| 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 | 67.6 | Low | 58.8 | Low | 237 Ų | 237 | 129.4 Ų | 129.4 | 100% | 1.167 | 79% | 0.794 | S | S | * | * | 0 | 96.5 | 0 | 52.3 | -169.2 | 79.7 | 0 | 0 | 108.5 | |||||
| 2 | P | 62.5 | Low | 58 | Low | 138 Ų | 138 | 129.4 Ų | 129.4 | 90% | 0.896 | 80% | 0.798 | S | S | * | * | trans | -141.9 | 156.3 | 132.8 | 39 | -26.5 | 0 | 0 | 0 | 109.5 | ||||
| 3 | G | 49 | Very low | 57.4 | Low | 68 Ų | 68 | 131.9 Ų | 131.9 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | cis | -178.7 | 146.9 | 4.9 | 0 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 4 | L | 68.2 | Low | 57.1 | Low | 174 Ų | 174 | 131.6 Ų | 131.6 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -54.9 | 131.7 | 175.9 | -148.1 | 83.6 | 0 | 0 | 0 | 110.6 | ||||
| 5 | V | 58.7 | Low | 56.4 | Low | 143 Ų | 143 | 134.1 Ų | 134.1 | 87% | 0.867 | 80% | 0.797 | S | S | * | * | trans | -126.2 | 104 | 152.7 | 45 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 6 | D | 54.2 | Low | 55.7 | Low | 120 Ų | 120 | 136.1 Ų | 136.1 | 64% | 0.642 | 80% | 0.795 | S | S | * | * | trans | -71.4 | 139 | 171.7 | 171.7 | -114.7 | 0 | 0 | 0 | 111.3 | ||||
| 7 | S | 58.6 | Low | 55.5 | Low | 93 Ų | 93 | 139.2 Ų | 139.2 | 65% | 0.65 | 80% | 0.797 | S | S | * | * | trans | 36.4 | 119.5 | 145.3 | -56 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 8 | N | 73.3 | Confident | 54.8 | Low | 139 Ų | 139 | 139.3 Ų | 139.3 | 74% | 0.743 | 79% | 0.787 | S | S | * | * | 68.3 | 117.1 | 127 | -163.1 | 21.1 | 0 | 0 | 0 | 119.5 | |||||
| 9 | P | 47.8 | Very low | 54.5 | Low | 124 Ų | 124 | 137.4 Ų | 137.4 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | trans | -101.4 | 125.2 | 143.8 | 31.6 | -24.1 | 0 | 0 | 0 | 111.8 | ||||
| 10 | A | 50.8 | Low | 54 | Low | 76 Ų | 76 | 136.6 Ų | 136.6 | 63% | 0.628 | 77% | 0.773 | S | S | * | * | trans | -32.5 | 156 | 169.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 11 | P | 56.6 | Low | 53.7 | Low | 111 Ų | 111 | 136.6 Ų | 136.6 | 72% | 0.721 | 77% | 0.765 | S | S | * | * | trans | -61 | 138.9 | -177.7 | 25.1 | -35.1 | 0 | 0 | 0 | 111.9 | E13 | P11-E13 PolarHBondContact O-N 2.86Å; P11-E13 VanDerWaalsContact O-N 3.11Å | ||
| 12 | P | 48.8 | Very low | 53.1 | Low | 130 Ų | 130 | 128.6 Ų | 128.6 | 84% | 0.844 | 73% | 0.731 | S | S | * | * | trans | -71.4 | 112.4 | 174 | 27.9 | -30.9 | 0 | 0 | 0 | 110 | ||||
| 13 | E | 50.3 | Low | 52.6 | Low | 162 Ų | 162 | 124.6 Ų | 124.6 | 76% | 0.757 | 71% | 0.705 | S | S | * | * | trans | -54.5 | 155.1 | 166.6 | -80.3 | 176.1 | 78.2 | 0 | 0 | 112.9 | P11 Q15 | P11-E13 PolarHBondContact O-N 2.86Å; P11-E13 VanDerWaalsContact O-N 3.11Å; E13-Q15 PolarHBondContact O-N 3.42Å; E13-Q15 VanDerWaalsContact O-N 3.07Å | ||
| 14 | P | 53.3 | Low | 52.9 | Low | 127 Ų | 127 | 126.6 Ų | 126.6 | 83% | 0.825 | 71% | 0.707 | S | S | * | * | trans | -80.2 | 92.6 | -169.1 | 31.8 | -33.1 | 0 | 0 | 0 | 112.1 | E16 | P14-E16 PolarHBondContact O-N 3.05Å; P14-E16 VanDerWaalsContact O-N 3.16Å | ||
| 15 | Q | 46 | Very low | 52.6 | Low | 170 Ų | 170 | 119.2 Ų | 119.2 | 79% | 0.794 | 67% | 0.671 | S | S | * | * | trans | -78.3 | 97.2 | 171.3 | -72.8 | 162.4 | 42.8 | 0 | 0 | 111 | E13 | E13-Q15 PolarHBondContact O-N 3.42Å; E13-Q15 VanDerWaalsContact O-N 3.07Å | ||
| 16 | E | 46.5 | Very low | 53.2 | Low | 165 Ų | 165 | 112.7 Ų | 112.7 | 77% | 0.771 | 63% | 0.632 | S | S | * | * | S | Bend | trans | 28.8 | 112 | 130.7 | -152.2 | 174.4 | 112.8 | 0 | 0 | 117.2 | P14 K18 | P14-E16 PolarHBondContact O-N 3.05Å; P14-E16 VanDerWaalsContact O-N 3.16Å; E16-K18 PolarHBondContact O-N 3.33Å; E16-K18 VanDerWaalsContact O-N 3.13Å |
