| 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 | 37.4 | Very low | 41.1 | Very low | 244 Ų | 244 | 150.9 Ų | 150.9 | 100% | 1.202 | 83% | 0.825 | S | S | * | * | 0 | 121.6 | 0 | -97.5 | -176.2 | 154.2 | 0 | 0 | 108 | |||||
| 2 | A | 39.3 | Very low | 40.4 | Very low | 99 Ų | 99 | 150.8 Ų | 150.8 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | 38.6 | 113.5 | 158 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 3 | D | 50.4 | Low | 40.1 | Very low | 149 Ų | 149 | 146.2 Ų | 146.2 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -79.7 | 148.7 | 146.4 | 179.1 | 11 | 0 | 0 | 0 | 109.2 | A5 | D3-A5 PolarHBondContact OD1-N 3.17Å; D3-A5 VanDerWaalsContact OD1-N 3.17Å | ||
| 4 | P | 52.5 | Low | 39.9 | Very low | 112 Ų | 112 | 148.1 Ų | 148.1 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | -146.3 | 122.4 | 128 | 32 | -12.4 | 0 | 0 | 0 | 116.1 | |||||
| 5 | A | 43.3 | Very low | 39.5 | Very low | 80 Ų | 80 | 148.5 Ų | 148.5 | 66% | 0.661 | 81% | 0.809 | S | S | * | * | 68 | 115.8 | 119.7 | 0 | 0 | 0 | 0 | 0 | 122.6 | D3 | D3-A5 PolarHBondContact OD1-N 3.17Å; D3-A5 VanDerWaalsContact OD1-N 3.17Å | |||
| 6 | R | 39.9 | Very low | 39 | Very low | 211 Ų | 211 | 143.9 Ų | 143.9 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | 70.3 | 128.4 | 114.7 | -157 | 177.2 | -159.8 | 173.4 | 6 | 120.6 | |||||
| 7 | I | 41.3 | Very low | 38.8 | Very low | 170 Ų | 170 | 145.6 Ų | 145.6 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | -173.8 | 146.2 | 122.3 | -85.5 | 148.1 | 0 | 0 | 0 | 111.2 | |||||
| 8 | K | 40.5 | Very low | 38.5 | Very low | 159 Ų | 159 | 142.2 Ų | 142.2 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | trans | -88.8 | 163.1 | -170.7 | -64.6 | 168.8 | 165.9 | -176.4 | 0 | 114.5 | ||||
| 9 | T | 35.2 | Very low | 38.2 | Very low | 131 Ų | 131 | 139.7 Ų | 139.7 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | 176.1 | 112.1 | 121.1 | 33.6 | 0 | 0 | 0 | 0 | 110 | |||||
| 10 | E | 36.9 | Very low | 38 | Very low | 182 Ų | 182 | 144 Ų | 144 | 85% | 0.85 | 80% | 0.795 | S | S | * | * | 78 | 121.4 | 94.3 | -73.2 | -160.1 | -172.1 | 0 | 0 | 118.5 | |||||
| 11 | S | 35.6 | Very low | 37.7 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | 152.9 | 148.5 | 138.9 | 56.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 12 | N | 32.7 | Very low | 37.6 | Very low | 150 Ų | 150 | 139.6 Ų | 139.6 | 80% | 0.802 | 78% | 0.779 | S | S | * | * | cis | -175.4 | 150.1 | -24.5 | 173.2 | 40.3 | 0 | 0 | 0 | 104.3 | ||||
| 13 | S | 35.8 | Very low | 37.6 | Very low | 90 Ų | 90 | 140.8 Ų | 140.8 | 63% | 0.629 | 78% | 0.778 | S | S | * | * | trans | 127 | 129.5 | 159.5 | -59.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 14 | E | 37.6 | Very low | 36.5 | Very low | 173 Ų | 173 | 143 Ų | 143 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | cis | -166.3 | 145.1 | 3 | -105.7 | 169.7 | 153.4 | 0 | 0 | 106.5 | ||||
| 15 | N | 33.7 | Very low | 35.5 | Very low | 154 Ų | 154 | 142.9 Ų | 142.9 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | trans | 44.2 | 138.2 | 137.4 | -119.3 | 28.7 | 0 | 0 | 0 | 120.2 | ||||
| 16 | S | 32.3 | Very low | 34.9 | Very low | 76 Ų | 76 | 147.7 Ų | 147.7 | 53% | 0.531 | 79% | 0.787 | S | S | . | * | cis | 176.1 | 139.5 | 7.3 | 36.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 17 | L | 35.3 | Very low | 34.5 | Very low | 172 Ų | 172 | 144.5 Ų | 144.5 | 90% | 0.901 | 79% | 0.785 | S | S | * | * | trans | 59.1 | 139.7 | 133.4 | -55.6 | 170.2 | 0 | 0 | 0 | 119.3 | ||||
| 18 | A | 33 | Very low | 34.1 | Very low | 85 Ų | 85 | 141.7 Ų | 141.7 | 70% | 0.702 | 78% | 0.776 | S | S | * | * | cis | -166.2 | 142.2 | 5.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 19 | A | 33.9 | Very low | 33.7 | Very low | 94 Ų | 94 | 142.1 Ų | 142.1 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | 51.7 | 142.6 | 104.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 20 | R | 34.2 | Very low | 33.6 | Very low | 225 Ų | 225 | 144.5 Ų | 144.5 | 85% | 0.849 | 78% | 0.783 | S | S | * | * | cis | -177 | 168 | -3.2 | -121.1 | -175.3 | 175.3 | -166.7 | -1 | 105.3 | ||||
| 21 | E | 31.1 | Very low | 33.8 | Very low | 184 Ų | 184 | 141.2 Ų | 141.2 | 86% | 0.86 | 78% | 0.775 | S | S | * | * | trans | 87.6 | 128.4 | 154.9 | -78 | 177.1 | 168.9 | 0 | 0 | 122.7 | ||||
| 22 | S | 34.8 | Very low | 34.2 | Very low | 113 Ų | 113 | 141.4 Ų | 141.4 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | trans | -84.2 | 162.6 | 168.8 | -25.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 23 | P | 38.9 | Very low | 34.4 | Very low | 123 Ų | 123 | 139.4 Ų | 139.4 | 80% | 0.799 | 77% | 0.766 | S | S | * | * | -157.7 | 160.3 | 94.9 | 37 | -16 | 0 | 0 | 0 | 118.5 | |||||
| 24 | K | 27.8 | Very low | 34.1 | Very low | 196 Ų | 196 | 142 Ų | 142 | 85% | 0.852 | 78% | 0.778 | S | S | * | * | trans | 33.9 | 136 | 142.9 | -111.5 | 173.9 | 175.4 | -177.7 | 0 | 120.8 | ||||
| 25 | T | 31.2 | Very low | 34 | Very low | 110 Ų | 110 | 137.9 Ų | 137.9 | 68% | 0.675 | 77% | 0.769 | S | S | * | * | -172.8 | 150.5 | 60.2 | 40.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 26 | E | 31.7 | Very low | 33.7 | Very low | 181 Ų | 181 | 138.4 Ų | 138.4 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | trans | 51.4 | 131.3 | 142.9 | -65.5 | 168.2 | 178.5 | 0 | 0 | 120.4 | ||||
| 27 | D | 31.8 | Very low | 33.9 | Very low | 143 Ų | 143 | 138.7 Ų | 138.7 | 77% | 0.765 | 78% | 0.779 | S | S | * | * | -167.6 | 135.4 | 60.5 | -157.7 | 17.2 | 0 | 0 | 0 | 112.1 | |||||
| 28 | T | 32.4 | Very low | 33.9 | Very low | 111 Ų | 111 | 137.7 Ų | 137.7 | 68% | 0.681 | 77% | 0.774 | S | S | * | * | trans | 43.8 | 132.9 | 136.4 | -47.3 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 29 | E | 32.7 | Very low | 33.7 | Very low | 169 Ų | 169 | 139 Ų | 139 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | cis | -165 | 137 | 40.5 | -149.1 | 166.8 | -158 | 0 | 0 | 112.8 | ||||
| 30 | E | 32.3 | Very low | 33.7 | Very low | 180 Ų | 180 | 142.7 Ų | 142.7 | 84% | 0.841 | 78% | 0.775 | S | S | * | * | trans | 34.1 | 134.7 | 149.5 | -55.7 | -161.4 | 163.8 | 0 | 0 | 127.3 | ||||
| 31 | V | 41.6 | Very low | 33.6 | Very low | 114 Ų | 114 | 136.5 Ų | 136.5 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | trans | -102.4 | 168.7 | 162.4 | -151.5 | 0 | 0 | 0 | 0 | 107.5 | V33 | V31-V33 HydrophobicContact CG1-CG2 4.04Š| ||
| 32 | P | 43.3 | Very low | 33.6 | Very low | 127 Ų | 127 | 137.6 Ų | 137.6 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | -145.2 | 145.3 | 92.9 | 32.5 | -13.7 | 0 | 0 | 0 | 116.2 | |||||
| 33 | V | 36.2 | Very low | 33.2 | Very low | 108 Ų | 108 | 139.1 Ų | 139.1 | 66% | 0.655 | 77% | 0.767 | S | S | * | * | trans | -80.7 | 146.2 | 161.4 | 173.5 | 0 | 0 | 0 | 0 | 108.5 | V31 | V31-V33 HydrophobicContact CG1-CG2 4.04Š| ||
| 34 | T | 30.1 | Very low | 32.9 | Very low | 143 Ų | 143 | 137.9 Ų | 137.9 | 88% | 0.877 | 76% | 0.762 | S | S | * | * | trans | -142.5 | 110.1 | 139.8 | 55.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 35 | S | 35.2 | Very low | 33.1 | Very low | 88 Ų | 88 | 134.2 Ų | 134.2 | 62% | 0.615 | 76% | 0.761 | S | S | * | * | trans | -83.3 | 149.5 | 153.6 | 47.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 36 | D | 28.7 | Very low | 33.3 | Very low | 165 Ų | 165 | 134.4 Ų | 134.4 | 88% | 0.882 | 77% | 0.766 | S | S | * | * | trans | -163.2 | 143.9 | 130.8 | -97.2 | -31.5 | 0 | 0 | 0 | 112.3 | ||||
| 37 | A | 36.4 | Very low | 33.5 | Very low | 82 Ų | 82 | 134.3 Ų | 134.3 | 68% | 0.678 | 77% | 0.766 | S | S | * | * | trans | -76.7 | 178.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 38 | D | 33.6 | Very low | 33.5 | Very low | 151 Ų | 151 | 133 Ų | 133 | 81% | 0.807 | 77% | 0.767 | S | S | * | * | cis | 179.8 | 167.8 | 27.7 | -136.5 | -19 | 0 | 0 | 0 | 108.9 | ||||
| 39 | T | 29.7 | Very low | 33.6 | Very low | 113 Ų | 113 | 135.2 Ų | 135.2 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | trans | 94.7 | 106.1 | 146.2 | -45 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 40 | E | 33.4 | Very low | 33.7 | Very low | 171 Ų | 171 | 136.2 Ų | 136.2 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | 68.7 | 125.7 | 129.6 | -70.8 | -165.6 | 174.8 | 0 | 0 | 128.4 | |||||
| 41 | S | 32.6 | Very low | 33.7 | Very low | 95 Ų | 95 | 139.1 Ų | 139.1 | 66% | 0.664 | 78% | 0.779 | S | S | * | * | 81.9 | 130.8 | 121.4 | -63.9 | 0 | 0 | 0 | 0 | 125.6 | |||||
| 42 | K | 30.8 | Very low | 33.3 | Very low | 207 Ų | 207 | 141.9 Ų | 141.9 | 90% | 0.9 | 79% | 0.785 | S | S | * | * | trans | 73.4 | 145.3 | 157.4 | -69.1 | 178 | 175.8 | 176.9 | 0 | 117 | ||||
| 43 | D | 27.5 | Very low | 32.8 | Very low | 144 Ų | 144 | 144.3 Ų | 144.3 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | cis | -157.4 | 162.5 | 21 | -174.7 | 22.4 | 0 | 0 | 0 | 110.8 | ||||
| 44 | S | 32.8 | Very low | 32.7 | Very low | 98 Ų | 98 | 148.4 Ų | 148.4 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -26.9 | 141.2 | 166.7 | -45.7 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 45 | S | 32 | Very low | 32.8 | Very low | 119 Ų | 119 | 149.5 Ų | 149.5 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | -158.5 | 116.5 | 135.1 | -150.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 46 | S | 34.3 | Very low | 32.6 | Very low | 114 Ų | 114 | 152.2 Ų | 152.2 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -65.8 | 124.3 | 172.4 | -42.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 47 | Q | 36.3 | Very low | 32.8 | Very low | 179 Ų | 179 | 148.9 Ų | 148.9 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | trans | -120.3 | 103.7 | 161.8 | -85.4 | -172 | -17.3 | 0 | 0 | 111 | L49 | Q47-L49 PolarHBondContact O-N 3.48Š| ||
| 48 | S | 32.2 | Very low | 32.6 | Very low | 114 Ų | 114 | 151.7 Ų | 151.7 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -54.8 | 108.3 | 163.4 | 174 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 49 | L | 34.2 | Very low | 32.6 | Very low | 158 Ų | 158 | 148.3 Ų | 148.3 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | trans | -98.5 | 98.4 | 165 | -70 | 178 | 0 | 0 | 0 | 108.9 | Q47 R51 | Q47-L49 PolarHBondContact O-N 3.48Å; L49-R51 PolarHBondContact O-N 2.68Å; L49-R51 VanDerWaalsContact O-N 3.07Å | ||
| 50 | K | 33.7 | Very low | 33.1 | Very low | 190 Ų | 190 | 146.4 Ų | 146.4 | 83% | 0.826 | 79% | 0.79 | S | S | * | * | trans | -52 | 102.1 | 167.4 | -155.2 | 169.3 | -175.8 | -177.7 | 0 | 109 | E52 | K50-E52 PolarHBondContact O-N 3.37Š| ||
| 51 | R | 33.8 | Very low | 33.2 | Very low | 241 Ų | 241 | 145.7 Ų | 145.7 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | trans | -81.2 | 102.1 | 170.9 | -80.4 | -176.9 | 177.7 | 163.5 | -0 | 108.8 | L49 | L49-R51 PolarHBondContact O-N 2.68Å; L49-R51 VanDerWaalsContact O-N 3.07Å | ||
| 52 | E | 32.9 | Very low | 33.8 | Very low | 172 Ų | 172 | 147.6 Ų | 147.6 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -68.4 | 126.7 | 164.7 | -65.8 | -166.1 | 131.9 | 0 | 0 | 109.6 | K50 K54 | K50-E52 PolarHBondContact O-N 3.37Å; E52-K54 PolarHBondContact O-N 2.69Å | ||
| 53 | H | 33.2 | Very low | 34.3 | Very low | 178 Ų | 178 | 147 Ų | 147 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | trans | -74.9 | 87.4 | 174.4 | -127 | 77.8 | 0 | 0 | 0 | 108.3 | Q55 | H53-Q55 PolarHBondContact O-N 3.28Š| ||
| 54 | K | 32.6 | Very low | 34.7 | Very low | 194 Ų | 194 | 147 Ų | 147 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | -87.9 | 99 | 166.5 | -163.5 | 163.4 | -177.9 | 178.9 | 0 | 107.9 | E52 D56 | E52-K54 PolarHBondContact O-N 2.69Å; K54-D56 PolarHBondContact O-N 3.43Å | ||
