å; Y63-H65 VanDerWaalsContact O-N 3.1Å; H65-K67 VanDerWaalsContact C-N 3.34Å; H65-K67 PolarHBondContact O-N 2.92Å |
| 66 | R | 64 | Low | 71.3 | Confident | 106 Ų | 106 | 119.7 Ų | 119.7 | 40% | 0.4 | 57% | 0.567 | S | S | . | * | trans | -67.9 | 100 | 167.8 | -94 | -169.7 | -176.6 | -151.1 | 11 | 108 | Y63 Y68 | Y63-R66 WeakPolarHBondContact O-CB 3.28Å; Y63-R66 PolarHBondContact O-N 3.26Å; R66-Y68 HydrophobicContact CB-CD2 4.4Å; R66-Y68 HydrophobicContact CB-CE2 4.08Å; R66-Y68 PolarHBondContact O-N 3.41Å | ||
| 67 | K | 61.1 | Low | 71.3 | Confident | 170 Ų | 170 | 118.2 Ų | 118.2 | 74% | 0.739 | 56% | 0.563 | S | S | * | * | trans | -63.2 | 96.7 | 152.3 | -65.1 | -176.4 | -177.5 | -178.9 | 0 | 105.8 | H65 F69 | H65-K67 VanDerWaalsContact C-N 3.34Å; H65-K67 PolarHBondContact O-N 2.92Å; K67-F69 HydrophobicContact CB-CD2 4.21Å; K67-F69 HydrophobicContact CB-CE2 4.04Å; K67-F69 HydrophobicContact CB-CZ 4.44Å; K67-F69 HydrophobicContact CD-CZ 4.28Å; K67-F69 PolarHBondContact O-N 2.89Å | ||
| 68 | Y | 60.8 | Low | 71.5 | Confident | 156 Ų | 156 | 125.2 Ų | 125.2 | 61% | 0.612 | 59% | 0.592 | S | S | * | * | trans | -62.7 | 95.3 | 158.5 | -64.4 | -82.3 | 0 | 0 | 0 | 104.6 | R66 N70 | R66-Y68 HydrophobicContact CB-CD2 4.4Å; R66-Y68 HydrophobicContact CB-CE2 4.08Å; R66-Y68 PolarHBondContact O-N 3.41Å; Y68-N70 PolarHBondContact O-N 3.01Å | ||
| 69 | F | 52.7 | Low | 71.5 | Confident | 148 Ų | 148 | 120.8 Ų | 120.8 | 65% | 0.649 | 59% | 0.586 | S | S | * | * | trans | -64.3 | 85.8 | 164.5 | -75 | -79.7 | 0 | 0 | 0 | 105.5 | K67 N71 | K67-F69 HydrophobicContact CB-CD2 4.21Å; K67-F69 HydrophobicContact CB-CE2 4.04Å; K67-F69 HydrophobicContact CB-CZ 4.44Å; K67-F69 HydrophobicContact CD-CZ 4.28Å; K67-F69 PolarHBondContact O-N 2.89Å; F69-N71 WeakPolarHBondContact CD1-OD1 3.33Å; F69-N71 PolarHBondContact O-N 3.1Å | ||
| 70 | N | 55.2 | Low | 71.7 | Confident | 119 Ų | 119 | 122 Ų | 122 | 64% | 0.636 | 58% | 0.577 | S | S | * | * | trans | -70.9 | 56.4 | 158.9 | -87 | -4.7 | 0 | 0 | 0 | 107.2 | Y68 E72 S73 | Y68-N70 PolarHBondContact O-N 3.01Å; N70-E72 PolarHBondContact O-N 2.64Å; N70-S73 VanDerWaalsContact CG-OG 3.27Å; N70-S73 PolarHBondContact OD1-OG 3.27Å | ||
| 71 | N | 55.9 | Low | 71.6 | Confident | 128 Ų | 128 | 118.9 Ų | 118.9 | 68% | 0.684 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -69.9 | -16.1 | 176.5 | -75.2 | 4.9 | 0 | 0 | 0 | 110.4 | F69 | F69-N71 WeakPolarHBondContact CD1-OD1 3.33Å; F69-N71 PolarHBondContact O-N 3.1Å |
| 72 | E | 59.7 | Low | 70.7 | Confident | 183 Ų | 183 | 123 Ų | 123 | 86% | 0.855 | 60% | 0.603 | S | S | * | * | trans | -139.5 | 25.3 | -174.3 | -60.8 | -162 | 174.4 | 0 | 0 | 114.6 | N70 K74 | N70-E72 PolarHBondContact O-N 2.64Å; E72-K74 PolarHBondContact O-N 2.78Å | ||
| 73 | S | 62.5 | Low | 70.3 | Confident | 80 Ų | 80 | 124.3 Ų | 124.3 | 56% | 0.559 | 61% | 0.61 | S | S | * | * | trans | -72.6 | 73.9 | 159.9 | -54.9 | 0 | 0 | 0 | 0 | 108.1 | N70 K75 | N70-S73 VanDerWaalsContact CG-OG 3.27Å; N70-S73 PolarHBondContact OD1-OG 3.27Å; S73-K75 PolarHBondContact O-N 3.08Å | ||
| 74 | K | 73.2 | Confident | 69.9 | Low | 144 Ų | 144 | 129 Ų | 129 | 63% | 0.626 | 64% | 0.635 | S | S | * | * | trans | -51.9 | 116.2 | 169.1 | -176.9 | -174.1 | -178.6 | -171.3 | 0 | 106.3 | E72 L76 E80 | E72-K74 PolarHBondContact O-N 2.78Å; K74-L76 PolarHBondContact O-N 2.93Å; K74-L76 VanDerWaalsContact O-N 3.1Å; K74-E80 WeakPolarHBondContact CE-OE1 3.34Å; K74-E80 IonicContact NZ-OE1 3.89Å; K74-E80 PolarHBondContact NZ-OE1 2.75Å; K74-E80 IonicContact NZ-OE2 2.75Å | ||
