| 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 | 53.5 | Low | 51.6 | Low | 219 Ų | 219 | 147.7 Ų | 147.7 | 100% | 1.079 | 85% | 0.852 | S | S | * | * | 0 | 128.7 | 0 | -9.3 | 76.1 | 148.8 | 0 | 0 | 109.9 | |||||
| 2 | K | 48 | Very low | 51.4 | Low | 210 Ų | 210 | 141.8 Ų | 141.8 | 91% | 0.913 | 85% | 0.846 | S | S | * | * | trans | -161.5 | 138.3 | 154.5 | -126.5 | 84.9 | 65.4 | -174.9 | 0 | 107.3 | ||||
| 3 | S | 44.1 | Very low | 51.4 | Low | 97 Ų | 97 | 139.4 Ų | 139.4 | 68% | 0.678 | 84% | 0.841 | S | S | * | * | trans | -106.6 | 155.3 | -155.6 | -53.7 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 4 | K | 51.8 | Low | 51.6 | Low | 191 Ų | 191 | 140.2 Ų | 140.2 | 83% | 0.83 | 84% | 0.839 | S | S | * | * | trans | 40.4 | 120.1 | 139.6 | 76.1 | -168.6 | 171.1 | -176.2 | 0 | 118.4 | ||||
| 5 | K | 53.3 | Low | 51.8 | Low | 214 Ų | 214 | 137.3 Ų | 137.3 | 93% | 0.93 | 83% | 0.828 | S | S | * | * | 110.7 | 124.5 | 64.2 | -172.1 | 160.7 | -179.8 | 172 | 0 | 108 | |||||
| 6 | G | 46.3 | Very low | 52 | Low | 78 Ų | 78 | 139.8 Ų | 139.8 | 80% | 0.804 | 83% | 0.827 | S | S | * | * | trans | -165.9 | 98.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 7 | L | 51.8 | Low | 51.9 | Low | 156 Ų | 156 | 139.9 Ų | 139.9 | 82% | 0.817 | 82% | 0.824 | S | S | * | * | trans | -77.5 | 130.5 | 171.7 | 168.4 | 76 | 0 | 0 | 0 | 108.6 | ||||
| 8 | V | 60.4 | Low | 52 | Low | 146 Ų | 146 | 142.1 Ų | 142.1 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | -134 | 113.6 | 149.7 | -65.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 9 | A | 51.9 | Low | 51.9 | Low | 88 Ų | 88 | 141.3 Ų | 141.3 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | trans | -95.3 | 130.7 | 163.7 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 10 | A | 54 | Low | 52.2 | Low | 102 Ų | 102 | 138.8 Ų | 138.8 | 84% | 0.843 | 81% | 0.807 | S | S | * | * | trans | -153.6 | 97 | 156.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 11 | S | 52.3 | Low | 52.3 | Low | 124 Ų | 124 | 139.6 Ų | 139.6 | 87% | 0.867 | 81% | 0.806 | S | S | * | * | trans | -63.1 | 131.4 | 157.8 | 179.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 12 | G | 49.5 | Very low | 52.4 | Low | 76 Ų | 76 | 135.1 Ų | 135.1 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | trans | -140.9 | 83.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 13 | S | 51.9 | Low | 53 | Low | 111 Ų | 111 | 129.4 Ų | 129.4 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | trans | -78.9 | 117.1 | 166.1 | -168.6 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 14 | D | 54 | Low | 53.6 | Low | 151 Ų | 151 | 129.4 Ų | 129.4 | 81% | 0.807 | 77% | 0.771 | S | S | * | * | trans | -110.8 | 113.3 | 175 | -165.9 | -111.5 | 0 | 0 | 0 | 107.6 | ||||
| 15 | S | 54.3 | Low | 53.8 | Low | 96 Ų | 96 | 127.2 Ų | 127.2 | 67% | 0.671 | 77% | 0.767 | S | S | * | * | trans | -150.8 | 103.1 | 172.9 | -69.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 16 | E | 54.4 | Low | 53.9 | Low | 177 Ų | 177 | 123.6 Ų | 123.6 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | trans | -151.6 | 101.4 | 160.3 | -57.9 | -174.6 | 99.7 | 0 | 0 | 104.1 | ||||
| 17 | D | 50.2 | Low | 54.3 | Low | 143 Ų | 143 | 127.4 Ų | 127.4 | 77% | 0.765 | 76% | 0.759 | S | S | * | * | 59.8 | 135.3 | 79.8 | -69.2 | -76 | 0 | 0 | 0 | 114 | |||||
| 18 | E | 54.7 | Low | 54.7 | Low | 179 Ų | 179 | 124.8 Ų | 124.8 | 84% | 0.836 | 75% | 0.754 | S | S | * | * | trans | 82.3 | 93 | 167 | -48.9 | -70.1 | 75.8 | 0 | 0 | 119.2 | ||||
| 19 | D | 49.8 | Very low | 54.3 | Low | 127 Ų | 127 | 123 Ų | 123 | 68% | 0.679 | 75% | 0.747 | S | S | * | * | -165.6 | 116.8 | 103.4 | -169.3 | -127.9 | 0 | 0 | 0 | 111.5 | M21 | D19-M21 PolarHBondContact O-N 3.3Å; D19-M21 WeakPolarHBondContact OD1-CE 3.06Å | |||
| 20 | S | 58.5 | Low | 54.5 | Low | 90 Ų | 90 | 124.3 Ų | 124.3 | 63% | 0.629 | 75% | 0.751 | S | S | * | * | trans | -63.6 | 108.3 | 169 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 21 | M | 54.7 | Low | 54.2 | Low | 157 Ų | 157 | 123.9 Ų | 123.9 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | trans | -108.9 | 54.2 | 157.6 | -72.2 | -74.9 | 156.6 | 0 | 0 | 109.9 | D19 S23 | D19-M21 PolarHBondContact O-N 3.3Å; D19-M21 WeakPolarHBondContact OD1-CE 3.06Å; M21-S23 PolarHBondContact O-N 3.28Å | ||