| 55 | Q | 33.6 | Very low | 34.8 | Very low | 167 Ų | 167 | 151.4 Ų | 151.4 | 78% | 0.78 | 81% | 0.805 | S | S | * | * | trans | -59 | 105.4 | 165.9 | -72.4 | 176.1 | -22.7 | 0 | 0 | 107.7 | H53 S57 | H53-Q55 PolarHBondContact O-N 3.28Å; Q55-S57 VanDerWaalsContact C-N 3.29Å; Q55-S57 PolarHBondContact O-N 2.91Å; Q55-S57 VanDerWaalsContact O-N 3.14Å | ||
| 56 | D | 30.5 | Very low | 34.9 | Very low | 145 Ų | 145 | 149.2 Ų | 149.2 | 78% | 0.775 | 80% | 0.801 | S | S | * | * | trans | -83.5 | 85.1 | 169.8 | -150.6 | 14.4 | 0 | 0 | 0 | 107.2 | K54 V58 | K54-D56 PolarHBondContact O-N 3.43Å; D56-V58 PolarHBondContact O-N 3.28Å | ||
| 57 | S | 33.3 | Very low | 35.1 | Very low | 95 Ų | 95 | 150 Ų | 150 | 66% | 0.664 | 80% | 0.802 | S | S | * | * | trans | -61.7 | 109.8 | 161.6 | 45.7 | 0 | 0 | 0 | 0 | 107.4 | Q55 A59 | Q55-S57 VanDerWaalsContact C-N 3.29Å; Q55-S57 PolarHBondContact O-N 2.91Å; Q55-S57 VanDerWaalsContact O-N 3.14Å; S57-A59 PolarHBondContact O-N 3.14Å | ||
| 58 | V | 32.8 | Very low | 35 | Very low | 141 Ų | 141 | 147.3 Ų | 147.3 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | trans | -68.5 | 82.1 | 162.2 | -179.8 | 0 | 0 | 0 | 0 | 106.4 | D56 G60 | D56-V58 PolarHBondContact O-N 3.28Å; V58-G60 PolarHBondContact O-N 2.73Å | ||
| 59 | A | 33.1 | Very low | 35.2 | Very low | 79 Ų | 79 | 148.1 Ų | 148.1 | 65% | 0.653 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 116.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 106.3 | S57 D61 | S57-A59 PolarHBondContact O-N 3.14Å; A59-D61 PolarHBondContact O-N 2.93Å |
| 60 | G | 40.4 | Very low | 35.4 | Very low | 73 Ų | 73 | 148.5 Ų | 148.5 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 117.3 | 157.4 | 0 | 0 | 0 | 0 | 0 | 106.6 | V58 | V58-G60 PolarHBondContact O-N 2.73Š|
| 61 | D | 35.8 | Very low | 35.9 | Very low | 156 Ų | 156 | 144.6 Ų | 144.6 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 129.4 | 168.3 | -154.8 | -130 | 0 | 0 | 0 | 108.3 | A59 | A59-D61 PolarHBondContact O-N 2.93Š|
| 62 | D | 44.4 | Very low | 36.4 | Very low | 136 Ų | 136 | 137.6 Ų | 137.6 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 160.5 | 174.5 | -96.2 | -78.8 | 0 | 0 | 0 | 113.3 | ||
| 63 | E | 41.2 | Very low | 36.8 | Very low | 193 Ų | 193 | 135.4 Ų | 135.4 | 90% | 0.902 | 79% | 0.787 | S | S | * | * | -166.7 | 140.5 | 112.9 | -101.6 | -177 | -173.8 | 0 | 0 | 112.7 | |||||
| 64 | D | 36.5 | Very low | 37.5 | Very low | 144 Ų | 144 | 136.8 Ų | 136.8 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -81.5 | 145.7 | -175.1 | 173.1 | -127.8 | 0 | 0 | 0 | 112.1 | ||||
| 65 | E | 34.4 | Very low | 38 | Very low | 191 Ų | 191 | 136.9 Ų | 136.9 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | trans | -174.7 | 134.9 | 137.8 | -119.9 | -151.2 | 165.3 | 0 | 0 | 112.5 | ||||
| 66 | G | 33.8 | Very low | 38.4 | Very low | 73 Ų | 73 | 136.8 Ų | 136.8 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | trans | 155.2 | 68 | 162.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 67 | T | 38.3 | Very low | 39.5 | Very low | 132 Ų | 132 | 139.6 Ų | 139.6 | 81% | 0.81 | 80% | 0.8 | S | S | * | * | trans | -54.5 | 139 | 169.5 | 174.4 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 68 | S | 35.4 | Very low | 40.5 | Very low | 121 Ų | 121 | 141 Ų | 141 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -160.8 | 131.2 | 150.1 | -154.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 69 | D | 35.1 | Very low | 41.4 | Very low | 131 Ų | 131 | 140 Ų | 140 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | trans | -71.7 | 132.7 | -172.7 | -82.8 | -67.6 | 0 | 0 | 0 | 116.6 | ||||
| 70 | Q | 38.2 | Very low | 42.4 | Very low | 167 Ų | 167 | 140 Ų | 140 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | trans | 55.2 | 165.8 | 139.9 | -73.1 | -165.6 | 68.7 | 0 | 0 | 123.1 | ||||
| 71 | P | 44.9 | Very low | 43.2 | Very low | 107 Ų | 107 | 142.7 Ų | 142.7 | 70% | 0.695 | 78% | 0.776 | S | S | * | * | cis | -131.8 | 165.6 | -15.3 | 26.2 | -3.3 | 0 | 0 | 0 | 116.4 | ||||
| 72 | A | 45 | Very low | 44.1 | Very low | 94 Ų | 94 | 140.9 Ų | 140.9 | 78% | 0.777 | 76% | 0.761 | S | S | * | * | trans | 45.1 | 109 | 149 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 73 | S | 39.8 | Very low | 44.6 | Very low | 127 Ų | 127 | 141 Ų | 141 | 89% | 0.888 | 76% | 0.755 | S | S | * | * | trans | -152.5 | 121.4 | 137.6 | -83.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 74 | K | 48.8 | Very low | 45.5 | Very low | 207 Ų | 207 | 138.7 Ų | 138.7 | 90% | 0.9 | 74% | 0.742 | S | S | * | * | trans | -59.9 | 130.4 | 170.6 | -66.4 | 171.7 | 177.6 | 174.9 | 0 | 109.5 | ||||
| 75 | K | 43.2 | Very low | 46.6 | Very low | 196 Ų | 196 | 136.8 Ų | 136.8 | 85% | 0.852 | 73% | 0.729 | S | S | * | * | trans | -171.6 | 118.1 | 145.3 | -101.6 | 160.9 | -161.2 | -164.5 | 0 | 112.1 | ||||
| 76 | L | 42.4 | Very low | 47.8 | Very low | 165 Ų | 165 | 135.1 Ų | 135.1 | 86% | 0.864 | 72% | 0.719 | S | S | * | * | trans | 54.2 | 88.7 | 147.7 | -61.6 | 161.9 | 0 | 0 | 0 | 117.6 | ||||
| 77 | K | 52.9 | Low | 49.2 | Very low | 203 Ų | 203 | 140 Ų | 140 | 88% | 0.883 | 71% | 0.714 | S | S | * | * | trans | -63.5 | 143.2 | 152.6 | -94.1 | 169.4 | 167.8 | 176.7 | 0 | 109.7 | ||||
| 78 | V | 54 | Low | 50.3 | Low | 126 Ų | 126 | 139.2 Ų | 139.2 | 76% | 0.764 | 70% | 0.702 | S | S | * | * | trans | 117.8 | 119.7 | 167 | -179.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 79 | E | 52.8 | Low | 51.6 | Low | 120 Ų | 120 | 139.9 Ų | 139.9 | 56% | 0.561 | 69% | 0.689 | S | S | * | * | S | Bend | trans | 106.6 | 31.4 | 177.6 | -67.4 | -91.3 | 133.8 | 0 | 0 | 120.6 | K82 | E79-K82 VanDerWaalsContact OE1-CD 3.31Å; E79-K82 WeakPolarHBondContact OE1-CD 3.3Å; E79-K82 IonicContact OE1-NZ 3.42Å; E79-K82 PolarHBondContact OE1-NZ 2.75Å |
| 80 | P | 54.1 | Low | 52.9 | Low | 77 Ų | 77 | 137.2 Ų | 137.2 | 50% | 0.5 | 68% | 0.678 | S | S | . | * | S | Bend | trans | -100.4 | -26.9 | 152.5 | 30.3 | -28.6 | 0 | 0 | 0 | 113.4 | K84 | P80-K84 PolarHBondContact O-N 2.9Š|
| 81 | E | 55.5 | Low | 54.5 | Low | 130 Ų | 130 | 133.7 Ų | 133.7 | 61% | 0.607 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -66.1 | -51.1 | -173.9 | -62.9 | -81.9 | 110 | 0 | 0 | 111.8 | K83 K84 E85 | E81-K83 VanDerWaalsContact C-N 3.26Å; E81-K83 PolarHBondContact O-N 3.5Å; E81-K84 PolarHBondContact O-N 3.16Å; E81-K84 VanDerWaalsContact O-N 3.12Å; E81-E85 WeakPolarHBondContact O-CG 3.02Å; E81-E85 PolarHBondContact O-N 3.49Å |
| 82 | K | 55 | Low | 56 | Low | 119 Ų | 119 | 133.3 Ų | 133.3 | 52% | 0.517 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -65 | -26 | -178 | -62.3 | -165.6 | -162.8 | 154.5 | 0 | 114 | E79 K86 | E79-K82 VanDerWaalsContact OE1-CD 3.31Å; E79-K82 WeakPolarHBondContact OE1-CD 3.3Å; E79-K82 IonicContact OE1-NZ 3.42Å; E79-K82 PolarHBondContact OE1-NZ 2.75Å; K82-K86 WeakPolarHBondContact O-CB 3.49Å; K82-K86 VanDerWaalsContact O-CG 3.26Å; K82-K86 WeakPolarHBondContact O-CG 3.49Å; K82-K86 PolarHBondContact O-N 3.01Å; K82-K86 VanDerWaalsContact O-N 3.15Å |
| 83 | K | 55.2 | Low | 57.5 | Low | 138 Ų | 138 | 132.8 Ų | 132.8 | 60% | 0.6 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -80.1 | -34 | 176.5 | -169.5 | 176.5 | 180 | 179.8 | 0 | 111.6 | E81 R87 | E81-K83 VanDerWaalsContact C-N 3.26Å; E81-K83 PolarHBondContact O-N 3.5Å; K83-R87 WeakPolarHBondContact O-CG 3.42Å; K83-R87 PolarHBondContact O-N 3.09Å |
| 84 | K | 60.2 | Low | 59.4 | Low | 144 Ų | 144 | 132.5 Ų | 132.5 | 63% | 0.626 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -69 | -46.7 | 171.5 | -75.4 | -175.9 | 175.9 | -174.8 | 0 | 111.2 | P80 E81 K86 R87 Q88 | P80-K84 PolarHBondContact O-N 2.9Å; E81-K84 PolarHBondContact O-N 3.16Å; E81-K84 VanDerWaalsContact O-N 3.12Å; K84-K86 VanDerWaalsContact C-N 3.34Å; K84-K86 PolarHBondContact O-N 3.01Å; K84-R87 PolarHBondContact O-N 3.35Å; K84-R87 VanDerWaalsContact O-N 3.16Å; K84-Q88 WeakPolarHBondContact O-CB 3.43Å; K84-Q88 PolarHBondContact O-N 3.26Å |
| 85 | E | 60.2 | Low | 60.9 | Low | 104 Ų | 104 | 127.2 Ų | 127.2 | 49% | 0.486 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -59.6 | -41.6 | 175.9 | -72.9 | -179.9 | 157.2 | 0 | 0 | 112.4 | E81 R87 Q88 K89 | E81-E85 WeakPolarHBondContact O-CG 3.02Å; E81-E85 PolarHBondContact O-N 3.49Å; E85-R87 PolarHBondContact O-N 3.46Å; E85-Q88 PolarHBondContact O-N 3.03Å; E85-K89 WeakPolarHBondContact O-CB 3.49Å; E85-K89 VanDerWaalsContact O-CG 3.31Å; E85-K89 WeakPolarHBondContact O-CG 3.39Å; E85-K89 PolarHBondContact O-N 3.16Å |
| 86 | K | 59.8 | Low | 62.8 | Low | 157 Ų | 157 | 123.1 Ų | 123.1 | 68% | 0.683 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -66 | -34.7 | 176.3 | -79.8 | 180 | -178.8 | -175 | 0 | 113.4 | K82 K84 V90 | K82-K86 WeakPolarHBondContact O-CB 3.49Å; K82-K86 VanDerWaalsContact O-CG 3.26Å; K82-K86 WeakPolarHBondContact O-CG 3.49Å; K82-K86 PolarHBondContact O-N 3.01Å; K82-K86 VanDerWaalsContact O-N 3.15Å; K84-K86 VanDerWaalsContact C-N 3.34Å; K84-K86 PolarHBondContact O-N 3.01Å; K86-V90 VanDerWaalsContact O-CG2 3.22Å; K86-V90 WeakPolarHBondContact O-CG2 3.44Å; K86-V90 PolarHBondContact O-N 3.28Å |
| 87 | R | 62 | Low | 64.8 | Low | 174 Ų | 174 | 122.2 Ų | 122.2 | 66% | 0.657 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -71.4 | -44.7 | 175 | -77 | 179.8 | 161.9 | -152.2 | -6.8 | 111.3 | K83 K84 E85 K89 V90 D91 | K83-R87 WeakPolarHBondContact O-CG 3.42Å; K83-R87 PolarHBondContact O-N 3.09Å; K84-R87 PolarHBondContact O-N 3.35Å; K84-R87 VanDerWaalsContact O-N 3.16Å; E85-R87 PolarHBondContact O-N 3.46Å; R87-K89 PolarHBondContact O-N 2.94Å; R87-V90 PolarHBondContact O-N 3.02Å; R87-D91 PolarHBondContact O-N 3.35Å; R87-D91 VanDerWaalsContact O-N 3.08Å |
| 88 | Q | 62.3 | Low | 66.1 | Low | 117 Ų | 117 | 116.6 Ų | 116.6 | 55% | 0.547 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.3 | -39.7 | 179.3 | -169 | 173.5 | 6.6 | 0 | 0 | 112.5 | K84 E85 D91 E92 | K84-Q88 WeakPolarHBondContact O-CB 3.43Å; K84-Q88 PolarHBondContact O-N 3.26Å; E85-Q88 PolarHBondContact O-N 3.03Å; Q88-D91 PolarHBondContact O-N 3.35Å; Q88-E92 PolarHBondContact O-N 3.38Å |
| 89 | K | 63.3 | Low | 67.5 | Low | 134 Ų | 134 | 117 Ų | 117 | 58% | 0.583 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.6 | -37 | 174.4 | -75.6 | -174.8 | 180 | -152.3 | 0 | 113.4 | E85 R87 D91 E92 D93 | E85-K89 WeakPolarHBondContact O-CB 3.49Å; E85-K89 VanDerWaalsContact O-CG 3.31Å; E85-K89 WeakPolarHBondContact O-CG 3.39Å; E85-K89 PolarHBondContact O-N 3.16Å; R87-K89 PolarHBondContact O-N 2.94Å; K89-D91 VanDerWaalsContact C-N 3.33Å; K89-E92 PolarHBondContact O-N 3.39Å; K89-D93 PolarHBondContact O-N 2.94Å |
| 90 | V | 62.2 | Low | 69 | Low | 76 Ų | 76 | 116.1 Ų | 116.1 | 46% | 0.461 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.5 | -39.8 | 176 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | K86 R87 D93 E94 | K86-V90 VanDerWaalsContact O-CG2 3.22Å; K86-V90 WeakPolarHBondContact O-CG2 3.44Å; K86-V90 PolarHBondContact O-N 3.28Å; R87-V90 PolarHBondContact O-N 3.02Å; V90-D93 PolarHBondContact O-N 3Å; V90-E94 WeakPolarHBondContact O-CG 3.16Å; V90-E94 PolarHBondContact O-N 2.93Å |
| 91 | D | 71.7 | Confident | 70.4 | Confident | 93 Ų | 93 | 117 Ų | 117 | 50% | 0.497 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.3 | -40.8 | 175.4 | -66.5 | -22.2 | 0 | 0 | 0 | 111.5 | R87 Q88 K89 E94 I95 | R87-D91 PolarHBondContact O-N 3.35Å; R87-D91 VanDerWaalsContact O-N 3.08Å; Q88-D91 PolarHBondContact O-N 3.35Å; K89-D91 VanDerWaalsContact C-N 3.33Å; D91-E94 PolarHBondContact O-N 3.04Å; D91-I95 WeakPolarHBondContact O-CB 3.02Å; D91-I95 WeakPolarHBondContact O-CD1 3.24Å; D91-I95 WeakPolarHBondContact O-CG1 3.29Å; D91-I95 PolarHBondContact O-N 3.5Å |
