| 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 | 48.4 | Very low | 55.5 | Low | 246 Ų | 246 | 151.4 Ų | 151.4 | 100% | 1.212 | 86% | 0.862 | S | S | * | * | 0 | 107.3 | 0 | -62.9 | 168.5 | 176.6 | 0 | 0 | 106.7 | |||||
| 2 | M | 50.7 | Low | 55 | Low | 186 Ų | 186 | 151 Ų | 151 | 92% | 0.916 | 86% | 0.856 | S | S | * | * | trans | -142.2 | 113.8 | -175.3 | -79 | 164.3 | 156.2 | 0 | 0 | 108.1 | ||||
| 3 | S | 55.6 | Low | 54.3 | Low | 124 Ų | 124 | 145.5 Ų | 145.5 | 87% | 0.867 | 85% | 0.852 | S | S | * | * | trans | -90.9 | 117.7 | 173 | -67.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 4 | M | 60.1 | Low | 54.2 | Low | 148 Ų | 148 | 142.5 Ų | 142.5 | 73% | 0.729 | 84% | 0.844 | S | S | * | * | trans | -133.5 | 94.9 | 166.8 | -69.1 | -62.9 | -67.9 | 0 | 0 | 108 | F6 | M4-F6 HydrophobicContact CE-CE2 3.72Å; M4-F6 PolarHBondContact O-N 3.41Å | ||
| 5 | G | 53.8 | Low | 54.1 | Low | 86 Ų | 86 | 141.6 Ų | 141.6 | 89% | 0.887 | 83% | 0.833 | S | S | * | * | trans | -86.9 | 100.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 6 | F | 61.7 | Low | 54.1 | Low | 175 Ų | 175 | 140.7 Ų | 140.7 | 77% | 0.768 | 83% | 0.833 | S | S | * | * | trans | -95.3 | 135.1 | 168.5 | -90 | -90.6 | 0 | 0 | 0 | 110.5 | M4 | M4-F6 HydrophobicContact CE-CE2 3.72Å; M4-F6 PolarHBondContact O-N 3.41Å | ||
| 7 | M | 55.9 | Low | 54.1 | Low | 182 Ų | 182 | 137.9 Ų | 137.9 | 90% | 0.897 | 82% | 0.822 | S | S | * | * | trans | -71.1 | 148.3 | 165.1 | -65.6 | -95.6 | 115.6 | 0 | 0 | 110.1 | ||||
| 8 | P | 64.4 | Low | 53.8 | Low | 120 Ų | 120 | 141.2 Ų | 141.2 | 78% | 0.779 | 82% | 0.824 | S | S | * | * | trans | -131.9 | 125 | 141.3 | 33.5 | -21.5 | 0 | 0 | 0 | 113.7 | ||||
| 9 | D | 49.5 | Very low | 53.7 | Low | 143 Ų | 143 | 140.7 Ų | 140.7 | 77% | 0.765 | 83% | 0.83 | S | S | * | * | trans | 20.4 | 121 | 141.6 | -133.6 | -105 | 0 | 0 | 0 | 120.6 | V11 | D9-V11 PolarHBondContact O-N 3.41Š| ||
| 10 | S | 51.2 | Low | 53.4 | Low | 126 Ų | 126 | 138.9 Ų | 138.9 | 88% | 0.881 | 83% | 0.831 | S | S | * | * | trans | -89 | 95.8 | 171.6 | -68.4 | 0 | 0 | 0 | 0 | 111.5 | N12 | S10-N12 PolarHBondContact O-N 3.3Š| ||
| 11 | V | 59.3 | Low | 53.1 | Low | 129 Ų | 129 | 141.3 Ų | 141.3 | 78% | 0.782 | 83% | 0.831 | S | S | * | * | trans | -75 | 110.5 | 175.7 | -74.4 | 0 | 0 | 0 | 0 | 112.9 | D9 G13 | D9-V11 PolarHBondContact O-N 3.41Å; V11-G13 PolarHBondContact O-N 3.44Å | ||
| 12 | N | 49.5 | Very low | 53.6 | Low | 147 Ų | 147 | 135.3 Ų | 135.3 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | trans | -18.7 | 108.8 | 163.7 | -172.4 | 77.3 | 0 | 0 | 0 | 116.6 | S10 | S10-N12 PolarHBondContact O-N 3.3Š| ||
| 13 | G | 46.3 | Very low | 53.4 | Low | 79 Ų | 79 | 135.8 Ų | 135.8 | 81% | 0.814 | 80% | 0.803 | S | S | * | * | trans | -87.2 | 124.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | V11 | V11-G13 PolarHBondContact O-N 3.44Š| ||
| 14 | S | 52.6 | Low | 52.9 | Low | 104 Ų | 104 | 138.2 Ų | 138.2 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -117.4 | 102.4 | 173.4 | 59.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 15 | D | 51.8 | Low | 52 | Low | 129 Ų | 129 | 134.1 Ų | 134.1 | 69% | 0.69 | 79% | 0.794 | S | S | * | * | trans | -88.3 | 121.2 | 175.6 | -176.3 | -29 | 0 | 0 | 0 | 110.2 | S17 | D15-S17 VanDerWaalsContact C-N 3.35Å; D15-S17 PolarHBondContact O-N 2.98Å; D15-S17 WeakPolarHBondContact OD1-CA 3.46Å; D15-S17 WeakPolarHBondContact OD1-CB 3.5Å; D15-S17 PolarHBondContact OD1-N 3.1Å; D15-S17 PolarHBondContact OD1-OG 2.9Å | ||
| 16 | P | 55.4 | Low | 51.6 | Low | 127 Ų | 127 | 139.3 Ų | 139.3 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -90.8 | 28.2 | 179.6 | 37.3 | -35.2 | 0 | 0 | 0 | 114.5 | ||||
| 17 | S | 52.7 | Low | 50.5 | Low | 93 Ų | 93 | 134.8 Ų | 134.8 | 65% | 0.65 | 80% | 0.797 | S | S | * | * | trans | -100.3 | 36.9 | -172.8 | -46.2 | 0 | 0 | 0 | 0 | 115.6 | D15 | D15-S17 VanDerWaalsContact C-N 3.35Å; D15-S17 PolarHBondContact O-N 2.98Å; D15-S17 WeakPolarHBondContact OD1-CA 3.46Å; D15-S17 WeakPolarHBondContact OD1-CB 3.5Å; D15-S17 PolarHBondContact OD1-N 3.1Å; D15-S17 PolarHBondContact OD1-OG 2.9Å | ||
| 18 | K | 50.3 | Low | 49.9 | Very low | 197 Ų | 197 | 135 Ų | 135 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | trans | -144.4 | 94.1 | 171.1 | -69.6 | -168.6 | -178.5 | -179.7 | 0 | 113.2 | ||||
| 19 | S | 50.6 | Low | 49.5 | Very low | 133 Ų | 133 | 135.3 Ų | 135.3 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | trans | -168.7 | 74.6 | 154 | -81.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 20 | A | 49 | Very low | 49.2 | Very low | 104 Ų | 104 | 132.9 Ų | 132.9 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -105.6 | 110.4 | 158.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 21 | F | 45.9 | Very low | 48.9 | Very low | 189 Ų | 189 | 134.9 Ų | 134.9 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | trans | -145 | 146.8 | 168.3 | -164.6 | -102.6 | 0 | 0 | 0 | 110.1 | ||||
| 22 | L | 58.5 | Low | 48.3 | Very low | 120 Ų | 120 | 136 Ų | 136 | 63% | 0.628 | 79% | 0.789 | S | S | * | * | trans | -79.3 | 147 | -172.6 | -63.8 | 77.6 | 0 | 0 | 0 | 110.8 | F24 | L22-F24 HydrophobicContact CD2-CE2 3.9Š| ||
| 23 | E | 48.3 | Very low | 47.8 | Very low | 197 Ų | 197 | 134.7 Ų | 134.7 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | trans | -142.4 | 143.5 | 147 | -153.2 | 161.5 | 136.4 | 0 | 0 | 111.4 | ||||
| 24 | F | 44 | Very low | 47.3 | Very low | 174 Ų | 174 | 138.7 Ų | 138.7 | 76% | 0.763 | 78% | 0.776 | S | S | * | * | trans | -106.5 | 142.9 | -167.1 | -92.3 | -95.9 | 0 | 0 | 0 | 112.7 | L22 | L22-F24 HydrophobicContact CD2-CE2 3.9Š| ||
| 25 | G | 40.6 | Very low | 46.7 | Very low | 62 Ų | 62 | 138.9 Ų | 138.9 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | 88.6 | 174.9 | 139.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 26 | H | 47.3 | Very low | 46.7 | Very low | 196 Ų | 196 | 138.8 Ų | 138.8 | 91% | 0.907 | 78% | 0.783 | S | S | * | * | trans | 70.2 | 124.6 | -168.8 | -40.5 | 88.9 | 0 | 0 | 0 | 113.6 | ||||
