| 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 | E | 37.6 | Very low | 52.2 | Low | 251 Ų | 251 | 152.4 Ų | 152.4 | 100% | 1.173 | 85% | 0.845 | S | S | * | * | 0 | 129.7 | 0 | -65.2 | 176.9 | 166.1 | 0 | 0 | 108.2 | |||||
| 2 | V | 44.6 | Very low | 52.5 | Low | 135 Ų | 135 | 148.6 Ų | 148.6 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | trans | -89.5 | 125.7 | 179.8 | 145.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 3 | S | 50.8 | Low | 53.3 | Low | 118 Ų | 118 | 148.1 Ų | 148.1 | 83% | 0.825 | 83% | 0.827 | S | S | * | * | trans | -132.4 | 93.2 | 160.9 | 63.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 4 | T | 57.5 | Low | 53.6 | Low | 130 Ų | 130 | 149.4 Ų | 149.4 | 80% | 0.798 | 82% | 0.819 | S | S | * | * | trans | -70.6 | 119.4 | 165.9 | -9.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 5 | L | 48.3 | Very low | 53.5 | Low | 178 Ų | 178 | 146.7 Ų | 146.7 | 93% | 0.932 | 81% | 0.814 | S | S | * | * | trans | -165.8 | 119.1 | 165.9 | -167.9 | 69.3 | 0 | 0 | 0 | 105.7 | ||||
| 6 | G | 40 | Very low | 53.7 | Low | 60 Ų | 60 | 144.3 Ų | 144.3 | 62% | 0.619 | 80% | 0.804 | S | S | * | * | cis | 145 | 126 | 14.5 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 7 | K | 55.8 | Low | 54.2 | Low | 218 Ų | 218 | 141.4 Ų | 141.4 | 95% | 0.948 | 80% | 0.796 | S | S | * | * | trans | 73.9 | 142.3 | 165.2 | -51.2 | -173.9 | 179.6 | -174.3 | 0 | 116.5 | ||||
| 8 | A | 54.9 | Low | 54.6 | Low | 87 Ų | 87 | 143.6 Ų | 143.6 | 72% | 0.719 | 80% | 0.798 | S | S | * | * | cis | -149.8 | 145.6 | -3.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | T10 | A8-T10 PolarHBondContact O-N 3.37Š| ||
| 9 | K | 60.9 | Low | 54.7 | Low | 215 Ų | 215 | 141.9 Ų | 141.9 | 94% | 0.935 | 80% | 0.796 | S | S | * | * | trans | -73.4 | 109.3 | 167.9 | -81.5 | 176 | 149.1 | -179.4 | 0 | 108 | E11 | K9-E11 PolarHBondContact O-N 3.1Š| ||
| 10 | T | 58.6 | Low | 55.1 | Low | 136 Ų | 136 | 139.7 Ų | 139.7 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 116.4 | 171.4 | -55 | 0 | 0 | 0 | 0 | 108.9 | A8 | A8-T10 PolarHBondContact O-N 3.37Š|
| 11 | E | 65.1 | Low | 55.5 | Low | 148 Ų | 148 | 137.7 Ų | 137.7 | 69% | 0.692 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 135.3 | 173.6 | -168 | 172.7 | 168.7 | 0 | 0 | 109.7 | K9 N13 | K9-E11 PolarHBondContact O-N 3.1Å; E11-N13 PolarHBondContact O-N 2.68Å |
| 12 | P | 55.8 | Low | 56.3 | Low | 107 Ų | 107 | 134.7 Ų | 134.7 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 124.3 | 177.9 | 24.9 | -32.2 | 0 | 0 | 0 | 109.7 | K14 | P12-K14 PolarHBondContact O-N 3.03Š|
| 13 | N | 62.7 | Low | 57.1 | Low | 142 Ų | 142 | 136.7 Ų | 136.7 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -45.3 | 106 | 174.1 | 173.6 | -14.8 | 0 | 0 | 0 | 110.4 | E11 C15 | E11-N13 PolarHBondContact O-N 2.68Å; N13-C15 VanDerWaalsContact C-N 3.26Å; N13-C15 PolarHBondContact O-N 2.91Å; N13-C15 PolarHBondContact OD1-N 3.49Å | ||
| 14 | K | 57.5 | Low | 57.3 | Low | 166 Ų | 166 | 135.6 Ų | 135.6 | 72% | 0.722 | 77% | 0.766 | S | S | * | * | trans | -79.6 | 80.5 | 169.2 | -61.9 | -160.9 | -170.1 | -175 | 0 | 108.5 | P12 V16 | P12-K14 PolarHBondContact O-N 3.03Å; K14-V16 VanDerWaalsContact C-N 3.29Å; K14-V16 HydrophobicContact CB-CG2 4.49Å; K14-V16 PolarHBondContact O-N 2.87Å | ||
| 15 | C | 52.3 | Low | 56.9 | Low | 109 Ų | 109 | 134.7 Ų | 134.7 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | trans | -71.5 | 91.5 | 168 | -167.1 | 0 | 0 | 0 | 0 | 107.8 | N13 S17 | N13-C15 VanDerWaalsContact C-N 3.26Å; N13-C15 PolarHBondContact O-N 2.91Å; N13-C15 PolarHBondContact OD1-N 3.49Å; C15-S17 PolarHBondContact O-N 3.35Å | ||
| 16 | V | 56.2 | Low | 57.6 | Low | 109 Ų | 109 | 134.7 Ų | 134.7 | 66% | 0.661 | 76% | 0.755 | S | S | * | * | trans | -83.7 | 95.5 | 173 | 177.5 | 0 | 0 | 0 | 0 | 107.4 | K14 Q18 | K14-V16 VanDerWaalsContact C-N 3.29Å; K14-V16 HydrophobicContact CB-CG2 4.49Å; K14-V16 PolarHBondContact O-N 2.87Å; V16-Q18 HydrophobicContact CG1-CG 4.02Å; V16-Q18 PolarHBondContact O-N 2.97Å | ||
| 17 | S | 63.3 | Low | 58.4 | Low | 95 Ų | 95 | 134.7 Ų | 134.7 | 66% | 0.664 | 75% | 0.754 | S | S | * | * | trans | -85.4 | 102.1 | 165.6 | 67.3 | 0 | 0 | 0 | 0 | 108.8 | C15 C19 | C15-S17 PolarHBondContact O-N 3.35Å; S17-C19 VanDerWaalsContact C-N 3.27Å; S17-C19 PolarHBondContact O-N 2.88Å | ||
| 18 | Q | 60.3 | Low | 58.1 | Low | 180 Ų | 180 | 132.9 Ų | 132.9 | 84% | 0.841 | 75% | 0.754 | S | S | * | * | trans | -77.2 | 83.4 | 165.9 | -70.6 | 177.1 | 26.5 | 0 | 0 | 108.4 | V16 A20 | V16-Q18 HydrophobicContact CG1-CG 4.02Å; V16-Q18 PolarHBondContact O-N 2.97Å; Q18-A20 PolarHBondContact O-N 3.23Å | ||
| 19 | C | 56.9 | Low | 57.9 | Low | 112 Ų | 112 | 136 Ų | 136 | 76% | 0.757 | 76% | 0.757 | S | S | * | * | trans | -77.2 | 96.1 | 164.5 | -70.5 | 0 | 0 | 0 | 0 | 107.4 | S17 A21 | S17-C19 VanDerWaalsContact C-N 3.27Å; S17-C19 PolarHBondContact O-N 2.88Å; C19-A21 PolarHBondContact O-N 3.12Å | ||