| 92 | E | 74.9 | Confident | 71.8 | Confident | 98 Ų | 98 | 112.8 Ų | 112.8 | 46% | 0.458 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 176 | -75.3 | 178.2 | -177.6 | 0 | 0 | 112.6 | Q88 K89 E94 I95 Q96 | Q88-E92 PolarHBondContact O-N 3.38Å; K89-E92 PolarHBondContact O-N 3.39Å; E92-E94 VanDerWaalsContact C-N 3.34Å; E92-E94 PolarHBondContact O-N 3.12Å; E92-I95 PolarHBondContact O-N 2.98Å; E92-Q96 WeakPolarHBondContact O-CB 3.36Å; E92-Q96 VanDerWaalsContact O-CG 3.3Å; E92-Q96 WeakPolarHBondContact O-CG 3.35Å; E92-Q96 PolarHBondContact O-N 3.23Å |
| 93 | D | 78.1 | Confident | 73.1 | Confident | 84 Ų | 84 | 111.8 Ų | 111.8 | 45% | 0.449 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.6 | -38.2 | 177.9 | -72.8 | -23.8 | 0 | 0 | 0 | 111.8 | K89 V90 K97 | K89-D93 PolarHBondContact O-N 2.94Å; V90-D93 PolarHBondContact O-N 3Å; D93-K97 WeakPolarHBondContact O-CB 3.37Å; D93-K97 VanDerWaalsContact O-CG 3.23Å; D93-K97 WeakPolarHBondContact O-CG 3.46Å; D93-K97 PolarHBondContact O-N 3.21Å |
| 94 | E | 79.2 | Confident | 74.7 | Confident | 121 Ų | 121 | 109.2 Ų | 109.2 | 57% | 0.565 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -67.9 | -41.6 | 175 | -76.2 | -172.8 | -176.8 | 0 | 0 | 112 | V90 D91 E92 K97 M98 | V90-E94 WeakPolarHBondContact O-CG 3.16Å; V90-E94 PolarHBondContact O-N 2.93Å; D91-E94 PolarHBondContact O-N 3.04Å; E92-E94 VanDerWaalsContact C-N 3.34Å; E92-E94 PolarHBondContact O-N 3.12Å; E94-K97 PolarHBondContact O-N 3.26Å; E94-M98 VanDerWaalsContact O-CB 3.31Å; E94-M98 WeakPolarHBondContact O-CB 3.28Å; E94-M98 PolarHBondContact O-N 3.1Å |
| 95 | I | 79.3 | Confident | 76.1 | Confident | 95 Ų | 95 | 105 Ų | 105 | 49% | 0.487 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.4 | -45.4 | 175.2 | -69.9 | 162.8 | 0 | 0 | 0 | 110.3 | D91 E92 M98 Q99 | D91-I95 WeakPolarHBondContact O-CB 3.02Å; D91-I95 WeakPolarHBondContact O-CD1 3.24Å; D91-I95 WeakPolarHBondContact O-CG1 3.29Å; D91-I95 PolarHBondContact O-N 3.5Å; E92-I95 PolarHBondContact O-N 2.98Å; I95-M98 PolarHBondContact O-N 2.7Å; I95-Q99 WeakPolarHBondContact O-CB 3.42Å; I95-Q99 PolarHBondContact O-N 2.79Å |
| 96 | Q | 83.5 | Confident | 77.7 | Confident | 110 Ų | 110 | 102.7 Ų | 102.7 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 178.2 | -73.3 | 176.6 | 17.1 | 0 | 0 | 111.7 | E92 M98 Q99 V100 | E92-Q96 WeakPolarHBondContact O-CB 3.36Å; E92-Q96 VanDerWaalsContact O-CG 3.3Å; E92-Q96 WeakPolarHBondContact O-CG 3.35Å; E92-Q96 PolarHBondContact O-N 3.23Å; Q96-M98 VanDerWaalsContact C-N 3.34Å; Q96-M98 PolarHBondContact O-N 3.43Å; Q96-Q99 PolarHBondContact O-N 3.38Å; Q96-V100 WeakPolarHBondContact O-CG2 3.35Å; Q96-V100 PolarHBondContact O-N 3.08Å |
| 97 | K | 84.1 | Confident | 79.2 | Confident | 147 Ų | 147 | 103.5 Ų | 103.5 | 64% | 0.639 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.1 | -44.7 | 175.3 | -76 | 169.5 | -173 | 168.1 | 0 | 111.7 | D93 E94 Q99 V100 L101 | D93-K97 WeakPolarHBondContact O-CB 3.37Å; D93-K97 VanDerWaalsContact O-CG 3.23Å; D93-K97 WeakPolarHBondContact O-CG 3.46Å; D93-K97 PolarHBondContact O-N 3.21Å; E94-K97 PolarHBondContact O-N 3.26Å; K97-Q99 VanDerWaalsContact C-N 3.31Å; K97-Q99 PolarHBondContact O-N 3.28Å; K97-V100 PolarHBondContact O-N 2.91Å; K97-L101 WeakPolarHBondContact O-CB 3.36Å; K97-L101 PolarHBondContact O-N 3.04Å |
| 98 | M | 81.5 | Confident | 80.7 | Confident | 85 Ų | 85 | 101.1 Ų | 101.1 | 42% | 0.419 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 176.3 | -176.2 | 173.6 | 56.9 | 0 | 0 | 110.9 | E94 I95 Q96 L101 V102 Y113 | E94-M98 VanDerWaalsContact O-CB 3.31Å; E94-M98 WeakPolarHBondContact O-CB 3.28Å; E94-M98 PolarHBondContact O-N 3.1Å; I95-M98 PolarHBondContact O-N 2.7Å; Q96-M98 VanDerWaalsContact C-N 3.34Å; Q96-M98 PolarHBondContact O-N 3.43Å; M98-L101 PolarHBondContact O-N 3.33Å; M98-V102 HydrophobicContact CG-CG2 4.19Å; M98-V102 WeakPolarHBondContact O-CB 3.28Å; M98-V102 WeakPolarHBondContact O-CG2 3.34Å; M98-V102 PolarHBondContact O-N 3.31Å; M98-Y113 PolarHBondContact SD-OH 3.49Å |
| 99 | Q | 81.9 | Confident | 82.1 | Confident | 135 Ų | 135 | 99.6 Ų | 99.6 | 63% | 0.631 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.4 | -45.5 | 178.7 | -171.6 | 172.3 | 19.3 | 0 | 0 | 112.1 | I95 Q96 K97 L101 V102 S103 | I95-Q99 WeakPolarHBondContact O-CB 3.42Å; I95-Q99 PolarHBondContact O-N 2.79Å; Q96-Q99 PolarHBondContact O-N 3.38Å; K97-Q99 VanDerWaalsContact C-N 3.31Å; K97-Q99 PolarHBondContact O-N 3.28Å; Q99-L101 VanDerWaalsContact C-N 3.33Å; Q99-L101 PolarHBondContact O-N 2.93Å; Q99-V102 PolarHBondContact O-N 3.08Å; Q99-S103 WeakPolarHBondContact O-CB 3.4Å; Q99-S103 PolarHBondContact O-N 2.9Å; Q99-S103 PolarHBondContact O-OG 3.11Å |
| 100 | V | 85.9 | Confident | 83.5 | Confident | 101 Ų | 101 | 96.1 Ų | 96.1 | 61% | 0.612 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.4 | -46.8 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 110.2 | Q96 K97 S103 S104 | Q96-V100 WeakPolarHBondContact O-CG2 3.35Å; Q96-V100 PolarHBondContact O-N 3.08Å; K97-V100 PolarHBondContact O-N 2.91Å; V100-S103 PolarHBondContact O-N 3.12Å; V100-S103 PolarHBondContact O-OG 3.47Å; V100-S104 PolarHBondContact O-N 2.86Å |
| 101 | L | 82.6 | Confident | 85.1 | Confident | 95 Ų | 95 | 97.2 Ų | 97.2 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61 | -50.2 | 178.9 | -175.8 | 66.2 | 0 | 0 | 0 | 111.9 | K97 M98 Q99 S103 S104 F105 | K97-L101 WeakPolarHBondContact O-CB 3.36Å; K97-L101 PolarHBondContact O-N 3.04Å; M98-L101 PolarHBondContact O-N 3.33Å; Q99-L101 VanDerWaalsContact C-N 3.33Å; Q99-L101 PolarHBondContact O-N 2.93Å; L101-S103 PolarHBondContact O-N 3.15Å; L101-S104 PolarHBondContact O-N 3.04Å; L101-S104 PolarHBondContact O-OG 3.31Å; L101-F105 HydrophobicContact CD1-CE1 3.8Å; L101-F105 HydrophobicContact CD1-CZ 4.44Å; L101-F105 HydrophobicContact CD2-CE1 4.24Å; L101-F105 HydrophobicContact CD2-CZ 4.06Å; L101-F105 HydrophobicContact CG-CE1 3.59Å; L101-F105 HydrophobicContact CG-CZ 3.78Å; L101-F105 WeakPolarHBondContact O-CD1 3.45Å; L101-F105 PolarHBondContact O-N 3.45Å |
| 102 | V | 83.9 | Confident | 86.1 | Confident | 41 Ų | 41 | 98.9 Ų | 98.9 | 25% | 0.248 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.3 | -35 | 179.7 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | M98 Q99 S104 F105 L110 Y113 | M98-V102 HydrophobicContact CG-CG2 4.19Å; M98-V102 WeakPolarHBondContact O-CB 3.28Å; M98-V102 WeakPolarHBondContact O-CG2 3.34Å; M98-V102 PolarHBondContact O-N 3.31Å; Q99-V102 PolarHBondContact O-N 3.08Å; V102-S104 PolarHBondContact O-N 3.49Å; V102-F105 HydrophobicContact CG2-CE2 4.33Å; V102-F105 PolarHBondContact O-N 3.47Å; V102-L110 HydrophobicContact CG1-CD1 3.63Å; V102-Y113 HydrophobicContact CG2-CD1 4.07Å; V102-Y113 HydrophobicContact CG2-CE1 3.68Å |
| 103 | S | 83.4 | Confident | 87 | Confident | 99 Ų | 99 | 97.1 Ų | 97.1 | 69% | 0.692 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -69.7 | -20.4 | 176.2 | 73.6 | 0 | 0 | 0 | 0 | 114 | Q99 V100 L101 | Q99-S103 WeakPolarHBondContact O-CB 3.4Å; Q99-S103 PolarHBondContact O-N 2.9Å; Q99-S103 PolarHBondContact O-OG 3.11Å; V100-S103 PolarHBondContact O-N 3.12Å; V100-S103 PolarHBondContact O-OG 3.47Å; L101-S103 PolarHBondContact O-N 3.15Å |
| 104 | S | 88.8 | Confident | 87.7 | Confident | 84 Ų | 84 | 96.6 Ų | 96.6 | 59% | 0.587 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | -1.2 | -179.6 | 70.3 | 0 | 0 | 0 | 0 | 114.2 | V100 L101 V102 | V100-S104 PolarHBondContact O-N 2.86Å; L101-S104 PolarHBondContact O-N 3.04Å; L101-S104 PolarHBondContact O-OG 3.31Å; V102-S104 PolarHBondContact O-N 3.49Å |
| 105 | F | 89 | Confident | 88.5 | Confident | 54 Ų | 54 | 97.2 Ų | 97.2 | 24% | 0.237 | 49% | 0.491 | C | S | . | . | S | Bend | trans | -71.5 | 147.7 | -179.9 | -75.6 | -9.8 | 0 | 0 | 0 | 112.6 | L101 V102 Q109 L110 Y113 | L101-F105 HydrophobicContact CD1-CE1 3.8Å; L101-F105 HydrophobicContact CD1-CZ 4.44Å; L101-F105 HydrophobicContact CD2-CE1 4.24Å; L101-F105 HydrophobicContact CD2-CZ 4.06Å; L101-F105 HydrophobicContact CG-CE1 3.59Å; L101-F105 HydrophobicContact CG-CZ 3.78Å; L101-F105 WeakPolarHBondContact O-CD1 3.45Å; L101-F105 PolarHBondContact O-N 3.45Å; V102-F105 HydrophobicContact CG2-CE2 4.33Å; V102-F105 PolarHBondContact O-N 3.47Å; F105-Q109 HydrophobicContact CB-CB 3.96Å; F105-Q109 HydrophobicContact CD2-CB 4.41Å; F105-Q109 HydrophobicContact CG-CB 4.08Å; F105-L110 HydrophobicContact CB-CB 4.2Å; F105-Y113 HydrophobicContact CE2-CD1 4.15Å; F105-Y113 AromaticContact CE2-CG 3.93Å; F105-Y113 HydrophobicContact CE2-CG 3.93Å |
| 106 | S | 93.6 | Very high | 89.2 | Confident | 56 Ų | 56 | 99.9 Ų | 99.9 | 39% | 0.392 | 50% | 0.496 | S | S | . | . | trans | -64.4 | 157.5 | 161 | 76.3 | 0 | 0 | 0 | 0 | 110.2 | E108 Q109 L110 | S106-E108 PolarHBondContact O-N 3.16Å; S106-Q109 PolarHBondContact O-N 2.88Å; S106-Q109 WeakPolarHBondContact OG-CG 3.19Å; S106-Q109 PolarHBondContact OG-N 3.27Å; S106-Q109 PolarHBondContact OG-OE1 3.46Å; S106-L110 PolarHBondContact O-N 3.34Å | ||
| 107 | E | 92.9 | Very high | 89.7 | Confident | 175 Ų | 175 | 101.1 Ų | 101.1 | 82% | 0.818 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -55 | -39.6 | 179 | -174.3 | 176.8 | -176.3 | 0 | 0 | 112.1 | L110 N111 | E107-L110 PolarHBondContact O-N 3.42Å; E107-N111 WeakPolarHBondContact O-CB 3.43Å; E107-N111 PolarHBondContact O-N 3.06Å |
| 108 | E | 91.8 | Very high | 90.2 | Very high | 124 Ų | 124 | 101 Ų | 101 | 58% | 0.579 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -67.8 | -41.2 | 177.9 | -159.1 | -161.8 | 179.5 | 0 | 0 | 112.3 | S106 N111 R112 | S106-E108 PolarHBondContact O-N 3.16Å; E108-N111 PolarHBondContact O-N 3.04Å; E108-R112 WeakPolarHBondContact O-CG 3.41Å; E108-R112 PolarHBondContact O-N 3.08Å; E108-R112 IonicContact OE1-NH1 4Å; E108-R112 PolarHBondContact OE1-NH1 3.06Å; E108-R112 IonicContact OE2-CZ 2.82Å; E108-R112 IonicContact OE2-NH1 2.76Å; E108-R112 PolarHBondContact OE2-NH1 2.93Å; E108-R112 IonicContact OE2-NH2 3.66Å |
| 109 | Q | 93.1 | Very high | 90.9 | Very high | 85 Ų | 85 | 99.4 Ų | 99.4 | 40% | 0.397 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 176.3 | -75.2 | 172 | -28.7 | 0 | 0 | 111.7 | F105 S106 R112 Y113 | F105-Q109 HydrophobicContact CB-CB 3.96Å; F105-Q109 HydrophobicContact CD2-CB 4.41Å; F105-Q109 HydrophobicContact CG-CB 4.08Å; S106-Q109 PolarHBondContact O-N 2.88Å; S106-Q109 WeakPolarHBondContact OG-CG 3.19Å; S106-Q109 PolarHBondContact OG-N 3.27Å; S106-Q109 PolarHBondContact OG-OE1 3.46Å; Q109-R112 PolarHBondContact O-N 3.43Å; Q109-Y113 WeakPolarHBondContact O-CB 3.36Å; Q109-Y113 PolarHBondContact O-N 3.3Å |
| 110 | L | 92.8 | Very high | 91.6 | Very high | 61 Ų | 61 | 97 Ų | 97 | 32% | 0.319 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.6 | -50 | 175.7 | -179.7 | 62.4 | 0 | 0 | 0 | 110.4 | V102 F105 S106 E107 R112 Y113 E114 | V102-L110 HydrophobicContact CG1-CD1 3.63Å; F105-L110 HydrophobicContact CB-CB 4.2Å; S106-L110 PolarHBondContact O-N 3.34Å; E107-L110 PolarHBondContact O-N 3.42Å; L110-R112 PolarHBondContact O-N 3.22Å; L110-Y113 PolarHBondContact O-N 3.07Å; L110-E114 HydrophobicContact CD1-CG 4.18Å; L110-E114 HydrophobicContact CG-CG 4.38Å; L110-E114 WeakPolarHBondContact O-CB 3.36Å; L110-E114 VanDerWaalsContact O-CG 3.31Å; L110-E114 WeakPolarHBondContact O-CG 3.36Å; L110-E114 PolarHBondContact O-N 3.27Å |
| 111 | N | 94.4 | Very high | 92.1 | Very high | 98 Ų | 98 | 96.1 Ų | 96.1 | 52% | 0.524 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.9 | -46 | 178.1 | -173.4 | 27.5 | 0 | 0 | 0 | 111.9 | E107 E108 Y113 E114 M115 | E107-N111 WeakPolarHBondContact O-CB 3.43Å; E107-N111 PolarHBondContact O-N 3.06Å; E108-N111 PolarHBondContact O-N 3.04Å; N111-Y113 PolarHBondContact O-N 2.92Å; N111-E114 PolarHBondContact O-N 3.19Å; N111-M115 WeakPolarHBondContact O-CB 3.3Å; N111-M115 VanDerWaalsContact O-CG 3.27Å; N111-M115 WeakPolarHBondContact O-CG 3.49Å; N111-M115 PolarHBondContact O-N 2.87Å |