| 75 | K | 76.8 | Confident | 69.9 | Low | 194 Ų | 194 | 132.3 Ų | 132.3 | 84% | 0.843 | 65% | 0.646 | S | S | * | * | trans | -62.9 | 115.4 | 167.3 | -79.7 | -172.1 | 176 | -175.8 | 0 | 106.4 | S73 T77 | S73-K75 PolarHBondContact O-N 3.08Å; K75-T77 PolarHBondContact O-N 3.33Å | ||
| 76 | L | 81.2 | Confident | 70.1 | Confident | 118 Ų | 118 | 132.9 Ų | 132.9 | 62% | 0.618 | 65% | 0.65 | S | S | * | * | trans | -59.5 | 135.4 | 173.4 | -68.2 | 171.6 | 0 | 0 | 0 | 108.6 | K74 E80 V81 | K74-L76 PolarHBondContact O-N 2.93Å; K74-L76 VanDerWaalsContact O-N 3.1Å; L76-E80 WeakPolarHBondContact CA-OE2 3.37Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; L76-V81 HydrophobicContact CB-CG2 4.11Å; L76-V81 HydrophobicContact CD1-CG2 4.5Å | ||
| 77 | T | 84.9 | Confident | 70.5 | Confident | 72 Ų | 72 | 134.6 Ų | 134.6 | 44% | 0.442 | 67% | 0.666 | S | S | . | * | trans | -80.9 | 153.7 | 171.4 | 53.6 | 0 | 0 | 0 | 0 | 109.4 | K75 T79 E80 | K75-T77 PolarHBondContact O-N 3.33Å; T77-T79 PolarHBondContact O-N 3.06Å; T77-T79 PolarHBondContact OG1-OG1 3.34Å; T77-T79 VanDerWaalsContact OG1-OG1 3.09Å; T77-E80 PolarHBondContact N-OE2 2.81Å; T77-E80 PolarHBondContact O-N 3.3Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-OE2 3.49Å | ||
| 78 | Q | 87.1 | Confident | 71.1 | Confident | 162 Ų | 162 | 132.3 Ų | 132.3 | 76% | 0.757 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -56.2 | -29 | -178.5 | -170.8 | 175.4 | 2.4 | 0 | 0 | 112.4 | E80 V81 I82 | Q78-E80 VanDerWaalsContact C-N 3.31Å; Q78-E80 PolarHBondContact O-N 3.46Å; Q78-V81 PolarHBondContact O-N 3.09Å; Q78-I82 HydrophobicContact CG-CD1 4.3Å |
| 79 | T | 89.8 | Confident | 71.8 | Confident | 112 Ų | 112 | 130.6 Ų | 130.6 | 69% | 0.687 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.2 | -17.9 | 175.5 | 47 | 0 | 0 | 0 | 0 | 114.7 | T77 | T77-T79 PolarHBondContact O-N 3.06Å; T77-T79 PolarHBondContact OG1-OG1 3.34Å; T77-T79 VanDerWaalsContact OG1-OG1 3.09Å |
| 80 | E | 84.7 | Confident | 73.3 | Confident | 81 Ų | 81 | 129.2 Ų | 129.2 | 38% | 0.379 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -91.8 | -15 | 175.3 | -67.6 | 169.2 | 129.9 | 0 | 0 | 112.3 | K74 L76 T77 Q78 | K74-E80 WeakPolarHBondContact CE-OE1 3.34Å; K74-E80 IonicContact NZ-OE1 3.89Å; K74-E80 PolarHBondContact NZ-OE1 2.75Å; K74-E80 IonicContact NZ-OE2 2.75Å; L76-E80 WeakPolarHBondContact CA-OE2 3.37Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; T77-E80 PolarHBondContact N-OE2 2.81Å; T77-E80 PolarHBondContact O-N 3.3Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-OE2 3.49Å; Q78-E80 VanDerWaalsContact C-N 3.31Å; Q78-E80 PolarHBondContact O-N 3.46Å |
| 81 | V | 77.3 | Confident | 74.8 | Confident | 105 Ų | 105 | 130.1 Ų | 130.1 | 64% | 0.636 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -90.6 | -18.5 | -178.3 | -180 | 0 | 0 | 0 | 0 | 111.8 | L76 Q78 | L76-V81 HydrophobicContact CB-CG2 4.11Å; L76-V81 HydrophobicContact CD1-CG2 4.5Å; Q78-V81 PolarHBondContact O-N 3.09Å |
| 82 | I | 64.5 | Low | 76.5 | Confident | 182 Ų | 182 | 130.3 Ų | 130.3 | 93% | 0.933 | 67% | 0.667 | S | S | * | * | trans | -100.2 | 0 | 178.6 | -57.8 | 170.5 | 0 | 0 | 0 | 108.9 | Q78 | Q78-I82 HydrophobicContact CG-CD1 4.3Š|
Retrieved 82 of 82 residues in 53 ms
(Link to these results)