| 27 | G | 38.4 | Very low | 45.9 | Very low | 79 Ų | 79 | 135.9 Ų | 135.9 | 81% | 0.814 | 78% | 0.777 | S | S | * | * | cis | 162 | 121 | -3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 28 | H | 43 | Very low | 46.1 | Very low | 188 Ų | 188 | 139.5 Ų | 139.5 | 87% | 0.87 | 79% | 0.788 | S | S | * | * | trans | -76.3 | 166.3 | 170.7 | -105.7 | -54.3 | 0 | 0 | 0 | 110.4 | ||||
| 29 | P | 55.3 | Low | 45.8 | Very low | 126 Ų | 126 | 135 Ų | 135 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | cis | -145.4 | -162.5 | 42.3 | 40.5 | -17.4 | 0 | 0 | 0 | 116.6 | ||||
| 30 | A | 42.8 | Very low | 45.5 | Very low | 92 Ų | 92 | 136.8 Ų | 136.8 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | trans | -85.2 | 161.9 | -166.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 31 | H | 45.6 | Very low | 45.2 | Very low | 167 Ų | 167 | 139 Ų | 139 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | -150.4 | 145 | 131.4 | -156.3 | -90.8 | 0 | 0 | 0 | 113 | ||||
| 32 | Q | 45.7 | Very low | 45.1 | Very low | 152 Ų | 152 | 139.8 Ų | 139.8 | 71% | 0.71 | 77% | 0.769 | S | S | * | * | trans | -66 | 156.6 | 172.4 | 171.4 | 176.3 | 83 | 0 | 0 | 111.9 | ||||
| 33 | Q | 40.3 | Very low | 45 | Very low | 121 Ų | 121 | 139.3 Ų | 139.3 | 57% | 0.565 | 77% | 0.773 | S | S | * | * | 175 | 144.6 | 129.4 | -95.5 | -45.6 | -11.7 | 0 | 0 | 117.2 | |||||
| 34 | H | 36.2 | Very low | 44.8 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 75% | 0.75 | 77% | 0.769 | S | S | * | * | trans | 36.7 | 133 | 164.2 | 23.7 | 81.8 | 0 | 0 | 0 | 125.6 | ||||
| 35 | S | 39.1 | Very low | 45.1 | Very low | 109 Ų | 109 | 136.8 Ų | 136.8 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | -87.9 | 178.3 | 159.4 | -129.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 36 | P | 51.1 | Low | 45 | Very low | 126 Ų | 126 | 137.3 Ų | 137.3 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | cis | -136.5 | 151.8 | 42.5 | 37.3 | -18 | 0 | 0 | 0 | 117.6 | ||||
| 37 | G | 40.1 | Very low | 45 | Very low | 67 Ų | 67 | 136.2 Ų | 136.2 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 161.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 38 | L | 55.6 | Low | 45 | Very low | 168 Ų | 168 | 141.4 Ų | 141.4 | 88% | 0.88 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 138 | 178.6 | -89.5 | 72.6 | 0 | 0 | 0 | 112.4 | H40 | L38-H40 PolarHBondContact O-N 3.46Š|
| 39 | S | 45.7 | Very low | 45 | Very low | 103 Ų | 103 | 136 Ų | 136 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 118.6 | 169.4 | 51.9 | 0 | 0 | 0 | 0 | 111.9 | ||
| 40 | H | 43 | Very low | 44.2 | Very low | 171 Ų | 171 | 135.3 Ų | 135.3 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | trans | -129.2 | 130.8 | 156.7 | -94.3 | 41.1 | 0 | 0 | 0 | 109.5 | L38 | L38-H40 PolarHBondContact O-N 3.46Š| ||
| 41 | I | 42.9 | Very low | 43.8 | Very low | 149 Ų | 149 | 134.4 Ų | 134.4 | 76% | 0.764 | 77% | 0.773 | S | S | * | * | trans | -98.8 | 127 | -163.6 | -66.1 | 159.3 | 0 | 0 | 0 | 110 | ||||
| 42 | Y | 43.7 | Very low | 43.5 | Very low | 206 Ų | 206 | 135.9 Ų | 135.9 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | trans | -140.8 | 128.5 | 159.4 | -73.8 | -72.4 | 0 | 0 | 0 | 109.8 | V44 | Y42-V44 PolarHBondContact O-N 2.92Š| ||
| 43 | P | 56.5 | Low | 43 | Very low | 110 Ų | 110 | 133.2 Ų | 133.2 | 71% | 0.714 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 118.2 | 176.4 | -11.3 | 27.5 | 0 | 0 | 0 | 111.3 | ||
| 44 | V | 44.6 | Very low | 43 | Very low | 136 Ų | 136 | 135 Ų | 135 | 82% | 0.824 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -91 | 121.7 | 159.9 | 172.1 | 0 | 0 | 0 | 0 | 107.4 | Y42 G46 | Y42-V44 PolarHBondContact O-N 2.92Å; V44-G46 PolarHBondContact O-N 3.29Å |
| 45 | H | 49.3 | Very low | 43 | Very low | 183 Ų | 183 | 136.2 Ų | 136.2 | 85% | 0.847 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 119.4 | 171.8 | -81.2 | -87.3 | 0 | 0 | 0 | 109.9 | ||
| 46 | G | 39.1 | Very low | 42.9 | Very low | 72 Ų | 72 | 138 Ų | 138 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 163.5 | -177 | 0 | 0 | 0 | 0 | 0 | 114.5 | V44 | V44-G46 PolarHBondContact O-N 3.29Š|
| 47 | L | 46.9 | Very low | 42.3 | Very low | 174 Ų | 174 | 135.5 Ų | 135.5 | 91% | 0.911 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -72 | 159.9 | 179.7 | -63.6 | 153.9 | 0 | 0 | 0 | 112.6 | ||
| 48 | H | 39.2 | Very low | 42.9 | Very low | 187 Ų | 187 | 138.4 Ų | 138.4 | 87% | 0.866 | 79% | 0.785 | S | S | * | * | trans | -120.7 | 148.9 | 147.5 | -158.9 | 80.8 | 0 | 0 | 0 | 109.2 | ||||
| 49 | A | 42.3 | Very low | 42.3 | Very low | 76 Ų | 76 | 140.3 Ų | 140.3 | 63% | 0.628 | 79% | 0.786 | S | S | * | * | trans | -137.1 | 172.9 | -169.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 50 | A | 39.2 | Very low | 42.6 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | trans | 73.4 | 141.3 | -179 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 51 | G | 33.9 | Very low | 42.4 | Very low | 74 Ų | 74 | 136.5 Ų | 136.5 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | cis | 176.9 | -164.3 | -5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 52 | H | 38.8 | Very low | 42.1 | Very low | 197 Ų | 197 | 137.5 Ų | 137.5 | 91% | 0.912 | 79% | 0.793 | S | S | * | * | trans | 79.9 | 162.1 | 170.8 | -97.5 | -52.3 | 0 | 0 | 0 | 121.4 | ||||
| 53 | S | 35.9 | Very low | 41.8 | Very low | 96 Ų | 96 | 131.3 Ų | 131.3 | 67% | 0.671 | 79% | 0.785 | S | S | * | * | trans | -127.3 | 173.5 | -144.1 | -38.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 54 | Q | 40.1 | Very low | 41.4 | Very low | 158 Ų | 158 | 130.7 Ų | 130.7 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | trans | 73.5 | 134.1 | 161.2 | -70 | -105.6 | -57.6 | 0 | 0 | 116.2 | ||||
| 55 | R | 37 | Very low | 41.6 | Very low | 189 Ų | 189 | 135 Ų | 135 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | cis | -171.4 | 165.6 | 43.1 | -133.1 | -171.1 | -150.1 | -81.7 | 2.7 | 113.8 | ||||
| 56 | E | 35.3 | Very low | 41.3 | Very low | 146 Ų | 146 | 129.5 Ų | 129.5 | 68% | 0.682 | 78% | 0.779 | S | S | * | * | trans | 57.4 | 108.1 | 153.8 | -51.7 | -59.7 | 121.7 | 0 | 0 | 124.4 | ||||