| 22 | D | 53.8 | Low | 54.2 | Low | 124 Ų | 124 | 122.8 Ų | 122.8 | 66% | 0.663 | 75% | 0.746 | S | S | * | * | trans | -69.7 | 101 | 149.5 | -179.2 | 66.5 | 0 | 0 | 0 | 107.7 | P24 | D22-P24 VanDerWaalsContact OD1-CD 3.26Å; D22-P24 WeakPolarHBondContact OD1-CD 3.26Å | ||
| 23 | S | 60.5 | Low | 54.2 | Low | 90 Ų | 90 | 124.3 Ų | 124.3 | 63% | 0.629 | 75% | 0.745 | S | S | * | * | trans | -139.9 | 80.3 | 159.6 | -84 | 0 | 0 | 0 | 0 | 108.4 | M21 L25 | M21-S23 PolarHBondContact O-N 3.28Å; S23-L25 VanDerWaalsContact C-N 3.29Å; S23-L25 PolarHBondContact O-N 2.81Å | ||
| 24 | P | 58.3 | Low | 53.8 | Low | 98 Ų | 98 | 122.2 Ų | 122.2 | 64% | 0.636 | 74% | 0.741 | S | S | * | * | trans | -69.2 | 95 | 163.3 | 28.7 | -31.1 | 0 | 0 | 0 | 106.7 | D22 D26 | D22-P24 VanDerWaalsContact OD1-CD 3.26Å; D22-P24 WeakPolarHBondContact OD1-CD 3.26Å; P24-D26 PolarHBondContact O-N 2.83Å | ||
| 25 | L | 55.1 | Low | 53.5 | Low | 144 Ų | 144 | 124.3 Ų | 124.3 | 75% | 0.754 | 74% | 0.743 | S | S | * | * | trans | -67.2 | 90.1 | 164.6 | -62.5 | 178.6 | 0 | 0 | 0 | 107.4 | S23 L27 | S23-L25 VanDerWaalsContact C-N 3.29Å; S23-L25 PolarHBondContact O-N 2.81Å; L25-L27 PolarHBondContact O-N 2.97Å | ||
| 26 | D | 54.9 | Low | 53.3 | Low | 138 Ų | 138 | 130.2 Ų | 130.2 | 74% | 0.738 | 75% | 0.75 | S | S | * | * | trans | -57.5 | 86.2 | 162.2 | -179.7 | -124 | 0 | 0 | 0 | 108.7 | P24 S28 | P24-D26 PolarHBondContact O-N 2.83Å; D26-S28 PolarHBondContact O-N 3.4Å | ||
| 27 | L | 55.2 | Low | 53.4 | Low | 158 Ų | 158 | 131.3 Ų | 131.3 | 83% | 0.827 | 75% | 0.747 | S | S | * | * | trans | -93 | 61.2 | 162.8 | -64.3 | 176.8 | 0 | 0 | 0 | 108.1 | L25 S29 | L25-L27 PolarHBondContact O-N 2.97Å; L27-S29 PolarHBondContact O-N 3.23Å | ||
| 28 | S | 60.1 | Low | 54 | Low | 102 Ų | 102 | 136.5 Ų | 136.5 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | trans | -74.3 | 85.3 | 158 | -169.6 | 0 | 0 | 0 | 0 | 108.3 | D26 | D26-S28 PolarHBondContact O-N 3.4Š| ||
| 29 | S | 52.6 | Low | 54.1 | Low | 107 Ų | 107 | 136.1 Ų | 136.1 | 75% | 0.748 | 75% | 0.747 | S | S | * | * | trans | -135.1 | 89.4 | 159.7 | -164.2 | 0 | 0 | 0 | 0 | 109.8 | L27 | L27-S29 PolarHBondContact O-N 3.23Š| ||
| 30 | S | 55.5 | Low | 54.9 | Low | 116 Ų | 116 | 133.1 Ų | 133.1 | 81% | 0.811 | 75% | 0.746 | S | S | * | * | trans | 36.3 | 89.9 | 136.8 | -174.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 31 | A | 47.3 | Very low | 55.4 | Low | 93 Ų | 93 | 136.6 Ų | 136.6 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | trans | -154.8 | 92.3 | 140 | 0 | 0 | 0 | 0 | 0 | 109.3 | S33 | A31-S33 PolarHBondContact O-N 2.88Š| ||
| 32 | A | 53.6 | Low | 56.4 | Low | 101 Ų | 101 | 133.4 Ų | 133.4 | 84% | 0.835 | 74% | 0.743 | S | S | * | * | trans | -54.3 | 105.8 | 158.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 33 | S | 48.5 | Very low | 57.7 | Low | 108 Ų | 108 | 130 Ų | 130 | 76% | 0.755 | 73% | 0.728 | S | S | * | * | trans | 178.4 | 113.2 | 150.8 | -84.1 | 0 | 0 | 0 | 0 | 111.6 | A31 | A31-S33 PolarHBondContact O-N 2.88Š| ||
| 34 | G | 43.5 | Very low | 58.7 | Low | 67 Ų | 67 | 134.5 Ų | 134.5 | 69% | 0.691 | 74% | 0.736 | S | S | * | * | trans | 91.2 | 118.1 | 162 | 0 | 0 | 0 | 0 | 0 | 114 | R36 | G34-R36 PolarHBondContact O-N 3.22Š| ||
| 35 | K | 47.3 | Very low | 59.9 | Low | 196 Ų | 196 | 136.2 Ų | 136.2 | 85% | 0.852 | 74% | 0.735 | S | S | * | * | trans | -64.2 | 53.5 | 166.4 | -71.3 | 95.3 | 166.7 | -171.7 | 0 | 111.5 | R37 | K35-R37 VanDerWaalsContact C-N 3.32Å; K35-R37 PolarHBondContact O-N 3.47Å | ||
| 36 | R | 50.1 | Low | 61.3 | Low | 219 Ų | 219 | 129.6 Ų | 129.6 | 83% | 0.826 | 70% | 0.701 | S | S | * | * | trans | -64.4 | 103 | 162.5 | -109.8 | -178.9 | -65.9 | 160.6 | 0.7 | 104.9 | G34 R38 | G34-R36 PolarHBondContact O-N 3.22Å; R36-R38 PolarHBondContact O-N 3.02Å | ||
| 37 | R | 56.3 | Low | 62.8 | Low | 201 Ų | 201 | 124.7 Ų | 124.7 | 76% | 0.758 | 68% | 0.676 | S | S | * | * | trans | -51.1 | 91.9 | 164.7 | -67.4 | -80 | 109.8 | 158.4 | -0.5 | 105.9 | K35 R39 | K35-R37 VanDerWaalsContact C-N 3.32Å; K35-R37 PolarHBondContact O-N 3.47Å; R37-R39 HydrophobicContact CB-CB 4.39Å; R37-R39 PolarHBondContact O-N 3.04Å | ||
| 38 | R | 64.1 | Low | 64.4 | Low | 252 Ų | 252 | 122.2 Ų | 122.2 | 95% | 0.951 | 66% | 0.66 | S | S | * | * | trans | -61.6 | 86.1 | 158.6 | -79.7 | -169.1 | 166.5 | -143.5 | 0.1 | 103.8 | R36 | R36-R38 PolarHBondContact O-N 3.02Š| ||
| 39 | R | 56.3 | Low | 65.7 | Low | 171 Ų | 171 | 119.1 Ų | 119.1 | 65% | 0.645 | 64% | 0.635 | S | S | * | * | trans | -95.5 | 112.6 | -171.3 | -139.7 | 173.2 | 179.9 | -161.3 | -2 | 105.3 | R37 | R37-R39 HydrophobicContact CB-CB 4.39Å; R37-R39 PolarHBondContact O-N 3.04Å | ||