| 20 | A | 63.3 | Low | 57.7 | Low | 98 Ų | 98 | 134.3 Ų | 134.3 | 81% | 0.81 | 75% | 0.752 | S | S | * | * | trans | -64.2 | 118.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | Q18 F22 | Q18-A20 PolarHBondContact O-N 3.23Å; A20-F22 PolarHBondContact O-N 3.06Å | ||
| 21 | A | 63.6 | Low | 57 | Low | 97 Ų | 97 | 130.2 Ų | 130.2 | 80% | 0.802 | 74% | 0.737 | S | S | * | * | trans | -66.3 | 117.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | C19 E23 | C19-A21 PolarHBondContact O-N 3.12Å; A21-E23 VanDerWaalsContact C-N 3.31Å; A21-E23 PolarHBondContact O-N 2.63Å | ||
| 22 | F | 53.3 | Low | 55.9 | Low | 189 Ų | 189 | 129.4 Ų | 129.4 | 83% | 0.829 | 75% | 0.746 | S | S | * | * | trans | -73.9 | 93.4 | 166.3 | -172.4 | -97.4 | 0 | 0 | 0 | 107.3 | A20 N24 | A20-F22 PolarHBondContact O-N 3.06Å; F22-N24 PolarHBondContact O-N 3.36Å | ||
| 23 | E | 62.6 | Low | 55.5 | Low | 177 Ų | 177 | 128.6 Ų | 128.6 | 83% | 0.827 | 74% | 0.744 | S | S | * | * | trans | -65.1 | 125.1 | 170.1 | -170.2 | 169.1 | -163.8 | 0 | 0 | 108.6 | A21 | A21-E23 VanDerWaalsContact C-N 3.31Å; A21-E23 PolarHBondContact O-N 2.63Å | ||
| 24 | N | 54.5 | Low | 54.9 | Low | 95 Ų | 95 | 131 Ų | 131 | 51% | 0.508 | 75% | 0.747 | S | S | . | * | trans | -66.6 | 122.3 | 178 | -172.4 | -20.8 | 0 | 0 | 0 | 108.6 | F22 K26 | F22-N24 PolarHBondContact O-N 3.36Å; N24-K26 VanDerWaalsContact ND2-CE 3.32Å; N24-K26 WeakPolarHBondContact ND2-CE 3.27Å; N24-K26 PolarHBondContact O-N 2.78Å | ||
| 25 | P | 49.7 | Very low | 54.3 | Low | 111 Ų | 111 | 129.7 Ų | 129.7 | 72% | 0.721 | 75% | 0.748 | S | S | * | * | trans | -76.2 | 71.8 | 178 | 32.3 | -33.2 | 0 | 0 | 0 | 109.4 | G27 | P25-G27 PolarHBondContact O-N 2.74Š| ||
| 26 | K | 62.3 | Low | 53.6 | Low | 178 Ų | 178 | 130.7 Ų | 130.7 | 77% | 0.774 | 75% | 0.746 | S | S | * | * | trans | -87.8 | 95.9 | 168.3 | -81.4 | 173.3 | 178.1 | 176.7 | 0 | 108.2 | N24 | N24-K26 VanDerWaalsContact ND2-CE 3.32Å; N24-K26 WeakPolarHBondContact ND2-CE 3.27Å; N24-K26 PolarHBondContact O-N 2.78Å | ||
| 27 | G | 57.3 | Low | 53.1 | Low | 59 Ų | 59 | 135.5 Ų | 135.5 | 61% | 0.608 | 75% | 0.753 | S | S | * | * | trans | 94.9 | 73 | 157.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | P25 I29 | P25-G27 PolarHBondContact O-N 2.74Å; G27-I29 PolarHBondContact O-N 3.5Å; G27-I29 VanDerWaalsContact O-N 3.12Å | ||
| 28 | L | 48.3 | Very low | 52.3 | Low | 180 Ų | 180 | 136.5 Ų | 136.5 | 94% | 0.942 | 75% | 0.75 | S | S | * | * | trans | -80.4 | 77.4 | 145.1 | -150.8 | 88.3 | 0 | 0 | 0 | 107.1 | H30 | L28-H30 PolarHBondContact O-N 2.77Š| ||
| 29 | I | 52.6 | Low | 51.5 | Low | 154 Ų | 154 | 134.9 Ų | 134.9 | 79% | 0.79 | 75% | 0.748 | S | S | * | * | trans | -61.2 | 112.6 | 168.1 | -55.7 | -179.4 | 0 | 0 | 0 | 105.1 | G27 G31 | G27-I29 PolarHBondContact O-N 3.5Å; G27-I29 VanDerWaalsContact O-N 3.12Å; I29-G31 PolarHBondContact O-N 2.9Å | ||
| 30 | H | 55.2 | Low | 50.9 | Low | 178 Ų | 178 | 135.3 Ų | 135.3 | 82% | 0.824 | 75% | 0.747 | S | S | * | * | trans | -54.6 | 105.4 | 177.9 | -164.2 | -61.1 | 0 | 0 | 0 | 108.1 | L28 C32 | L28-H30 PolarHBondContact O-N 2.77Å; H30-C32 PolarHBondContact O-N 3.02Å | ||
| 31 | G | 45.4 | Very low | 50.4 | Low | 51 Ų | 51 | 140 Ų | 140 | 53% | 0.526 | 75% | 0.752 | S | S | . | * | trans | -56.3 | 130.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | I29 | I29-G31 PolarHBondContact O-N 2.9Š| ||
| 32 | C | 41 | Very low | 49.8 | Very low | 130 Ų | 130 | 138.5 Ų | 138.5 | 88% | 0.878 | 75% | 0.746 | S | S | * | * | trans | 5.9 | 136.1 | 131.8 | -140.2 | 0 | 0 | 0 | 0 | 114.2 | H30 | H30-C32 PolarHBondContact O-N 3.02Š| ||
| 33 | S | 47.4 | Very low | 49.5 | Very low | 91 Ų | 91 | 137.9 Ų | 137.9 | 64% | 0.636 | 74% | 0.743 | S | S | * | * | cis | 173.4 | 140.2 | 9.4 | 141.9 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 34 | K | 50.5 | Low | 49.1 | Very low | 191 Ų | 191 | 139.2 Ų | 139.2 | 83% | 0.83 | 75% | 0.746 | S | S | * | * | trans | 50.4 | 118.2 | 136.6 | -149.1 | 175.9 | -169 | 179 | 0 | 119.8 | ||||
| 35 | D | 43.8 | Very low | 49.2 | Very low | 139 Ų | 139 | 143.4 Ų | 143.4 | 74% | 0.743 | 76% | 0.756 | S | S | * | * | 159.1 | 153.2 | 104 | -164.5 | 25.7 | 0 | 0 | 0 | 114.4 | |||||
| 36 | N | 38.5 | Very low | 49.4 | Very low | 131 Ų | 131 | 143.5 Ų | 143.5 | 70% | 0.701 | 76% | 0.757 | S | S | * | * | trans | 75.7 | 111 | 173.6 | 99.4 | 58.2 | 0 | 0 | 0 | 115.8 | ||||
| 37 | R | 46.5 | Very low | 49.3 | Very low | 210 Ų | 210 | 143.4 Ų | 143.4 | 79% | 0.792 | 76% | 0.764 | S | S | * | * | 55 | 91.3 | 63.5 | -74.7 | -171.5 | 84.3 | 178.2 | 6.4 | 113 | |||||
| 38 | N | 46.3 | Very low | 49 | Very low | 116 Ų | 116 | 143.6 Ų | 143.6 | 62% | 0.62 | 77% | 0.766 | S | S | * | * | 119.8 | 133.9 | 129 | -50.3 | -31.3 | 0 | 0 | 0 | 115.2 | |||||
| 39 | D | 43.5 | Very low | 49.4 | Very low | 146 Ų | 146 | 142 Ų | 142 | 78% | 0.781 | 75% | 0.753 | S | S | * | * | trans | 93 | 122.3 | 142.9 | -57 | -26.9 | 0 | 0 | 0 | 121.6 | ||||