| 112 | R | 94.1 | Very high | 92.8 | Very high | 128 Ų | 128 | 95.8 Ų | 95.8 | 48% | 0.483 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 175.4 | -74.3 | -166.4 | -62.5 | -102.9 | -1 | 112.3 | E108 Q109 L110 M115 Y116 | E108-R112 WeakPolarHBondContact O-CG 3.41Å; E108-R112 PolarHBondContact O-N 3.08Å; E108-R112 IonicContact OE1-NH1 4Å; E108-R112 PolarHBondContact OE1-NH1 3.06Å; E108-R112 IonicContact OE2-CZ 2.82Å; E108-R112 IonicContact OE2-NH1 2.76Å; E108-R112 PolarHBondContact OE2-NH1 2.93Å; E108-R112 IonicContact OE2-NH2 3.66Å; Q109-R112 PolarHBondContact O-N 3.43Å; L110-R112 PolarHBondContact O-N 3.22Å; R112-M115 PolarHBondContact O-N 2.93Å; R112-Y116 WeakPolarHBondContact O-CB 3.49Å; R112-Y116 PolarHBondContact O-N 3.35Å |
| 113 | Y | 92.8 | Very high | 93.3 | Very high | 61 Ų | 61 | 99.5 Ų | 99.5 | 24% | 0.239 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -65.4 | -43.5 | 178.5 | 176.4 | -111.3 | 0 | 0 | 0 | 112.2 | M98 V102 F105 Q109 L110 N111 M115 Y116 R117 | M98-Y113 PolarHBondContact SD-OH 3.49Å; V102-Y113 HydrophobicContact CG2-CD1 4.07Å; V102-Y113 HydrophobicContact CG2-CE1 3.68Å; F105-Y113 HydrophobicContact CE2-CD1 4.15Å; F105-Y113 AromaticContact CE2-CG 3.93Å; F105-Y113 HydrophobicContact CE2-CG 3.93Å; Q109-Y113 WeakPolarHBondContact O-CB 3.36Å; Q109-Y113 PolarHBondContact O-N 3.3Å; L110-Y113 PolarHBondContact O-N 3.07Å; N111-Y113 PolarHBondContact O-N 2.92Å; Y113-M115 VanDerWaalsContact C-N 3.32Å; Y113-M115 PolarHBondContact O-N 3.01Å; Y113-Y116 HydrophobicContact CD2-CD1 4.31Å; Y113-Y116 HydrophobicContact CE2-CD1 4.44Å; Y113-Y116 PolarHBondContact O-N 3.33Å; Y113-R117 WeakPolarHBondContact O-CB 3.45Å; Y113-R117 PolarHBondContact O-N 2.97Å |
| 114 | E | 93.8 | Very high | 94 | Very high | 74 Ų | 74 | 97.3 Ų | 97.3 | 35% | 0.346 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 177.3 | -76.2 | -142.8 | 114.6 | 0 | 0 | 112 | L110 N111 R118 | L110-E114 HydrophobicContact CD1-CG 4.18Å; L110-E114 HydrophobicContact CG-CG 4.38Å; L110-E114 WeakPolarHBondContact O-CB 3.36Å; L110-E114 VanDerWaalsContact O-CG 3.31Å; L110-E114 WeakPolarHBondContact O-CG 3.36Å; L110-E114 PolarHBondContact O-N 3.27Å; N111-E114 PolarHBondContact O-N 3.19Å; E114-R118 WeakPolarHBondContact O-CB 3.48Å; E114-R118 WeakPolarHBondContact O-CG 3.42Å; E114-R118 PolarHBondContact O-N 3.33Å; E114-R118 IonicContact OE1-CZ 3.35Å; E114-R118 IonicContact OE1-NH1 3.03Å; E114-R118 PolarHBondContact OE1-NH1 3.05Å; E114-R118 IonicContact OE1-NH2 2.98Å; E114-R118 PolarHBondContact OE1-NH2 3.23Å; E114-R118 IonicContact OE2-NH1 3.74Å |
| 115 | M | 95.3 | Very high | 94.4 | Very high | 133 Ų | 133 | 95.7 Ų | 95.7 | 66% | 0.655 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -65 | -44.7 | 175.3 | -69.7 | -65.4 | -106.3 | 0 | 0 | 111.4 | N111 R112 Y113 S119 | N111-M115 WeakPolarHBondContact O-CB 3.3Å; N111-M115 VanDerWaalsContact O-CG 3.27Å; N111-M115 WeakPolarHBondContact O-CG 3.49Å; N111-M115 PolarHBondContact O-N 2.87Å; R112-M115 PolarHBondContact O-N 2.93Å; Y113-M115 VanDerWaalsContact C-N 3.32Å; Y113-M115 PolarHBondContact O-N 3.01Å; M115-S119 WeakPolarHBondContact O-CB 3.38Å; M115-S119 PolarHBondContact O-N 3Å; M115-S119 PolarHBondContact O-OG 2.82Å |
| 116 | Y | 94.4 | Very high | 94.8 | Very high | 152 Ų | 152 | 94 Ų | 94 | 60% | 0.596 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -59.3 | -49.3 | 175.1 | 165.9 | -108.2 | 0 | 0 | 0 | 112.1 | R112 Y113 R118 S119 K151 | R112-Y116 WeakPolarHBondContact O-CB 3.49Å; R112-Y116 PolarHBondContact O-N 3.35Å; Y113-Y116 HydrophobicContact CD2-CD1 4.31Å; Y113-Y116 HydrophobicContact CE2-CD1 4.44Å; Y113-Y116 PolarHBondContact O-N 3.33Å; Y116-R118 PolarHBondContact O-N 3.06Å; Y116-S119 PolarHBondContact O-N 2.95Å; Y116-S119 PolarHBondContact O-OG 2.88Å; Y116-K151 PolarHBondContact O-NZ 2.68Å |
| 117 | R | 94.2 | Very high | 95 | Very high | 135 Ų | 135 | 95.8 Ų | 95.8 | 51% | 0.509 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | -177 | -169.5 | -176.3 | 73.5 | 112.5 | -2 | 111.9 | Y113 | Y113-R117 WeakPolarHBondContact O-CB 3.45Å; Y113-R117 PolarHBondContact O-N 2.97Å |
| 118 | R | 94.4 | Very high | 95.3 | Very high | 144 Ų | 144 | 95.9 Ų | 95.9 | 54% | 0.543 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -84.3 | -14 | -178.1 | -65.1 | -173 | -178.3 | 83.6 | -7.9 | 113.9 | E114 Y116 A120 | E114-R118 WeakPolarHBondContact O-CB 3.48Å; E114-R118 WeakPolarHBondContact O-CG 3.42Å; E114-R118 PolarHBondContact O-N 3.33Å; E114-R118 IonicContact OE1-CZ 3.35Å; E114-R118 IonicContact OE1-NH1 3.03Å; E114-R118 PolarHBondContact OE1-NH1 3.05Å; E114-R118 IonicContact OE1-NH2 2.98Å; E114-R118 PolarHBondContact OE1-NH2 3.23Å; E114-R118 IonicContact OE2-NH1 3.74Å; Y116-R118 PolarHBondContact O-N 3.06Å; R118-A120 PolarHBondContact O-N 3.07Å |
| 119 | S | 96 | Very high | 95.6 | Very high | 52 Ų | 52 | 94.8 Ų | 94.8 | 36% | 0.364 | 46% | 0.461 | S | S | . | . | trans | -62.1 | 126.6 | 177.7 | 65.6 | 0 | 0 | 0 | 0 | 111.3 | M115 Y116 K151 | M115-S119 WeakPolarHBondContact O-CB 3.38Å; M115-S119 PolarHBondContact O-N 3Å; M115-S119 PolarHBondContact O-OG 2.82Å; Y116-S119 PolarHBondContact O-N 2.95Å; Y116-S119 PolarHBondContact O-OG 2.88Å; S119-K151 WeakPolarHBondContact O-CE 3.36Å; S119-K151 PolarHBondContact O-NZ 3.3Å; S119-K151 WeakPolarHBondContact OG-CE 3.47Å; S119-K151 PolarHBondContact OG-NZ 3.41Å | ||
| 120 | A | 96 | Very high | 95.8 | Very high | 85 Ų | 85 | 91.9 Ų | 91.9 | 70% | 0.702 | 45% | 0.448 | S | S | * | . | trans | -154.4 | 150.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | R118 | R118-A120 PolarHBondContact O-N 3.07Š| ||
| 121 | F | 96.6 | Very high | 96 | Very high | 82 Ų | 82 | 92 Ų | 92 | 36% | 0.36 | 45% | 0.447 | S | S | . | . | trans | -75.5 | 138.3 | 172.8 | -66.2 | -69.8 | 0 | 0 | 0 | 110.8 | K123 I126 K151 | F121-K123 PolarHBondContact O-N 3.27Å; F121-K123 VanDerWaalsContact O-N 3.12Å; F121-I126 HydrophobicContact CB-CD1 3.82Å; F121-I126 HydrophobicContact CB-CG1 3.66Å; F121-I126 HydrophobicContact CG-CD1 4.14Å; F121-I126 HydrophobicContact CG-CG1 4.5Å; F121-K151 HydrophobicContact CE2-CB 4.36Å | ||
| 122 | P | 97.1 | Very high | 96.2 | Very high | 89 Ų | 89 | 91.7 Ų | 91.7 | 58% | 0.578 | 45% | 0.452 | S | S | * | . | trans | -60.1 | 117.4 | 174.3 | -23.7 | 33.7 | 0 | 0 | 0 | 111.2 | A124 A125 I126 | P122-A124 PolarHBondContact O-N 3.47Å; P122-A124 VanDerWaalsContact O-N 3.11Å; P122-A125 HydrophobicContact CB-CB 4.23Å; P122-A125 PolarHBondContact O-N 2.88Å; P122-I126 PolarHBondContact O-N 3.2Å | ||
| 123 | K | 95.8 | Very high | 96.3 | Very high | 118 Ų | 118 | 91.9 Ų | 91.9 | 51% | 0.513 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -53.2 | -37.5 | -176.7 | -67.1 | 178.7 | -177.8 | 169.4 | 0 | 112.7 | F121 K127 V143 | F121-K123 PolarHBondContact O-N 3.27Å; F121-K123 VanDerWaalsContact O-N 3.12Å; K123-K127 VanDerWaalsContact O-CB 3.26Å; K123-K127 WeakPolarHBondContact O-CB 3.33Å; K123-K127 PolarHBondContact O-N 3.46Å; K123-V143 HydrophobicContact CB-CG1 3.99Å; K123-V143 HydrophobicContact CG-CG1 4.3Å; K123-V143 WeakPolarHBondContact O-CG1 3.32Å |
| 124 | A | 97.3 | Very high | 96.5 | Very high | 54 Ų | 54 | 92.6 Ų | 92.6 | 45% | 0.446 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.5 | -39.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | P122 R128 | P122-A124 PolarHBondContact O-N 3.47Å; P122-A124 VanDerWaalsContact O-N 3.11Å; A124-R128 VanDerWaalsContact O-CG 3.26Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.72Å |
| 125 | A | 97.6 | Very high | 96.6 | Very high | 49 Ų | 49 | 92.5 Ų | 92.5 | 41% | 0.405 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.4 | -45.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111 | P122 K127 R128 L129 | P122-A125 HydrophobicContact CB-CB 4.23Å; P122-A125 PolarHBondContact O-N 2.88Å; A125-K127 PolarHBondContact O-N 3.41Å; A125-R128 PolarHBondContact O-N 3Å; A125-L129 PolarHBondContact O-N 2.7Å |
| 126 | I | 97.8 | Very high | 96.6 | Very high | 20 Ų | 20 | 89.9 Ų | 89.9 | 10% | 0.103 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -61.4 | -45.6 | 176.2 | -60.5 | -59.9 | 0 | 0 | 0 | 110.8 | F121 P122 R128 L129 I130 V143 M146 | F121-I126 HydrophobicContact CB-CD1 3.82Å; F121-I126 HydrophobicContact CB-CG1 3.66Å; F121-I126 HydrophobicContact CG-CD1 4.14Å; F121-I126 HydrophobicContact CG-CG1 4.5Å; P122-I126 PolarHBondContact O-N 3.2Å; I126-R128 PolarHBondContact O-N 3.42Å; I126-L129 PolarHBondContact O-N 2.94Å; I126-I130 HydrophobicContact CG2-CD1 3.73Å; I126-I130 HydrophobicContact CG2-CG1 4.33Å; I126-I130 VanDerWaalsContact O-CG1 3.29Å; I126-I130 WeakPolarHBondContact O-CG1 3.26Å; I126-I130 PolarHBondContact O-N 3.01Å; I126-V143 HydrophobicContact CB-CG1 4.17Å; I126-V143 HydrophobicContact CG2-CG1 4.06Å; I126-M146 HydrophobicContact CG2-CB 4.29Å; I126-M146 HydrophobicContact CG2-CG 4.3Å |
| 127 | K | 97.8 | Very high | 96.7 | Very high | 92 Ų | 92 | 88 Ų | 88 | 40% | 0.4 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.1 | -48.4 | 177.1 | -172 | 176.2 | -177.8 | 178.9 | 0 | 111.6 | K123 A125 L129 I130 Q131 V143 | K123-K127 VanDerWaalsContact O-CB 3.26Å; K123-K127 WeakPolarHBondContact O-CB 3.33Å; K123-K127 PolarHBondContact O-N 3.46Å; A125-K127 PolarHBondContact O-N 3.41Å; K127-L129 VanDerWaalsContact C-N 3.34Å; K127-L129 PolarHBondContact O-N 3.38Å; K127-I130 PolarHBondContact O-N 3.38Å; K127-Q131 HydrophobicContact CG-CG 4.39Å; K127-Q131 WeakPolarHBondContact O-CB 3.35Å; K127-Q131 WeakPolarHBondContact O-CG 3.48Å; K127-Q131 PolarHBondContact O-N 3.2Å; K127-V143 HydrophobicContact CB-CG2 3.88Å; K127-V143 HydrophobicContact CG-CG2 4.1Å |
| 128 | R | 97.8 | Very high | 96.8 | Very high | 178 Ų | 178 | 82.6 Ų | 82.6 | 67% | 0.672 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.7 | -43.5 | 177.5 | -73.2 | 174.2 | -162.1 | 155.3 | 3.1 | 111.9 | A124 A125 I126 Q131 S132 | A124-R128 VanDerWaalsContact O-CG 3.26Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.72Å; A125-R128 PolarHBondContact O-N 3Å; I126-R128 PolarHBondContact O-N 3.42Å; R128-Q131 PolarHBondContact O-N 3.31Å; R128-S132 WeakPolarHBondContact O-CB 3.49Å; R128-S132 PolarHBondContact O-N 2.77Å; R128-S132 PolarHBondContact O-OG 2.88Å |
| 129 | L | 97.8 | Very high | 96.9 | Very high | 101 Ų | 101 | 79 Ų | 79 | 53% | 0.529 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.2 | -49.4 | 178.4 | 179.6 | 62 | 0 | 0 | 0 | 111.4 | A125 I126 K127 Q131 S132 I133 | A125-L129 PolarHBondContact O-N 2.7Å; I126-L129 PolarHBondContact O-N 2.94Å; K127-L129 VanDerWaalsContact C-N 3.34Å; K127-L129 PolarHBondContact O-N 3.38Å; L129-Q131 VanDerWaalsContact C-N 3.34Å; L129-Q131 PolarHBondContact O-N 3.5Å; L129-S132 PolarHBondContact O-N 3.09Å; L129-S132 PolarHBondContact O-OG 2.72Å; L129-I133 HydrophobicContact CD1-CD1 4.1Å; L129-I133 HydrophobicContact CG-CD1 4.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.43Å; L129-I133 PolarHBondContact O-N 3.49Å |
| 130 | I | 97.7 | Very high | 97 | Very high | 24 Ų | 24 | 82.6 Ų | 82.6 | 12% | 0.123 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 178.9 | -59.4 | 165.1 | 0 | 0 | 0 | 110 | I126 K127 S132 I133 T134 V138 V142 M146 | I126-I130 HydrophobicContact CG2-CD1 3.73Å; I126-I130 HydrophobicContact CG2-CG1 4.33Å; I126-I130 VanDerWaalsContact O-CG1 3.29Å; I126-I130 WeakPolarHBondContact O-CG1 3.26Å; I126-I130 PolarHBondContact O-N 3.01Å; K127-I130 PolarHBondContact O-N 3.38Å; I130-S132 VanDerWaalsContact C-N 3.33Å; I130-S132 PolarHBondContact O-N 3.25Å; I130-I133 PolarHBondContact O-N 3.39Å; I130-I133 VanDerWaalsContact O-N 3.11Å; I130-T134 HydrophobicContact CG2-CG2 4.1Å; I130-T134 PolarHBondContact O-N 3.26Å; I130-T134 PolarHBondContact O-OG1 2.94Å; I130-T134 VanDerWaalsContact O-OG1 3.08Å; I130-V138 HydrophobicContact CB-CG2 4.25Å; I130-V138 HydrophobicContact CG2-CG1 4.18Å; I130-V138 HydrophobicContact CG2-CG2 3.61Å; I130-V142 HydrophobicContact CD1-CG1 4.47Å; I130-M146 HydrophobicContact CD1-CB 3.99Å; I130-M146 HydrophobicContact CD1-CG 4Å; I130-M146 HydrophobicContact CG1-CG 4.48Å |