| 40 | G | 67 | Low | 67.3 | Low | 64 Ų | 64 | 116.8 Ų | 116.8 | 66% | 0.66 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -47.4 | 155.2 | 160.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 41 | N | 67.8 | Low | 68.9 | Low | 162 Ų | 162 | 119.4 Ų | 119.4 | 87% | 0.866 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -4.6 | 123.9 | -178.4 | -62.1 | -31.2 | 0 | 0 | 0 | 116 | ||
| 42 | L | 76.5 | Confident | 71 | Confident | 91 Ų | 91 | 119.4 Ų | 119.4 | 48% | 0.476 | 59% | 0.593 | S | S | . | * | trans | -46.6 | 142.1 | 173.4 | -67.5 | 121.4 | 0 | 0 | 0 | 111 | K44 V47 L77 | L42-K44 PolarHBondContact O-N 2.69Å; L42-V47 HydrophobicContact CB-CG2 3.62Å; L42-L77 HydrophobicContact CD2-CD1 3.16Å; L42-L77 HydrophobicContact CD2-CD2 3.48Å; L42-L77 VanDerWaalsContact CD2-CD2 3.48Å; L42-L77 HydrophobicContact CD2-CG 3.91Å | ||
| 43 | P | 81.6 | Confident | 72.7 | Confident | 52 Ų | 52 | 115.8 Ų | 115.8 | 34% | 0.338 | 56% | 0.558 | S | S | . | * | trans | -51.3 | 142 | 174.1 | -22.7 | 31.4 | 0 | 0 | 0 | 110.9 | E45 S46 V47 | P43-E45 PolarHBondContact O-N 3.05Å; P43-S46 WeakPolarHBondContact O-CB 3.48Å; P43-S46 PolarHBondContact O-N 3.06Å; P43-V47 PolarHBondContact O-N 2.79Å | ||
| 44 | K | 81 | Confident | 74.7 | Confident | 184 Ų | 184 | 114.8 Ų | 114.8 | 80% | 0.8 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -55.8 | -39.6 | -178.2 | -68.8 | -174.5 | 178.6 | -179.6 | 0 | 112.2 | L42 V47 Q48 | L42-K44 PolarHBondContact O-N 2.69Å; K44-V47 PolarHBondContact O-N 2.86Å; K44-Q48 WeakPolarHBondContact O-CB 3.35Å; K44-Q48 PolarHBondContact O-N 3.31Å |
| 45 | E | 84.4 | Confident | 76.9 | Confident | 134 Ų | 134 | 120.1 Ų | 120.1 | 63% | 0.626 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -56.5 | -50.1 | 173.8 | -62.7 | -55.9 | 135.5 | 0 | 0 | 112.1 | P43 V47 Q48 I49 | P43-E45 PolarHBondContact O-N 3.05Å; E45-V47 VanDerWaalsContact C-N 3.28Å; E45-V47 PolarHBondContact O-N 3.33Å; E45-Q48 PolarHBondContact O-N 2.75Å; E45-Q48 VanDerWaalsContact O-N 3.15Å; E45-I49 WeakPolarHBondContact O-CD1 3.43Å; E45-I49 WeakPolarHBondContact O-CG1 3.48Å; E45-I49 PolarHBondContact O-N 3.26Å |
| 46 | S | 84.6 | Confident | 78.9 | Confident | 6 Ų | 6 | 118 Ų | 118 | 4% | 0.042 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -59.1 | -41.4 | 177.6 | -51.3 | 0 | 0 | 0 | 0 | 111.5 | P43 L50 T75 | P43-S46 WeakPolarHBondContact O-CB 3.48Å; P43-S46 PolarHBondContact O-N 3.06Å; S46-L50 VanDerWaalsContact O-CG 3.31Å; S46-L50 WeakPolarHBondContact O-CG 3.27Å; S46-L50 PolarHBondContact O-N 3.15Å; S46-T75 WeakPolarHBondContact O-CG2 3.31Å; S46-T75 PolarHBondContact OG-O 3.46Å |
| 47 | V | 84.7 | Confident | 80.7 | Confident | 35 Ų | 35 | 109.7 Ų | 109.7 | 21% | 0.212 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -67.8 | -38.1 | 178.3 | 175.8 | 0 | 0 | 0 | 0 | 111.4 | L42 P43 K44 E45 L50 R51 | L42-V47 HydrophobicContact CB-CG2 3.62Å; P43-V47 PolarHBondContact O-N 2.79Å; K44-V47 PolarHBondContact O-N 2.86Å; E45-V47 VanDerWaalsContact C-N 3.28Å; E45-V47 PolarHBondContact O-N 3.33Å; V47-L50 PolarHBondContact O-N 3.24Å; V47-R51 HydrophobicContact CG1-CG 4.34Å; V47-R51 WeakPolarHBondContact O-CB 3.45Å; V47-R51 VanDerWaalsContact O-CG 3.27Å; V47-R51 WeakPolarHBondContact O-CG 3.42Å; V47-R51 PolarHBondContact O-N 3.03Å |
| 48 | Q | 88.8 | Confident | 82.1 | Confident | 105 Ų | 105 | 107.2 Ų | 107.2 | 49% | 0.491 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.6 | -48.7 | 179 | -175.8 | 160.8 | -23 | 0 | 0 | 111.2 | K44 E45 L50 R51 D52 | K44-Q48 WeakPolarHBondContact O-CB 3.35Å; K44-Q48 PolarHBondContact O-N 3.31Å; E45-Q48 PolarHBondContact O-N 2.75Å; E45-Q48 VanDerWaalsContact O-N 3.15Å; Q48-L50 VanDerWaalsContact C-N 3.3Å; Q48-L50 PolarHBondContact O-N 2.95Å; Q48-R51 WeakPolarHBondContact O-CB 3.44Å; Q48-R51 PolarHBondContact O-N 2.91Å; Q48-R51 VanDerWaalsContact O-N 3.07Å; Q48-D52 VanDerWaalsContact O-CG 3.24Å; Q48-D52 PolarHBondContact O-N 3.44Å |