| 40 | T | 43.2 | Very low | 49.4 | Very low | 120 Ų | 120 | 143.8 Ų | 143.8 | 74% | 0.736 | 76% | 0.758 | S | S | * | * | trans | 92.1 | 95.4 | 141.8 | -38.7 | 0 | 0 | 0 | 0 | 118.8 | G42 | T40-G42 PolarHBondContact O-N 2.99Š| ||
| 41 | E | 53.2 | Low | 49.5 | Very low | 197 Ų | 197 | 139.2 Ų | 139.2 | 92% | 0.921 | 74% | 0.742 | S | S | * | * | 24.2 | 93.2 | 123.4 | -159.3 | 172.6 | -144.3 | 0 | 0 | 115.9 | |||||
| 42 | G | 50.7 | Low | 50.1 | Low | 65 Ų | 65 | 143.1 Ų | 143.1 | 67% | 0.67 | 75% | 0.751 | S | S | * | * | trans | 178.1 | 71.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | T40 | T40-G42 PolarHBondContact O-N 2.99Š| ||
| 43 | F | 46.8 | Very low | 51 | Low | 176 Ų | 176 | 145.4 Ų | 145.4 | 77% | 0.772 | 75% | 0.749 | S | S | * | * | 172.5 | 107.2 | 128.6 | -115.9 | -103.8 | 0 | 0 | 0 | 108.8 | Y45 | F43-Y45 AromaticContact CD1-CD2 3.83Å; F43-Y45 HydrophobicContact CD1-CD2 3.83Å; F43-Y45 AromaticContact CD1-CE2 3.59Å; F43-Y45 HydrophobicContact CD1-CE2 3.59Å; F43-Y45 HydrophobicContact CE1-CE2 4Å; F43-Y45 PolarHBondContact O-N 2.94Å; F43-Y45 VanDerWaalsContact O-N 3.1Å | |||
| 44 | K | 55.2 | Low | 51.7 | Low | 205 Ų | 205 | 145.5 Ų | 145.5 | 89% | 0.891 | 75% | 0.749 | S | S | * | * | trans | -69.4 | 100.1 | 157.9 | -74.6 | -147 | 178 | -157.7 | 0 | 107.8 | ||||
| 45 | Y | 55.9 | Low | 52.2 | Low | 184 Ų | 184 | 146.4 Ų | 146.4 | 72% | 0.722 | 75% | 0.748 | S | S | * | * | trans | -83.6 | 123.1 | 144 | -91.4 | -88.5 | 0 | 0 | 0 | 106.7 | F43 L47 | F43-Y45 AromaticContact CD1-CD2 3.83Å; F43-Y45 HydrophobicContact CD1-CD2 3.83Å; F43-Y45 AromaticContact CD1-CE2 3.59Å; F43-Y45 HydrophobicContact CD1-CE2 3.59Å; F43-Y45 HydrophobicContact CE1-CE2 4Å; F43-Y45 PolarHBondContact O-N 2.94Å; F43-Y45 VanDerWaalsContact O-N 3.1Å; Y45-L47 PolarHBondContact O-N 3.25Å | ||
| 46 | P | 55 | Low | 53 | Low | 113 Ų | 113 | 148 Ų | 148 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | trans | -56.3 | 117.2 | 161 | -9.1 | 23.2 | 0 | 0 | 0 | 105.1 | G48 | P46-G48 PolarHBondContact O-N 3.18Š| ||
| 47 | L | 59.5 | Low | 54.4 | Low | 175 Ų | 175 | 145.8 Ų | 145.8 | 92% | 0.916 | 74% | 0.742 | S | S | * | * | trans | -65.2 | 73.7 | 161.2 | -81.6 | 157.6 | 0 | 0 | 0 | 106 | Y45 H49 | Y45-L47 PolarHBondContact O-N 3.25Å; L47-H49 PolarHBondContact O-N 3.26Å | ||
| 48 | G | 49.8 | Very low | 55.6 | Low | 63 Ų | 63 | 140.2 Ų | 140.2 | 65% | 0.649 | 74% | 0.735 | S | S | * | * | trans | -68.5 | 90.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | P46 E50 | P46-G48 PolarHBondContact O-N 3.18Å; G48-E50 PolarHBondContact O-N 3.06Å | ||
| 49 | H | 58.6 | Low | 57.2 | Low | 148 Ų | 148 | 141.6 Ų | 141.6 | 69% | 0.685 | 74% | 0.741 | S | S | * | * | trans | 53 | 72.7 | 146.1 | -164.4 | -88.2 | 0 | 0 | 0 | 113.6 | L47 V51 | L47-H49 PolarHBondContact O-N 3.26Å; H49-V51 WeakPolarHBondContact CE1-CB 3.37Å; H49-V51 WeakPolarHBondContact CE1-CG2 3.31Å; H49-V51 VanDerWaalsContact ND1-CB 3.31Å; H49-V51 WeakPolarHBondContact ND1-CB 2.95Å; H49-V51 WeakPolarHBondContact ND1-CG2 3.15Å; H49-V51 VanDerWaalsContact NE2-CG2 3.27Å; H49-V51 WeakPolarHBondContact NE2-CG2 3.32Å; H49-V51 PolarHBondContact O-N 3.37Å | ||
| 50 | E | 51.7 | Low | 58.7 | Low | 190 Ų | 190 | 143 Ų | 143 | 89% | 0.888 | 74% | 0.743 | S | S | * | * | trans | -75.9 | 60.2 | 157.7 | -161.1 | 159.9 | -155 | 0 | 0 | 109 | G48 N52 | G48-E50 PolarHBondContact O-N 3.06Å; E50-N52 PolarHBondContact O-N 3.44Å | ||
| 51 | V | 58.3 | Low | 60.6 | Low | 82 Ų | 82 | 145.4 Ų | 145.4 | 50% | 0.497 | 75% | 0.748 | S | S | . | * | trans | -73.4 | 98.4 | 144.1 | 172.9 | 0 | 0 | 0 | 0 | 103.9 | H49 | H49-V51 WeakPolarHBondContact CE1-CB 3.37Å; H49-V51 WeakPolarHBondContact CE1-CG2 3.31Å; H49-V51 VanDerWaalsContact ND1-CB 3.31Å; H49-V51 WeakPolarHBondContact ND1-CB 2.95Å; H49-V51 WeakPolarHBondContact ND1-CG2 3.15Å; H49-V51 VanDerWaalsContact NE2-CG2 3.27Å; H49-V51 WeakPolarHBondContact NE2-CG2 3.32Å; H49-V51 PolarHBondContact O-N 3.37Å | ||
| 52 | N | 57.1 | Low | 61.8 | Low | 133 Ų | 133 | 144.3 Ų | 144.3 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | -157.3 | 104.2 | 110.2 | -77 | -54.9 | 0 | 0 | 0 | 103.9 | E50 S54 | E50-N52 PolarHBondContact O-N 3.44Å; N52-S54 PolarHBondContact O-N 3.05Å | |||
| 53 | H | 60.1 | Low | 63 | Low | 179 Ų | 179 | 150.5 Ų | 150.5 | 83% | 0.829 | 75% | 0.754 | S | S | * | * | trans | -39.4 | 119.8 | 145.9 | -84.2 | -66.3 | 0 | 0 | 0 | 105.5 | R55 | H53-R55 PolarHBondContact O-N 3.08Š| ||
| 54 | S | 61.3 | Low | 64.5 | Low | 93 Ų | 93 | 146.6 Ų | 146.6 | 65% | 0.65 | 75% | 0.749 | S | S | * | * | trans | -45.7 | 95.1 | 166.5 | 46.8 | 0 | 0 | 0 | 0 | 106 | N52 E56 | N52-S54 PolarHBondContact O-N 3.05Å; S54-E56 PolarHBondContact O-N 3.34Å | ||
| 55 | R | 60.8 | Low | 65.9 | Low | 210 Ų | 210 | 146 Ų | 146 | 79% | 0.792 | 75% | 0.749 | S | S | * | * | trans | -77.4 | 80.3 | 177.4 | 178.2 | 173.9 | 155.1 | -162.4 | -7.9 | 102.4 | H53 T57 | H53-R55 PolarHBondContact O-N 3.08Å; R55-T57 HydrophobicContact CG-CG2 3.92Å; R55-T57 PolarHBondContact O-N 2.96Å; R55-T57 PolarHBondContact O-OG1 2.96Å | ||