| 17 | K | 50.8 | Low | 54.2 | Low | 189 Ų | 189 | 111 Ų | 111 | 82% | 0.822 | 63% | 0.628 | S | S | * | * | trans | 49.5 | 44.1 | 158.8 | -59.6 | 169.9 | -170.3 | 157.3 | 0 | 115.8 | ||||
| 18 | K | 43.8 | Very low | 55.1 | Low | 142 Ų | 142 | 114.6 Ų | 114.6 | 62% | 0.617 | 63% | 0.634 | S | S | * | * | trans | -70.8 | 124 | 160.8 | -169.8 | 95.7 | -89.4 | -170.9 | 0 | 107.3 | E16 L20 K21 | E16-K18 PolarHBondContact O-N 3.33Å; E16-K18 VanDerWaalsContact O-N 3.13Å; K18-L20 PolarHBondContact O-N 3.49Å; K18-K21 HydrophobicContact CG-CG 4.39Å | ||
| 19 | P | 48 | Very low | 55.5 | Low | 103 Ų | 103 | 109.4 Ų | 109.4 | 67% | 0.669 | 61% | 0.608 | S | S | * | * | trans | -51.8 | 121.6 | 170 | 22.9 | -31.9 | 0 | 0 | 0 | 106 | K21 | P19-K21 PolarHBondContact O-N 3.24Š| ||
| 20 | L | 45.1 | Very low | 56.9 | Low | 121 Ų | 121 | 107.2 Ų | 107.2 | 63% | 0.634 | 59% | 0.585 | S | S | * | * | trans | -44.9 | 114.9 | -178.5 | -112.7 | 71.9 | 0 | 0 | 0 | 106.1 | K18 F61 | K18-L20 PolarHBondContact O-N 3.49Å; L20-F61 HydrophobicContact CB-CE1 3.3Å; L20-F61 HydrophobicContact CB-CZ 3.26Å; L20-F61 HydrophobicContact CD2-CE1 4.49Å; L20-F61 HydrophobicContact CD2-CZ 3.64Å; L20-F61 HydrophobicContact CG-CE1 4.5Å; L20-F61 HydrophobicContact CG-CZ 4.08Å; L20-F61 WeakPolarHBondContact O-CE1 3.4Å | ||
| 21 | K | 47.9 | Very low | 58.4 | Low | 136 Ų | 136 | 111.2 Ų | 111.2 | 59% | 0.591 | 59% | 0.589 | S | S | * | * | trans | -56.4 | 130.4 | -169.6 | -56.3 | 168.7 | -166.6 | 166.1 | 0 | 106.2 | K18 P19 C23 C24 | K18-K21 HydrophobicContact CG-CG 4.39Å; P19-K21 PolarHBondContact O-N 3.24Å; K21-C23 WeakPolarHBondContact CB-SG 3.44Å; K21-C23 PolarHBondContact O-N 3.26Å; K21-C24 PolarHBondContact O-N 3.21Å; K21-C24 VanDerWaalsContact O-N 3.11Å | ||
| 22 | P | 54.7 | Low | 59.6 | Low | 70 Ų | 70 | 107.8 Ų | 107.8 | 46% | 0.455 | 57% | 0.569 | S | S | . | * | G | 310 helix | trans | -58.6 | -8.2 | -179.3 | 23.4 | -34.6 | 0 | 0 | 0 | 113.3 | C24 M56 | P22-C24 VanDerWaalsContact C-N 3.26Å; P22-C24 PolarHBondContact O-N 3.35Å; P22-M56 HydrophobicContact CB-CE 4.24Å; P22-M56 HydrophobicContact CB-SD 3.36Å; P22-M56 WeakPolarHBondContact CB-SD 3.44Å |
| 23 | C | 51.3 | Low | 61.3 | Low | 53 Ų | 53 | 104.7 Ų | 104.7 | 36% | 0.358 | 54% | 0.541 | S | S | . | . | G | 310 helix | trans | -65.5 | -16.4 | 172.7 | 68.8 | 0 | 0 | 0 | 0 | 115.6 | K21 K30 | K21-C23 WeakPolarHBondContact CB-SG 3.44Å; K21-C23 PolarHBondContact O-N 3.26Å; C23-K30 HydrophobicContact CB-CD 4.47Å |
| 24 | C | 55.7 | Low | 62.9 | Low | 110 Ų | 110 | 99.9 Ų | 99.9 | 74% | 0.743 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -103.6 | -9.7 | -178.2 | -105.1 | 0 | 0 | 0 | 0 | 115.3 | K21 P22 | K21-C24 PolarHBondContact O-N 3.21Å; K21-C24 VanDerWaalsContact O-N 3.11Å; P22-C24 VanDerWaalsContact C-N 3.26Å; P22-C24 PolarHBondContact O-N 3.35Å |
| 25 | A | 62.6 | Low | 64.4 | Low | 20 Ų | 20 | 96 Ų | 96 | 17% | 0.165 | 50% | 0.499 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | -44 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | M56 L59 F61 | A25-M56 HydrophobicContact CB-CG 3.87Å; A25-L59 VanDerWaalsContact CA-CD1 3.47Å; A25-L59 HydrophobicContact CB-CD1 3.39Å; A25-L59 VanDerWaalsContact O-CD1 3.31Å; A25-L59 WeakPolarHBondContact O-CD1 3.22Å; A25-F61 HydrophobicContact CB-CE2 4.49Å |