| 131 | Q | 97.7 | Very high | 97.1 | Very high | 64 Ų | 64 | 84.3 Ų | 84.3 | 30% | 0.299 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.5 | -36.9 | 179.2 | -71 | -179.5 | -39.7 | 0 | 0 | 112.9 | K127 R128 L129 I133 G135 S136 V138 | K127-Q131 HydrophobicContact CG-CG 4.39Å; K127-Q131 WeakPolarHBondContact O-CB 3.35Å; K127-Q131 WeakPolarHBondContact O-CG 3.48Å; K127-Q131 PolarHBondContact O-N 3.2Å; R128-Q131 PolarHBondContact O-N 3.31Å; L129-Q131 VanDerWaalsContact C-N 3.34Å; L129-Q131 PolarHBondContact O-N 3.5Å; Q131-I133 PolarHBondContact O-N 3.47Å; Q131-G135 WeakPolarHBondContact O-CA 3.33Å; Q131-G135 PolarHBondContact O-N 2.94Å; Q131-S136 WeakPolarHBondContact CG-O 3.21Å; Q131-V138 HydrophobicContact CG-CB 4.38Å; Q131-V138 HydrophobicContact CG-CG2 3.8Å |
| 132 | S | 98 | Very high | 97.1 | Very high | 90 Ų | 90 | 83.5 Ų | 83.5 | 63% | 0.629 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -65 | -25.1 | 176.4 | 70.1 | 0 | 0 | 0 | 0 | 113.2 | R128 L129 I130 | R128-S132 WeakPolarHBondContact O-CB 3.49Å; R128-S132 PolarHBondContact O-N 2.77Å; R128-S132 PolarHBondContact O-OG 2.88Å; L129-S132 PolarHBondContact O-N 3.09Å; L129-S132 PolarHBondContact O-OG 2.72Å; I130-S132 VanDerWaalsContact C-N 3.33Å; I130-S132 PolarHBondContact O-N 3.25Å |
| 133 | I | 97.1 | Very high | 97.1 | Very high | 132 Ų | 132 | 79.5 Ų | 79.5 | 68% | 0.677 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -91 | -43.3 | 179.3 | -63.6 | 166.3 | 0 | 0 | 0 | 110.8 | L129 I130 Q131 | L129-I133 HydrophobicContact CD1-CD1 4.1Å; L129-I133 HydrophobicContact CG-CD1 4.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.43Å; L129-I133 PolarHBondContact O-N 3.49Å; I130-I133 PolarHBondContact O-N 3.39Å; I130-I133 VanDerWaalsContact O-N 3.11Å; Q131-I133 PolarHBondContact O-N 3.47Å |
| 134 | T | 96.4 | Very high | 97.2 | Very high | 76 Ų | 76 | 77.8 Ų | 77.8 | 47% | 0.466 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -85.7 | -19.5 | -176 | 61.6 | 0 | 0 | 0 | 0 | 113.8 | I130 S136 | I130-T134 HydrophobicContact CG2-CG2 4.1Å; I130-T134 PolarHBondContact O-N 3.26Å; I130-T134 PolarHBondContact O-OG1 2.94Å; I130-T134 VanDerWaalsContact O-OG1 3.08Å; T134-S136 PolarHBondContact O-N 2.9Å; T134-S136 VanDerWaalsContact O-N 3.17Å; T134-S136 PolarHBondContact OG1-N 3.46Å; T134-S136 PolarHBondContact OG1-O 3.02Å |
| 135 | G | 95.9 | Very high | 97.3 | Very high | 72 Ų | 72 | 77.7 Ų | 77.7 | 74% | 0.742 | 45% | 0.453 | S | S | * | . | S | Bend | trans | 66.6 | 9.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q131 | Q131-G135 WeakPolarHBondContact O-CA 3.33Å; Q131-G135 PolarHBondContact O-N 2.94Å |
| 136 | S | 95.3 | Very high | 97.3 | Very high | 78 Ų | 78 | 79.2 Ų | 79.2 | 55% | 0.545 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -130.9 | 161.8 | -173.2 | -63.6 | 0 | 0 | 0 | 0 | 111.8 | Q131 T134 | Q131-S136 WeakPolarHBondContact CG-O 3.21Å; T134-S136 PolarHBondContact O-N 2.9Å; T134-S136 VanDerWaalsContact O-N 3.17Å; T134-S136 PolarHBondContact OG1-N 3.46Å; T134-S136 PolarHBondContact OG1-O 3.02Å |
| 137 | S | 95.9 | Very high | 97.2 | Very high | 112 Ų | 112 | 79.1 Ų | 79.1 | 78% | 0.783 | 45% | 0.454 | S | S | * | . | trans | -66.1 | 149.3 | 174.2 | 63 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 138 | V | 96.9 | Very high | 97.2 | Very high | 22 Ų | 22 | 76.4 Ų | 76.4 | 13% | 0.133 | 45% | 0.452 | C | S | . | . | trans | -129.9 | 135.4 | -173.9 | -178.2 | 0 | 0 | 0 | 0 | 109.1 | I130 Q131 V142 V143 | I130-V138 HydrophobicContact CB-CG2 4.25Å; I130-V138 HydrophobicContact CG2-CG1 4.18Å; I130-V138 HydrophobicContact CG2-CG2 3.61Å; Q131-V138 HydrophobicContact CG-CB 4.38Å; Q131-V138 HydrophobicContact CG-CG2 3.8Å; V138-V142 HydrophobicContact CG1-CB 3.7Å; V138-V142 HydrophobicContact CG1-CG1 3.58Å; V138-V143 HydrophobicContact CG1-CG2 4.22Å | ||
| 139 | S | 97.1 | Very high | 97.1 | Very high | 70 Ų | 70 | 73.4 Ų | 73.4 | 49% | 0.49 | 45% | 0.448 | S | S | . | . | trans | -73.9 | 155.4 | 178.9 | 70.1 | 0 | 0 | 0 | 0 | 112.2 | N141 V142 V143 | S139-N141 VanDerWaalsContact C-N 3.3Å; S139-N141 PolarHBondContact O-N 3.44Å; S139-V142 PolarHBondContact O-N 3.38Å; S139-V142 WeakPolarHBondContact OG-CG2 3.27Å; S139-V143 PolarHBondContact O-N 3.45Å | ||
| 140 | Q | 97.1 | Very high | 97.1 | Very high | 126 Ų | 126 | 70.3 Ų | 70.3 | 59% | 0.589 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -62.1 | -36.3 | -179.4 | 178 | 168.5 | -21.6 | 0 | 0 | 112.7 | V142 V143 I144 | Q140-V142 VanDerWaalsContact C-N 3.3Å; Q140-V142 PolarHBondContact O-N 3.43Å; Q140-V143 WeakPolarHBondContact O-CB 3.48Å; Q140-V143 PolarHBondContact O-N 3.2Å; Q140-V143 VanDerWaalsContact O-N 3.09Å; Q140-I144 HydrophobicContact CG-CD1 3.96Å; Q140-I144 HydrophobicContact CG-CG1 4.37Å; Q140-I144 WeakPolarHBondContact O-CG1 3.38Å; Q140-I144 PolarHBondContact O-N 3.48Å |
| 141 | N | 97.6 | Very high | 97 | Very high | 122 Ų | 122 | 71.9 Ų | 71.9 | 65% | 0.652 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.8 | -37.3 | 178.9 | -67.5 | -13.4 | 0 | 0 | 0 | 112.1 | S139 V143 I144 A145 | S139-N141 VanDerWaalsContact C-N 3.3Å; S139-N141 PolarHBondContact O-N 3.44Å; N141-V143 VanDerWaalsContact C-N 3.34Å; N141-I144 PolarHBondContact O-N 3Å; N141-A145 WeakPolarHBondContact O-CB 3.31Å; N141-A145 PolarHBondContact O-N 3.38Å |
| 142 | V | 97.6 | Very high | 96.9 | Very high | 65 Ų | 65 | 73 Ų | 73 | 39% | 0.394 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.2 | -41 | 173.8 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | I130 V138 S139 Q140 I144 A145 M146 | I130-V142 HydrophobicContact CD1-CG1 4.47Å; V138-V142 HydrophobicContact CG1-CB 3.7Å; V138-V142 HydrophobicContact CG1-CG1 3.58Å; S139-V142 PolarHBondContact O-N 3.38Å; S139-V142 WeakPolarHBondContact OG-CG2 3.27Å; Q140-V142 VanDerWaalsContact C-N 3.3Å; Q140-V142 PolarHBondContact O-N 3.43Å; V142-I144 VanDerWaalsContact C-N 3.34Å; V142-I144 PolarHBondContact O-N 3.38Å; V142-A145 PolarHBondContact O-N 2.83Å; V142-M146 VanDerWaalsContact O-CB 3.28Å; V142-M146 WeakPolarHBondContact O-CB 3.45Å; V142-M146 PolarHBondContact O-N 2.83Å |
| 143 | V | 97.9 | Very high | 96.8 | Very high | 5 Ų | 5 | 73.1 Ų | 73.1 | 3% | 0.03 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -62.6 | -42.1 | 176 | 178.4 | 0 | 0 | 0 | 0 | 111.1 | K123 I126 K127 V138 S139 Q140 N141 S147 | K123-V143 HydrophobicContact CB-CG1 3.99Å; K123-V143 HydrophobicContact CG-CG1 4.3Å; K123-V143 WeakPolarHBondContact O-CG1 3.32Å; I126-V143 HydrophobicContact CB-CG1 4.17Å; I126-V143 HydrophobicContact CG2-CG1 4.06Å; K127-V143 HydrophobicContact CB-CG2 3.88Å; K127-V143 HydrophobicContact CG-CG2 4.1Å; V138-V143 HydrophobicContact CG1-CG2 4.22Å; S139-V143 PolarHBondContact O-N 3.45Å; Q140-V143 WeakPolarHBondContact O-CB 3.48Å; Q140-V143 PolarHBondContact O-N 3.2Å; Q140-V143 VanDerWaalsContact O-N 3.09Å; N141-V143 VanDerWaalsContact C-N 3.34Å; V143-S147 VanDerWaalsContact O-CB 3.29Å; V143-S147 WeakPolarHBondContact O-CB 3.42Å; V143-S147 PolarHBondContact O-N 3.43Å; V143-S147 PolarHBondContact O-OG 2.99Å |
| 144 | I | 97.4 | Very high | 96.8 | Very high | 81 Ų | 81 | 68.8 Ų | 68.8 | 42% | 0.415 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.3 | -50.2 | 176.8 | -67.4 | 166.9 | 0 | 0 | 0 | 110.4 | Q140 N141 V142 M146 S147 G148 | Q140-I144 HydrophobicContact CG-CD1 3.96Å; Q140-I144 HydrophobicContact CG-CG1 4.37Å; Q140-I144 WeakPolarHBondContact O-CG1 3.38Å; Q140-I144 PolarHBondContact O-N 3.48Å; N141-I144 PolarHBondContact O-N 3Å; V142-I144 VanDerWaalsContact C-N 3.34Å; V142-I144 PolarHBondContact O-N 3.38Å; I144-M146 PolarHBondContact O-N 2.87Å; I144-S147 PolarHBondContact O-N 2.87Å; I144-G148 PolarHBondContact O-N 3.29Å |
| 145 | A | 98.1 | Very high | 96.7 | Very high | 53 Ų | 53 | 66.3 Ų | 66.3 | 44% | 0.438 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.7 | -47.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | N141 V142 S147 G148 I149 | N141-A145 WeakPolarHBondContact O-CB 3.31Å; N141-A145 PolarHBondContact O-N 3.38Å; V142-A145 PolarHBondContact O-N 2.83Å; A145-S147 VanDerWaalsContact C-N 3.34Å; A145-S147 PolarHBondContact O-N 3.48Å; A145-G148 PolarHBondContact O-N 3.36Å; A145-I149 WeakPolarHBondContact O-CG1 3.15Å; A145-I149 PolarHBondContact O-N 3.4Å |
| 146 | M | 97.7 | Very high | 96.7 | Very high | 81 Ų | 81 | 66.6 Ų | 66.6 | 40% | 0.399 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.5 | -40.5 | 179.1 | -167.6 | 61.6 | 65.1 | 0 | 0 | 111.9 | I126 I130 V142 I144 G148 S150 | I126-M146 HydrophobicContact CG2-CB 4.29Å; I126-M146 HydrophobicContact CG2-CG 4.3Å; I130-M146 HydrophobicContact CD1-CB 3.99Å; I130-M146 HydrophobicContact CD1-CG 4Å; I130-M146 HydrophobicContact CG1-CG 4.48Å; V142-M146 VanDerWaalsContact O-CB 3.28Å; V142-M146 WeakPolarHBondContact O-CB 3.45Å; V142-M146 PolarHBondContact O-N 2.83Å; I144-M146 PolarHBondContact O-N 2.87Å; M146-G148 VanDerWaalsContact C-N 3.33Å; M146-G148 PolarHBondContact O-N 3.46Å; M146-S150 VanDerWaalsContact O-CB 3.26Å; M146-S150 WeakPolarHBondContact O-CB 3.41Å; M146-S150 PolarHBondContact O-N 2.93Å; M146-S150 PolarHBondContact O-OG 3.18Å |
| 147 | S | 97.5 | Very high | 96.8 | Very high | 17 Ų | 17 | 63.6 Ų | 63.6 | 12% | 0.119 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 175.8 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | V143 I144 A145 K151 | V143-S147 VanDerWaalsContact O-CB 3.29Å; V143-S147 WeakPolarHBondContact O-CB 3.42Å; V143-S147 PolarHBondContact O-N 3.43Å; V143-S147 PolarHBondContact O-OG 2.99Å; I144-S147 PolarHBondContact O-N 2.87Å; A145-S147 VanDerWaalsContact C-N 3.34Å; A145-S147 PolarHBondContact O-N 3.48Å; S147-K151 WeakPolarHBondContact O-CB 3.33Å; S147-K151 PolarHBondContact O-N 2.83Å |
| 148 | G | 97 | Very high | 96.8 | Very high | 36 Ų | 36 | 61.2 Ų | 61.2 | 37% | 0.371 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.7 | -51.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | I144 A145 M146 S150 K151 V152 | I144-G148 PolarHBondContact O-N 3.29Å; A145-G148 PolarHBondContact O-N 3.36Å; M146-G148 VanDerWaalsContact C-N 3.33Å; M146-G148 PolarHBondContact O-N 3.46Å; G148-S150 VanDerWaalsContact C-N 3.3Å; G148-S150 PolarHBondContact O-N 3.48Å; G148-K151 WeakPolarHBondContact O-CB 3.31Å; G148-K151 PolarHBondContact O-N 3.46Å; G148-K151 VanDerWaalsContact O-N 3.09Å; G148-V152 WeakPolarHBondContact O-CG2 3.42Å; G148-V152 PolarHBondContact O-N 3.06Å |
| 149 | I | 96 | Very high | 96.7 | Very high | 114 Ų | 114 | 66.3 Ų | 66.3 | 59% | 0.585 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -60.5 | -42.2 | 178 | -64 | 163.7 | 0 | 0 | 0 | 110.6 | A145 K151 V152 F153 | A145-I149 WeakPolarHBondContact O-CG1 3.15Å; A145-I149 PolarHBondContact O-N 3.4Å; I149-K151 VanDerWaalsContact C-N 3.29Å; I149-K151 PolarHBondContact O-N 3.24Å; I149-V152 PolarHBondContact O-N 2.99Å; I149-F153 WeakPolarHBondContact O-CB 3.37Å; I149-F153 PolarHBondContact O-N 3.36Å |