| 56 | E | 61.2 | Low | 67.3 | Low | 172 Ų | 172 | 142.3 Ų | 142.3 | 80% | 0.804 | 74% | 0.741 | S | S | * | * | trans | -62.8 | 77.7 | 160.5 | -71.2 | 170.9 | 164.2 | 0 | 0 | 105 | S54 S58 | S54-E56 PolarHBondContact O-N 3.34Å; E56-S58 PolarHBondContact O-N 3.05Å | ||
| 57 | T | 67.7 | Low | 68.9 | Low | 84 Ų | 84 | 141.9 Ų | 141.9 | 52% | 0.515 | 73% | 0.733 | S | S | . | * | trans | -63.4 | 93.2 | 159.5 | 27.6 | 0 | 0 | 0 | 0 | 105.2 | R55 I59 | R55-T57 HydrophobicContact CG-CG2 3.92Å; R55-T57 PolarHBondContact O-N 2.96Å; R55-T57 PolarHBondContact O-OG1 2.96Å; T57-I59 PolarHBondContact O-N 3.34Å | ||
| 58 | S | 72.7 | Confident | 70.4 | Confident | 93 Ų | 93 | 136.4 Ų | 136.4 | 65% | 0.65 | 71% | 0.713 | S | S | * | * | trans | -56.5 | 107.6 | 159.2 | 52.8 | 0 | 0 | 0 | 0 | 105.9 | E56 E60 | E56-S58 PolarHBondContact O-N 3.05Å; S58-E60 VanDerWaalsContact C-N 3.26Å; S58-E60 PolarHBondContact O-N 3.03Å | ||
| 59 | I | 79.3 | Confident | 72.4 | Confident | 145 Ų | 145 | 139.2 Ų | 139.2 | 74% | 0.744 | 71% | 0.709 | S | S | * | * | trans | -70.6 | 96.8 | 171.6 | -61.6 | 171.8 | 0 | 0 | 0 | 104.7 | T57 M61 | T57-I59 PolarHBondContact O-N 3.34Å; I59-M61 WeakPolarHBondContact O-CG 3.46Å; I59-M61 PolarHBondContact O-N 3.36Å | ||
| 60 | E | 75.7 | Confident | 73.9 | Confident | 177 Ų | 177 | 138.3 Ų | 138.3 | 83% | 0.827 | 70% | 0.7 | S | S | * | * | trans | -65.4 | 104.4 | 168.7 | -69.7 | 177.8 | -176 | 0 | 0 | 106.7 | S58 | S58-E60 VanDerWaalsContact C-N 3.26Å; S58-E60 PolarHBondContact O-N 3.03Å | ||
| 61 | M | 83.1 | Confident | 75.8 | Confident | 169 Ų | 169 | 133.4 Ų | 133.4 | 83% | 0.833 | 68% | 0.68 | S | S | * | * | trans | -86 | 122.8 | 175.6 | -13 | -173.8 | -61.4 | 0 | 0 | 107.2 | I59 | I59-M61 WeakPolarHBondContact O-CG 3.46Å; I59-M61 PolarHBondContact O-N 3.36Å | ||
| 62 | E | 77.5 | Confident | 77.4 | Confident | 175 Ų | 175 | 135.4 Ų | 135.4 | 82% | 0.818 | 68% | 0.684 | S | S | * | * | trans | -74.6 | 127.2 | 172.9 | -169.1 | -176.8 | -168.7 | 0 | 0 | 109.4 | S64 | E62-S64 PolarHBondContact O-N 3.24Å; E62-S64 VanDerWaalsContact O-N 3.08Å | ||
| 63 | E | 75.4 | Confident | 79 | Confident | 194 Ų | 194 | 133.1 Ų | 133.1 | 91% | 0.907 | 67% | 0.671 | S | S | * | * | trans | -71.5 | 99.3 | 167.2 | -87.6 | -168.9 | 155.6 | 0 | 0 | 108.8 | ||||
| 64 | S | 78.3 | Confident | 80.5 | Confident | 94 Ų | 94 | 127 Ų | 127 | 66% | 0.657 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -73 | 130.3 | 169.4 | -54.9 | 0 | 0 | 0 | 0 | 110.2 | E62 L66 | E62-S64 PolarHBondContact O-N 3.24Å; E62-S64 VanDerWaalsContact O-N 3.08Å; S64-L66 PolarHBondContact O-N 3.2Å |
| 65 | E | 84.9 | Confident | 82 | Confident | 193 Ų | 193 | 128.5 Ų | 128.5 | 90% | 0.902 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 125.8 | 173.1 | -173.9 | 174.4 | -175.4 | 0 | 0 | 110.2 | ||
| 66 | L | 84.6 | Confident | 83.4 | Confident | 106 Ų | 106 | 121.4 Ų | 121.4 | 56% | 0.555 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 121.6 | 178.2 | -72.7 | 173.5 | 0 | 0 | 0 | 110.2 | S64 Y70 L71 | S64-L66 PolarHBondContact O-N 3.2Å; L66-Y70 HydrophobicContact CD2-CD1 3.91Å; L66-Y70 HydrophobicContact CD2-CE1 3.96Å; L66-L71 HydrophobicContact CB-CD2 4.4Å; L66-L71 HydrophobicContact CD1-CD2 4.23Å |
| 67 | D | 90.2 | Very high | 84.8 | Confident | 105 Ų | 105 | 121.5 Ų | 121.5 | 56% | 0.561 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 146.3 | 178 | 177.3 | 52.5 | 0 | 0 | 0 | 112.7 | Q69 Y70 L71 | D67-Q69 VanDerWaalsContact C-N 3.25Å; D67-Q69 PolarHBondContact O-N 3.06Å; D67-Q69 WeakPolarHBondContact OD2-CB 3.48Å; D67-Q69 PolarHBondContact OD2-N 2.95Å; D67-Y70 WeakPolarHBondContact O-CB 3.36Å; D67-Y70 PolarHBondContact O-N 3.26Å; D67-L71 PolarHBondContact O-N 3.28Å |
| 68 | A | 91.2 | Very high | 86 | Confident | 60 Ų | 60 | 124.2 Ų | 124.2 | 50% | 0.496 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -60.5 | -34 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y70 L71 Q72 | A68-Y70 VanDerWaalsContact C-N 3.3Å; A68-Y70 PolarHBondContact O-N 3.29Å; A68-L71 PolarHBondContact O-N 3Å; A68-Q72 WeakPolarHBondContact O-CG 3.36Å; A68-Q72 PolarHBondContact O-N 3.32Å |
| 69 | Q | 91.8 | Very high | 87 | Confident | 121 Ų | 121 | 124.4 Ų | 124.4 | 57% | 0.565 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -65.6 | -35.8 | 177.4 | -172.9 | 56 | 74.8 | 0 | 0 | 111.6 | D67 N73 | D67-Q69 VanDerWaalsContact C-N 3.25Å; D67-Q69 PolarHBondContact O-N 3.06Å; D67-Q69 WeakPolarHBondContact OD2-CB 3.48Å; D67-Q69 PolarHBondContact OD2-N 2.95Å; Q69-N73 WeakPolarHBondContact O-CB 3.5Å; Q69-N73 PolarHBondContact O-N 3.43Å |