| 26 | C | 71.4 | Confident | 66.3 | Low | 5 Ų | 5 | 88.9 Ų | 88.9 | 3% | 0.034 | 47% | 0.468 | C | S | . | . | trans | -148.3 | 75 | -171.8 | -35.1 | 0 | 0 | 0 | 0 | 108.8 | E28 T29 K30 C55 | C26-E28 PolarHBondContact O-N 3.13Å; C26-T29 HydrophobicContact CB-CG2 4.35Å; C26-T29 WeakPolarHBondContact CB-OG1 3.49Å; C26-T29 PolarHBondContact O-N 3.34Å; C26-T29 PolarHBondContact O-OG1 3.34Å; C26-K30 VanDerWaalsContact O-CB 3.24Å; C26-K30 WeakPolarHBondContact O-CB 3.46Å; C26-K30 PolarHBondContact O-N 3.43Å; C26-C55 HydrophobicContact CB-CB 3.96Å; C26-C55 WeakPolarHBondContact CB-SG 3.2Å; C26-C55 VanDerWaalsContact SG-C 3.53Å; C26-C55 WeakPolarHBondContact SG-CB 3.12Å; C26-C55 CovalentContact SG-SG 2Å; C26-C55 PolarHBondContact SG-SG 3.09Å | ||
| 27 | P | 75.6 | Confident | 68.1 | Low | 85 Ų | 85 | 83 Ų | 83 | 55% | 0.552 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -61.7 | -32.7 | -178.8 | 24.8 | -33.4 | 0 | 0 | 0 | 111.8 | K31 | P27-K31 WeakPolarHBondContact O-CB 3.48Å; P27-K31 PolarHBondContact O-N 3.35Å |
| 28 | E | 77.3 | Confident | 69.7 | Low | 168 Ų | 168 | 80.4 Ų | 80.4 | 79% | 0.785 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -64.5 | -55.8 | 176 | -103.9 | 175.1 | 76.2 | 0 | 0 | 112.5 | C26 K30 K31 A32 | C26-E28 PolarHBondContact O-N 3.13Å; E28-K30 VanDerWaalsContact C-N 3.31Å; E28-K30 PolarHBondContact O-N 2.91Å; E28-K31 PolarHBondContact O-N 3.15Å; E28-A32 WeakPolarHBondContact O-CB 3.38Å; E28-A32 PolarHBondContact O-N 2.82Å |
| 29 | T | 80.4 | Confident | 71.6 | Confident | 31 Ų | 31 | 81.7 Ų | 81.7 | 19% | 0.19 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -68.8 | -33.2 | -178 | 67.3 | 0 | 0 | 0 | 0 | 111.4 | C26 R33 A51 H52 | C26-T29 HydrophobicContact CB-CG2 4.35Å; C26-T29 WeakPolarHBondContact CB-OG1 3.49Å; C26-T29 PolarHBondContact O-N 3.34Å; C26-T29 PolarHBondContact O-OG1 3.34Å; T29-R33 WeakPolarHBondContact O-CB 3.05Å; T29-R33 PolarHBondContact O-N 2.86Å; T29-A51 HydrophobicContact CG2-CB 4.35Å; T29-H52 VanDerWaalsContact OG1-CA 3.31Å; T29-H52 WeakPolarHBondContact OG1-CA 3.33Å; T29-H52 VanDerWaalsContact OG1-CB 3.31Å; T29-H52 WeakPolarHBondContact OG1-CB 3.46Å; T29-H52 PolarHBondContact OG1-ND1 2.99Å |
| 30 | K | 77.9 | Confident | 73.1 | Confident | 77 Ų | 77 | 83.8 Ų | 83.8 | 34% | 0.335 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66 | -45.3 | 174.8 | -170.4 | -125.7 | 175 | 179.1 | 0 | 111.2 | C23 C26 E28 R33 D34 | C23-K30 HydrophobicContact CB-CD 4.47Å; C26-K30 VanDerWaalsContact O-CB 3.24Å; C26-K30 WeakPolarHBondContact O-CB 3.46Å; C26-K30 PolarHBondContact O-N 3.43Å; E28-K30 VanDerWaalsContact C-N 3.31Å; E28-K30 PolarHBondContact O-N 2.91Å; K30-R33 PolarHBondContact O-N 2.83Å; K30-D34 WeakPolarHBondContact O-CB 3.36Å; K30-D34 PolarHBondContact O-N 3Å |
| 31 | K | 81.5 | Confident | 74.7 | Confident | 161 Ų | 161 | 79.1 Ų | 79.1 | 70% | 0.7 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -67 | -41.3 | 178 | -172.3 | 177.6 | -178.4 | -179.1 | 0 | 111.3 | P27 E28 R33 D34 A35 | P27-K31 WeakPolarHBondContact O-CB 3.48Å; P27-K31 PolarHBondContact O-N 3.35Å; E28-K31 PolarHBondContact O-N 3.15Å; K31-R33 VanDerWaalsContact C-N 3.35Å; K31-D34 PolarHBondContact O-N 3.42Å; K31-A35 WeakPolarHBondContact O-CB 3.48Å; K31-A35 PolarHBondContact O-N 3.08Å |
| 32 | A | 83.3 | Confident | 75.8 | Confident | 38 Ų | 38 | 79.3 Ų | 79.3 | 31% | 0.314 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | E28 A35 C36 L48 | E28-A32 WeakPolarHBondContact O-CB 3.38Å; E28-A32 PolarHBondContact O-N 2.82Å; A32-A35 PolarHBondContact O-N 3.13Å; A32-C36 WeakPolarHBondContact O-CB 3.38Å; A32-C36 PolarHBondContact O-N 2Å; A32-L48 HydrophobicContact CB-CD1 4.23Å; A32-L48 HydrophobicContact CB-CD2 3.96Å; A32-L48 WeakPolarHBondContact O-CD1 3.31Å |