| 57 | G | 40.2 | Very low | 41.8 | Very low | 74 Ų | 74 | 132.3 Ų | 132.3 | 76% | 0.763 | 78% | 0.784 | S | S | * | * | 71.7 | 168.3 | 124.7 | 0 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 58 | P | 51.3 | Low | 42 | Very low | 128 Ų | 128 | 129.9 Ų | 129.9 | 83% | 0.831 | 78% | 0.779 | S | S | * | * | -127.8 | 155.6 | -52 | 38.1 | -27 | 0 | 0 | 0 | 113.5 | |||||
| 59 | F | 43.8 | Very low | 42.6 | Very low | 207 Ų | 207 | 129.4 Ų | 129.4 | 91% | 0.908 | 78% | 0.782 | S | S | * | * | trans | -77.6 | 147.4 | 169.6 | -71.4 | -80.5 | 0 | 0 | 0 | 111.8 | ||||
| 60 | P | 52 | Low | 42.5 | Very low | 128 Ų | 128 | 129.6 Ų | 129.6 | 83% | 0.831 | 79% | 0.791 | S | S | * | * | -133.3 | 172.6 | 90.9 | 38.9 | -28.8 | 0 | 0 | 0 | 111.9 | |||||
| 61 | G | 37.6 | Very low | 42.5 | Very low | 67 Ų | 67 | 134.8 Ų | 134.8 | 69% | 0.691 | 79% | 0.788 | S | S | * | * | cis | 165.4 | 136.1 | -6.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 62 | N | 37.6 | Very low | 42.9 | Very low | 170 Ų | 170 | 135.8 Ų | 135.8 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | trans | 75.6 | 147.9 | 157.4 | -144.5 | 23.6 | 0 | 0 | 0 | 122.3 | ||||
| 63 | A | 37.9 | Very low | 42.9 | Very low | 76 Ų | 76 | 136.7 Ų | 136.7 | 63% | 0.628 | 79% | 0.786 | S | S | * | * | trans | 70.4 | 95.2 | 154.1 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 64 | S | 48.4 | Very low | 43.7 | Very low | 97 Ų | 97 | 137.8 Ų | 137.8 | 68% | 0.678 | 79% | 0.791 | S | S | * | * | 32.6 | 149.2 | 122 | -54.4 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 65 | Y | 47.2 | Very low | 43.8 | Very low | 226 Ų | 226 | 132.7 Ų | 132.7 | 89% | 0.886 | 78% | 0.781 | S | S | * | * | trans | 93.2 | 105.8 | 156.7 | -55.8 | -71.7 | 0 | 0 | 0 | 119.6 | ||||
| 66 | G | 44 | Very low | 44.4 | Very low | 67 Ų | 67 | 130 Ų | 130 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | trans | 84.6 | 128.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | P68 | G66-P68 WeakPolarHBondContact O-CD 3.23Š| ||
| 67 | P | 48.4 | Very low | 44.9 | Very low | 132 Ų | 132 | 130.1 Ų | 130.1 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | trans | -81 | 118.7 | 162.8 | -4.5 | 22.4 | 0 | 0 | 0 | 110.6 | ||||
| 68 | P | 51.4 | Low | 45 | Very low | 123 Ų | 123 | 134.4 Ų | 134.4 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | trans | -83.2 | 130.2 | 170.4 | 32.1 | -32 | 0 | 0 | 0 | 111.2 | G66 G70 | G66-P68 WeakPolarHBondContact O-CD 3.23Å; P68-G70 PolarHBondContact O-N 2.99Å | ||
| 69 | L | 52.8 | Low | 44.3 | Very low | 177 Ų | 177 | 132.5 Ų | 132.5 | 93% | 0.927 | 80% | 0.797 | S | S | * | * | trans | -78.4 | 99 | 169.8 | -72.4 | 168.3 | 0 | 0 | 0 | 109.8 | Y71 | L69-Y71 PolarHBondContact O-N 3.47Š| ||
| 70 | G | 40 | Very low | 44.5 | Very low | 79 Ų | 79 | 130.7 Ų | 130.7 | 81% | 0.814 | 79% | 0.791 | S | S | * | * | trans | -82.5 | 102.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | P68 | P68-G70 PolarHBondContact O-N 2.99Š| ||
| 71 | Y | 38.3 | Very low | 44.2 | Very low | 220 Ų | 220 | 130.3 Ų | 130.3 | 86% | 0.863 | 79% | 0.788 | S | S | * | * | trans | -85.4 | 124.2 | 163.7 | -109.5 | -89 | 0 | 0 | 0 | 109.7 | L69 | L69-Y71 PolarHBondContact O-N 3.47Š| ||
| 72 | A | 42.3 | Very low | 44.8 | Very low | 95 Ų | 95 | 132.6 Ų | 132.6 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -90.6 | 133.5 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 73 | Y | 39.7 | Very low | 45 | Very low | 215 Ų | 215 | 129.8 Ų | 129.8 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | -113.9 | 133.5 | -177.1 | -151.8 | -83 | 0 | 0 | 0 | 109.7 | ||||
| 74 | P | 53.3 | Low | 45.4 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -121.2 | 112.6 | 154.7 | 32.2 | -19.6 | 0 | 0 | 0 | 110.6 | ||||
| 75 | G | 40.9 | Very low | 45.5 | Very low | 52 Ų | 52 | 135.9 Ų | 135.9 | 54% | 0.536 | 80% | 0.801 | S | S | . | * | trans | -93.8 | 168.4 | 152 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 76 | T | 50.1 | Low | 45.5 | Very low | 132 Ų | 132 | 132.5 Ų | 132.5 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | cis | -159 | 141.2 | 1.3 | 46.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 77 | V | 44.7 | Very low | 45.1 | Very low | 149 Ų | 149 | 134.8 Ų | 134.8 | 90% | 0.903 | 80% | 0.801 | S | S | * | * | trans | -161.8 | 149.4 | 141.2 | -96.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 78 | N | 42.8 | Very low | 45.3 | Very low | 164 Ų | 164 | 134.1 Ų | 134.1 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | trans | -26 | 124.2 | 174.8 | -71 | -10.3 | 0 | 0 | 0 | 117.1 | ||||
| 79 | A | 37.2 | Very low | 45 | Very low | 87 Ų | 87 | 139 Ų | 139 | 72% | 0.719 | 80% | 0.8 | S | S | * | * | 176.4 | 129.9 | 106.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 80 | H | 47.4 | Very low | 44.6 | Very low | 170 Ų | 170 | 138.3 Ų | 138.3 | 79% | 0.787 | 79% | 0.793 | S | S | * | * | trans | -79.6 | 130.1 | 173.8 | 33.4 | -96 | 0 | 0 | 0 | 110.8 | P82 | H80-P82 WeakPolarHBondContact O-CD 3.4Š| ||
| 81 | P | 46.3 | Very low | 44.5 | Very low | 120 Ų | 120 | 142 Ų | 142 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | trans | -92.9 | 100.4 | 158.5 | 31.9 | -26.8 | 0 | 0 | 0 | 109.2 | S83 | P81-S83 PolarHBondContact O-N 3.07Š| ||
| 82 | P | 50.6 | Low | 44.8 | Very low | 114 Ų | 114 | 136.1 Ų | 136.1 | 74% | 0.74 | 78% | 0.779 | S | S | * | * | trans | -66.5 | 131 | 171.4 | 27.7 | -32.8 | 0 | 0 | 0 | 110 | H80 A84 | H80-P82 WeakPolarHBondContact O-CD 3.4Å; P82-A84 PolarHBondContact O-N 3.28Å | ||
| 83 | S | 41.3 | Very low | 44.5 | Very low | 112 Ų | 112 | 137.5 Ų | 137.5 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | -50.1 | 132.9 | 173.1 | -175.2 | 0 | 0 | 0 | 0 | 111.5 | P81 Y85 | P81-S83 PolarHBondContact O-N 3.07Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 2.98Å | ||
| 84 | A | 47 | Very low | 44.9 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 90% | 0.901 | 78% | 0.783 | S | S | * | * | trans | -71.4 | 80 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | P82 | P82-A84 PolarHBondContact O-N 3.28Š| ||
| 85 | Y | 49.9 | Very low | 44.2 | Very low | 192 Ų | 192 | 136.5 Ų | 136.5 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -122.1 | 137.3 | 164.2 | -159.3 | -104.5 | 0 | 0 | 0 | 108.9 | S83 | S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 2.98Å | ||