| 70 | Y | 89.9 | Confident | 87.6 | Confident | 129 Ų | 129 | 120.6 Ų | 120.6 | 51% | 0.506 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66.8 | -45.2 | 176.1 | 179.6 | -94.3 | 0 | 0 | 0 | 111.2 | L66 D67 A68 Q72 N73 L74 | L66-Y70 HydrophobicContact CD2-CD1 3.91Å; L66-Y70 HydrophobicContact CD2-CE1 3.96Å; D67-Y70 WeakPolarHBondContact O-CB 3.36Å; D67-Y70 PolarHBondContact O-N 3.26Å; A68-Y70 VanDerWaalsContact C-N 3.3Å; A68-Y70 PolarHBondContact O-N 3.29Å; Y70-Q72 PolarHBondContact O-N 3.44Å; Y70-N73 PolarHBondContact O-N 2.92Å; Y70-L74 HydrophobicContact CE1-CD2 4.12Å; Y70-L74 VanDerWaalsContact O-CB 3.26Å; Y70-L74 WeakPolarHBondContact O-CB 3.35Å; Y70-L74 PolarHBondContact O-N 3.39Å |
| 71 | L | 90.1 | Very high | 88.5 | Confident | 88 Ų | 88 | 114.8 Ų | 114.8 | 46% | 0.461 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.4 | -42.5 | 177.6 | -66.7 | 176.4 | 0 | 0 | 0 | 112.4 | L66 D67 A68 L74 H75 | L66-L71 HydrophobicContact CB-CD2 4.4Å; L66-L71 HydrophobicContact CD1-CD2 4.23Å; D67-L71 PolarHBondContact O-N 3.28Å; A68-L71 PolarHBondContact O-N 3Å; L71-L74 PolarHBondContact O-N 2.87Å; L71-H75 WeakPolarHBondContact O-CB 3.4Å; L71-H75 PolarHBondContact O-N 3.3Å |
| 72 | Q | 92.1 | Very high | 89.1 | Confident | 123 Ų | 123 | 109.1 Ų | 109.1 | 58% | 0.575 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66 | -41.1 | 177 | -72.6 | -177 | -2.7 | 0 | 0 | 112.5 | A68 Y70 H75 S76 | A68-Q72 WeakPolarHBondContact O-CG 3.36Å; A68-Q72 PolarHBondContact O-N 3.32Å; Y70-Q72 PolarHBondContact O-N 3.44Å; Q72-H75 PolarHBondContact O-N 3.06Å; Q72-S76 PolarHBondContact O-N 3.05Å; Q72-S76 VanDerWaalsContact O-N 3.07Å; Q72-S76 PolarHBondContact O-OG 3.36Å |
| 73 | N | 90.2 | Very high | 89.9 | Confident | 85 Ų | 85 | 105.2 Ų | 105.2 | 46% | 0.455 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.7 | -46.2 | 175.2 | -171.9 | -48.5 | 0 | 0 | 0 | 110.3 | Q69 Y70 H75 S76 R77 | Q69-N73 WeakPolarHBondContact O-CB 3.5Å; Q69-N73 PolarHBondContact O-N 3.43Å; Y70-N73 PolarHBondContact O-N 2.92Å; N73-H75 PolarHBondContact O-N 3.45Å; N73-S76 WeakPolarHBondContact O-CB 3.22Å; N73-S76 PolarHBondContact O-N 3.48Å; N73-S76 VanDerWaalsContact O-N 3.15Å; N73-R77 WeakPolarHBondContact O-CG 3.15Å; N73-R77 PolarHBondContact O-N 3.44Å; N73-R77 WeakPolarHBondContact OD1-CD 3.26Å; N73-R77 WeakPolarHBondContact OD1-CG 3.48Å |
| 74 | L | 93.3 | Very high | 90.9 | Very high | 50 Ų | 50 | 101 Ų | 101 | 26% | 0.262 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.2 | -45.3 | 178.3 | -170.9 | 62.7 | 0 | 0 | 0 | 112.1 | Y70 L71 S76 R77 F78 | Y70-L74 HydrophobicContact CE1-CD2 4.12Å; Y70-L74 VanDerWaalsContact O-CB 3.26Å; Y70-L74 WeakPolarHBondContact O-CB 3.35Å; Y70-L74 PolarHBondContact O-N 3.39Å; L71-L74 PolarHBondContact O-N 2.87Å; L74-S76 VanDerWaalsContact C-N 3.35Å; L74-S76 PolarHBondContact O-N 3.15Å; L74-R77 PolarHBondContact O-N 3.06Å; L74-F78 HydrophobicContact CD1-CD2 3.81Å; L74-F78 HydrophobicContact CD1-CE2 3.16Å; L74-F78 HydrophobicContact CD1-CZ 3.68Å; L74-F78 HydrophobicContact CD2-CE2 3.9Å; L74-F78 HydrophobicContact CG-CD2 3.69Å; L74-F78 HydrophobicContact CG-CE2 3.3Å; L74-F78 HydrophobicContact CG-CZ 4.29Å; L74-F78 WeakPolarHBondContact O-CD2 3.05Å; L74-F78 PolarHBondContact O-N 3.33Å |
| 75 | H | 91.6 | Very high | 91.8 | Very high | 125 Ų | 125 | 101.9 Ų | 101.9 | 58% | 0.579 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -55.4 | -49.7 | 173.1 | -176.5 | 108.3 | 0 | 0 | 0 | 111.4 | L71 Q72 N73 R77 F78 Q79 | L71-H75 WeakPolarHBondContact O-CB 3.4Å; L71-H75 PolarHBondContact O-N 3.3Å; Q72-H75 PolarHBondContact O-N 3.06Å; N73-H75 PolarHBondContact O-N 3.45Å; H75-R77 VanDerWaalsContact C-N 3.33Å; H75-R77 PolarHBondContact O-N 3.02Å; H75-F78 PolarHBondContact O-N 3.48Å; H75-Q79 WeakPolarHBondContact O-CB 3.39Å; H75-Q79 PolarHBondContact O-N 2.92Å |
| 76 | S | 91.6 | Very high | 92.3 | Very high | 61 Ų | 61 | 99.1 Ų | 99.1 | 43% | 0.427 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.5 | -39.6 | -178.3 | -57.4 | 0 | 0 | 0 | 0 | 112.2 | Q72 N73 L74 S80 | Q72-S76 PolarHBondContact O-N 3.05Å; Q72-S76 VanDerWaalsContact O-N 3.07Å; Q72-S76 PolarHBondContact O-OG 3.36Å; N73-S76 WeakPolarHBondContact O-CB 3.22Å; N73-S76 PolarHBondContact O-N 3.48Å; N73-S76 VanDerWaalsContact O-N 3.15Å; L74-S76 VanDerWaalsContact C-N 3.35Å; L74-S76 PolarHBondContact O-N 3.15Å; S76-S80 WeakPolarHBondContact O-CB 3.45Å; S76-S80 PolarHBondContact O-N 3.32Å; S76-S80 PolarHBondContact O-OG 3.45Å |
| 77 | R | 90.7 | Very high | 92.9 | Very high | 175 Ų | 175 | 99.2 Ų | 99.2 | 66% | 0.66 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66 | -46.7 | 176.6 | -68.6 | -179.8 | 94.7 | -176.6 | 8.6 | 111.8 | N73 L74 H75 S80 A81 | N73-R77 WeakPolarHBondContact O-CG 3.15Å; N73-R77 PolarHBondContact O-N 3.44Å; N73-R77 WeakPolarHBondContact OD1-CD 3.26Å; N73-R77 WeakPolarHBondContact OD1-CG 3.48Å; L74-R77 PolarHBondContact O-N 3.06Å; H75-R77 VanDerWaalsContact C-N 3.33Å; H75-R77 PolarHBondContact O-N 3.02Å; R77-S80 PolarHBondContact O-N 3.47Å; R77-A81 PolarHBondContact O-N 3.02Å |