| 33 | R | 84.9 | Confident | 76.8 | Confident | 65 Ų | 65 | 84 Ų | 84 | 25% | 0.245 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -62.3 | -49 | 175.1 | -170.4 | -131.4 | 72.2 | -164.1 | 6.2 | 111.4 | T29 K30 K31 C36 I37 L48 I49 | T29-R33 WeakPolarHBondContact O-CB 3.05Å; T29-R33 PolarHBondContact O-N 2.86Å; K30-R33 PolarHBondContact O-N 2.83Å; K31-R33 VanDerWaalsContact C-N 3.35Å; R33-C36 PolarHBondContact O-N 3.37Å; R33-I37 HydrophobicContact CG-CD1 4.09Å; R33-I37 WeakPolarHBondContact O-CG1 2.85Å; R33-I37 PolarHBondContact O-N 3Å; R33-L48 HydrophobicContact CB-CB 4.23Å; R33-I49 HydrophobicContact CG-CG1 3.66Å |
| 34 | D | 83.6 | Confident | 78 | Confident | 61 Ų | 61 | 86.9 Ų | 86.9 | 33% | 0.326 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -58.7 | -47.8 | 176.9 | -120.8 | -97.4 | 0 | 0 | 0 | 111.5 | K30 K31 C36 I37 I38 | K30-D34 WeakPolarHBondContact O-CB 3.36Å; K30-D34 PolarHBondContact O-N 3Å; K31-D34 PolarHBondContact O-N 3.42Å; D34-C36 VanDerWaalsContact C-N 3.35Å; D34-C36 PolarHBondContact O-N 3.23Å; D34-I37 PolarHBondContact O-N 2.96Å; D34-I38 VanDerWaalsContact O-CG1 3.27Å; D34-I38 WeakPolarHBondContact O-CG1 3.31Å; D34-I38 PolarHBondContact O-N 2.91Å |
| 35 | A | 84.1 | Confident | 79.2 | Confident | 47 Ų | 47 | 81.7 Ų | 81.7 | 39% | 0.388 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | K31 A32 I38 E39 | K31-A35 WeakPolarHBondContact O-CB 3.48Å; K31-A35 PolarHBondContact O-N 3.08Å; A32-A35 PolarHBondContact O-N 3.13Å; A35-I38 PolarHBondContact O-N 3.38Å; A35-E39 WeakPolarHBondContact O-CB 3.42Å; A35-E39 WeakPolarHBondContact O-CG 3.15Å; A35-E39 PolarHBondContact O-N 3.45Å |
| 36 | C | 85.7 | Confident | 80 | Confident | 19 Ų | 19 | 82.4 Ų | 82.4 | 13% | 0.128 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -65.6 | -38.7 | 176.4 | 176.9 | 0 | 0 | 0 | 0 | 111.8 | A32 R33 D34 I38 E39 K40 G41 C45 L48 | A32-C36 WeakPolarHBondContact O-CB 3.38Å; A32-C36 PolarHBondContact O-N 2Å; R33-C36 PolarHBondContact O-N 3.37Å; D34-C36 VanDerWaalsContact C-N 3.35Å; D34-C36 PolarHBondContact O-N 3.23Å; C36-I38 VanDerWaalsContact C-N 3.29Å; C36-I38 PolarHBondContact O-N 2.97Å; C36-E39 PolarHBondContact O-N 2.98Å; C36-K40 WeakPolarHBondContact O-CA 3.46Å; C36-K40 PolarHBondContact O-N 3.33Å; C36-G41 PolarHBondContact O-N 2.99Å; C36-C45 VanDerWaalsContact CA-SG 3.56Å; C36-C45 HydrophobicContact CB-CB 3.9Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 PolarHBondContact O-SG 3.38Å; C36-C45 WeakPolarHBondContact SG-CA 3.45Å; C36-C45 WeakPolarHBondContact SG-CB 3.37Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 3.11Å; C36-L48 HydrophobicContact CB-CD1 3.39Å |
| 37 | I | 83.8 | Confident | 80.5 | Confident | 41 Ų | 41 | 89.6 Ų | 89.6 | 21% | 0.21 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 175.6 | -68.8 | 171.3 | 0 | 0 | 0 | 110.1 | R33 D34 G41 E42 C45 | R33-I37 HydrophobicContact CG-CD1 4.09Å; R33-I37 WeakPolarHBondContact O-CG1 2.85Å; R33-I37 PolarHBondContact O-N 3Å; D34-I37 PolarHBondContact O-N 2.96Å; I37-G41 VanDerWaalsContact O-CA 3.28Å; I37-G41 WeakPolarHBondContact O-CA 3.37Å; I37-G41 PolarHBondContact O-N 2.85Å; I37-G41 VanDerWaalsContact O-N 3.09Å; I37-E42 HydrophobicContact CB-CG 4.34Å; I37-E42 HydrophobicContact CD1-CG 4.01Å; I37-E42 HydrophobicContact CG1-CB 4.39Å; I37-E42 HydrophobicContact CG1-CG 3.85Å; I37-E42 HydrophobicContact CG2-CG 3.63Å; I37-C45 HydrophobicContact CG1-CB 4.38Å; I37-C45 PolarHBondContact N-SG 3.2Å; I37-C45 VanDerWaalsContact N-SG 3.36Å |
| 38 | I | 84.8 | Confident | 80.9 | Confident | 135 Ų | 135 | 88.2 Ų | 88.2 | 69% | 0.692 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -67.4 | -40.1 | 177.4 | -68.2 | 166.5 | 0 | 0 | 0 | 111.5 | D34 A35 C36 | D34-I38 VanDerWaalsContact O-CG1 3.27Å; D34-I38 WeakPolarHBondContact O-CG1 3.31Å; D34-I38 PolarHBondContact O-N 2.91Å; A35-I38 PolarHBondContact O-N 3.38Å; C36-I38 VanDerWaalsContact C-N 3.29Å; C36-I38 PolarHBondContact O-N 2.97Å |