| 49 | I | 87.9 | Confident | 83.1 | Confident | 37 Ų | 37 | 104.2 Ų | 104.2 | 19% | 0.19 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -56.1 | -45 | 176.3 | -67 | 154.8 | 0 | 0 | 0 | 111.6 | E45 R51 D52 W53 L71 Q74 T75 | E45-I49 WeakPolarHBondContact O-CD1 3.43Å; E45-I49 WeakPolarHBondContact O-CG1 3.48Å; E45-I49 PolarHBondContact O-N 3.26Å; I49-R51 PolarHBondContact O-N 3.38Å; I49-D52 PolarHBondContact O-N 3.22Å; I49-W53 PolarHBondContact O-N 3.33Å; I49-L71 HydrophobicContact CG2-CD2 3.75Å; I49-Q74 HydrophobicContact CD1-CB 3.94Å; I49-Q74 WeakPolarHBondContact CD1-O 3.45Å; I49-Q74 HydrophobicContact CG2-CB 3.99Å; I49-Q74 VanDerWaalsContact CG2-OE1 3.29Å; I49-T75 HydrophobicContact CB-CG2 3.89Å; I49-T75 HydrophobicContact CD1-CG2 4.23Å; I49-T75 HydrophobicContact CG2-CG2 3.76Å |
| 50 | L | 87.1 | Confident | 84.3 | Confident | 59 Ų | 59 | 100.8 Ų | 100.8 | 31% | 0.309 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -37.7 | 178.2 | -68.4 | 171.7 | 0 | 0 | 0 | 112.3 | S46 V47 Q48 L54 L71 T75 L77 | S46-L50 VanDerWaalsContact O-CG 3.31Å; S46-L50 WeakPolarHBondContact O-CG 3.27Å; S46-L50 PolarHBondContact O-N 3.15Å; V47-L50 PolarHBondContact O-N 3.24Å; Q48-L50 VanDerWaalsContact C-N 3.3Å; Q48-L50 PolarHBondContact O-N 2.95Å; L50-L54 WeakPolarHBondContact O-CB 3.44Å; L50-L54 VanDerWaalsContact O-CG 3.23Å; L50-L54 WeakPolarHBondContact O-CG 3.42Å; L50-L54 PolarHBondContact O-N 3.01Å; L50-L71 HydrophobicContact CD2-CB 4.43Å; L50-L71 HydrophobicContact CD2-CD1 4.31Å; L50-L71 HydrophobicContact CD2-CD2 4.4Å; L50-T75 HydrophobicContact CD2-CG2 4.21Å; L50-T75 HydrophobicContact CG-CG2 3.95Å; L50-L77 HydrophobicContact CD1-CD1 4.07Å |
| 51 | R | 88.3 | Confident | 85 | Confident | 171 Ų | 171 | 100.3 Ų | 100.3 | 65% | 0.645 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -67.4 | -42.9 | 176.6 | -77.9 | 174.3 | 178 | 162 | 0.1 | 111.8 | V47 Q48 I49 W53 L54 Y55 | V47-R51 HydrophobicContact CG1-CG 4.34Å; V47-R51 WeakPolarHBondContact O-CB 3.45Å; V47-R51 VanDerWaalsContact O-CG 3.27Å; V47-R51 WeakPolarHBondContact O-CG 3.42Å; V47-R51 PolarHBondContact O-N 3.03Å; Q48-R51 WeakPolarHBondContact O-CB 3.44Å; Q48-R51 PolarHBondContact O-N 2.91Å; Q48-R51 VanDerWaalsContact O-N 3.07Å; I49-R51 PolarHBondContact O-N 3.38Å; R51-W53 VanDerWaalsContact C-N 3.34Å; R51-L54 PolarHBondContact O-N 2.97Å; R51-Y55 WeakPolarHBondContact O-CB 3.46Å; R51-Y55 PolarHBondContact O-N 3.07Å |
| 52 | D | 91.1 | Very high | 85.8 | Confident | 92 Ų | 92 | 101.5 Ų | 101.5 | 49% | 0.492 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 178.7 | -66.6 | -14.9 | 0 | 0 | 0 | 110.1 | Q48 I49 L54 Y55 E56 | Q48-D52 VanDerWaalsContact O-CG 3.24Å; Q48-D52 PolarHBondContact O-N 3.44Å; I49-D52 PolarHBondContact O-N 3.22Å; D52-L54 PolarHBondContact O-N 3.5Å; D52-Y55 WeakPolarHBondContact O-CB 3.45Å; D52-Y55 PolarHBondContact O-N 3Å; D52-E56 PolarHBondContact O-N 3.44Å |
| 53 | W | 89.5 | Confident | 86.1 | Confident | 25 Ų | 25 | 98.8 Ų | 98.8 | 10% | 0.095 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.9 | -175.3 | 87.3 | 0 | 0 | 0 | 112.7 | I49 R51 Y55 E56 H57 P63 E67 L71 | I49-W53 PolarHBondContact O-N 3.33Å; R51-W53 VanDerWaalsContact C-N 3.34Å; W53-Y55 VanDerWaalsContact C-N 3.26Å; W53-Y55 PolarHBondContact O-N 3.04Å; W53-E56 PolarHBondContact O-N 2.92Å; W53-H57 AromaticContact CD1-CE1 3.78Å; W53-H57 AromaticContact CD1-ND1 3.58Å; W53-H57 HydrophobicContact CD2-CB 4.32Å; W53-H57 AromaticContact CD2-ND1 3.75Å; W53-H57 AromaticContact CE2-CE1 3.77Å; W53-H57 AromaticContact CE2-CG 3.49Å; W53-H57 VanDerWaalsContact CE2-CG 3.49Å; W53-H57 AromaticContact CE2-ND1 3.27Å; W53-H57 VanDerWaalsContact CE2-ND1 3.27Å; W53-H57 HydrophobicContact CE3-CB 4.29Å; W53-H57 AromaticContact CG-ND1 3.89Å; W53-H57 HydrophobicContact CH2-CB 3.56Å; W53-H57 AromaticContact CH2-CG 3.79Å; W53-H57 HydrophobicContact CZ2-CB 3.64Å; W53-H57 AromaticContact CZ2-CD2 3.64Å; W53-H57 AromaticContact CZ2-CG 3.28Å; W53-H57 AromaticContact CZ2-ND1 3.62Å; W53-H57 HydrophobicContact CZ3-CB 3.94Å; W53-H57 AromaticContact NE1-CE1 3.29Å; W53-H57 PolarHBondContact NE1-CE1 2.83Å; W53-H57 VanDerWaalsContact NE1-CE1 3.29Å; W53-H57 AromaticContact NE1-CG 3.85Å; W53-H57 AromaticContact NE1-ND1 3.22Å; W53-H57 PolarHBondContact NE1-ND1 3.32Å; W53-H57 AromaticContact NE1-NE2 3.96Å; W53-H57 WeakPolarHBondContact O-CB 3.49Å; W53-H57 PolarHBondContact O-N 2.71Å; W53-H57 PolarHBondContact O-ND1 2.62Å; W53-H57 VanDerWaalsContact O-ND1 3.07Å; W53-P63 VanDerWaalsContact CH2-CA 3.47Å; W53-P63 HydrophobicContact CH2-CB 3.49Å; W53-P63 VanDerWaalsContact CH2-CB 3.49Å; W53-P63 HydrophobicContact CH2-CG 3.84Å; W53-P63 VanDerWaalsContact CH2-N 3.27Å; W53-P63 HydrophobicContact CZ2-CB 3.38Å; W53-P63 HydrophobicContact CZ2-CG 4.24Å; W53-P63 HydrophobicContact CZ3-CB 4.14Å; W53-P63 HydrophobicContact CZ3-CG 4.14Å; W53-E67 PolarHBondContact NE1-OE1 3.5Å; W53-L71 HydrophobicContact CB-CD1 4.36Å; W53-L71 HydrophobicContact CB-CD2 3.72Å; W53-L71 HydrophobicContact CD2-CD1 3.81Å; W53-L71 HydrophobicContact CE3-CD1 4.28Å; W53-L71 HydrophobicContact CG-CD1 3.79Å; W53-L71 HydrophobicContact CG-CD2 3.85Å; W53-L71 HydrophobicContact CG-CG 4.28Å |