| 78 | F | 91.3 | Very high | 93.1 | Very high | 140 Ų | 140 | 98.7 Ų | 98.7 | 61% | 0.614 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.8 | -35.7 | 179.1 | -72.7 | -52.8 | 0 | 0 | 0 | 112.7 | L74 H75 A81 S82 | L74-F78 HydrophobicContact CD1-CD2 3.81Å; L74-F78 HydrophobicContact CD1-CE2 3.16Å; L74-F78 HydrophobicContact CD1-CZ 3.68Å; L74-F78 HydrophobicContact CD2-CE2 3.9Å; L74-F78 HydrophobicContact CG-CD2 3.69Å; L74-F78 HydrophobicContact CG-CE2 3.3Å; L74-F78 HydrophobicContact CG-CZ 4.29Å; L74-F78 WeakPolarHBondContact O-CD2 3.05Å; L74-F78 PolarHBondContact O-N 3.33Å; H75-F78 PolarHBondContact O-N 3.48Å; F78-A81 PolarHBondContact O-N 2.97Å; F78-S82 WeakPolarHBondContact O-CB 3.47Å; F78-S82 PolarHBondContact O-N 3.29Å |
| 79 | Q | 93.9 | Very high | 93.3 | Very high | 97 Ų | 97 | 99.9 Ų | 99.9 | 45% | 0.453 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.4 | -44.5 | 172.9 | -172.1 | -178.8 | 36.6 | 0 | 0 | 111.3 | H75 S82 H83 | H75-Q79 WeakPolarHBondContact O-CB 3.39Å; H75-Q79 PolarHBondContact O-N 2.92Å; Q79-S82 WeakPolarHBondContact O-CB 3.26Å; Q79-S82 PolarHBondContact O-N 2.9Å; Q79-H83 PolarHBondContact O-N 3.45Å; Q79-H83 PolarHBondContact O-ND1 2.93Å |
| 80 | S | 93 | Very high | 93.5 | Very high | 66 Ų | 66 | 98.9 Ų | 98.9 | 46% | 0.462 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 177.2 | -59.6 | 0 | 0 | 0 | 0 | 112 | S76 R77 S82 H83 L84 | S76-S80 WeakPolarHBondContact O-CB 3.45Å; S76-S80 PolarHBondContact O-N 3.32Å; S76-S80 PolarHBondContact O-OG 3.45Å; R77-S80 PolarHBondContact O-N 3.47Å; S80-S82 PolarHBondContact O-N 3.06Å; S80-H83 PolarHBondContact O-N 3.45Å; S80-L84 PolarHBondContact O-N 3Å |
| 81 | A | 93.9 | Very high | 93.7 | Very high | 54 Ų | 54 | 95.4 Ų | 95.4 | 45% | 0.446 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.9 | -41.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R77 F78 H83 L84 L85 | R77-A81 PolarHBondContact O-N 3.02Å; F78-A81 PolarHBondContact O-N 2.97Å; A81-H83 PolarHBondContact O-N 3.39Å; A81-L84 PolarHBondContact O-N 2.93Å; A81-L85 WeakPolarHBondContact O-CB 3.29Å; A81-L85 PolarHBondContact O-N 3.34Å |
| 82 | S | 95.7 | Very high | 93.7 | Very high | 51 Ų | 51 | 96.4 Ų | 96.4 | 36% | 0.357 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 174.2 | 173.2 | 0 | 0 | 0 | 0 | 112.2 | F78 Q79 S80 R86 | F78-S82 WeakPolarHBondContact O-CB 3.47Å; F78-S82 PolarHBondContact O-N 3.29Å; Q79-S82 WeakPolarHBondContact O-CB 3.26Å; Q79-S82 PolarHBondContact O-N 2.9Å; S80-S82 PolarHBondContact O-N 3.06Å; S82-R86 WeakPolarHBondContact O-CB 3.3Å; S82-R86 WeakPolarHBondContact O-CG 3.39Å; S82-R86 PolarHBondContact O-N 2.88Å; S82-R86 PolarHBondContact O-NE 2.93Å; S82-R86 PolarHBondContact OG-NE 3.48Å; S82-R86 PolarHBondContact OG-NH2 3.44Å |
| 83 | H | 95.1 | Very high | 93.7 | Very high | 92 Ų | 92 | 96.2 Ų | 96.2 | 43% | 0.426 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.5 | -44.1 | 176.7 | -71.7 | 125.6 | 0 | 0 | 0 | 112.2 | Q79 S80 A81 R86 F87 | Q79-H83 PolarHBondContact O-N 3.45Å; Q79-H83 PolarHBondContact O-ND1 2.93Å; S80-H83 PolarHBondContact O-N 3.45Å; A81-H83 PolarHBondContact O-N 3.39Å; H83-R86 VanDerWaalsContact CD2-CZ 3.48Å; H83-R86 PolarHBondContact CD2-NH2 3.26Å; H83-R86 PolarHBondContact NE2-NH2 2.83Å; H83-R86 PolarHBondContact O-N 3.47Å; H83-F87 WeakPolarHBondContact O-CB 3.28Å; H83-F87 PolarHBondContact O-N 3.35Å |
| 84 | L | 96.1 | Very high | 93.7 | Very high | 107 Ų | 107 | 97 Ų | 97 | 56% | 0.56 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -60 | -46 | 176.3 | -86 | 156.2 | 0 | 0 | 0 | 111.9 | S80 A81 F87 Q88 | S80-L84 PolarHBondContact O-N 3Å; A81-L84 PolarHBondContact O-N 2.93Å; L84-F87 PolarHBondContact O-N 3.31Å; L84-Q88 VanDerWaalsContact O-CG 3.28Å; L84-Q88 WeakPolarHBondContact O-CG 3.43Å; L84-Q88 PolarHBondContact O-N 3.4Å |
| 85 | L | 95.9 | Very high | 93.2 | Very high | 111 Ų | 111 | 100.2 Ų | 100.2 | 58% | 0.581 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.8 | -45.1 | 178 | -176.9 | 62.5 | 0 | 0 | 0 | 111.4 | A81 F87 Q88 I89 | A81-L85 WeakPolarHBondContact O-CB 3.29Å; A81-L85 PolarHBondContact O-N 3.34Å; L85-F87 VanDerWaalsContact C-N 3.33Å; L85-F87 PolarHBondContact O-N 2.99Å; L85-Q88 PolarHBondContact O-N 3.32Å; L85-I89 HydrophobicContact CD1-CD1 4.25Å; L85-I89 HydrophobicContact CD1-CG1 4.5Å; L85-I89 HydrophobicContact CG-CD1 3.99Å; L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.39Å; L85-I89 PolarHBondContact O-N 3.06Å |
| 86 | R | 97.1 | Very high | 92.5 | Very high | 136 Ų | 136 | 99.8 Ų | 99.8 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 175.5 | -79.8 | -175.8 | -85.7 | 157.1 | -4.6 | 111.9 | S82 H83 I89 Q90 | S82-R86 WeakPolarHBondContact O-CB 3.3Å; S82-R86 WeakPolarHBondContact O-CG 3.39Å; S82-R86 PolarHBondContact O-N 2.88Å; S82-R86 PolarHBondContact O-NE 2.93Å; S82-R86 PolarHBondContact OG-NE 3.48Å; S82-R86 PolarHBondContact OG-NH2 3.44Å; H83-R86 VanDerWaalsContact CD2-CZ 3.48Å; H83-R86 PolarHBondContact CD2-NH2 3.26Å; H83-R86 PolarHBondContact NE2-NH2 2.83Å; H83-R86 PolarHBondContact O-N 3.47Å; R86-I89 PolarHBondContact O-N 3.23Å; R86-Q90 PolarHBondContact O-N 3.34Å |