| 39 | E | 85 | Confident | 81.1 | Confident | 170 Ų | 170 | 82.7 Ų | 82.7 | 79% | 0.794 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -88.9 | -36.7 | -174.9 | -71.6 | -138.8 | 113.1 | 0 | 0 | 114.8 | A35 C36 | A35-E39 WeakPolarHBondContact O-CB 3.42Å; A35-E39 WeakPolarHBondContact O-CG 3.15Å; A35-E39 PolarHBondContact O-N 3.45Å; C36-E39 PolarHBondContact O-N 2.98Å |
| 40 | K | 79.8 | Confident | 81.2 | Confident | 146 Ų | 146 | 87.5 Ų | 87.5 | 64% | 0.635 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -125.3 | -9 | -170.7 | -66 | -157 | 172.8 | -150.2 | 0 | 114.7 | C36 H44 | C36-K40 WeakPolarHBondContact O-CA 3.46Å; C36-K40 PolarHBondContact O-N 3.33Å; K40-H44 HydrophobicContact CB-CB 3.87Å; K40-H44 HydrophobicContact CD-CB 4.37Å; K40-H44 PolarHBondContact O-ND1 3.32Å; K40-H44 VanDerWaalsContact O-ND1 3.14Å |
| 41 | G | 77.1 | Confident | 81.4 | Confident | 23 Ų | 23 | 86 Ų | 86 | 24% | 0.237 | 44% | 0.441 | C | S | . | . | trans | 81.4 | 153.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | C36 I37 E43 H44 C45 | C36-G41 PolarHBondContact O-N 2.99Å; I37-G41 VanDerWaalsContact O-CA 3.28Å; I37-G41 WeakPolarHBondContact O-CA 3.37Å; I37-G41 PolarHBondContact O-N 2.85Å; I37-G41 VanDerWaalsContact O-N 3.09Å; G41-E43 PolarHBondContact O-N 2.86Å; G41-H44 PolarHBondContact O-N 3.3Å; G41-H44 VanDerWaalsContact O-N 3.11Å; G41-C45 PolarHBondContact O-SG 2.03Å | ||
| 42 | E | 71.6 | Confident | 81.5 | Confident | 140 Ų | 140 | 78.9 Ų | 78.9 | 65% | 0.654 | 41% | 0.411 | S | S | * | . | G | 310 helix | trans | -54.6 | -29.5 | -174 | -55.6 | -170.4 | 91.4 | 0 | 0 | 113.8 | I37 H44 C45 | I37-E42 HydrophobicContact CB-CG 4.34Å; I37-E42 HydrophobicContact CD1-CG 4.01Å; I37-E42 HydrophobicContact CG1-CB 4.39Å; I37-E42 HydrophobicContact CG1-CG 3.85Å; I37-E42 HydrophobicContact CG2-CG 3.63Å; E42-H44 VanDerWaalsContact C-N 3.32Å; E42-H44 PolarHBondContact O-N 3.4Å; E42-C45 PolarHBondContact O-N 3.14Å |
| 43 | E | 74.9 | Confident | 81.3 | Confident | 168 Ų | 168 | 82.1 Ų | 82.1 | 79% | 0.785 | 42% | 0.418 | S | S | * | . | G | 310 helix | trans | -63.6 | -30.2 | -179.5 | 65.9 | -165.2 | 79.7 | 0 | 0 | 114 | G41 | G41-E43 PolarHBondContact O-N 2.86Š|
| 44 | H | 76.5 | Confident | 81.1 | Confident | 115 Ų | 115 | 85.7 Ų | 85.7 | 53% | 0.532 | 44% | 0.437 | S | S | . | . | G | 310 helix | trans | -92.9 | -8.6 | 179.3 | -71.3 | 92.5 | 0 | 0 | 0 | 113.3 | K40 G41 E42 | K40-H44 HydrophobicContact CB-CB 3.87Å; K40-H44 HydrophobicContact CD-CB 4.37Å; K40-H44 PolarHBondContact O-ND1 3.32Å; K40-H44 VanDerWaalsContact O-ND1 3.14Å; G41-H44 PolarHBondContact O-N 3.3Å; G41-H44 VanDerWaalsContact O-N 3.11Å; E42-H44 VanDerWaalsContact C-N 3.32Å; E42-H44 PolarHBondContact O-N 3.4Å |
| 45 | C | 81.8 | Confident | 80.9 | Confident | 1 Ų | 1 | 84.7 Ų | 84.7 | 1% | 0.007 | 43% | 0.434 | C | S | . | . | trans | -99.7 | 10.5 | -171.1 | -50.7 | 0 | 0 | 0 | 0 | 113.3 | C36 I37 G41 E42 H47 L48 I49 | C36-C45 VanDerWaalsContact CA-SG 3.56Å; C36-C45 HydrophobicContact CB-CB 3.9Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 PolarHBondContact O-SG 3.38Å; C36-C45 WeakPolarHBondContact SG-CA 3.45Å; C36-C45 WeakPolarHBondContact SG-CB 3.37Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 3.11Å; I37-C45 HydrophobicContact CG1-CB 4.38Å; I37-C45 PolarHBondContact N-SG 3.2Å; I37-C45 VanDerWaalsContact N-SG 3.36Å; G41-C45 PolarHBondContact O-SG 2.03Å; E42-C45 PolarHBondContact O-N 3.14Å; C45-H47 VanDerWaalsContact C-N 3.26Å; C45-H47 PolarHBondContact O-N 3.26Å; C45-L48 PolarHBondContact O-N 3.05Å; C45-I49 WeakPolarHBondContact O-CG1 3.5Å; C45-I49 PolarHBondContact O-N 3.41Å | ||