| 86 | M | 46.2 | Very low | 44.4 | Very low | 154 Ų | 154 | 139.9 Ų | 139.9 | 76% | 0.759 | 81% | 0.806 | S | S | * | * | trans | 77.9 | 108.6 | -170.7 | -46.6 | -76.8 | 69 | 0 | 0 | 115.7 | ||||
| 87 | S | 36.6 | Very low | 43.8 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -139.8 | 133.6 | 139.4 | -166.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 88 | P | 53.7 | Low | 43.3 | Very low | 118 Ų | 118 | 133.7 Ų | 133.7 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | trans | -80.6 | 175.1 | -174 | 33.6 | -35.8 | 0 | 0 | 0 | 112.7 | ||||
| 89 | Y | 43.7 | Very low | 43.4 | Very low | 225 Ų | 225 | 134.2 Ų | 134.2 | 88% | 0.882 | 80% | 0.8 | S | S | * | * | trans | -48.2 | 143.9 | 169.7 | -85.1 | -107.7 | 0 | 0 | 0 | 112.5 | ||||
| 90 | Q | 44.7 | Very low | 43.5 | Very low | 164 Ų | 164 | 134.5 Ų | 134.5 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | -175.3 | 129.7 | 118.8 | -82.8 | -97.4 | 54.7 | 0 | 0 | 111.7 | |||||
| 91 | H | 38.4 | Very low | 43.4 | Very low | 157 Ų | 157 | 134.4 Ų | 134.4 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | 30.2 | 124.5 | 157 | -68.8 | 90.6 | 0 | 0 | 0 | 126 | ||||
| 92 | S | 43.3 | Very low | 43.1 | Very low | 96 Ų | 96 | 133.4 Ų | 133.4 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | 40.6 | 120.2 | 129.8 | -57.5 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 93 | S | 36.4 | Very low | 42.5 | Very low | 124 Ų | 124 | 139.8 Ų | 139.8 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -149 | 132 | 134.1 | -48 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 94 | H | 49.3 | Very low | 42.8 | Very low | 179 Ų | 179 | 142.2 Ų | 142.2 | 83% | 0.829 | 81% | 0.805 | S | S | * | * | trans | -83 | 141 | 169.3 | -65 | -112.7 | 0 | 0 | 0 | 109.6 | ||||
| 95 | S | 37.4 | Very low | 42.2 | Very low | 134 Ų | 134 | 145 Ų | 145 | 94% | 0.937 | 80% | 0.799 | S | S | * | * | trans | -162.8 | 150.7 | 144.1 | -91.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 96 | S | 46 | Very low | 41.8 | Very low | 123 Ų | 123 | 146 Ų | 146 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | trans | -107.1 | 160.4 | -166.5 | 49.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 97 | G | 36.4 | Very low | 41.7 | Very low | 83 Ų | 83 | 144.3 Ų | 144.3 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | trans | 120.6 | 131.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 98 | G | 35.5 | Very low | 41.8 | Very low | 68 Ų | 68 | 145.6 Ų | 145.6 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | cis | 149.4 | 144.2 | -6.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 99 | L | 44.8 | Very low | 41.8 | Very low | 175 Ų | 175 | 145.4 Ų | 145.4 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | trans | 67.8 | 142.9 | 164.2 | -52.9 | 172.1 | 0 | 0 | 0 | 114.5 | ||||
| 100 | S | 39.6 | Very low | 41.4 | Very low | 92 Ų | 92 | 142.1 Ų | 142.1 | 64% | 0.643 | 79% | 0.794 | S | S | * | * | cis | -150 | 171 | -0.4 | -66.7 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 101 | H | 44.8 | Very low | 41.3 | Very low | 168 Ų | 168 | 144.1 Ų | 144.1 | 78% | 0.778 | 80% | 0.801 | S | S | * | * | cis | -159.8 | 134.7 | 38.1 | -108.2 | -74.6 | 0 | 0 | 0 | 113 | ||||
| 102 | S | 38.7 | Very low | 41.2 | Very low | 100 Ų | 100 | 141.9 Ų | 141.9 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | 0.3 | 129.4 | 144 | 54.8 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 103 | R | 39.2 | Very low | 40.9 | Very low | 248 Ų | 248 | 140.8 Ų | 140.8 | 94% | 0.936 | 81% | 0.806 | S | S | * | * | -152.1 | 137.8 | 127 | -176.7 | 168 | -93.8 | -156.4 | -6.3 | 110.4 | |||||
| 104 | L | 46.8 | Very low | 40.9 | Very low | 162 Ų | 162 | 143.2 Ų | 143.2 | 85% | 0.848 | 81% | 0.806 | S | S | * | * | trans | -117 | 149.4 | -172.5 | -84.2 | 165.2 | 0 | 0 | 0 | 112.9 | ||||
| 105 | E | 35.7 | Very low | 40.7 | Very low | 168 Ų | 168 | 141.4 Ų | 141.4 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | 148.4 | 114 | 160.8 | -96.5 | -80.9 | 87.5 | 0 | 0 | 106.6 | ||||
| 106 | R | 40.9 | Very low | 41 | Very low | 213 Ų | 213 | 142 Ų | 142 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | 51 | 124.5 | 54.8 | -67.7 | -166.8 | 180 | -141.6 | 2.6 | 111 | |||||
| 107 | T | 43.1 | Very low | 40.9 | Very low | 118 Ų | 118 | 142.2 Ų | 142.2 | 72% | 0.724 | 80% | 0.797 | S | S | * | * | cis | -137.7 | -178.9 | 37.2 | 48.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 108 | D | 38.6 | Very low | 41.4 | Very low | 142 Ų | 142 | 147.6 Ų | 147.6 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | cis | -157.9 | 175.9 | -18.6 | -109.2 | -13.8 | 0 | 0 | 0 | 110.9 | ||||
| 109 | P | 54.3 | Low | 41.8 | Very low | 114 Ų | 114 | 150.5 Ų | 150.5 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | trans | -102.3 | 174.4 | -169.8 | 39.2 | -35.1 | 0 | 0 | 0 | 116.2 | ||||
| 110 | N | 35 | Very low | 42.3 | Very low | 156 Ų | 156 | 147.8 Ų | 147.8 | 83% | 0.834 | 78% | 0.781 | S | S | * | * | trans | 93.1 | 100.3 | 156 | -159.2 | 1.5 | 0 | 0 | 0 | 119.3 | ||||
| 111 | K | 42.8 | Very low | 43 | Very low | 207 Ų | 207 | 153.7 Ų | 153.7 | 90% | 0.9 | 79% | 0.789 | S | S | * | * | -159.4 | 139.8 | 116.5 | -162.2 | 156.2 | -178.8 | 174.2 | 0 | 112.5 | |||||
| 112 | S | 36.6 | Very low | 43.4 | Very low | 110 Ų | 110 | 154 Ų | 154 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -76.8 | 154.5 | -176.2 | -174.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 113 | G | 36.8 | Very low | 44.2 | Very low | 72 Ų | 72 | 154.9 Ų | 154.9 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | -166.4 | 64.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | T115 | G113-T115 PolarHBondContact O-N 3.13Š| ||
| 114 | M | 36.9 | Very low | 44.6 | Very low | 176 Ų | 176 | 151.3 Ų | 151.3 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -61.8 | 125.8 | 179.4 | -175 | 92 | 93 | 0 | 0 | 111.7 | ||||
| 115 | T | 44.5 | Very low | 44.9 | Very low | 140 Ų | 140 | 146.2 Ų | 146.2 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | -139.5 | 124 | 153.6 | 174.5 | 0 | 0 | 0 | 0 | 109.1 | G113 | G113-T115 PolarHBondContact O-N 3.13Š| ||