| 150 | S | 96.9 | Very high | 96.7 | Very high | 36 Ų | 36 | 63.7 Ų | 63.7 | 25% | 0.252 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.1 | -35.2 | 176.9 | -57.6 | 0 | 0 | 0 | 0 | 112.3 | M146 G148 A154 | M146-S150 VanDerWaalsContact O-CB 3.26Å; M146-S150 WeakPolarHBondContact O-CB 3.41Å; M146-S150 PolarHBondContact O-N 2.93Å; M146-S150 PolarHBondContact O-OG 3.18Å; G148-S150 VanDerWaalsContact C-N 3.3Å; G148-S150 PolarHBondContact O-N 3.48Å; S150-A154 WeakPolarHBondContact O-CB 3.22Å; S150-A154 PolarHBondContact O-N 3.48Å |
| 151 | K | 96.7 | Very high | 96.8 | Very high | 58 Ų | 58 | 57.7 Ų | 57.7 | 25% | 0.252 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -68.9 | -43.8 | 177.5 | -178.7 | 175.9 | 179.5 | 172.6 | 0 | 111 | Y116 S119 F121 S147 G148 I149 F153 A154 G155 | Y116-K151 PolarHBondContact O-NZ 2.68Å; S119-K151 WeakPolarHBondContact O-CE 3.36Å; S119-K151 PolarHBondContact O-NZ 3.3Å; S119-K151 WeakPolarHBondContact OG-CE 3.47Å; S119-K151 PolarHBondContact OG-NZ 3.41Å; F121-K151 HydrophobicContact CE2-CB 4.36Å; S147-K151 WeakPolarHBondContact O-CB 3.33Å; S147-K151 PolarHBondContact O-N 2.83Å; G148-K151 WeakPolarHBondContact O-CB 3.31Å; G148-K151 PolarHBondContact O-N 3.46Å; G148-K151 VanDerWaalsContact O-N 3.09Å; I149-K151 VanDerWaalsContact C-N 3.29Å; I149-K151 PolarHBondContact O-N 3.24Å; K151-F153 VanDerWaalsContact C-N 3.33Å; K151-A154 PolarHBondContact O-N 3.39Å; K151-G155 PolarHBondContact O-N 2.91Å |
| 152 | V | 95.4 | Very high | 96.7 | Very high | 88 Ų | 88 | 55.9 Ų | 55.9 | 53% | 0.533 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58.6 | -48.9 | 174.7 | 175.8 | 0 | 0 | 0 | 0 | 109.9 | G148 I149 A154 G155 E156 | G148-V152 WeakPolarHBondContact O-CG2 3.42Å; G148-V152 PolarHBondContact O-N 3.06Å; I149-V152 PolarHBondContact O-N 2.99Å; V152-A154 VanDerWaalsContact C-N 3.35Å; V152-A154 PolarHBondContact O-N 2.98Å; V152-G155 WeakPolarHBondContact O-CA 3.23Å; V152-G155 PolarHBondContact O-N 2.92Å; V152-E156 HydrophobicContact CG1-CG 4.37Å; V152-E156 WeakPolarHBondContact O-CG 3.39Å; V152-E156 PolarHBondContact O-N 3.29Å |
| 153 | F | 95.6 | Very high | 96.7 | Very high | 92 Ų | 92 | 55.8 Ų | 55.8 | 40% | 0.404 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -57.5 | -43.9 | 177.6 | 177.7 | -105.6 | 0 | 0 | 0 | 113.3 | I149 K151 G155 I157 I192 | I149-F153 WeakPolarHBondContact O-CB 3.37Å; I149-F153 PolarHBondContact O-N 3.36Å; K151-F153 VanDerWaalsContact C-N 3.33Å; F153-G155 VanDerWaalsContact C-N 3.34Å; F153-I157 HydrophobicContact CD1-CD1 3.91Å; F153-I157 HydrophobicContact CD2-CD1 4.32Å; F153-I157 HydrophobicContact CE1-CD1 3.4Å; F153-I157 VanDerWaalsContact CE1-CD1 3.4Å; F153-I157 HydrophobicContact CE2-CD1 3.87Å; F153-I157 HydrophobicContact CG-CD1 4.36Å; F153-I157 HydrophobicContact CZ-CD1 3.4Å; F153-I157 WeakPolarHBondContact O-CG1 3.29Å; F153-I157 PolarHBondContact O-N 3.32Å; F153-I192 HydrophobicContact CD2-CD1 4.46Å; F153-I192 HydrophobicContact CD2-CG1 4.4Å; F153-I192 HydrophobicContact CE2-CD1 3.67Å; F153-I192 HydrophobicContact CE2-CG1 3.89Å; F153-I192 HydrophobicContact CE2-CG2 3.97Å; F153-I192 HydrophobicContact CZ-CD1 4.41Å |
| 154 | A | 96.1 | Very high | 96.6 | Very high | 40 Ų | 40 | 55.6 Ų | 55.6 | 33% | 0.331 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.7 | -39.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | S150 K151 V152 I157 V158 | S150-A154 WeakPolarHBondContact O-CB 3.22Å; S150-A154 PolarHBondContact O-N 3.48Å; K151-A154 PolarHBondContact O-N 3.39Å; V152-A154 VanDerWaalsContact C-N 3.35Å; V152-A154 PolarHBondContact O-N 2.98Å; A154-I157 PolarHBondContact O-N 3.11Å; A154-V158 VanDerWaalsContact O-CG2 3.3Å; A154-V158 WeakPolarHBondContact O-CG2 3.44Å; A154-V158 PolarHBondContact O-N 3.42Å |
| 155 | G | 95.9 | Very high | 96.6 | Very high | 24 Ų | 24 | 51.9 Ų | 51.9 | 25% | 0.247 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.5 | -52.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | K151 V152 F153 I157 V158 E159 | K151-G155 PolarHBondContact O-N 2.91Å; V152-G155 WeakPolarHBondContact O-CA 3.23Å; V152-G155 PolarHBondContact O-N 2.92Å; F153-G155 VanDerWaalsContact C-N 3.34Å; G155-I157 VanDerWaalsContact C-N 3.27Å; G155-I157 PolarHBondContact O-N 2.7Å; G155-V158 PolarHBondContact O-N 3.25Å; G155-V158 VanDerWaalsContact O-N 3.07Å; G155-E159 WeakPolarHBondContact O-CG 3.28Å; G155-E159 PolarHBondContact O-N 3.42Å |
| 156 | E | 95.2 | Very high | 96.5 | Very high | 79 Ų | 79 | 56.7 Ų | 56.7 | 37% | 0.369 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.2 | -41.5 | 178.8 | -69.4 | 173.8 | 163.5 | 0 | 0 | 112.2 | V152 E160 L186 | V152-E156 HydrophobicContact CG1-CG 4.37Å; V152-E156 WeakPolarHBondContact O-CG 3.39Å; V152-E156 PolarHBondContact O-N 3.29Å; E156-E160 PolarHBondContact O-N 3.08Å; E156-E160 VanDerWaalsContact O-N 3.08Å; E156-L186 HydrophobicContact CB-CD1 4.49Å |
| 157 | I | 96.6 | Very high | 96.4 | Very high | 14 Ų | 14 | 58.6 Ų | 58.6 | 7% | 0.072 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.4 | -44.2 | 177.2 | -67.8 | 170.7 | 0 | 0 | 0 | 111.3 | F153 A154 G155 A161 M179 A182 V183 L186 | F153-I157 HydrophobicContact CD1-CD1 3.91Å; F153-I157 HydrophobicContact CD2-CD1 4.32Å; F153-I157 HydrophobicContact CE1-CD1 3.4Å; F153-I157 VanDerWaalsContact CE1-CD1 3.4Å; F153-I157 HydrophobicContact CE2-CD1 3.87Å; F153-I157 HydrophobicContact CG-CD1 4.36Å; F153-I157 HydrophobicContact CZ-CD1 3.4Å; F153-I157 WeakPolarHBondContact O-CG1 3.29Å; F153-I157 PolarHBondContact O-N 3.32Å; A154-I157 PolarHBondContact O-N 3.11Å; G155-I157 VanDerWaalsContact C-N 3.27Å; G155-I157 PolarHBondContact O-N 2.7Å; I157-A161 WeakPolarHBondContact O-CB 3.39Å; I157-A161 PolarHBondContact O-N 3.45Å; I157-M179 HydrophobicContact CG2-CE 3.5Å; I157-M179 VanDerWaalsContact CG2-CE 3.5Å; I157-M179 HydrophobicContact CG2-SD 4.22Å; I157-A182 HydrophobicContact CG2-CB 4.44Å; I157-V183 HydrophobicContact CD1-CG2 3.86Å; I157-V183 HydrophobicContact CG1-CG2 4.08Å; I157-V183 HydrophobicContact CG2-CG2 4.02Å; I157-L186 HydrophobicContact CB-CD1 4.46Å; I157-L186 HydrophobicContact CG1-CD1 3.83Å |
| 158 | V | 96.8 | Very high | 96.3 | Very high | 62 Ų | 62 | 63.4 Ų | 63.4 | 38% | 0.376 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -67.5 | -40.2 | -178.6 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | A154 G155 A161 L162 L174 M179 | A154-V158 VanDerWaalsContact O-CG2 3.3Å; A154-V158 WeakPolarHBondContact O-CG2 3.44Å; A154-V158 PolarHBondContact O-N 3.42Å; G155-V158 PolarHBondContact O-N 3.25Å; G155-V158 VanDerWaalsContact O-N 3.07Å; V158-A161 PolarHBondContact O-N 3.48Å; V158-L162 HydrophobicContact CG1-CD1 4.28Å; V158-L162 WeakPolarHBondContact O-CG 3.33Å; V158-L162 PolarHBondContact O-N 3.41Å; V158-L174 HydrophobicContact CG1-CD1 4.11Å; V158-M179 HydrophobicContact CG2-CE 4.4Å |
| 159 | E | 95.6 | Very high | 96.3 | Very high | 130 Ų | 130 | 64.9 Ų | 64.9 | 61% | 0.607 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.6 | -51.7 | 174.9 | -73 | 175.3 | -166.5 | 0 | 0 | 111.2 | G155 A161 L162 D163 | G155-E159 WeakPolarHBondContact O-CG 3.28Å; G155-E159 PolarHBondContact O-N 3.42Å; E159-A161 VanDerWaalsContact C-N 3.25Å; E159-A161 PolarHBondContact O-N 2.87Å; E159-L162 PolarHBondContact O-N 2.96Å; E159-D163 PolarHBondContact O-N 3.29Å |
| 160 | E | 97 | Very high | 96.2 | Very high | 15 Ų | 15 | 62.1 Ų | 62.1 | 7% | 0.07 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -65.9 | -29.6 | 177.2 | -175.7 | 71.2 | -151.4 | 0 | 0 | 111.7 | E156 D163 V164 A182 R185 L186 R189 | E156-E160 PolarHBondContact O-N 3.08Å; E156-E160 VanDerWaalsContact O-N 3.08Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.29Å; E160-D163 PolarHBondContact O-N 2.96Å; E160-V164 VanDerWaalsContact O-CG2 3.24Å; E160-V164 WeakPolarHBondContact O-CG2 3.43Å; E160-V164 PolarHBondContact O-N 2.68Å; E160-A182 HydrophobicContact CB-CB 3.97Å; E160-A182 HydrophobicContact CG-CB 3.93Å; E160-R185 HydrophobicContact CG-CB 4.28Å; E160-R185 WeakPolarHBondContact OE1-CD 3.39Å; E160-R185 IonicContact OE1-NE 3.75Å; E160-R185 IonicContact OE1-NH1 3.75Å; E160-R185 PolarHBondContact OE1-NH1 3.09Å; E160-L186 HydrophobicContact CB-CD1 4.31Å; E160-L186 HydrophobicContact CB-CD2 4.27Å; E160-L186 HydrophobicContact CB-CG 4.23Å; E160-L186 HydrophobicContact CG-CD2 4.46Å; E160-L186 HydrophobicContact CG-CG 4.27Å; E160-R189 IonicContact OE1-CZ 3.01Å; E160-R189 IonicContact OE1-NH1 3.89Å; E160-R189 IonicContact OE1-NH2 3.89Å; E160-R189 PolarHBondContact OE1-NH2 3.38Å; E160-R189 IonicContact OE2-CZ 2.9Å; E160-R189 IonicContact OE2-NH1 3.01Å; E160-R189 PolarHBondContact OE2-NH1 2.91Å; E160-R189 IonicContact OE2-NH2 3.77Å; E160-R189 PolarHBondContact OE2-NH2 2.88Å |
| 161 | A | 97.8 | Very high | 95.9 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -69.4 | -36.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I157 V158 E159 V164 C165 L174 H178 M179 A182 | I157-A161 WeakPolarHBondContact O-CB 3.39Å; I157-A161 PolarHBondContact O-N 3.45Å; V158-A161 PolarHBondContact O-N 3.48Å; E159-A161 VanDerWaalsContact C-N 3.25Å; E159-A161 PolarHBondContact O-N 2.87Å; A161-V164 PolarHBondContact O-N 3.47Å; A161-C165 WeakPolarHBondContact O-CB 3.47Å; A161-C165 PolarHBondContact O-N 2.76Å; A161-L174 HydrophobicContact CB-CD1 3.93Å; A161-L174 HydrophobicContact CB-CD2 4.05Å; A161-L174 WeakPolarHBondContact O-CD2 3.42Å; A161-H178 HydrophobicContact CB-CB 4.32Å; A161-M179 HydrophobicContact CB-SD 3.65Å; A161-A182 HydrophobicContact CB-CB 3.86Å |
| 162 | L | 96.4 | Very high | 95.5 | Very high | 84 Ų | 84 | 67.9 Ų | 67.9 | 44% | 0.44 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 172.2 | -72.2 | 168.5 | 0 | 0 | 0 | 110.6 | V158 E159 V164 C165 E166 L174 | V158-L162 HydrophobicContact CG1-CD1 4.28Å; V158-L162 WeakPolarHBondContact O-CG 3.33Å; V158-L162 PolarHBondContact O-N 3.41Å; E159-L162 PolarHBondContact O-N 2.96Å; L162-V164 VanDerWaalsContact C-N 3.32Å; L162-V164 PolarHBondContact O-N 2.9Å; L162-C165 WeakPolarHBondContact O-CB 3.14Å; L162-C165 PolarHBondContact O-N 2.98Å; L162-C165 VanDerWaalsContact O-N 3.16Å; L162-E166 PolarHBondContact O-N 3.21Å; L162-L174 HydrophobicContact CD2-CD1 4.28Å; L162-L174 HydrophobicContact CD2-CD2 3.93Å; L162-L174 HydrophobicContact CD2-CG 4.17Å; L162-L174 HydrophobicContact CG-CD1 4.29Å; L162-L174 HydrophobicContact CG-CD2 4.34Å |
| 163 | D | 96.6 | Very high | 95.5 | Very high | 63 Ų | 63 | 68.7 Ų | 68.7 | 34% | 0.337 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -55.9 | -43.3 | 172.6 | -106.5 | 43.6 | 0 | 0 | 0 | 112.8 | E159 E160 K167 | E159-D163 PolarHBondContact O-N 3.29Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.29Å; E160-D163 PolarHBondContact O-N 2.96Å; D163-K167 VanDerWaalsContact O-CB 3.3Å; D163-K167 WeakPolarHBondContact O-CB 3.3Å; D163-K167 VanDerWaalsContact O-CD 3.29Å; D163-K167 WeakPolarHBondContact O-CD 3.34Å; D163-K167 WeakPolarHBondContact O-CG 3.48Å; D163-K167 PolarHBondContact O-N 3.43Å; D163-K167 IonicContact OD2-NZ 3.26Å; D163-K167 PolarHBondContact OD2-NZ 3.45Å |
| 164 | V | 97 | Very high | 95.6 | Very high | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.5 | -45.7 | 175.8 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | E160 A161 L162 E166 K167 W168 H178 E181 | E160-V164 VanDerWaalsContact O-CG2 3.24Å; E160-V164 WeakPolarHBondContact O-CG2 3.43Å; E160-V164 PolarHBondContact O-N 2.68Å; A161-V164 PolarHBondContact O-N 3.47Å; L162-V164 VanDerWaalsContact C-N 3.32Å; L162-V164 PolarHBondContact O-N 2.9Å; V164-E166 PolarHBondContact O-N 2.92Å; V164-K167 PolarHBondContact O-N 3.3Å; V164-W168 HydrophobicContact CG1-CD2 3.84Å; V164-W168 HydrophobicContact CG1-CE3 4.07Å; V164-W168 HydrophobicContact CG1-CG 4.4Å; V164-W168 HydrophobicContact CG1-CH2 4.19Å; V164-W168 HydrophobicContact CG1-CZ2 3.97Å; V164-W168 HydrophobicContact CG1-CZ3 4.25Å; V164-W168 WeakPolarHBondContact O-CB 3.44Å; V164-W168 PolarHBondContact O-N 3.05Å; V164-H178 HydrophobicContact CG1-CB 4.41Å; V164-E181 HydrophobicContact CB-CG 4.45Å; V164-E181 HydrophobicContact CG1-CB 4.06Å; V164-E181 HydrophobicContact CG1-CG 3.75Å; V164-E181 HydrophobicContact CG2-CB 4.35Å; V164-E181 HydrophobicContact CG2-CG 3.74Å |