| 54 | L | 90.4 | Very high | 86.4 | Confident | 87 Ų | 87 | 98.8 Ų | 98.8 | 46% | 0.455 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.7 | -34.1 | 176.2 | -77.7 | 170.1 | 0 | 0 | 0 | 112.4 | L50 R51 D52 H57 R58 A61 | L50-L54 WeakPolarHBondContact O-CB 3.44Å; L50-L54 VanDerWaalsContact O-CG 3.23Å; L50-L54 WeakPolarHBondContact O-CG 3.42Å; L50-L54 PolarHBondContact O-N 3.01Å; R51-L54 PolarHBondContact O-N 2.97Å; D52-L54 PolarHBondContact O-N 3.5Å; L54-H57 CarbonylContact O-C 3.46Å; L54-R58 VanDerWaalsContact O-CA 3.28Å; L54-R58 WeakPolarHBondContact O-CA 3.35Å; L54-R58 PolarHBondContact O-N 3.26Å; L54-A61 HydrophobicContact CD2-CB 4.25Å |
| 55 | Y | 90.6 | Very high | 86.5 | Confident | 179 Ų | 179 | 98.3 Ų | 98.3 | 70% | 0.702 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -67.9 | -43.8 | 176.3 | -175.3 | -98.6 | 0 | 0 | 0 | 111.3 | R51 D52 W53 H57 R58 | R51-Y55 WeakPolarHBondContact O-CB 3.46Å; R51-Y55 PolarHBondContact O-N 3.07Å; D52-Y55 WeakPolarHBondContact O-CB 3.45Å; D52-Y55 PolarHBondContact O-N 3Å; W53-Y55 VanDerWaalsContact C-N 3.26Å; W53-Y55 PolarHBondContact O-N 3.04Å; Y55-H57 VanDerWaalsContact C-N 3.35Å; Y55-R58 WeakPolarHBondContact O-CB 3.43Å; Y55-R58 WeakPolarHBondContact O-CD 3.4Å; Y55-R58 WeakPolarHBondContact O-CG 3.23Å |
| 56 | E | 88.2 | Confident | 86.6 | Confident | 151 Ų | 151 | 99.4 Ų | 99.4 | 71% | 0.706 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.5 | -39.4 | 175.8 | -168.7 | 170.3 | -165.5 | 0 | 0 | 111.8 | D52 W53 | D52-E56 PolarHBondContact O-N 3.44Å; W53-E56 PolarHBondContact O-N 2.92Å |
| 57 | H | 88.9 | Confident | 86.7 | Confident | 45 Ų | 45 | 101.3 Ų | 101.3 | 21% | 0.208 | 47% | 0.47 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.6 | 24.5 | -177.5 | -64.9 | 78.6 | 0 | 0 | 0 | 113.4 | W53 L54 Y55 Y59 N60 A61 E67 | W53-H57 AromaticContact CD1-CE1 3.78Å; W53-H57 AromaticContact CD1-ND1 3.58Å; W53-H57 HydrophobicContact CD2-CB 4.32Å; W53-H57 AromaticContact CD2-ND1 3.75Å; W53-H57 AromaticContact CE2-CE1 3.77Å; W53-H57 AromaticContact CE2-CG 3.49Å; W53-H57 VanDerWaalsContact CE2-CG 3.49Å; W53-H57 AromaticContact CE2-ND1 3.27Å; W53-H57 VanDerWaalsContact CE2-ND1 3.27Å; W53-H57 HydrophobicContact CE3-CB 4.29Å; W53-H57 AromaticContact CG-ND1 3.89Å; W53-H57 HydrophobicContact CH2-CB 3.56Å; W53-H57 AromaticContact CH2-CG 3.79Å; W53-H57 HydrophobicContact CZ2-CB 3.64Å; W53-H57 AromaticContact CZ2-CD2 3.64Å; W53-H57 AromaticContact CZ2-CG 3.28Å; W53-H57 AromaticContact CZ2-ND1 3.62Å; W53-H57 HydrophobicContact CZ3-CB 3.94Å; W53-H57 AromaticContact NE1-CE1 3.29Å; W53-H57 PolarHBondContact NE1-CE1 2.83Å; W53-H57 VanDerWaalsContact NE1-CE1 3.29Å; W53-H57 AromaticContact NE1-CG 3.85Å; W53-H57 AromaticContact NE1-ND1 3.22Å; W53-H57 PolarHBondContact NE1-ND1 3.32Å; W53-H57 AromaticContact NE1-NE2 3.96Å; W53-H57 WeakPolarHBondContact O-CB 3.49Å; W53-H57 PolarHBondContact O-N 2.71Å; W53-H57 PolarHBondContact O-ND1 2.62Å; W53-H57 VanDerWaalsContact O-ND1 3.07Å; L54-H57 CarbonylContact O-C 3.46Å; Y55-H57 VanDerWaalsContact C-N 3.35Å; H57-Y59 PolarHBondContact O-N 2.85Å; H57-N60 CarbonylContact O-C 3.02Å; H57-N60 PolarHBondContact O-N 3.03Å; H57-A61 PolarHBondContact O-N 3.49Å; H57-A61 VanDerWaalsContact O-N 3.12Å; H57-E67 IonicContact CD2-OE1 3.63Å; H57-E67 IonicContact CE1-OE1 3.3Å; H57-E67 PolarHBondContact CE1-OE1 3.48Å; H57-E67 VanDerWaalsContact CE1-OE1 3.3Å; H57-E67 IonicContact NE2-OE1 2.99Å; H57-E67 PolarHBondContact NE2-OE1 3.46Å |
| 58 | R | 85.6 | Confident | 86.6 | Confident | 150 Ų | 150 | 105.1 Ų | 105.1 | 57% | 0.566 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -21.7 | -173.8 | 65.2 | -172.1 | 179.9 | 104.8 | -7.5 | 115.3 | L54 Y55 | L54-R58 VanDerWaalsContact O-CA 3.28Å; L54-R58 WeakPolarHBondContact O-CA 3.35Å; L54-R58 PolarHBondContact O-N 3.26Å; Y55-R58 WeakPolarHBondContact O-CB 3.43Å; Y55-R58 WeakPolarHBondContact O-CD 3.4Å; Y55-R58 WeakPolarHBondContact O-CG 3.23Å |
| 59 | Y | 85.1 | Confident | 86.4 | Confident | 189 Ų | 189 | 102.6 Ų | 102.6 | 74% | 0.741 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | -20 | 176.5 | -60.4 | -69.2 | 0 | 0 | 0 | 113.5 | H57 | H57-Y59 PolarHBondContact O-N 2.85Š|