| 116 | E | 44.1 | Very low | 45.8 | Very low | 148 Ų | 148 | 148.1 Ų | 148.1 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | trans | -86.9 | 125.9 | -167 | -176.5 | -177.2 | 167.9 | 0 | 0 | 110.8 | ||||
| 117 | S | 44.2 | Very low | 46.7 | Very low | 126 Ų | 126 | 142 Ų | 142 | 88% | 0.881 | 79% | 0.792 | S | S | * | * | trans | -145.9 | 101.9 | 159.4 | -168.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 118 | R | 46.7 | Very low | 47.8 | Very low | 196 Ų | 196 | 145 Ų | 145 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | trans | -86.8 | 133.5 | -162.1 | -163.9 | 170.4 | -177.4 | 171.3 | -1.1 | 112.1 | ||||
| 119 | D | 44.5 | Very low | 49.6 | Very low | 130 Ų | 130 | 147.6 Ų | 147.6 | 70% | 0.695 | 80% | 0.799 | S | S | * | * | trans | 28.9 | 109.4 | 153.9 | -61.6 | -64.1 | 0 | 0 | 0 | 120.3 | ||||
| 120 | V | 54 | Low | 50.7 | Low | 118 Ų | 118 | 150.7 Ų | 150.7 | 72% | 0.715 | 81% | 0.806 | S | S | * | * | trans | -136.1 | 104.7 | 144.7 | -176 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 121 | R | 54.4 | Low | 53.1 | Low | 215 Ų | 215 | 154.5 Ų | 154.5 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | 76.7 | 74.8 | 155.8 | -63.1 | 166.3 | -156.4 | 169.7 | 8.1 | 118.3 | V123 | R121-V123 HydrophobicContact CB-CG2 4.07Å; R121-V123 HydrophobicContact CG-CG2 4.41Å; R121-V123 PolarHBondContact O-N 3.14Å | ||
| 122 | L | 53.5 | Low | 55.1 | Low | 174 Ų | 174 | 153.8 Ų | 153.8 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | trans | -62 | 104.7 | 136.9 | -65.6 | 171.6 | 0 | 0 | 0 | 109 | ||||
| 123 | V | 55.3 | Low | 57.6 | Low | 120 Ų | 120 | 154.3 Ų | 154.3 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | -123.2 | 99.9 | 167.9 | -177.2 | 0 | 0 | 0 | 0 | 109.9 | R121 G125 | R121-V123 HydrophobicContact CB-CG2 4.07Å; R121-V123 HydrophobicContact CG-CG2 4.41Å; R121-V123 PolarHBondContact O-N 3.14Å; V123-G125 PolarHBondContact O-N 3.31Å | ||
| 124 | N | 48.8 | Very low | 60.1 | Low | 172 Ų | 172 | 162.6 Ų | 162.6 | 92% | 0.92 | 82% | 0.815 | S | S | * | * | trans | -16.3 | 115.4 | 163.9 | -159.4 | 51.6 | 0 | 0 | 0 | 115.9 | ||||
| 125 | G | 52.4 | Low | 62.7 | Low | 55 Ų | 55 | 159.6 Ų | 159.6 | 57% | 0.567 | 81% | 0.807 | S | S | * | * | trans | -176.9 | 63.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 118.1 | V123 G127 | V123-G125 PolarHBondContact O-N 3.31Å; G125-G127 PolarHBondContact O-N 3.27Å | ||
| 126 | K | 54.6 | Low | 65.1 | Low | 209 Ų | 209 | 160.1 Ų | 160.1 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 29.1 | 83.8 | 156.6 | -72.3 | 173.1 | 173 | 174 | 0 | 116.5 | K128 | K126-K128 PolarHBondContact O-N 2.94Š|
| 127 | G | 60.6 | Low | 67.6 | Low | 84 Ų | 84 | 155.8 Ų | 155.8 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62 | 3.1 | 153.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | G125 K129 | G125-G127 PolarHBondContact O-N 3.27Å; G127-K129 PolarHBondContact O-N 2.85Å |
| 128 | K | 66.2 | Low | 70.2 | Confident | 180 Ų | 180 | 152.5 Ų | 152.5 | 78% | 0.783 | 76% | 0.758 | S | S | * | * | trans | -74.7 | 97.9 | -179.8 | -72.1 | -175.1 | -179.6 | 179.5 | 0 | 110.3 | K126 M130 | K126-K128 PolarHBondContact O-N 2.94Å; K128-M130 PolarHBondContact O-N 3.43Å | ||
| 129 | K | 75.4 | Confident | 72.6 | Confident | 198 Ų | 198 | 147.9 Ų | 147.9 | 86% | 0.861 | 76% | 0.755 | S | S | * | * | trans | -40.4 | 103.7 | 171.2 | 57.8 | -165.8 | 175.1 | -168.9 | 0 | 111.4 | G127 R131 | G127-K129 PolarHBondContact O-N 2.85Å; K129-R131 PolarHBondContact O-N 3.14Å | ||
| 130 | M | 78.4 | Confident | 75.2 | Confident | 178 Ų | 178 | 147.7 Ų | 147.7 | 88% | 0.877 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 125 | -178.9 | -73.2 | -101.8 | 72.4 | 0 | 0 | 108.9 | K128 | K128-M130 PolarHBondContact O-N 3.43Š|
| 131 | R | 84.5 | Confident | 77.3 | Confident | 236 Ų | 236 | 143.8 Ų | 143.8 | 89% | 0.891 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 140.3 | 174.3 | -59.7 | -177.5 | 81.9 | 153.5 | 4.7 | 107.6 | K129 | K129-R131 PolarHBondContact O-N 3.14Š|
| 132 | K | 85.9 | Confident | 79.4 | Confident | 193 Ų | 193 | 136.4 Ų | 136.4 | 84% | 0.839 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 133.6 | 175.7 | -78 | 86.2 | 167.2 | -176.1 | 0 | 109.5 | ||
| 133 | P | 87.1 | Confident | 81.5 | Confident | 121 Ų | 121 | 134.1 Ų | 134.1 | 79% | 0.786 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 147.8 | 173.9 | 25.8 | -33.7 | 0 | 0 | 0 | 110.1 | ||
| 134 | R | 90.4 | Very high | 83.6 | Confident | 245 Ų | 245 | 129.5 Ų | 129.5 | 93% | 0.925 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 123.9 | 178.1 | -69.2 | 179.5 | 177.7 | 146.2 | -3.3 | 109.5 | ||
| 135 | T | 90.8 | Very high | 85.9 | Confident | 113 Ų | 113 | 121.3 Ų | 121.3 | 69% | 0.693 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 136.9 | 168.6 | -43.9 | 0 | 0 | 0 | 0 | 110.2 | ||
| 136 | I | 94.7 | Very high | 88.1 | Confident | 151 Ų | 151 | 122.2 Ų | 122.2 | 77% | 0.774 | 61% | 0.609 | S | S | * | * | trans | -104.2 | 147.4 | 168.9 | 57.5 | 173.3 | 0 | 0 | 0 | 109.7 | ||||
| 137 | Y | 97.5 | Very high | 90.2 | Very high | 57 Ų | 57 | 117.5 Ų | 117.5 | 22% | 0.224 | 59% | 0.59 | C | S | . | * | trans | -86.4 | 147.1 | 174.4 | -56.5 | -61 | 0 | 0 | 0 | 110.2 | L142 L169 Q173 W177 | Y137-L142 HydrophobicContact CD2-CD2 4.18Å; Y137-L142 HydrophobicContact CG-CD2 4.5Å; Y137-L169 HydrophobicContact CD1-CD1 3.99Å; Y137-L169 HydrophobicContact CD1-CD2 3.8Å; Y137-L169 HydrophobicContact CE1-CD1 3.96Å; Y137-L169 HydrophobicContact CE1-CD2 3.79Å; Y137-Q173 HydrophobicContact CE1-CB 4.26Å; Y137-Q173 HydrophobicContact CE1-CG 4.39Å; Y137-Q173 WeakPolarHBondContact OH-CB 3.28Å; Y137-W177 AromaticContact CD2-CD1 3.91Å; Y137-W177 AromaticContact CE2-CD1 3.72Å | ||
| 138 | S | 98.3 | Very high | 92 | Very high | 58 Ų | 58 | 116.1 Ų | 116.1 | 41% | 0.406 | 56% | 0.559 | S | S | . | * | trans | -71.7 | 162.7 | 176.1 | 76.9 | 0 | 0 | 0 | 0 | 112 | L140 Q141 L142 | S138-L140 VanDerWaalsContact C-N 3.32Å; S138-L140 PolarHBondContact O-N 3.16Å; S138-Q141 PolarHBondContact O-N 3.13Å; S138-Q141 WeakPolarHBondContact OG-CG 3.43Å; S138-Q141 PolarHBondContact OG-N 3.39Å; S138-L142 WeakPolarHBondContact O-CG 3.48Å; S138-L142 PolarHBondContact O-N 2.76Å | ||