| 165 | C | 96.5 | Very high | 95.6 | Very high | 4 Ų | 4 | 69.4 Ų | 69.4 | 3% | 0.027 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -57.2 | -49.7 | 179.4 | -165.6 | 0 | 0 | 0 | 0 | 110.6 | A161 L162 W168 G169 D170 L174 H178 | A161-C165 WeakPolarHBondContact O-CB 3.47Å; A161-C165 PolarHBondContact O-N 2.76Å; L162-C165 WeakPolarHBondContact O-CB 3.14Å; L162-C165 PolarHBondContact O-N 2.98Å; L162-C165 VanDerWaalsContact O-N 3.16Å; C165-W168 PolarHBondContact O-N 3.08Å; C165-G169 PolarHBondContact O-N 2.94Å; C165-D170 PolarHBondContact O-N 3.43Å; C165-D170 PolarHBondContact SG-O 2.9Å; C165-L174 HydrophobicContact CB-CD2 3.95Å; C165-H178 PolarHBondContact SG-CE1 3.17Å |
| 166 | E | 96.2 | Very high | 95.7 | Very high | 154 Ų | 154 | 72.3 Ų | 72.3 | 72% | 0.72 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -62.9 | -46.5 | 178 | -175.3 | 178.7 | -168.6 | 0 | 0 | 111.9 | L162 V164 W168 G169 | L162-E166 PolarHBondContact O-N 3.21Å; V164-E166 PolarHBondContact O-N 2.92Å; E166-W168 PolarHBondContact O-N 3.36Å; E166-G169 PolarHBondContact O-N 3.35Å |
| 167 | K | 96 | Very high | 95.7 | Very high | 121 Ų | 121 | 72.1 Ų | 72.1 | 53% | 0.526 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.7 | -25.5 | 178.4 | -75.3 | 165.4 | -174.9 | 148.2 | 0 | 113.2 | D163 V164 | D163-K167 VanDerWaalsContact O-CB 3.3Å; D163-K167 WeakPolarHBondContact O-CB 3.3Å; D163-K167 VanDerWaalsContact O-CD 3.29Å; D163-K167 WeakPolarHBondContact O-CD 3.34Å; D163-K167 WeakPolarHBondContact O-CG 3.48Å; D163-K167 PolarHBondContact O-N 3.43Å; D163-K167 IonicContact OD2-NZ 3.26Å; D163-K167 PolarHBondContact OD2-NZ 3.45Å; V164-K167 PolarHBondContact O-N 3.3Å |
| 168 | W | 96.1 | Very high | 95.8 | Very high | 117 Ų | 117 | 71.5 Ų | 71.5 | 44% | 0.443 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -4.5 | 176.8 | -70 | 1.2 | 0 | 0 | 0 | 113.1 | V164 C165 E166 D170 K177 H178 E181 | V164-W168 HydrophobicContact CG1-CD2 3.84Å; V164-W168 HydrophobicContact CG1-CE3 4.07Å; V164-W168 HydrophobicContact CG1-CG 4.4Å; V164-W168 HydrophobicContact CG1-CH2 4.19Å; V164-W168 HydrophobicContact CG1-CZ2 3.97Å; V164-W168 HydrophobicContact CG1-CZ3 4.25Å; V164-W168 WeakPolarHBondContact O-CB 3.44Å; V164-W168 PolarHBondContact O-N 3.05Å; C165-W168 PolarHBondContact O-N 3.08Å; E166-W168 PolarHBondContact O-N 3.36Å; W168-D170 PolarHBondContact O-N 3.05Å; W168-K177 HydrophobicContact CE3-CD 4.47Å; W168-K177 HydrophobicContact CZ3-CB 4.24Å; W168-K177 HydrophobicContact CZ3-CD 4Å; W168-K177 HydrophobicContact CZ3-CG 3.93Å; W168-H178 AromaticContact CE3-CD2 3.71Å; W168-H178 AromaticContact CE3-NE2 3.98Å; W168-H178 AromaticContact CZ3-CD2 3.9Å; W168-E181 HydrophobicContact CH2-CB 4.13Å; W168-E181 HydrophobicContact CH2-CG 4.17Å; W168-E181 HydrophobicContact CZ2-CB 4.32Å; W168-E181 HydrophobicContact CZ2-CG 3.85Å |
| 169 | G | 95.4 | Very high | 95.8 | Very high | 68 Ų | 68 | 71.7 Ų | 71.7 | 70% | 0.701 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.7 | 14.3 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | C165 E166 | C165-G169 PolarHBondContact O-N 2.94Å; E166-G169 PolarHBondContact O-N 3.35Å |
| 170 | D | 94.8 | Very high | 95.8 | Very high | 55 Ų | 55 | 73.4 Ų | 73.4 | 29% | 0.294 | 39% | 0.388 | S | S | . | . | P | Polyproline II helix | trans | -80.9 | 142.2 | 175 | -76.1 | -40.7 | 0 | 0 | 0 | 109.1 | C165 W168 K177 H178 | C165-D170 PolarHBondContact O-N 3.43Å; C165-D170 PolarHBondContact SG-O 2.9Å; W168-D170 PolarHBondContact O-N 3.05Å; D170-K177 IonicContact OD1-NZ 3.54Å; D170-K177 WeakPolarHBondContact OD2-CE 3.37Å; D170-K177 IonicContact OD2-NZ 2.69Å; D170-K177 PolarHBondContact OD2-NZ 3.06Å; D170-H178 IonicContact OD2-CE1 2.79Å; D170-H178 IonicContact OD2-NE2 3.43Å; D170-H178 PolarHBondContact OD2-NE2 3.33Å |
| 171 | T | 91.2 | Very high | 95.8 | Very high | 120 Ų | 120 | 74.1 Ų | 74.1 | 74% | 0.736 | 39% | 0.392 | S | S | * | . | P | Polyproline II helix | trans | -92.1 | 150.5 | 172.5 | 39.6 | 0 | 0 | 0 | 0 | 111.3 | ||
| 172 | P | 88.5 | Confident | 95.8 | Very high | 95 Ų | 95 | 74.1 Ų | 74.1 | 62% | 0.617 | 39% | 0.392 | S | S | * | . | S | Bend | trans | -52.3 | 146.2 | 171 | -24.4 | 33.7 | 0 | 0 | 0 | 111.1 | ||
| 173 | P | 94.8 | Very high | 95.7 | Very high | 106 Ų | 106 | 71.9 Ų | 71.9 | 69% | 0.688 | 38% | 0.381 | S | S | * | . | S | Bend | cis | -84.4 | 154.6 | 18.9 | 31.6 | -35.7 | 0 | 0 | 0 | 115.2 | Q175 | P173-Q175 PolarHBondContact O-N 3.25Š|
| 174 | L | 96.6 | Very high | 95.6 | Very high | 53 Ų | 53 | 75 Ų | 75 | 28% | 0.277 | 39% | 0.388 | S | S | . | . | P | Polyproline II helix | trans | -59.8 | 121.9 | 175.5 | -69.8 | 178.7 | 0 | 0 | 0 | 111.2 | V158 A161 L162 C165 H178 M179 | V158-L174 HydrophobicContact CG1-CD1 4.11Å; A161-L174 HydrophobicContact CB-CD1 3.93Å; A161-L174 HydrophobicContact CB-CD2 4.05Å; A161-L174 WeakPolarHBondContact O-CD2 3.42Å; L162-L174 HydrophobicContact CD2-CD1 4.28Å; L162-L174 HydrophobicContact CD2-CD2 3.93Å; L162-L174 HydrophobicContact CD2-CG 4.17Å; L162-L174 HydrophobicContact CG-CD1 4.29Å; L162-L174 HydrophobicContact CG-CD2 4.34Å; C165-L174 HydrophobicContact CB-CD2 3.95Å; L174-H178 HydrophobicContact CD2-CB 4.21Å; L174-M179 HydrophobicContact CD1-SD 4.18Å |
| 175 | Q | 96.6 | Very high | 95.5 | Very high | 93 Ų | 93 | 77 Ų | 77 | 44% | 0.435 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -89.7 | 158.7 | 177.2 | -65.6 | -171.7 | -24.6 | 0 | 0 | 111.3 | P173 K177 H178 M179 | P173-Q175 PolarHBondContact O-N 3.25Å; Q175-K177 HydrophobicContact CB-CG 3.94Å; Q175-K177 PolarHBondContact O-N 3.39Å; Q175-K177 VanDerWaalsContact OE1-NZ 3.1Å; Q175-H178 PolarHBondContact N-ND1 2.93Å; Q175-H178 VanDerWaalsContact N-ND1 3.16Å; Q175-H178 WeakPolarHBondContact O-CB 3.4Å; Q175-H178 PolarHBondContact O-N 3.5Å; Q175-M179 PolarHBondContact O-N 3.16Å |
| 176 | P | 97.2 | Very high | 95.4 | Very high | 86 Ų | 86 | 77 Ų | 77 | 56% | 0.558 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -54.8 | -28.4 | 175.8 | -28.1 | 35.7 | 0 | 0 | 0 | 114.2 | R180 | P176-R180 VanDerWaalsContact CB-NH1 3.3Å; P176-R180 WeakPolarHBondContact O-CG 3.26Å; P176-R180 PolarHBondContact O-N 3.36Å; P176-R180 VanDerWaalsContact O-N 3.08Å |
| 177 | K | 96.6 | Very high | 95.1 | Very high | 75 Ų | 75 | 74.4 Ų | 74.4 | 33% | 0.326 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 175 | 67.3 | -177.3 | -163.9 | -170.1 | 0 | 112.2 | W168 D170 Q175 E181 | W168-K177 HydrophobicContact CE3-CD 4.47Å; W168-K177 HydrophobicContact CZ3-CB 4.24Å; W168-K177 HydrophobicContact CZ3-CD 4Å; W168-K177 HydrophobicContact CZ3-CG 3.93Å; D170-K177 IonicContact OD1-NZ 3.54Å; D170-K177 WeakPolarHBondContact OD2-CE 3.37Å; D170-K177 IonicContact OD2-NZ 2.69Å; D170-K177 PolarHBondContact OD2-NZ 3.06Å; Q175-K177 HydrophobicContact CB-CG 3.94Å; Q175-K177 PolarHBondContact O-N 3.39Å; Q175-K177 VanDerWaalsContact OE1-NZ 3.1Å; K177-E181 WeakPolarHBondContact O-CB 3.26Å; K177-E181 PolarHBondContact O-N 3.15Å; K177-E181 VanDerWaalsContact O-N 3.11Å |
| 178 | H | 97.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -67.7 | -45.9 | 177.9 | -51.5 | 150.6 | 0 | 0 | 0 | 110.9 | A161 V164 C165 W168 D170 L174 Q175 R180 E181 A182 | A161-H178 HydrophobicContact CB-CB 4.32Å; V164-H178 HydrophobicContact CG1-CB 4.41Å; C165-H178 PolarHBondContact SG-CE1 3.17Å; W168-H178 AromaticContact CE3-CD2 3.71Å; W168-H178 AromaticContact CE3-NE2 3.98Å; W168-H178 AromaticContact CZ3-CD2 3.9Å; D170-H178 IonicContact OD2-CE1 2.79Å; D170-H178 IonicContact OD2-NE2 3.43Å; D170-H178 PolarHBondContact OD2-NE2 3.33Å; L174-H178 HydrophobicContact CD2-CB 4.21Å; Q175-H178 PolarHBondContact N-ND1 2.93Å; Q175-H178 VanDerWaalsContact N-ND1 3.16Å; Q175-H178 WeakPolarHBondContact O-CB 3.4Å; Q175-H178 PolarHBondContact O-N 3.5Å; H178-R180 PolarHBondContact O-N 3.49Å; H178-E181 PolarHBondContact O-N 2.85Å; H178-A182 WeakPolarHBondContact O-CB 3.35Å; H178-A182 PolarHBondContact O-N 3.26Å |
| 179 | M | 97.2 | Very high | 94.6 | Very high | 67 Ų | 67 | 72.8 Ų | 72.8 | 33% | 0.33 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 179.7 | -64.1 | -62.8 | -72.6 | 0 | 0 | 112.2 | I157 V158 A161 L174 Q175 A182 V183 | I157-M179 HydrophobicContact CG2-CE 3.5Å; I157-M179 VanDerWaalsContact CG2-CE 3.5Å; I157-M179 HydrophobicContact CG2-SD 4.22Å; V158-M179 HydrophobicContact CG2-CE 4.4Å; A161-M179 HydrophobicContact CB-SD 3.65Å; L174-M179 HydrophobicContact CD1-SD 4.18Å; Q175-M179 PolarHBondContact O-N 3.16Å; M179-A182 PolarHBondContact O-N 2.99Å; M179-V183 WeakPolarHBondContact O-CG2 3.38Å; M179-V183 PolarHBondContact O-N 3.43Å; M179-V183 VanDerWaalsContact O-N 3.12Å |
| 180 | R | 96.8 | Very high | 94 | Very high | 165 Ų | 165 | 76.8 Ų | 76.8 | 62% | 0.623 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -65.4 | -42.6 | 177.6 | -73.9 | -172.3 | -63.8 | -97.9 | 3.7 | 112 | P176 H178 V183 R184 | P176-R180 VanDerWaalsContact CB-NH1 3.3Å; P176-R180 WeakPolarHBondContact O-CG 3.26Å; P176-R180 PolarHBondContact O-N 3.36Å; P176-R180 VanDerWaalsContact O-N 3.08Å; H178-R180 PolarHBondContact O-N 3.49Å; R180-V183 PolarHBondContact O-N 3.49Å; R180-R184 PolarHBondContact O-N 3.35Å |
| 181 | E | 97 | Very high | 93.5 | Very high | 31 Ų | 31 | 79.4 Ų | 79.4 | 15% | 0.145 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66 | -40.4 | 177.5 | 175.9 | 58.2 | -164.6 | 0 | 0 | 111.7 | V164 W168 K177 H178 V183 R184 R185 | V164-E181 HydrophobicContact CB-CG 4.45Å; V164-E181 HydrophobicContact CG1-CB 4.06Å; V164-E181 HydrophobicContact CG1-CG 3.75Å; V164-E181 HydrophobicContact CG2-CB 4.35Å; V164-E181 HydrophobicContact CG2-CG 3.74Å; W168-E181 HydrophobicContact CH2-CB 4.13Å; W168-E181 HydrophobicContact CH2-CG 4.17Å; W168-E181 HydrophobicContact CZ2-CB 4.32Å; W168-E181 HydrophobicContact CZ2-CG 3.85Å; K177-E181 WeakPolarHBondContact O-CB 3.26Å; K177-E181 PolarHBondContact O-N 3.15Å; K177-E181 VanDerWaalsContact O-N 3.11Å; H178-E181 PolarHBondContact O-N 2.85Å; E181-V183 PolarHBondContact O-N 3.4Å; E181-R184 WeakPolarHBondContact O-CB 3.2Å; E181-R184 PolarHBondContact O-N 2.87Å; E181-R184 VanDerWaalsContact O-N 3.16Å; E181-R184 IonicContact OE1-CZ 3.49Å; E181-R184 IonicContact OE1-NE 3.5Å; E181-R184 PolarHBondContact OE1-NE 2.89Å; E181-R184 IonicContact OE1-NH2 2.68Å; E181-R184 PolarHBondContact OE1-NH2 2.96Å; E181-R184 IonicContact OE2-CZ 3.54Å; E181-R184 IonicContact OE2-NE 2.75Å; E181-R184 PolarHBondContact OE2-NE 3.17Å; E181-R184 IonicContact OE2-NH2 3.48Å; E181-R184 PolarHBondContact OE2-NH2 3.11Å; E181-R185 WeakPolarHBondContact O-CG 3.43Å; E181-R185 PolarHBondContact O-N 3.25Å; E181-R185 IonicContact OE1-CZ 3.74Å; E181-R185 IonicContact OE1-NE 2.7Å; E181-R185 PolarHBondContact OE1-NE 3.45Å; E181-R185 IonicContact OE1-NH2 3.45Å |
| 182 | A | 96.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 74.4 Ų | 74.4 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57 | -51.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I157 E160 A161 H178 M179 R184 R185 L186 | I157-A182 HydrophobicContact CG2-CB 4.44Å; E160-A182 HydrophobicContact CB-CB 3.97Å; E160-A182 HydrophobicContact CG-CB 3.93Å; A161-A182 HydrophobicContact CB-CB 3.86Å; H178-A182 WeakPolarHBondContact O-CB 3.35Å; H178-A182 PolarHBondContact O-N 3.26Å; M179-A182 PolarHBondContact O-N 2.99Å; A182-R184 VanDerWaalsContact C-N 3.28Å; A182-R184 PolarHBondContact O-N 3.03Å; A182-R185 PolarHBondContact O-N 3.36Å; A182-R185 VanDerWaalsContact O-N 3.14Å; A182-L186 WeakPolarHBondContact O-CG 3.4Å; A182-L186 PolarHBondContact O-N 3.12Å |