| 60 | N | 81.7 | Confident | 86.3 | Confident | 99 Ų | 99 | 105 Ų | 105 | 53% | 0.529 | 49% | 0.493 | S | S | . | . | trans | -143.3 | 74.4 | 178.6 | -174.6 | 29.1 | 0 | 0 | 0 | 109.8 | H57 Y62 | H57-N60 CarbonylContact O-C 3.02Å; H57-N60 PolarHBondContact O-N 3.03Å; N60-Y62 PolarHBondContact O-N 2.62Å; N60-Y62 WeakPolarHBondContact OD1-CD2 3.1Å | ||
| 61 | A | 82.1 | Confident | 86.3 | Confident | 54 Ų | 54 | 102.8 Ų | 102.8 | 45% | 0.446 | 48% | 0.481 | S | S | . | . | trans | -73.3 | 31.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | L54 H57 P63 | L54-A61 HydrophobicContact CD2-CB 4.25Å; H57-A61 PolarHBondContact O-N 3.49Å; H57-A61 VanDerWaalsContact O-N 3.12Å; A61-P63 WeakPolarHBondContact O-CD 3.49Å | ||
| 62 | Y | 84.1 | Confident | 86 | Confident | 187 Ų | 187 | 95.1 Ų | 95.1 | 73% | 0.733 | 45% | 0.454 | S | S | * | . | trans | -111 | 92.4 | 176.8 | -66.6 | -80.3 | 0 | 0 | 0 | 108.6 | N60 S64 | N60-Y62 PolarHBondContact O-N 2.62Å; N60-Y62 WeakPolarHBondContact OD1-CD2 3.1Å; Y62-S64 PolarHBondContact O-N 2.96Å | ||
| 63 | P | 82.8 | Confident | 85.6 | Confident | 33 Ų | 33 | 97.6 Ų | 97.6 | 21% | 0.214 | 46% | 0.463 | C | S | . | . | trans | -62.2 | 133.2 | 177.9 | 23 | -29 | 0 | 0 | 0 | 109.1 | W53 A61 E67 K68 L71 | W53-P63 VanDerWaalsContact CH2-CA 3.47Å; W53-P63 HydrophobicContact CH2-CB 3.49Å; W53-P63 VanDerWaalsContact CH2-CB 3.49Å; W53-P63 HydrophobicContact CH2-CG 3.84Å; W53-P63 VanDerWaalsContact CH2-N 3.27Å; W53-P63 HydrophobicContact CZ2-CB 3.38Å; W53-P63 HydrophobicContact CZ2-CG 4.24Å; W53-P63 HydrophobicContact CZ3-CB 4.14Å; W53-P63 HydrophobicContact CZ3-CG 4.14Å; A61-P63 WeakPolarHBondContact O-CD 3.49Å; P63-E67 HydrophobicContact CB-CB 3.95Å; P63-K68 HydrophobicContact CB-CG 3.85Å; P63-K68 HydrophobicContact CG-CG 3.79Å; P63-K68 WeakPolarHBondContact O-CE 3.34Å; P63-L71 HydrophobicContact CB-CD1 4.46Å | ||
| 64 | S | 86.8 | Confident | 85.3 | Confident | 53 Ų | 53 | 101.2 Ų | 101.2 | 37% | 0.371 | 48% | 0.481 | S | S | . | . | trans | -61.3 | 165.8 | 168.7 | 64.1 | 0 | 0 | 0 | 0 | 110.8 | Y62 Q66 E67 K68 | Y62-S64 PolarHBondContact O-N 2.96Å; S64-Q66 PolarHBondContact O-N 3Å; S64-E67 VanDerWaalsContact CB-OE2 3.31Å; S64-E67 WeakPolarHBondContact CB-OE2 3.35Å; S64-E67 PolarHBondContact N-OE2 3.07Å; S64-E67 PolarHBondContact O-N 2.87Å; S64-E67 VanDerWaalsContact O-N 3.16Å; S64-E67 VanDerWaalsContact OG-CG 3.26Å; S64-E67 WeakPolarHBondContact OG-CG 3.2Å; S64-E67 PolarHBondContact OG-N 2.87Å; S64-E67 PolarHBondContact OG-OE2 2.95Å; S64-K68 WeakPolarHBondContact O-CG 3.37Å; S64-K68 PolarHBondContact O-N 3.12Å | ||
| 65 | E | 84.9 | Confident | 84.8 | Confident | 173 Ų | 173 | 97.3 Ų | 97.3 | 81% | 0.808 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -58.6 | -37.2 | 178.2 | -170.4 | 168.5 | -164 | 0 | 0 | 112.3 | A69 | E65-A69 PolarHBondContact O-N 3.29Å; E65-A69 VanDerWaalsContact O-N 3.08Å |
| 66 | Q | 86.1 | Confident | 83.9 | Confident | 158 Ų | 158 | 96.4 Ų | 96.4 | 74% | 0.738 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.2 | -45 | 175 | -176.5 | 174.7 | -7 | 0 | 0 | 112 | S64 A69 L70 | S64-Q66 PolarHBondContact O-N 3Å; Q66-A69 PolarHBondContact O-N 3.3Å; Q66-L70 WeakPolarHBondContact O-CB 3.28Å; Q66-L70 PolarHBondContact O-N 2.82Å |
| 67 | E | 85.4 | Confident | 83.1 | Confident | 46 Ų | 46 | 91.2 Ų | 91.2 | 22% | 0.215 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -69 | -38.6 | 179.3 | -68.6 | 169.2 | 108.9 | 0 | 0 | 111.9 | W53 H57 P63 S64 A69 L70 L71 | W53-E67 PolarHBondContact NE1-OE1 3.5Å; H57-E67 IonicContact CD2-OE1 3.63Å; H57-E67 IonicContact CE1-OE1 3.3Å; H57-E67 PolarHBondContact CE1-OE1 3.48Å; H57-E67 VanDerWaalsContact CE1-OE1 3.3Å; H57-E67 IonicContact NE2-OE1 2.99Å; H57-E67 PolarHBondContact NE2-OE1 3.46Å; P63-E67 HydrophobicContact CB-CB 3.95Å; S64-E67 VanDerWaalsContact CB-OE2 3.31Å; S64-E67 WeakPolarHBondContact CB-OE2 3.35Å; S64-E67 PolarHBondContact N-OE2 3.07Å; S64-E67 PolarHBondContact O-N 2.87Å; S64-E67 VanDerWaalsContact O-N 3.16Å; S64-E67 VanDerWaalsContact OG-CG 3.26Å; S64-E67 WeakPolarHBondContact OG-CG 3.2Å; S64-E67 PolarHBondContact OG-N 2.87Å; S64-E67 PolarHBondContact OG-OE2 2.95Å; E67-A69 VanDerWaalsContact C-N 3.31Å; E67-A69 PolarHBondContact O-N 3.22Å; E67-L70 PolarHBondContact O-N 2.83Å; E67-L71 WeakPolarHBondContact O-CB 3.25Å; E67-L71 VanDerWaalsContact O-CG 3.25Å; E67-L71 WeakPolarHBondContact O-CG 3.37Å; E67-L71 PolarHBondContact O-N 3.39Å |