| 139 | S | 97.9 | Very high | 93.5 | Very high | 98 Ų | 98 | 108 Ų | 108 | 69% | 0.685 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -56 | -46.2 | 177.8 | -169.3 | 0 | 0 | 0 | 0 | 112 | Q141 L142 Q143 | S139-Q141 PolarHBondContact O-N 3.03Å; S139-L142 PolarHBondContact O-N 3.15Å; S139-Q143 PolarHBondContact O-N 2.77Å |
| 140 | L | 98.1 | Very high | 94.6 | Very high | 126 Ų | 126 | 106.4 Ų | 106.4 | 66% | 0.66 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.2 | -44.1 | 176.8 | -178.3 | 65 | 0 | 0 | 0 | 112.4 | S138 Q143 A144 | S138-L140 VanDerWaalsContact C-N 3.32Å; S138-L140 PolarHBondContact O-N 3.16Å; L140-Q143 PolarHBondContact O-N 3.13Å; L140-A144 PolarHBondContact O-N 3.31Å; L140-A144 VanDerWaalsContact O-N 3.07Å |
| 141 | Q | 98.4 | Very high | 95.5 | Very high | 37 Ų | 37 | 104.1 Ų | 104.1 | 17% | 0.173 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 176 | -72.3 | 172.1 | -23.1 | 0 | 0 | 111.2 | S138 S139 A144 L145 L167 | S138-Q141 PolarHBondContact O-N 3.13Å; S138-Q141 WeakPolarHBondContact OG-CG 3.43Å; S138-Q141 PolarHBondContact OG-N 3.39Å; S139-Q141 PolarHBondContact O-N 3.03Å; Q141-A144 PolarHBondContact O-N 2.86Å; Q141-L145 WeakPolarHBondContact O-CB 3.09Å; Q141-L145 WeakPolarHBondContact O-CD1 3.34Å; Q141-L145 WeakPolarHBondContact O-CG 3.35Å; Q141-L145 PolarHBondContact O-N 2.88Å; Q141-L167 HydrophobicContact CG-CB 4.32Å; Q141-L167 PolarHBondContact NE2-O 3.45Å |
| 142 | L | 98.4 | Very high | 96.1 | Very high | 60 Ų | 60 | 94.9 Ų | 94.9 | 31% | 0.314 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 177.9 | -68.5 | 173.7 | 0 | 0 | 0 | 112.1 | Y137 S138 S139 L145 H146 | Y137-L142 HydrophobicContact CD2-CD2 4.18Å; Y137-L142 HydrophobicContact CG-CD2 4.5Å; S138-L142 WeakPolarHBondContact O-CG 3.48Å; S138-L142 PolarHBondContact O-N 2.76Å; S139-L142 PolarHBondContact O-N 3.15Å; L142-L145 PolarHBondContact O-N 3.3Å; L142-H146 WeakPolarHBondContact O-CB 3.47Å; L142-H146 PolarHBondContact O-N 3.25Å; L142-H146 PolarHBondContact O-ND1 3.47Å |
| 143 | Q | 98.4 | Very high | 96.7 | Very high | 125 Ų | 125 | 89 Ų | 89 | 58% | 0.584 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -61.4 | -49.5 | 177.4 | -178.7 | 177.4 | -18.3 | 0 | 0 | 111.7 | S139 L140 L145 H146 Q147 | S139-Q143 PolarHBondContact O-N 2.77Å; L140-Q143 PolarHBondContact O-N 3.13Å; Q143-L145 PolarHBondContact O-N 2.65Å; Q143-H146 WeakPolarHBondContact O-CB 3.47Å; Q143-H146 PolarHBondContact O-N 3.32Å; Q143-Q147 PolarHBondContact O-N 2.86Å |
| 144 | A | 98.1 | Very high | 97.2 | Very high | 24 Ų | 24 | 90.5 Ų | 90.5 | 20% | 0.198 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L140 Q141 H146 Q147 R148 L167 | L140-A144 PolarHBondContact O-N 3.31Å; L140-A144 VanDerWaalsContact O-N 3.07Å; Q141-A144 PolarHBondContact O-N 2.86Å; A144-H146 VanDerWaalsContact C-N 3.32Å; A144-H146 PolarHBondContact O-N 2.88Å; A144-Q147 PolarHBondContact O-N 2.84Å; A144-R148 PolarHBondContact O-N 3.04Å; A144-L167 HydrophobicContact CB-CD1 4.09Å; A144-L167 HydrophobicContact CB-CD2 3.65Å; A144-L167 HydrophobicContact CB-CG 4.46Å |
| 145 | L | 98.6 | Very high | 97.5 | Very high | 0 Ų | 0 | 79.6 Ų | 79.6 | 0% | 0 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.8 | -39.5 | 173.3 | -71.4 | 165.4 | 0 | 0 | 0 | 111.6 | Q141 L142 Q143 F149 L163 L167 L169 V174 W177 F178 | Q141-L145 WeakPolarHBondContact O-CB 3.09Å; Q141-L145 WeakPolarHBondContact O-CD1 3.34Å; Q141-L145 WeakPolarHBondContact O-CG 3.35Å; Q141-L145 PolarHBondContact O-N 2.88Å; L142-L145 PolarHBondContact O-N 3.3Å; Q143-L145 PolarHBondContact O-N 2.65Å; L145-F149 WeakPolarHBondContact O-CB 3.31Å; L145-F149 PolarHBondContact O-N 3.22Å; L145-L163 HydrophobicContact CD2-CD2 4Å; L145-L163 HydrophobicContact CD2-CG 4.49Å; L145-L167 HydrophobicContact CD1-CD1 4.5Å; L145-L167 HydrophobicContact CD2-CD1 3.99Å; L145-L167 HydrophobicContact CG-CD1 3.77Å; L145-L169 HydrophobicContact CD1-CD1 4.24Å; L145-V174 HydrophobicContact CD2-CG1 4.33Å; L145-W177 VanDerWaalsContact C-CH2 3.46Å; L145-W177 HydrophobicContact CB-CD2 4.02Å; L145-W177 HydrophobicContact CB-CE3 4.03Å; L145-W177 HydrophobicContact CB-CH2 3.63Å; L145-W177 HydrophobicContact CB-CZ2 3.58Å; L145-W177 HydrophobicContact CB-CZ3 3.86Å; L145-W177 HydrophobicContact CD1-CD2 4Å; L145-W177 HydrophobicContact CD1-CG 3.99Å; L145-W177 HydrophobicContact CD2-CD2 4.36Å; L145-W177 HydrophobicContact CD2-CE3 4.27Å; L145-W177 HydrophobicContact CG-CD2 4.36Å; L145-W177 WeakPolarHBondContact O-CH2 3.33Å; L145-W177 WeakPolarHBondContact O-CZ3 3.49Å; L145-F178 HydrophobicContact CD2-CE2 3.95Å |
| 146 | H | 98.4 | Very high | 97.9 | Very high | 73 Ų | 73 | 76.6 Ų | 76.6 | 34% | 0.338 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.2 | -47.8 | 175.3 | -74.5 | 142.5 | 0 | 0 | 0 | 113 | L142 Q143 A144 R148 F149 Q150 W177 K181 | L142-H146 WeakPolarHBondContact O-CB 3.47Å; L142-H146 PolarHBondContact O-N 3.25Å; L142-H146 PolarHBondContact O-ND1 3.47Å; Q143-H146 WeakPolarHBondContact O-CB 3.47Å; Q143-H146 PolarHBondContact O-N 3.32Å; A144-H146 VanDerWaalsContact C-N 3.32Å; A144-H146 PolarHBondContact O-N 2.88Å; H146-R148 PolarHBondContact O-N 3.5Å; H146-F149 WeakPolarHBondContact O-CB 3.45Å; H146-F149 PolarHBondContact O-N 3.48Å; H146-F149 VanDerWaalsContact O-N 3.13Å; H146-Q150 PolarHBondContact O-N 2.89Å; H146-W177 AromaticContact CD2-CH2 3.5Å; H146-W177 VanDerWaalsContact CD2-CH2 3.5Å; H146-W177 WeakPolarHBondContact CD2-CH2 3.4Å; H146-W177 AromaticContact CD2-CZ2 3.46Å; H146-W177 VanDerWaalsContact CD2-CZ2 3.46Å; H146-W177 WeakPolarHBondContact CD2-CZ2 3.38Å; H146-W177 AromaticContact NE2-CZ2 3.59Å; H146-K181 PolarHBondContact CD2-NZ 2.91Å; H146-K181 PolarHBondContact NE2-NZ 3Å |
| 147 | Q | 98.3 | Very high | 98.1 | Very high | 111 Ų | 111 | 74.7 Ų | 74.7 | 52% | 0.519 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.1 | -47.1 | 178.2 | -175.2 | -175.1 | 2.9 | 0 | 0 | 111.2 | Q143 A144 F149 Q150 Q151 | Q143-Q147 PolarHBondContact O-N 2.86Å; A144-Q147 PolarHBondContact O-N 2.84Å; Q147-F149 VanDerWaalsContact C-N 3.32Å; Q147-F149 PolarHBondContact O-N 3.37Å; Q147-Q150 PolarHBondContact O-N 3.45Å; Q147-Q151 PolarHBondContact O-N 3.18Å |