| 46 | G | 79.5 | Confident | 80.6 | Confident | 34 Ų | 34 | 83.1 Ų | 83.1 | 35% | 0.351 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -49.9 | -45 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | L48 I49 E50 | G46-L48 VanDerWaalsContact C-N 3.32Å; G46-L48 PolarHBondContact O-N 3.24Å; G46-I49 WeakPolarHBondContact O-CB 3.38Å; G46-I49 PolarHBondContact O-N 3.36Å; G46-I49 VanDerWaalsContact O-N 3.15Å; G46-E50 PolarHBondContact O-N 2.87Å |
| 47 | H | 81.9 | Confident | 80.2 | Confident | 157 Ų | 157 | 91.2 Ų | 91.2 | 73% | 0.727 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -61.3 | -36.3 | 177.4 | -66.2 | -71 | 0 | 0 | 0 | 113.5 | C45 A51 | C45-H47 VanDerWaalsContact C-N 3.26Å; C45-H47 PolarHBondContact O-N 3.26Å; H47-A51 PolarHBondContact O-N 3.48Å; H47-A51 VanDerWaalsContact O-N 3.13Å |
| 48 | L | 83.6 | Confident | 79.8 | Confident | 56 Ų | 56 | 93.6 Ų | 93.6 | 29% | 0.293 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -76.1 | -31.6 | 176.9 | -66.8 | 171 | 0 | 0 | 0 | 112 | A32 R33 C36 C45 G46 H52 | A32-L48 HydrophobicContact CB-CD1 4.23Å; A32-L48 HydrophobicContact CB-CD2 3.96Å; A32-L48 WeakPolarHBondContact O-CD1 3.31Å; R33-L48 HydrophobicContact CB-CB 4.23Å; C36-L48 HydrophobicContact CB-CD1 3.39Å; C45-L48 PolarHBondContact O-N 3.05Å; G46-L48 VanDerWaalsContact C-N 3.32Å; G46-L48 PolarHBondContact O-N 3.24Å; L48-H52 WeakPolarHBondContact O-CB 3.31Å; L48-H52 PolarHBondContact O-N 2.85Å |
| 49 | I | 81.4 | Confident | 79.1 | Confident | 51 Ų | 51 | 91.9 Ų | 91.9 | 26% | 0.262 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67.3 | -42.9 | 173.6 | -64 | 165.6 | 0 | 0 | 0 | 110.2 | R33 C45 G46 H52 K53 | R33-I49 HydrophobicContact CG-CG1 3.66Å; C45-I49 WeakPolarHBondContact O-CG1 3.5Å; C45-I49 PolarHBondContact O-N 3.41Å; G46-I49 WeakPolarHBondContact O-CB 3.38Å; G46-I49 PolarHBondContact O-N 3.36Å; G46-I49 VanDerWaalsContact O-N 3.15Å; I49-H52 PolarHBondContact O-N 2.84Å; I49-K53 HydrophobicContact CG2-CD 4.27Å; I49-K53 HydrophobicContact CG2-CG 4.5Å; I49-K53 WeakPolarHBondContact O-CB 3.06Å; I49-K53 WeakPolarHBondContact O-CG 3.24Å; I49-K53 PolarHBondContact O-N 2.86Å |
| 50 | E | 83.2 | Confident | 78.4 | Confident | 133 Ų | 133 | 86.9 Ų | 86.9 | 62% | 0.621 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.4 | -46.6 | 175.7 | -73 | -159.8 | 108.3 | 0 | 0 | 111.9 | G46 H52 K53 E54 | G46-E50 PolarHBondContact O-N 2.87Å; E50-H52 VanDerWaalsContact C-N 3.29Å; E50-H52 PolarHBondContact O-N 2.94Å; E50-K53 PolarHBondContact O-N 3.32Å; E50-K53 VanDerWaalsContact O-N 3.13Å; E50-E54 WeakPolarHBondContact O-CB 3.08Å; E50-E54 PolarHBondContact O-N 2.81Å |
| 51 | A | 82.6 | Confident | 77.6 | Confident | 44 Ų | 44 | 82.6 Ų | 82.6 | 36% | 0.364 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.3 | -40 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | T29 H47 C55 | T29-A51 HydrophobicContact CG2-CB 4.35Å; H47-A51 PolarHBondContact O-N 3.48Å; H47-A51 VanDerWaalsContact O-N 3.13Å; A51-C55 WeakPolarHBondContact O-CB 3.36Å; A51-C55 PolarHBondContact O-N 3.36Å; A51-C55 VanDerWaalsContact O-N 3.08Å |