| 87 | F | 95.8 | Very high | 91.6 | Very high | 107 Ų | 107 | 101.5 Ų | 101.5 | 47% | 0.469 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -48.8 | 175.9 | 177.2 | -98.5 | 0 | 0 | 0 | 111.8 | H83 L84 L85 I89 Q90 E91 | H83-F87 WeakPolarHBondContact O-CB 3.28Å; H83-F87 PolarHBondContact O-N 3.35Å; L84-F87 PolarHBondContact O-N 3.31Å; L85-F87 VanDerWaalsContact C-N 3.33Å; L85-F87 PolarHBondContact O-N 2.99Å; F87-I89 VanDerWaalsContact C-N 3.34Å; F87-I89 PolarHBondContact O-N 3.37Å; F87-Q90 PolarHBondContact O-N 3.03Å; F87-E91 HydrophobicContact CD1-CG 4.19Å; F87-E91 HydrophobicContact CD2-CG 4.44Å; F87-E91 HydrophobicContact CE1-CG 3.73Å; F87-E91 HydrophobicContact CE2-CG 4Å; F87-E91 HydrophobicContact CZ-CG 3.62Å; F87-E91 WeakPolarHBondContact O-CG 3.47Å; F87-E91 PolarHBondContact O-N 3.02Å |
| 88 | Q | 94.9 | Very high | 90.3 | Very high | 95 Ų | 95 | 100 Ų | 100 | 44% | 0.444 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | 179.1 | -71.1 | -65.5 | -29 | 0 | 0 | 112.2 | L84 L85 Q90 E91 M92 | L84-Q88 VanDerWaalsContact O-CG 3.28Å; L84-Q88 WeakPolarHBondContact O-CG 3.43Å; L84-Q88 PolarHBondContact O-N 3.4Å; L85-Q88 PolarHBondContact O-N 3.32Å; Q88-Q90 VanDerWaalsContact C-N 3.34Å; Q88-Q90 PolarHBondContact O-N 2.93Å; Q88-E91 PolarHBondContact O-N 3.05Å; Q88-M92 VanDerWaalsContact O-CG 3.26Å; Q88-M92 WeakPolarHBondContact O-CG 3.48Å; Q88-M92 PolarHBondContact O-N 3.09Å |
| 89 | I | 94.9 | Very high | 88.9 | Confident | 84 Ų | 84 | 101.3 Ų | 101.3 | 43% | 0.431 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.4 | -46.2 | 176.2 | -69.8 | 166 | 0 | 0 | 0 | 110.4 | L85 R86 F87 E91 M92 Q93 | L85-I89 HydrophobicContact CD1-CD1 4.25Å; L85-I89 HydrophobicContact CD1-CG1 4.5Å; L85-I89 HydrophobicContact CG-CD1 3.99Å; L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.39Å; L85-I89 PolarHBondContact O-N 3.06Å; R86-I89 PolarHBondContact O-N 3.23Å; F87-I89 VanDerWaalsContact C-N 3.34Å; F87-I89 PolarHBondContact O-N 3.37Å; I89-E91 VanDerWaalsContact C-N 3.34Å; I89-E91 PolarHBondContact O-N 3.03Å; I89-M92 PolarHBondContact O-N 3.07Å; I89-Q93 HydrophobicContact CG2-CG 4.46Å; I89-Q93 VanDerWaalsContact O-CG 3.29Å; I89-Q93 WeakPolarHBondContact O-CG 3.41Å; I89-Q93 PolarHBondContact O-N 3.25Å |
| 90 | Q | 95.4 | Very high | 87.3 | Confident | 101 Ų | 101 | 100.4 Ų | 100.4 | 47% | 0.472 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 179.2 | -168.2 | -178.7 | 0.7 | 0 | 0 | 111.8 | R86 F87 Q88 Q93 K94 | R86-Q90 PolarHBondContact O-N 3.34Å; F87-Q90 PolarHBondContact O-N 3.03Å; Q88-Q90 VanDerWaalsContact C-N 3.34Å; Q88-Q90 PolarHBondContact O-N 2.93Å; Q90-Q93 PolarHBondContact O-N 3.24Å; Q90-K94 WeakPolarHBondContact O-CG 3.42Å; Q90-K94 PolarHBondContact O-N 3.47Å |
| 91 | E | 94.2 | Very high | 85.7 | Confident | 55 Ų | 55 | 102.9 Ų | 102.9 | 26% | 0.257 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67 | -37.5 | 176.3 | -70.7 | -57 | 118.6 | 0 | 0 | 112.6 | F87 Q88 I89 K94 R95 | F87-E91 HydrophobicContact CD1-CG 4.19Å; F87-E91 HydrophobicContact CD2-CG 4.44Å; F87-E91 HydrophobicContact CE1-CG 3.73Å; F87-E91 HydrophobicContact CE2-CG 4Å; F87-E91 HydrophobicContact CZ-CG 3.62Å; F87-E91 WeakPolarHBondContact O-CG 3.47Å; F87-E91 PolarHBondContact O-N 3.02Å; Q88-E91 PolarHBondContact O-N 3.05Å; I89-E91 VanDerWaalsContact C-N 3.34Å; I89-E91 PolarHBondContact O-N 3.03Å; E91-K94 WeakPolarHBondContact OE1-CD 3.33Å; E91-K94 IonicContact OE1-NZ 2.74Å; E91-K94 PolarHBondContact OE1-NZ 2.89Å; E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 3.39Å; E91-R95 PolarHBondContact O-NE 3.42Å |
| 92 | M | 91.7 | Very high | 84 | Confident | 109 Ų | 109 | 105.6 Ų | 105.6 | 54% | 0.537 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 172.4 | -71.4 | -65.1 | -63 | 0 | 0 | 111.6 | Q88 I89 R95 N96 | Q88-M92 VanDerWaalsContact O-CG 3.26Å; Q88-M92 WeakPolarHBondContact O-CG 3.48Å; Q88-M92 PolarHBondContact O-N 3.09Å; I89-M92 PolarHBondContact O-N 3.07Å; M92-R95 PolarHBondContact O-N 2.9Å; M92-R95 PolarHBondContact SD-NH2 3.23Å; M92-N96 WeakPolarHBondContact O-CB 3.37Å; M92-N96 PolarHBondContact O-N 3.04Å |
| 93 | Q | 91.4 | Very high | 82.4 | Confident | 120 Ų | 120 | 109.9 Ų | 109.9 | 56% | 0.561 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -65.5 | -44.4 | 177.2 | -72.9 | 173.4 | -27.3 | 0 | 0 | 111.8 | I89 Q90 R95 N96 V97 | I89-Q93 HydrophobicContact CG2-CG 4.46Å; I89-Q93 VanDerWaalsContact O-CG 3.29Å; I89-Q93 WeakPolarHBondContact O-CG 3.41Å; I89-Q93 PolarHBondContact O-N 3.25Å; Q90-Q93 PolarHBondContact O-N 3.24Å; Q93-R95 PolarHBondContact O-N 3.05Å; Q93-N96 PolarHBondContact O-N 2.94Å; Q93-V97 WeakPolarHBondContact O-CG2 3.34Å; Q93-V97 PolarHBondContact O-N 3.24Å |
| 94 | K | 90.6 | Very high | 80.6 | Confident | 101 Ų | 101 | 113.7 Ų | 113.7 | 44% | 0.439 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -59.1 | -45.9 | 175.2 | -74 | 173.6 | -173 | 167.2 | 0 | 112 | Q90 E91 N96 V97 Q98 | Q90-K94 WeakPolarHBondContact O-CG 3.42Å; Q90-K94 PolarHBondContact O-N 3.47Å; E91-K94 WeakPolarHBondContact OE1-CD 3.33Å; E91-K94 IonicContact OE1-NZ 2.74Å; E91-K94 PolarHBondContact OE1-NZ 2.89Å; K94-N96 VanDerWaalsContact C-N 3.33Å; K94-N96 PolarHBondContact O-N 2.83Å; K94-V97 PolarHBondContact O-N 2.97Å; K94-Q98 WeakPolarHBondContact O-CB 3.43Å; K94-Q98 PolarHBondContact O-N 3.06Å |