| 148 | R | 98.1 | Very high | 98.1 | Very high | 55 Ų | 55 | 76.1 Ų | 76.1 | 21% | 0.208 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -68 | -31.1 | 177.3 | -174.6 | 53.3 | 176.1 | -99.2 | 8.7 | 112.7 | A144 H146 Q150 Q151 T152 L155 E159 L163 F178 | A144-R148 PolarHBondContact O-N 3.04Å; H146-R148 PolarHBondContact O-N 3.5Å; R148-Q150 VanDerWaalsContact C-N 3.34Å; R148-Q151 VanDerWaalsContact CD-OE1 3.26Å; R148-Q151 PolarHBondContact O-N 3.38Å; R148-T152 WeakPolarHBondContact CD-OG1 3.34Å; R148-T152 PolarHBondContact NE-OG1 3.23Å; R148-T152 PolarHBondContact O-N 3.07Å; R148-T152 PolarHBondContact O-OG1 2.98Å; R148-L155 HydrophobicContact CG-CD2 3.94Å; R148-E159 IonicContact CZ-OE1 3.85Å; R148-E159 IonicContact NH2-OE1 2.65Å; R148-E159 PolarHBondContact NH2-OE1 3.47Å; R148-L163 HydrophobicContact CB-CD2 4.2Å; R148-L163 HydrophobicContact CG-CD2 4.05Å; R148-F178 HydrophobicContact CG-CZ 4.34Å |
| 149 | F | 98.3 | Very high | 98.1 | Very high | 10 Ų | 10 | 75.9 Ų | 75.9 | 4% | 0.044 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -66.2 | -33.7 | 174.6 | -175.9 | -93.8 | 0 | 0 | 0 | 113.2 | L145 H146 Q147 Q151 T152 Q153 W177 F178 K181 R182 Y185 | L145-F149 WeakPolarHBondContact O-CB 3.31Å; L145-F149 PolarHBondContact O-N 3.22Å; H146-F149 WeakPolarHBondContact O-CB 3.45Å; H146-F149 PolarHBondContact O-N 3.48Å; H146-F149 VanDerWaalsContact O-N 3.13Å; Q147-F149 VanDerWaalsContact C-N 3.32Å; Q147-F149 PolarHBondContact O-N 3.37Å; F149-Q151 VanDerWaalsContact C-N 3.33Å; F149-T152 CarbonylContact O-C 3.55Å; F149-Q153 HydrophobicContact CD2-CB 4.42Å; F149-Q153 HydrophobicContact CE1-CG 4.06Å; F149-Q153 HydrophobicContact CE2-CB 3.81Å; F149-Q153 HydrophobicContact CE2-CG 3.98Å; F149-Q153 HydrophobicContact CZ-CB 4.02Å; F149-Q153 HydrophobicContact CZ-CG 3.7Å; F149-W177 HydrophobicContact CB-CH2 4.26Å; F149-W177 HydrophobicContact CB-CZ3 4.09Å; F149-W177 HydrophobicContact CD2-CZ3 4.39Å; F149-W177 HydrophobicContact CG-CZ3 4.45Å; F149-F178 HydrophobicContact CB-CE1 4.18Å; F149-F178 HydrophobicContact CB-CZ 4.36Å; F149-F178 AromaticContact CD2-CD1 3.88Å; F149-F178 HydrophobicContact CD2-CD1 3.88Å; F149-F178 AromaticContact CD2-CE1 3.82Å; F149-F178 HydrophobicContact CD2-CE1 3.82Å; F149-K181 HydrophobicContact CD1-CD 4.46Å; F149-K181 HydrophobicContact CD1-CG 3.78Å; F149-K181 HydrophobicContact CD2-CB 4.17Å; F149-K181 HydrophobicContact CD2-CG 3.6Å; F149-K181 HydrophobicContact CE1-CG 3.77Å; F149-K181 HydrophobicContact CE2-CB 4.05Å; F149-K181 HydrophobicContact CE2-CG 3.6Å; F149-K181 HydrophobicContact CG-CG 3.7Å; F149-K181 HydrophobicContact CZ-CB 4.46Å; F149-K181 HydrophobicContact CZ-CG 3.69Å; F149-R182 HydrophobicContact CE2-CG 3.72Å; F149-R182 HydrophobicContact CZ-CG 4.14Å; F149-Y185 HydrophobicContact CE1-CD2 4.45Å |
| 150 | Q | 97.9 | Very high | 98.1 | Very high | 163 Ų | 163 | 73.8 Ų | 73.8 | 76% | 0.762 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -66.3 | -36.2 | 174.8 | -70.4 | 169.6 | -54.8 | 0 | 0 | 111.9 | H146 Q147 R148 | H146-Q150 PolarHBondContact O-N 2.89Å; Q147-Q150 PolarHBondContact O-N 3.45Å; R148-Q150 VanDerWaalsContact C-N 3.34Å |
| 151 | Q | 97.6 | Very high | 98.1 | Very high | 130 Ų | 130 | 69.3 Ų | 69.3 | 61% | 0.607 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -73.5 | -48.8 | 175.5 | -63.7 | 168.8 | -9.4 | 0 | 0 | 111.9 | Q147 R148 F149 | Q147-Q151 PolarHBondContact O-N 3.18Å; R148-Q151 VanDerWaalsContact CD-OE1 3.26Å; R148-Q151 PolarHBondContact O-N 3.38Å; F149-Q151 VanDerWaalsContact C-N 3.33Å |
| 152 | T | 97.3 | Very high | 98.1 | Very high | 43 Ų | 43 | 71.7 Ų | 71.7 | 26% | 0.264 | 36% | 0.361 | S | S | . | . | trans | -143.6 | 109.7 | -172.7 | 52.2 | 0 | 0 | 0 | 0 | 109.9 | R148 F149 Y154 L155 F178 | R148-T152 WeakPolarHBondContact CD-OG1 3.34Å; R148-T152 PolarHBondContact NE-OG1 3.23Å; R148-T152 PolarHBondContact O-N 3.07Å; R148-T152 PolarHBondContact O-OG1 2.98Å; F149-T152 CarbonylContact O-C 3.55Å; T152-Y154 PolarHBondContact O-N 3.38Å; T152-L155 WeakPolarHBondContact OG1-CD2 3.46Å; T152-F178 WeakPolarHBondContact O-CE1 3.36Å | ||
| 153 | Q | 97.7 | Very high | 98.1 | Very high | 69 Ų | 69 | 69.6 Ų | 69.6 | 32% | 0.322 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -71.4 | -15 | 179.2 | -61.9 | -168.9 | -3.9 | 0 | 0 | 113.8 | F149 R182 | F149-Q153 HydrophobicContact CD2-CB 4.42Å; F149-Q153 HydrophobicContact CE1-CG 4.06Å; F149-Q153 HydrophobicContact CE2-CB 3.81Å; F149-Q153 HydrophobicContact CE2-CG 3.98Å; F149-Q153 HydrophobicContact CZ-CB 4.02Å; F149-Q153 HydrophobicContact CZ-CG 3.7Å; Q153-R182 VanDerWaalsContact O-CD 3.28Å; Q153-R182 WeakPolarHBondContact O-CD 3.26Å |
| 154 | Y | 98.2 | Very high | 98.1 | Very high | 153 Ų | 153 | 63.8 Ų | 63.8 | 60% | 0.6 | 32% | 0.324 | S | S | * | . | S | Bend | trans | -127.4 | 132.1 | 179.7 | -65.6 | -103.8 | 0 | 0 | 0 | 107.7 | T152 R182 | T152-Y154 PolarHBondContact O-N 3.38Å; Y154-R182 PolarHBondContact OH-NH1 3.32Å |
| 155 | L | 97.6 | Very high | 98.2 | Very high | 16 Ų | 16 | 66.6 Ų | 66.6 | 8% | 0.084 | 35% | 0.346 | C | S | . | . | trans | -109.9 | 128.2 | 176 | -65.6 | -179.7 | 0 | 0 | 0 | 110.7 | R148 T152 E159 R160 L163 V174 F178 | R148-L155 HydrophobicContact CG-CD2 3.94Å; T152-L155 WeakPolarHBondContact OG1-CD2 3.46Å; L155-E159 WeakPolarHBondContact CA-OE2 3.45Å; L155-E159 HydrophobicContact CB-CB 4.46Å; L155-E159 HydrophobicContact CD2-CB 4.12Å; L155-R160 HydrophobicContact CB-CB 4.25Å; L155-R160 PolarHBondContact O-NH2 3.29Å; L155-L163 HydrophobicContact CD1-CD2 3.67Å; L155-V174 HydrophobicContact CD1-CG1 4.04Å; L155-F178 HydrophobicContact CD1-CD1 4.39Å; L155-F178 HydrophobicContact CD1-CD2 4.07Å; L155-F178 HydrophobicContact CD1-CE1 3.93Å; L155-F178 HydrophobicContact CD1-CE2 3.57Å; L155-F178 HydrophobicContact CD1-CG 4.48Å; L155-F178 HydrophobicContact CD1-CZ 3.5Å; L155-F178 VanDerWaalsContact CD1-CZ 3.5Å; L155-F178 HydrophobicContact CD2-CE1 4.42Å; L155-F178 HydrophobicContact CD2-CZ 4.46Å; L155-F178 HydrophobicContact CG-CD1 4.2Å; L155-F178 HydrophobicContact CG-CE1 3.78Å; L155-F178 HydrophobicContact CG-CE2 4.34Å; L155-F178 HydrophobicContact CG-CZ 3.88Å | ||