| 52 | H | 81.8 | Confident | 76.5 | Confident | 13 Ų | 13 | 92 Ų | 92 | 6% | 0.06 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -66.7 | -40.7 | 175.3 | -173.6 | 45.4 | 0 | 0 | 0 | 112.5 | T29 L48 I49 E50 M56 | T29-H52 VanDerWaalsContact OG1-CA 3.31Å; T29-H52 WeakPolarHBondContact OG1-CA 3.33Å; T29-H52 VanDerWaalsContact OG1-CB 3.31Å; T29-H52 WeakPolarHBondContact OG1-CB 3.46Å; T29-H52 PolarHBondContact OG1-ND1 2.99Å; L48-H52 WeakPolarHBondContact O-CB 3.31Å; L48-H52 PolarHBondContact O-N 2.85Å; I49-H52 PolarHBondContact O-N 2.84Å; E50-H52 VanDerWaalsContact C-N 3.29Å; E50-H52 PolarHBondContact O-N 2.94Å; H52-M56 WeakPolarHBondContact O-CB 3.33Å; H52-M56 PolarHBondContact O-N 2.8Å |
| 53 | K | 79.1 | Confident | 76 | Confident | 106 Ų | 106 | 91.9 Ų | 91.9 | 46% | 0.461 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.1 | -41.2 | 175.3 | -80.8 | 179.7 | 172.8 | -178.1 | 0 | 112 | I49 E50 M56 R57 I63 | I49-K53 HydrophobicContact CG2-CD 4.27Å; I49-K53 HydrophobicContact CG2-CG 4.5Å; I49-K53 WeakPolarHBondContact O-CB 3.06Å; I49-K53 WeakPolarHBondContact O-CG 3.24Å; I49-K53 PolarHBondContact O-N 2.86Å; E50-K53 PolarHBondContact O-N 3.32Å; E50-K53 VanDerWaalsContact O-N 3.13Å; K53-M56 PolarHBondContact O-N 3.11Å; K53-R57 WeakPolarHBondContact O-CB 3.36Å; K53-R57 PolarHBondContact O-N 3.13Å; K53-I63 HydrophobicContact CB-CD1 4.03Å; K53-I63 HydrophobicContact CG-CD1 4.13Å; K53-I63 WeakPolarHBondContact O-CD1 2.95Å |
| 54 | E | 81.3 | Confident | 76.1 | Confident | 139 Ų | 139 | 88.1 Ų | 88.1 | 65% | 0.65 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -66.2 | -42 | 179.7 | -160.5 | 171.5 | 103.5 | 0 | 0 | 111.3 | E50 R57 A58 | E50-E54 WeakPolarHBondContact O-CB 3.08Å; E50-E54 PolarHBondContact O-N 2.81Å; E54-R57 WeakPolarHBondContact O-CB 3.41Å; E54-R57 PolarHBondContact O-N 3.16Å; E54-A58 WeakPolarHBondContact O-CB 3.41Å; E54-A58 PolarHBondContact O-N 2.85Å |
| 55 | C | 79.7 | Confident | 76 | Confident | 40 Ų | 40 | 86.6 Ų | 86.6 | 27% | 0.27 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 175 | 170.3 | 0 | 0 | 0 | 0 | 112.4 | C26 A51 A58 L59 | C26-C55 HydrophobicContact CB-CB 3.96Å; C26-C55 WeakPolarHBondContact CB-SG 3.2Å; C26-C55 VanDerWaalsContact SG-C 3.53Å; C26-C55 WeakPolarHBondContact SG-CB 3.12Å; C26-C55 CovalentContact SG-SG 2Å; C26-C55 PolarHBondContact SG-SG 3.09Å; A51-C55 WeakPolarHBondContact O-CB 3.36Å; A51-C55 PolarHBondContact O-N 3.36Å; A51-C55 VanDerWaalsContact O-N 3.08Å; C55-A58 PolarHBondContact O-N 3.46Å; C55-L59 WeakPolarHBondContact O-CD1 3.28Å; C55-L59 WeakPolarHBondContact O-CG 3.18Å; C55-L59 PolarHBondContact O-N 3.27Å |
| 56 | M | 78.3 | Confident | 75.7 | Confident | 15 Ų | 15 | 91.4 Ų | 91.4 | 7% | 0.074 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -66.2 | -37.9 | 171.1 | -83.4 | -160.9 | -77.2 | 0 | 0 | 112.8 | P22 A25 H52 K53 L59 G60 F61 I63 | P22-M56 HydrophobicContact CB-CE 4.24Å; P22-M56 HydrophobicContact CB-SD 3.36Å; P22-M56 WeakPolarHBondContact CB-SD 3.44Å; A25-M56 HydrophobicContact CB-CG 3.87Å; H52-M56 WeakPolarHBondContact O-CB 3.33Å; H52-M56 PolarHBondContact O-N 2.8Å; K53-M56 PolarHBondContact O-N 3.11Å; M56-L59 PolarHBondContact O-N 2.99Å; M56-G60 PolarHBondContact O-N 3.24Å; M56-F61 HydrophobicContact CB-CB 4.22Å; M56-F61 WeakPolarHBondContact O-CB 3.15Å; M56-F61 PolarHBondContact O-N 3.24Å; M56-I63 HydrophobicContact CB-CD1 3.19Å; M56-I63 HydrophobicContact CB-CG1 3.95Å; M56-I63 HydrophobicContact CE-CD1 3.72Å; M56-I63 HydrophobicContact CE-CG1 4.35Å; M56-I63 HydrophobicContact CE-CG2 4.02Å; M56-I63 HydrophobicContact CG-CD1 4.2Å; M56-I63 HydrophobicContact SD-CD1 4.11Å; M56-I63 HydrophobicContact SD-CG1 4.4Å |
| 57 | R | 77.7 | Confident | 75.5 | Confident | 189 Ų | 189 | 94.8 Ų | 94.8 | 71% | 0.713 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.1 | -41.6 | 174.5 | -178.2 | -172.8 | -77.4 | 167.6 | -5.1 | 111.3 | K53 E54 L59 G60 | K53-R57 WeakPolarHBondContact O-CB 3.36Å; K53-R57 PolarHBondContact O-N 3.13Å; E54-R57 WeakPolarHBondContact O-CB 3.41Å; E54-R57 PolarHBondContact O-N 3.16Å; R57-L59 PolarHBondContact O-N 2.74Å; R57-G60 PolarHBondContact O-N 3.35Å |