| 68 | K | 84.3 | Confident | 81.6 | Confident | 115 Ų | 115 | 93.2 Ų | 93.2 | 50% | 0.5 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.8 | -45.1 | 172.7 | -72.7 | 176.8 | -177.1 | 168.5 | 0 | 111.3 | P63 S64 S72 | P63-K68 HydrophobicContact CB-CG 3.85Å; P63-K68 HydrophobicContact CG-CG 3.79Å; P63-K68 WeakPolarHBondContact O-CE 3.34Å; S64-K68 WeakPolarHBondContact O-CG 3.37Å; S64-K68 PolarHBondContact O-N 3.12Å; K68-S72 VanDerWaalsContact O-CB 3.31Å; K68-S72 WeakPolarHBondContact O-CB 3.39Å; K68-S72 PolarHBondContact O-N 2.97Å |
| 69 | A | 83.8 | Confident | 80.1 | Confident | 51 Ų | 51 | 90 Ų | 90 | 42% | 0.421 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | E65 Q66 E67 S72 Q73 | E65-A69 PolarHBondContact O-N 3.29Å; E65-A69 VanDerWaalsContact O-N 3.08Å; Q66-A69 PolarHBondContact O-N 3.3Å; E67-A69 VanDerWaalsContact C-N 3.31Å; E67-A69 PolarHBondContact O-N 3.22Å; A69-S72 WeakPolarHBondContact O-CB 3.42Å; A69-S72 PolarHBondContact O-N 3.42Å; A69-Q73 WeakPolarHBondContact O-CG 3.4Å; A69-Q73 PolarHBondContact O-N 3.28Å |
| 70 | L | 86.3 | Confident | 78.6 | Confident | 87 Ų | 87 | 88.8 Ų | 88.8 | 46% | 0.455 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.4 | -47.4 | -179.8 | -157.7 | 153.2 | 0 | 0 | 0 | 111.7 | Q66 E67 S72 Q73 Q74 | Q66-L70 WeakPolarHBondContact O-CB 3.28Å; Q66-L70 PolarHBondContact O-N 2.82Å; E67-L70 PolarHBondContact O-N 2.83Å; L70-S72 VanDerWaalsContact C-N 3.29Å; L70-S72 PolarHBondContact O-N 2.8Å; L70-Q73 PolarHBondContact O-N 2.91Å; L70-Q74 HydrophobicContact CD2-CG 3.97Å; L70-Q74 WeakPolarHBondContact O-CB 3.48Å; L70-Q74 WeakPolarHBondContact O-CG 3.39Å; L70-Q74 PolarHBondContact O-N 3.22Å |
| 71 | L | 85.9 | Confident | 76.8 | Confident | 13 Ų | 13 | 92 Ų | 92 | 7% | 0.068 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -60.5 | -39.4 | 174.7 | -70.2 | 171.2 | 0 | 0 | 0 | 111.4 | I49 L50 W53 P63 E67 Q74 T75 | I49-L71 HydrophobicContact CG2-CD2 3.75Å; L50-L71 HydrophobicContact CD2-CB 4.43Å; L50-L71 HydrophobicContact CD2-CD1 4.31Å; L50-L71 HydrophobicContact CD2-CD2 4.4Å; W53-L71 HydrophobicContact CB-CD1 4.36Å; W53-L71 HydrophobicContact CB-CD2 3.72Å; W53-L71 HydrophobicContact CD2-CD1 3.81Å; W53-L71 HydrophobicContact CE3-CD1 4.28Å; W53-L71 HydrophobicContact CG-CD1 3.79Å; W53-L71 HydrophobicContact CG-CD2 3.85Å; W53-L71 HydrophobicContact CG-CG 4.28Å; P63-L71 HydrophobicContact CB-CD1 4.46Å; E67-L71 WeakPolarHBondContact O-CB 3.25Å; E67-L71 VanDerWaalsContact O-CG 3.25Å; E67-L71 WeakPolarHBondContact O-CG 3.37Å; E67-L71 PolarHBondContact O-N 3.39Å; L71-Q74 PolarHBondContact O-N 3.21Å; L71-T75 WeakPolarHBondContact O-CB 3.31Å; L71-T75 WeakPolarHBondContact O-CG2 3.35Å; L71-T75 PolarHBondContact O-N 2.8Å; L71-T75 PolarHBondContact O-OG1 2.7Å |
| 72 | S | 82.6 | Confident | 74.8 | Confident | 11 Ų | 11 | 93.4 Ų | 93.4 | 8% | 0.077 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.8 | -42.8 | 175.8 | 176.2 | 0 | 0 | 0 | 0 | 112.9 | K68 A69 L70 H76 L77 T79 | K68-S72 VanDerWaalsContact O-CB 3.31Å; K68-S72 WeakPolarHBondContact O-CB 3.39Å; K68-S72 PolarHBondContact O-N 2.97Å; A69-S72 WeakPolarHBondContact O-CB 3.42Å; A69-S72 PolarHBondContact O-N 3.42Å; L70-S72 VanDerWaalsContact C-N 3.29Å; L70-S72 PolarHBondContact O-N 2.8Å; S72-H76 WeakPolarHBondContact O-CA 3.43Å; S72-H76 PolarHBondContact O-N 3.34Å; S72-L77 WeakPolarHBondContact CA-O 3.31Å; S72-L77 WeakPolarHBondContact CB-O 3.36Å; S72-L77 PolarHBondContact O-N 2.95Å; S72-L77 PolarHBondContact OG-O 3.16Å; S72-T79 PolarHBondContact OG-N 2.87Å |
| 73 | Q | 82.7 | Confident | 72.8 | Confident | 144 Ų | 144 | 90.4 Ų | 90.4 | 67% | 0.673 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62 | -47.1 | 175.1 | -69.3 | -58.6 | -61.6 | 0 | 0 | 111.1 | A69 L70 H76 | A69-Q73 WeakPolarHBondContact O-CG 3.4Å; A69-Q73 PolarHBondContact O-N 3.28Å; L70-Q73 PolarHBondContact O-N 2.91Å; Q73-H76 PolarHBondContact O-N 2.89Å |
| 74 | Q | 83.1 | Confident | 70.7 | Confident | 101 Ų | 101 | 97.6 Ų | 97.6 | 47% | 0.472 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.2 | -42.8 | -178.5 | -73.1 | -176.7 | -29 | 0 | 0 | 112.8 | I49 L70 L71 H76 | I49-Q74 HydrophobicContact CD1-CB 3.94Å; I49-Q74 WeakPolarHBondContact CD1-O 3.45Å; I49-Q74 HydrophobicContact CG2-CB 3.99Å; I49-Q74 VanDerWaalsContact CG2-OE1 3.29Å; L70-Q74 HydrophobicContact CD2-CG 3.97Å; L70-Q74 WeakPolarHBondContact O-CB 3.48Å; L70-Q74 WeakPolarHBondContact O-CG 3.39Å; L70-Q74 PolarHBondContact O-N 3.22Å; L71-Q74 PolarHBondContact O-N 3.21Å; Q74-H76 VanDerWaalsContact C-N 3.26Å; Q74-H76 PolarHBondContact O-N 2.96Å |