| 183 | V | 94.6 | Very high | 92.8 | Very high | 36 Ų | 36 | 75 Ų | 75 | 22% | 0.218 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.6 | -37.8 | 176.8 | 174.1 | 0 | 0 | 0 | 0 | 111.6 | I157 M179 R180 E181 K187 | I157-V183 HydrophobicContact CD1-CG2 3.86Å; I157-V183 HydrophobicContact CG1-CG2 4.08Å; I157-V183 HydrophobicContact CG2-CG2 4.02Å; M179-V183 WeakPolarHBondContact O-CG2 3.38Å; M179-V183 PolarHBondContact O-N 3.43Å; M179-V183 VanDerWaalsContact O-N 3.12Å; R180-V183 PolarHBondContact O-N 3.49Å; E181-V183 PolarHBondContact O-N 3.4Å; V183-K187 HydrophobicContact CG1-CD 4.05Å; V183-K187 HydrophobicContact CG1-CG 4.49Å; V183-K187 WeakPolarHBondContact O-CB 3.39Å; V183-K187 VanDerWaalsContact O-CG 3.28Å; V183-K187 WeakPolarHBondContact O-CG 3.37Å; V183-K187 PolarHBondContact O-N 2.96Å; V183-K187 VanDerWaalsContact O-N 3.08Å |
| 184 | R | 94.8 | Very high | 91.7 | Very high | 130 Ų | 130 | 74.3 Ų | 74.3 | 49% | 0.491 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 176.2 | -169.2 | -163.2 | 67.5 | 76.8 | -0.4 | 111.4 | R180 E181 A182 S188 | R180-R184 PolarHBondContact O-N 3.35Å; E181-R184 WeakPolarHBondContact O-CB 3.2Å; E181-R184 PolarHBondContact O-N 2.87Å; E181-R184 VanDerWaalsContact O-N 3.16Å; E181-R184 IonicContact OE1-CZ 3.49Å; E181-R184 IonicContact OE1-NE 3.5Å; E181-R184 PolarHBondContact OE1-NE 2.89Å; E181-R184 IonicContact OE1-NH2 2.68Å; E181-R184 PolarHBondContact OE1-NH2 2.96Å; E181-R184 IonicContact OE2-CZ 3.54Å; E181-R184 IonicContact OE2-NE 2.75Å; E181-R184 PolarHBondContact OE2-NE 3.17Å; E181-R184 IonicContact OE2-NH2 3.48Å; E181-R184 PolarHBondContact OE2-NH2 3.11Å; A182-R184 VanDerWaalsContact C-N 3.28Å; A182-R184 PolarHBondContact O-N 3.03Å; R184-S188 WeakPolarHBondContact O-CB 3.26Å; R184-S188 PolarHBondContact O-N 3.49Å; R184-S188 VanDerWaalsContact O-N 3.09Å; R184-S188 PolarHBondContact O-OG 2.9Å |
| 185 | R | 94.6 | Very high | 90.5 | Very high | 42 Ų | 42 | 77.8 Ų | 77.8 | 16% | 0.158 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -66.2 | -48.4 | 178.3 | -70.9 | -179.1 | -178.9 | -171.1 | 2.2 | 112.1 | E160 E181 A182 K187 S188 R189 | E160-R185 HydrophobicContact CG-CB 4.28Å; E160-R185 WeakPolarHBondContact OE1-CD 3.39Å; E160-R185 IonicContact OE1-NE 3.75Å; E160-R185 IonicContact OE1-NH1 3.75Å; E160-R185 PolarHBondContact OE1-NH1 3.09Å; E181-R185 WeakPolarHBondContact O-CG 3.43Å; E181-R185 PolarHBondContact O-N 3.25Å; E181-R185 IonicContact OE1-CZ 3.74Å; E181-R185 IonicContact OE1-NE 2.7Å; E181-R185 PolarHBondContact OE1-NE 3.45Å; E181-R185 IonicContact OE1-NH2 3.45Å; A182-R185 PolarHBondContact O-N 3.36Å; A182-R185 VanDerWaalsContact O-N 3.14Å; R185-K187 VanDerWaalsContact C-N 3.3Å; R185-K187 PolarHBondContact O-N 3.28Å; R185-S188 WeakPolarHBondContact O-CB 3.31Å; R185-S188 PolarHBondContact O-N 3.34Å; R185-R189 WeakPolarHBondContact O-CG 3.5Å; R185-R189 PolarHBondContact O-N 3.21Å |
| 186 | L | 93.4 | Very high | 89.1 | Confident | 4 Ų | 4 | 81 Ų | 81 | 2% | 0.021 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -59.5 | -39.7 | 179 | -69 | 173 | 0 | 0 | 0 | 112.2 | E156 I157 E160 A182 R189 E190 Q191 I192 | E156-L186 HydrophobicContact CB-CD1 4.49Å; I157-L186 HydrophobicContact CB-CD1 4.46Å; I157-L186 HydrophobicContact CG1-CD1 3.83Å; E160-L186 HydrophobicContact CB-CD1 4.31Å; E160-L186 HydrophobicContact CB-CD2 4.27Å; E160-L186 HydrophobicContact CB-CG 4.23Å; E160-L186 HydrophobicContact CG-CD2 4.46Å; E160-L186 HydrophobicContact CG-CG 4.27Å; A182-L186 WeakPolarHBondContact O-CG 3.4Å; A182-L186 PolarHBondContact O-N 3.12Å; L186-R189 PolarHBondContact O-N 3.12Å; L186-E190 PolarHBondContact O-N 3.19Å; L186-Q191 HydrophobicContact CD2-CB 4.35Å; L186-Q191 PolarHBondContact O-N 3.39Å; L186-I192 HydrophobicContact CB-CD1 3.42Å; L186-I192 VanDerWaalsContact CB-CD1 3.42Å; L186-I192 HydrophobicContact CB-CG1 3.85Å; L186-I192 HydrophobicContact CD1-CD1 3.77Å; L186-I192 HydrophobicContact CG-CD1 4.24Å; L186-I192 PolarHBondContact O-N 3.23Å |
| 187 | K | 91.4 | Very high | 87.7 | Confident | 99 Ų | 99 | 84.9 Ų | 84.9 | 43% | 0.43 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66 | -37.6 | 172.7 | -74.4 | 176.8 | 179.4 | 180 | 0 | 113.1 | V183 R185 R189 E190 I192 | V183-K187 HydrophobicContact CG1-CD 4.05Å; V183-K187 HydrophobicContact CG1-CG 4.49Å; V183-K187 WeakPolarHBondContact O-CB 3.39Å; V183-K187 VanDerWaalsContact O-CG 3.28Å; V183-K187 WeakPolarHBondContact O-CG 3.37Å; V183-K187 PolarHBondContact O-N 2.96Å; V183-K187 VanDerWaalsContact O-N 3.08Å; R185-K187 VanDerWaalsContact C-N 3.3Å; R185-K187 PolarHBondContact O-N 3.28Å; K187-R189 VanDerWaalsContact C-N 3.31Å; K187-E190 PolarHBondContact O-N 3.42Å; K187-I192 HydrophobicContact CG-CB 4.24Å; K187-I192 HydrophobicContact CG-CG2 4.42Å |
| 188 | S | 90.1 | Very high | 86.5 | Confident | 80 Ų | 80 | 87.4 Ų | 87.4 | 56% | 0.559 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -72 | -28 | 180 | -54.5 | 0 | 0 | 0 | 0 | 112.2 | R184 R185 E190 | R184-S188 WeakPolarHBondContact O-CB 3.26Å; R184-S188 PolarHBondContact O-N 3.49Å; R184-S188 VanDerWaalsContact O-N 3.09Å; R184-S188 PolarHBondContact O-OG 2.9Å; R185-S188 WeakPolarHBondContact O-CB 3.31Å; R185-S188 PolarHBondContact O-N 3.34Å; S188-E190 VanDerWaalsContact C-N 3.28Å |
| 189 | R | 91.1 | Very high | 85 | Confident | 123 Ų | 123 | 94.3 Ų | 94.3 | 46% | 0.464 | 45% | 0.453 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 4.6 | 173.8 | -63.8 | -178.5 | -169.4 | 154.9 | 12 | 113.5 | E160 R185 L186 K187 Q191 | E160-R189 IonicContact OE1-CZ 3.01Å; E160-R189 IonicContact OE1-NH1 3.89Å; E160-R189 IonicContact OE1-NH2 3.89Å; E160-R189 PolarHBondContact OE1-NH2 3.38Å; E160-R189 IonicContact OE2-CZ 2.9Å; E160-R189 IonicContact OE2-NH1 3.01Å; E160-R189 PolarHBondContact OE2-NH1 2.91Å; E160-R189 IonicContact OE2-NH2 3.77Å; E160-R189 PolarHBondContact OE2-NH2 2.88Å; R185-R189 WeakPolarHBondContact O-CG 3.5Å; R185-R189 PolarHBondContact O-N 3.21Å; L186-R189 PolarHBondContact O-N 3.12Å; K187-R189 VanDerWaalsContact C-N 3.31Å; R189-Q191 HydrophobicContact CB-CG 4.13Å; R189-Q191 PolarHBondContact O-N 3.46Å; R189-Q191 VanDerWaalsContact O-N 3.1Å |
| 190 | E | 83.7 | Confident | 84 | Confident | 152 Ų | 152 | 96.9 Ų | 96.9 | 71% | 0.71 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.7 | 20.5 | -176.8 | -52.7 | -169.3 | 150 | 0 | 0 | 114.7 | L186 K187 S188 | L186-E190 PolarHBondContact O-N 3.19Å; K187-E190 PolarHBondContact O-N 3.42Å; S188-E190 VanDerWaalsContact C-N 3.28Å |
| 191 | Q | 84.3 | Confident | 82.7 | Confident | 110 Ų | 110 | 95.7 Ų | 95.7 | 51% | 0.514 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -79.2 | -25.2 | 176.7 | -70.5 | 178.1 | -18.1 | 0 | 0 | 112 | L186 R189 | L186-Q191 HydrophobicContact CD2-CB 4.35Å; L186-Q191 PolarHBondContact O-N 3.39Å; R189-Q191 HydrophobicContact CB-CG 4.13Å; R189-Q191 PolarHBondContact O-N 3.46Å; R189-Q191 VanDerWaalsContact O-N 3.1Å |
| 192 | I | 85.7 | Confident | 81.3 | Confident | 15 Ų | 15 | 103 Ų | 103 | 8% | 0.077 | 50% | 0.504 | C | S | . | . | S | Bend | trans | -107.4 | 129.2 | 168.9 | -62.6 | 168.7 | 0 | 0 | 0 | 108.5 | F153 L186 K187 N194 | F153-I192 HydrophobicContact CD2-CD1 4.46Å; F153-I192 HydrophobicContact CD2-CG1 4.4Å; F153-I192 HydrophobicContact CE2-CD1 3.67Å; F153-I192 HydrophobicContact CE2-CG1 3.89Å; F153-I192 HydrophobicContact CE2-CG2 3.97Å; F153-I192 HydrophobicContact CZ-CD1 4.41Å; L186-I192 HydrophobicContact CB-CD1 3.42Å; L186-I192 VanDerWaalsContact CB-CD1 3.42Å; L186-I192 HydrophobicContact CB-CG1 3.85Å; L186-I192 HydrophobicContact CD1-CD1 3.77Å; L186-I192 HydrophobicContact CG-CD1 4.24Å; L186-I192 PolarHBondContact O-N 3.23Å; K187-I192 HydrophobicContact CG-CB 4.24Å; K187-I192 HydrophobicContact CG-CG2 4.42Å; I192-N194 PolarHBondContact O-N 3.33Å |
| 193 | P | 78.1 | Confident | 79.5 | Confident | 109 Ų | 109 | 114.5 Ų | 114.5 | 71% | 0.708 | 56% | 0.557 | S | S | * | * | trans | -56.2 | 132.1 | 177.8 | 18.8 | -29.1 | 0 | 0 | 0 | 111.5 | T195 | P193-T195 PolarHBondContact O-N 3.07Š| ||
| 194 | N | 72.1 | Confident | 78.8 | Confident | 91 Ų | 91 | 118.4 Ų | 118.4 | 49% | 0.487 | 57% | 0.574 | S | S | . | * | trans | -74.7 | 124.2 | -178.7 | -170.9 | -9.2 | 0 | 0 | 0 | 110.2 | I192 K196 | I192-N194 PolarHBondContact O-N 3.33Å; N194-K196 VanDerWaalsContact C-N 3.34Å; N194-K196 WeakPolarHBondContact OD1-CB 3.45Å; N194-K196 PolarHBondContact OD1-N 3.24Å | ||
| 195 | T | 70.4 | Confident | 77.9 | Confident | 126 Ų | 126 | 117.8 Ų | 117.8 | 77% | 0.773 | 58% | 0.578 | S | S | * | * | trans | -84.2 | -7.5 | 178.6 | 57.4 | 0 | 0 | 0 | 0 | 113.5 | P193 | P193-T195 PolarHBondContact O-N 3.07Š| ||
| 196 | K | 68 | Low | 77 | Confident | 161 Ų | 161 | 122 Ų | 122 | 70% | 0.7 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -79.8 | 123.5 | 175.4 | -61.4 | -174.6 | 179.5 | -175.2 | 0 | 109.6 | N194 K198 | N194-K196 VanDerWaalsContact C-N 3.34Å; N194-K196 WeakPolarHBondContact OD1-CB 3.45Å; N194-K196 PolarHBondContact OD1-N 3.24Å; K196-K198 PolarHBondContact O-N 3.06Å; K196-K198 VanDerWaalsContact O-N 3.15Å |
| 197 | H | 68.6 | Low | 76 | Confident | 166 Ų | 166 | 128.9 Ų | 128.9 | 77% | 0.769 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 116.4 | 172.9 | -170.3 | 72.4 | 0 | 0 | 0 | 109.7 | N199 | H197-N199 PolarHBondContact CD2-OD1 3.04Å; H197-N199 VanDerWaalsContact CD2-OD1 3.28Å; H197-N199 PolarHBondContact NE2-OD1 3.37Å |
| 198 | K | 70.1 | Confident | 75.1 | Confident | 128 Ų | 128 | 130.8 Ų | 130.8 | 56% | 0.557 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 116.6 | 169.1 | -63.3 | -176.2 | -176.6 | 179.2 | 0 | 106.3 | K196 I200 | K196-K198 PolarHBondContact O-N 3.06Å; K196-K198 VanDerWaalsContact O-N 3.15Å; K198-I200 VanDerWaalsContact C-N 3.31Å; K198-I200 HydrophobicContact CB-CG1 4.38Å; K198-I200 WeakPolarHBondContact O-CG1 3.31Å; K198-I200 PolarHBondContact O-N 3.14Å |
| 199 | N | 67.5 | Low | 74.1 | Confident | 146 Ų | 146 | 134.2 Ų | 134.2 | 78% | 0.781 | 65% | 0.654 | S | S | * | * | trans | -67.4 | 94.5 | 169.1 | -75.2 | -34.3 | 0 | 0 | 0 | 107.7 | H197 L201 | H197-N199 PolarHBondContact CD2-OD1 3.04Å; H197-N199 VanDerWaalsContact CD2-OD1 3.28Å; H197-N199 PolarHBondContact NE2-OD1 3.37Å; N199-L201 PolarHBondContact O-N 3.42Å | ||
| 200 | I | 74.6 | Confident | 72.9 | Confident | 120 Ų | 120 | 135 Ų | 135 | 62% | 0.615 | 67% | 0.668 | S | S | * | * | trans | -83.3 | 99.5 | 172.6 | -43.5 | 177 | 0 | 0 | 0 | 105.5 | K198 F202 | K198-I200 VanDerWaalsContact C-N 3.31Å; K198-I200 HydrophobicContact CB-CG1 4.38Å; K198-I200 WeakPolarHBondContact O-CG1 3.31Å; K198-I200 PolarHBondContact O-N 3.14Å; I200-F202 HydrophobicContact CG2-CE1 4.42Å; I200-F202 HydrophobicContact CG2-CZ 4.35Å; I200-F202 PolarHBondContact O-N 2.78Å | ||
| 201 | L | 70.9 | Confident | 72 | Confident | 140 Ų | 140 | 133.7 Ų | 133.7 | 73% | 0.733 | 67% | 0.665 | S | S | * | * | trans | -75.1 | 109.2 | 171.4 | -161.1 | 74 | 0 | 0 | 0 | 107 | N199 H203 | N199-L201 PolarHBondContact O-N 3.42Å; L201-H203 PolarHBondContact O-N 3.32Å | ||
| 202 | F | 67.1 | Low | 71 | Confident | 185 Ų | 185 | 135.7 Ų | 135.7 | 81% | 0.811 | 68% | 0.677 | S | S | * | * | trans | -74 | 119 | 170.2 | -63.5 | -81.6 | 0 | 0 | 0 | 107.6 | I200 | I200-F202 HydrophobicContact CG2-CE1 4.42Å; I200-F202 HydrophobicContact CG2-CZ 4.35Å; I200-F202 PolarHBondContact O-N 2.78Å | ||
| 203 | H | 58.9 | Low | 69.7 | Low | 241 Ų | 241 | 146.6 Ų | 146.6 | 100% | 1.116 | 73% | 0.732 | S | S | * | * | trans | -99.5 | 0 | 177.4 | -115.3 | -59 | 0 | 0 | 0 | 111 | L201 | L201-H203 PolarHBondContact O-N 3.32Š|
Retrieved 203 of 203 residues in 89.3 ms
(Link to these results)