| 95 | R | 83.1 | Confident | 79 | Confident | 118 Ų | 118 | 111.2 Ų | 111.2 | 45% | 0.445 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.1 | -41.4 | 176.5 | -76.7 | -173.9 | -76 | 169.1 | -11.5 | 112.1 | E91 M92 Q93 Q98 H99 | E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 3.39Å; E91-R95 PolarHBondContact O-NE 3.42Å; M92-R95 PolarHBondContact O-N 2.9Å; M92-R95 PolarHBondContact SD-NH2 3.23Å; Q93-R95 PolarHBondContact O-N 3.05Å; R95-Q98 PolarHBondContact O-N 3.47Å; R95-H99 PolarHBondContact O-CD2 2.93Å; R95-H99 PolarHBondContact O-N 2.98Å |
| 96 | N | 76.1 | Confident | 77.1 | Confident | 115 Ų | 115 | 115.9 Ų | 115.9 | 62% | 0.615 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -62.5 | -43.1 | 176.5 | -168.9 | -33.9 | 0 | 0 | 0 | 111.9 | M92 Q93 K94 Q98 H99 S100 | M92-N96 WeakPolarHBondContact O-CB 3.37Å; M92-N96 PolarHBondContact O-N 3.04Å; Q93-N96 PolarHBondContact O-N 2.94Å; K94-N96 VanDerWaalsContact C-N 3.33Å; K94-N96 PolarHBondContact O-N 2.83Å; N96-Q98 VanDerWaalsContact C-N 3.31Å; N96-Q98 PolarHBondContact O-N 3.28Å; N96-H99 PolarHBondContact O-N 2.91Å; N96-S100 PolarHBondContact O-N 3.17Å; N96-S100 PolarHBondContact O-OG 3.45Å |
| 97 | V | 72.6 | Confident | 76.1 | Confident | 98 Ų | 98 | 114.9 Ų | 114.9 | 59% | 0.594 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -63.6 | -37.7 | 175 | 174.7 | 0 | 0 | 0 | 0 | 111.6 | Q93 K94 S100 L101 | Q93-V97 WeakPolarHBondContact O-CG2 3.34Å; Q93-V97 PolarHBondContact O-N 3.24Å; K94-V97 PolarHBondContact O-N 2.97Å; V97-S100 VanDerWaalsContact CA-OG 3.29Å; V97-S100 WeakPolarHBondContact CA-OG 3.49Å; V97-S100 PolarHBondContact O-N 2.94Å; V97-S100 PolarHBondContact O-OG 3.27Å; V97-L101 PolarHBondContact O-N 3.46Å |
| 98 | Q | 63.5 | Low | 75.1 | Confident | 144 Ų | 144 | 115.3 Ų | 115.3 | 67% | 0.673 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -70.9 | -32.9 | -179.4 | -157.3 | 160.6 | 19.5 | 0 | 0 | 113.1 | K94 R95 N96 S100 | K94-Q98 WeakPolarHBondContact O-CB 3.43Å; K94-Q98 PolarHBondContact O-N 3.06Å; R95-Q98 PolarHBondContact O-N 3.47Å; N96-Q98 VanDerWaalsContact C-N 3.31Å; N96-Q98 PolarHBondContact O-N 3.28Å; Q98-S100 VanDerWaalsContact C-N 3.31Å |
| 99 | H | 61.4 | Low | 74 | Confident | 166 Ų | 166 | 116.4 Ų | 116.4 | 77% | 0.769 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -77.8 | -11.4 | 173.4 | -70.2 | -62.4 | 0 | 0 | 0 | 114.2 | R95 N96 | R95-H99 PolarHBondContact O-CD2 2.93Å; R95-H99 PolarHBondContact O-N 2.98Å; N96-H99 PolarHBondContact O-N 2.91Å |
| 100 | S | 60.6 | Low | 72.8 | Confident | 78 Ų | 78 | 118.3 Ų | 118.3 | 55% | 0.545 | 64% | 0.643 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -100.8 | 2.6 | 177.8 | 45.4 | 0 | 0 | 0 | 0 | 114 | N96 V97 Q98 | N96-S100 PolarHBondContact O-N 3.17Å; N96-S100 PolarHBondContact O-OG 3.45Å; V97-S100 VanDerWaalsContact CA-OG 3.29Å; V97-S100 WeakPolarHBondContact CA-OG 3.49Å; V97-S100 PolarHBondContact O-N 2.94Å; V97-S100 PolarHBondContact O-OG 3.27Å; Q98-S100 VanDerWaalsContact C-N 3.31Å |
| 101 | L | 60 | Low | 71.3 | Confident | 118 Ų | 118 | 119.4 Ų | 119.4 | 62% | 0.618 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -66.1 | 123.9 | 165.7 | -86.2 | 156.9 | 0 | 0 | 0 | 109.6 | V97 T103 | V97-L101 PolarHBondContact O-N 3.46Å; L101-T103 PolarHBondContact O-N 3.13Å; L101-T103 VanDerWaalsContact O-N 3.13Å |
| 102 | P | 57.8 | Low | 69.8 | Low | 111 Ų | 111 | 123.7 Ų | 123.7 | 72% | 0.721 | 68% | 0.68 | S | S | * | * | trans | -62.9 | 121.2 | 174.1 | 24.8 | -30.2 | 0 | 0 | 0 | 108.2 | L104 | P102-L104 VanDerWaalsContact C-N 3.31Å; P102-L104 PolarHBondContact O-N 2.92Å | ||
| 103 | T | 61.3 | Low | 68.2 | Low | 142 Ų | 142 | 124.7 Ų | 124.7 | 87% | 0.871 | 69% | 0.69 | S | S | * | * | trans | -67 | 97 | 169.6 | -20.6 | 0 | 0 | 0 | 0 | 106.1 | L101 G105 | L101-T103 PolarHBondContact O-N 3.13Å; L101-T103 VanDerWaalsContact O-N 3.13Å; T103-G105 VanDerWaalsContact C-N 3.28Å; T103-G105 PolarHBondContact O-N 2.74Å | ||
| 104 | L | 57.6 | Low | 66.5 | Low | 172 Ų | 172 | 125.1 Ų | 125.1 | 90% | 0.901 | 70% | 0.7 | S | S | * | * | trans | -71 | 94.7 | 171.4 | -158.4 | 76.8 | 0 | 0 | 0 | 106.3 | P102 | P102-L104 VanDerWaalsContact C-N 3.31Å; P102-L104 PolarHBondContact O-N 2.92Å | ||
| 105 | G | 62.3 | Low | 64.5 | Low | 54 Ų | 54 | 127.1 Ų | 127.1 | 56% | 0.557 | 72% | 0.722 | S | S | * | * | trans | -68.6 | 155.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | T103 | T103-G105 VanDerWaalsContact C-N 3.28Å; T103-G105 PolarHBondContact O-N 2.74Å | ||
| 106 | P | 57.2 | Low | 62.8 | Low | 209 Ų | 209 | 127.9 Ų | 127.9 | 100% | 1.357 | 75% | 0.747 | S | S | * | * | trans | -65.2 | 0 | -180 | 29.4 | -35.2 | 0 | 0 | 0 | 113.2 |
Retrieved 106 of 106 residues in 61.7 ms
(Link to these results)