| 75 | T | 80.9 | Confident | 69.9 | Low | 4 Ų | 4 | 99.9 Ų | 99.9 | 3% | 0.025 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -81.3 | -9.4 | -177.1 | 62.5 | 0 | 0 | 0 | 0 | 112.5 | S46 I49 L50 L71 L77 | S46-T75 WeakPolarHBondContact O-CG2 3.31Å; S46-T75 PolarHBondContact OG-O 3.46Å; I49-T75 HydrophobicContact CB-CG2 3.89Å; I49-T75 HydrophobicContact CD1-CG2 4.23Å; I49-T75 HydrophobicContact CG2-CG2 3.76Å; L50-T75 HydrophobicContact CD2-CG2 4.21Å; L50-T75 HydrophobicContact CG-CG2 3.95Å; L71-T75 WeakPolarHBondContact O-CB 3.31Å; L71-T75 WeakPolarHBondContact O-CG2 3.35Å; L71-T75 PolarHBondContact O-N 2.8Å; L71-T75 PolarHBondContact O-OG1 2.7Å; T75-L77 HydrophobicContact CG2-CD1 4.35Å; T75-L77 PolarHBondContact O-N 2.99Å; T75-L77 WeakPolarHBondContact OG1-CB 3.36Å; T75-L77 WeakPolarHBondContact OG1-CD1 3.18Å; T75-L77 WeakPolarHBondContact OG1-CG 3.2Å; T75-L77 PolarHBondContact OG1-N 2.78Å |
| 76 | H | 71.2 | Confident | 69.2 | Low | 160 Ų | 160 | 96 Ų | 96 | 74% | 0.741 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49 | 19.4 | -167.2 | -58.1 | -73.1 | 0 | 0 | 0 | 113.4 | S72 Q73 Q74 S78 | S72-H76 WeakPolarHBondContact O-CA 3.43Å; S72-H76 PolarHBondContact O-N 3.34Å; Q73-H76 PolarHBondContact O-N 2.89Å; Q74-H76 VanDerWaalsContact C-N 3.26Å; Q74-H76 PolarHBondContact O-N 2.96Å; H76-S78 PolarHBondContact O-N 2.63Å |
| 77 | L | 70.8 | Confident | 68.2 | Low | 42 Ų | 42 | 92.6 Ų | 92.6 | 22% | 0.22 | 52% | 0.522 | C | S | . | . | trans | -82.9 | 102 | 168.1 | -56.4 | 170.7 | 0 | 0 | 0 | 103.3 | L42 L50 S72 T75 T79 | L42-L77 HydrophobicContact CD2-CD1 3.16Å; L42-L77 HydrophobicContact CD2-CD2 3.48Å; L42-L77 VanDerWaalsContact CD2-CD2 3.48Å; L42-L77 HydrophobicContact CD2-CG 3.91Å; L50-L77 HydrophobicContact CD1-CD1 4.07Å; S72-L77 WeakPolarHBondContact CA-O 3.31Å; S72-L77 WeakPolarHBondContact CB-O 3.36Å; S72-L77 PolarHBondContact O-N 2.95Å; S72-L77 PolarHBondContact OG-O 3.16Å; T75-L77 HydrophobicContact CG2-CD1 4.35Å; T75-L77 PolarHBondContact O-N 2.99Å; T75-L77 WeakPolarHBondContact OG1-CB 3.36Å; T75-L77 WeakPolarHBondContact OG1-CD1 3.18Å; T75-L77 WeakPolarHBondContact OG1-CG 3.2Å; T75-L77 PolarHBondContact OG1-N 2.78Å; L77-T79 PolarHBondContact O-N 3.29Å | ||
| 78 | S | 57.8 | Low | 67.2 | Low | 88 Ų | 88 | 95.3 Ų | 95.3 | 62% | 0.615 | 54% | 0.54 | S | S | * | . | trans | -44.8 | 113.2 | 168.1 | -167.8 | 0 | 0 | 0 | 0 | 105.9 | H76 L80 | H76-S78 PolarHBondContact O-N 2.63Å; S78-L80 VanDerWaalsContact C-N 3.32Å; S78-L80 PolarHBondContact O-N 3.34Å | ||
| 79 | T | 53.4 | Low | 66.1 | Low | 81 Ų | 81 | 94.1 Ų | 94.1 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | trans | -43.8 | 113 | 164.3 | 35.1 | 0 | 0 | 0 | 0 | 102.5 | S72 L77 Q81 | S72-T79 PolarHBondContact OG-N 2.87Å; L77-T79 PolarHBondContact O-N 3.29Å; T79-Q81 PolarHBondContact O-N 3.34Å | ||
| 80 | L | 53.2 | Low | 65 | Low | 164 Ų | 164 | 96.9 Ų | 96.9 | 86% | 0.859 | 55% | 0.551 | S | S | * | * | trans | -20.5 | 107.4 | 175.1 | -98.8 | 146.6 | 0 | 0 | 0 | 106.6 | S78 A82 | S78-L80 VanDerWaalsContact C-N 3.32Å; S78-L80 PolarHBondContact O-N 3.34Å; L80-A82 PolarHBondContact O-N 3.08Å | ||
| 81 | Q | 44.7 | Very low | 63.4 | Low | 168 Ų | 168 | 97.6 Ų | 97.6 | 79% | 0.785 | 56% | 0.558 | S | S | * | * | trans | -52.9 | 101.3 | 170.5 | -81.1 | -176 | -49 | 0 | 0 | 102.5 | T79 P83 | T79-Q81 PolarHBondContact O-N 3.34Å; Q81-P83 WeakPolarHBondContact O-CD 3.26Å | ||
| 82 | A | 39.8 | Very low | 61.7 | Low | 82 Ų | 82 | 104.2 Ų | 104.2 | 68% | 0.678 | 60% | 0.595 | S | S | * | * | trans | -56.2 | 114.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 101.3 | L80 S84 | L80-A82 PolarHBondContact O-N 3.08Å; A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 2.81Å | ||
| 83 | P | 42.6 | Very low | 60 | Low | 125 Ų | 125 | 111.9 Ų | 111.9 | 81% | 0.812 | 64% | 0.639 | S | S | * | * | trans | -58.4 | 110.8 | 177.9 | 24.4 | -30.1 | 0 | 0 | 0 | 104.3 | Q81 | Q81-P83 WeakPolarHBondContact O-CD 3.26Š| ||
| 84 | S | 39.5 | Very low | 57.9 | Low | 184 Ų | 184 | 109 Ų | 109 | 100% | 1.287 | 64% | 0.635 | S | S | * | * | trans | -59.8 | 0 | 167.3 | -178.8 | 0 | 0 | 0 | 0 | 109.3 | A82 | A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 2.81Å |
Retrieved 84 of 84 residues in 43.1 ms
(Link to these results)