| 58 | A | 74.9 | Confident | 75.1 | Confident | 90 Ų | 90 | 90.9 Ų | 90.9 | 74% | 0.744 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61.6 | -31.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | E54 C55 G60 | E54-A58 WeakPolarHBondContact O-CB 3.41Å; E54-A58 PolarHBondContact O-N 2.85Å; C55-A58 PolarHBondContact O-N 3.46Å; A58-G60 VanDerWaalsContact C-N 3.28Å; A58-G60 PolarHBondContact O-N 3.46Å |
| 59 | L | 69.9 | Low | 74.5 | Confident | 99 Ų | 99 | 93.2 Ų | 93.2 | 52% | 0.518 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | 4.7 | 177 | -70.8 | 163.7 | 0 | 0 | 0 | 113.6 | A25 C55 M56 R57 F61 | A25-L59 VanDerWaalsContact CA-CD1 3.47Å; A25-L59 HydrophobicContact CB-CD1 3.39Å; A25-L59 VanDerWaalsContact O-CD1 3.31Å; A25-L59 WeakPolarHBondContact O-CD1 3.22Å; C55-L59 WeakPolarHBondContact O-CD1 3.28Å; C55-L59 WeakPolarHBondContact O-CG 3.18Å; C55-L59 PolarHBondContact O-N 3.27Å; M56-L59 PolarHBondContact O-N 2.99Å; R57-L59 PolarHBondContact O-N 2.74Å; L59-F61 HydrophobicContact CB-CD2 3.89Å; L59-F61 HydrophobicContact CB-CE2 4.05Å |
| 60 | G | 69.5 | Low | 74 | Confident | 65 Ų | 65 | 96.2 Ų | 96.2 | 67% | 0.67 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.9 | 12.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | M56 R57 A58 K62 | M56-G60 PolarHBondContact O-N 3.24Å; R57-G60 PolarHBondContact O-N 3.35Å; A58-G60 VanDerWaalsContact C-N 3.28Å; A58-G60 PolarHBondContact O-N 3.46Å; G60-K62 PolarHBondContact O-N 3.07Å |
| 61 | F | 63.4 | Low | 73.3 | Confident | 57 Ų | 57 | 93.4 Ų | 93.4 | 25% | 0.25 | 50% | 0.495 | C | S | . | . | trans | -76.8 | 118.5 | 169.6 | -67.8 | -91.6 | 0 | 0 | 0 | 109.1 | L20 A25 M56 L59 I63 | L20-F61 HydrophobicContact CB-CE1 3.3Å; L20-F61 HydrophobicContact CB-CZ 3.26Å; L20-F61 HydrophobicContact CD2-CE1 4.49Å; L20-F61 HydrophobicContact CD2-CZ 3.64Å; L20-F61 HydrophobicContact CG-CE1 4.5Å; L20-F61 HydrophobicContact CG-CZ 4.08Å; L20-F61 WeakPolarHBondContact O-CE1 3.4Å; A25-F61 HydrophobicContact CB-CE2 4.49Å; M56-F61 HydrophobicContact CB-CB 4.22Å; M56-F61 WeakPolarHBondContact O-CB 3.15Å; M56-F61 PolarHBondContact O-N 3.24Å; L59-F61 HydrophobicContact CB-CD2 3.89Å; L59-F61 HydrophobicContact CB-CE2 4.05Å; F61-I63 HydrophobicContact CB-CG1 4.27Å; F61-I63 WeakPolarHBondContact O-CG1 3.27Å; F61-I63 PolarHBondContact O-N 3.11Å | ||
| 62 | K | 54.3 | Low | 72.6 | Confident | 220 Ų | 220 | 97.5 Ų | 97.5 | 96% | 0.957 | 51% | 0.506 | S | S | * | . | trans | -73.1 | 116.2 | 163 | -91.8 | 177.4 | 173.9 | 173.8 | 0 | 107.8 | G60 | G60-K62 PolarHBondContact O-N 3.07Š| ||
| 63 | I | 61 | Low | 71.7 | Confident | 137 Ų | 137 | 105.2 Ų | 105.2 | 70% | 0.703 | 55% | 0.546 | S | S | * | . | trans | -123.4 | 0 | -177.9 | -19.9 | 157.8 | 0 | 0 | 0 | 108.8 | K53 M56 F61 | K53-I63 HydrophobicContact CB-CD1 4.03Å; K53-I63 HydrophobicContact CG-CD1 4.13Å; K53-I63 WeakPolarHBondContact O-CD1 2.95Å; M56-I63 HydrophobicContact CB-CD1 3.19Å; M56-I63 HydrophobicContact CB-CG1 3.95Å; M56-I63 HydrophobicContact CE-CD1 3.72Å; M56-I63 HydrophobicContact CE-CG1 4.35Å; M56-I63 HydrophobicContact CE-CG2 4.02Å; M56-I63 HydrophobicContact CG-CD1 4.2Å; M56-I63 HydrophobicContact SD-CD1 4.11Å; M56-I63 HydrophobicContact SD-CG1 4.4Å; F61-I63 HydrophobicContact CB-CG1 4.27Å; F61-I63 WeakPolarHBondContact O-CG1 3.27Å; F61-I63 PolarHBondContact O-N 3.11Å |
Retrieved 63 of 63 residues in 92 ms
(Link to these results)