| 156 | A | 97.9 | Very high | 98.1 | Very high | 50 Ų | 50 | 74.3 Ų | 74.3 | 41% | 0.413 | 38% | 0.38 | S | S | . | . | trans | -60.8 | 168.9 | 165.5 | 0 | 0 | 0 | 0 | 0 | 111 | P158 E159 R160 | A156-P158 HydrophobicContact CB-CG 4.46Å; A156-E159 HydrophobicContact CB-CG 4.22Å; A156-E159 WeakPolarHBondContact CB-OE2 3.47Å; A156-E159 PolarHBondContact N-OE2 3.01Å; A156-R160 VanDerWaalsContact O-CB 3.26Å; A156-R160 WeakPolarHBondContact O-CB 3.29Å; A156-R160 PolarHBondContact O-N 3.49Å; A156-R160 VanDerWaalsContact O-N 3.16Å | ||
| 157 | L | 98.2 | Very high | 98.1 | Very high | 111 Ų | 111 | 72 Ų | 72 | 58% | 0.581 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -60 | -49.5 | 179.7 | -171.8 | 62.5 | 0 | 0 | 0 | 113.8 | R160 A161 | L157-R160 PolarHBondContact O-N 2.89Å; L157-A161 PolarHBondContact O-N 3.19Å; L157-A161 VanDerWaalsContact O-N 3.14Å |
| 158 | P | 98.1 | Very high | 98.1 | Very high | 87 Ų | 87 | 70 Ų | 70 | 57% | 0.565 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -63.6 | -49.2 | 179.8 | 23.3 | -33.4 | 0 | 0 | 0 | 112.2 | A156 R160 A161 D162 | A156-P158 HydrophobicContact CB-CG 4.46Å; P158-R160 PolarHBondContact O-N 2.91Å; P158-R160 VanDerWaalsContact O-N 3.1Å; P158-A161 WeakPolarHBondContact O-CA 3.49Å; P158-A161 WeakPolarHBondContact O-CB 3.29Å; P158-A161 PolarHBondContact O-N 3.04Å; P158-D162 PolarHBondContact O-N 2.97Å |
| 159 | E | 98.3 | Very high | 98.1 | Very high | 53 Ų | 53 | 68.4 Ų | 68.4 | 25% | 0.248 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -55.8 | -34.9 | 179.2 | -55.9 | 177.8 | 113.1 | 0 | 0 | 113.1 | R148 L155 A156 L163 | R148-E159 IonicContact CZ-OE1 3.85Å; R148-E159 IonicContact NH2-OE1 2.65Å; R148-E159 PolarHBondContact NH2-OE1 3.47Å; L155-E159 WeakPolarHBondContact CA-OE2 3.45Å; L155-E159 HydrophobicContact CB-CB 4.46Å; L155-E159 HydrophobicContact CD2-CB 4.12Å; A156-E159 HydrophobicContact CB-CG 4.22Å; A156-E159 WeakPolarHBondContact CB-OE2 3.47Å; A156-E159 PolarHBondContact N-OE2 3.01Å; E159-L163 WeakPolarHBondContact O-CB 3.38Å; E159-L163 PolarHBondContact O-N 3.19Å |
| 160 | R | 98.6 | Very high | 98.1 | Very high | 54 Ų | 54 | 71.4 Ų | 71.4 | 20% | 0.204 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -72.2 | -36.2 | 176.6 | -171.7 | -169.8 | -51.7 | 150.1 | 11.2 | 111.9 | L155 A156 L157 P158 A164 Q171 V174 | L155-R160 HydrophobicContact CB-CB 4.25Å; L155-R160 PolarHBondContact O-NH2 3.29Å; A156-R160 VanDerWaalsContact O-CB 3.26Å; A156-R160 WeakPolarHBondContact O-CB 3.29Å; A156-R160 PolarHBondContact O-N 3.49Å; A156-R160 VanDerWaalsContact O-N 3.16Å; L157-R160 PolarHBondContact O-N 2.89Å; P158-R160 PolarHBondContact O-N 2.91Å; P158-R160 VanDerWaalsContact O-N 3.1Å; R160-A164 WeakPolarHBondContact O-CB 3.16Å; R160-A164 PolarHBondContact O-N 3.27Å; R160-Q171 WeakPolarHBondContact CD-O 3.45Å; R160-Q171 HydrophobicContact CG-CB 4.36Å; R160-V174 HydrophobicContact CG-CB 4.12Å; R160-V174 HydrophobicContact CG-CG1 3.92Å |
| 161 | A | 98.5 | Very high | 98.1 | Very high | 31 Ų | 31 | 67.7 Ų | 67.7 | 26% | 0.256 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65 | -45.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | L157 P158 L163 A164 A165 | L157-A161 PolarHBondContact O-N 3.19Å; L157-A161 VanDerWaalsContact O-N 3.14Å; P158-A161 WeakPolarHBondContact O-CA 3.49Å; P158-A161 WeakPolarHBondContact O-CB 3.29Å; P158-A161 PolarHBondContact O-N 3.04Å; A161-L163 PolarHBondContact O-N 2.94Å; A161-A164 WeakPolarHBondContact O-CB 3.33Å; A161-A164 PolarHBondContact O-N 3.36Å; A161-A165 WeakPolarHBondContact O-CB 3.35Å; A161-A165 PolarHBondContact O-N 3.19Å |
| 162 | D | 98.4 | Very high | 98.1 | Very high | 88 Ų | 88 | 65.8 Ų | 65.8 | 47% | 0.471 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.7 | -46.5 | 177.8 | -60.4 | -24.5 | 0 | 0 | 0 | 112.2 | P158 A165 K166 | P158-D162 PolarHBondContact O-N 2.97Å; D162-A165 PolarHBondContact O-N 3.44Å; D162-K166 WeakPolarHBondContact O-CB 3.42Å; D162-K166 WeakPolarHBondContact O-CD 3.41Å; D162-K166 VanDerWaalsContact O-CG 3.23Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.42Å |
| 163 | L | 98.4 | Very high | 98.2 | Very high | 15 Ų | 15 | 66 Ų | 66 | 8% | 0.079 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -68.7 | -35.7 | 179.5 | -173.2 | 62.5 | 0 | 0 | 0 | 112 | L145 R148 L155 E159 A161 L167 V174 F178 | L145-L163 HydrophobicContact CD2-CD2 4Å; L145-L163 HydrophobicContact CD2-CG 4.49Å; R148-L163 HydrophobicContact CB-CD2 4.2Å; R148-L163 HydrophobicContact CG-CD2 4.05Å; L155-L163 HydrophobicContact CD1-CD2 3.67Å; E159-L163 WeakPolarHBondContact O-CB 3.38Å; E159-L163 PolarHBondContact O-N 3.19Å; A161-L163 PolarHBondContact O-N 2.94Å; L163-L167 HydrophobicContact CD1-CD1 3.83Å; L163-L167 HydrophobicContact CD1-CG 4.22Å; L163-L167 HydrophobicContact CG-CD1 4.11Å; L163-L167 WeakPolarHBondContact O-CB 3.49Å; L163-L167 WeakPolarHBondContact O-CG 3.38Å; L163-L167 PolarHBondContact O-N 3.44Å; L163-V174 HydrophobicContact CD2-CG1 4.08Å; L163-F178 HydrophobicContact CD2-CE2 3.92Å; L163-F178 HydrophobicContact CD2-CZ 4.24Å |
| 164 | A | 98.6 | Very high | 98.2 | Very high | 4 Ų | 4 | 62.8 Ų | 62.8 | 3% | 0.033 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.4 | -49.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111 | R160 A161 L167 G168 L169 Q171 V174 | R160-A164 WeakPolarHBondContact O-CB 3.16Å; R160-A164 PolarHBondContact O-N 3.27Å; A161-A164 WeakPolarHBondContact O-CB 3.33Å; A161-A164 PolarHBondContact O-N 3.36Å; A164-L167 PolarHBondContact O-N 2.95Å; A164-G168 PolarHBondContact O-N 3.39Å; A164-G168 VanDerWaalsContact O-N 3.13Å; A164-L169 CarbonylContact C-O 3.42Å; A164-L169 VanDerWaalsContact CB-O 3.31Å; A164-L169 WeakPolarHBondContact CB-O 3.36Å; A164-L169 PolarHBondContact O-N 3.26Å; A164-Q171 HydrophobicContact CB-CG 4.1Å; A164-V174 HydrophobicContact CB-CG2 4.01Å |
| 165 | A | 98.4 | Very high | 98.2 | Very high | 82 Ų | 82 | 60.7 Ų | 60.7 | 68% | 0.678 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -59.8 | -49.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A161 D162 L167 G168 | A161-A165 WeakPolarHBondContact O-CB 3.35Å; A161-A165 PolarHBondContact O-N 3.19Å; D162-A165 PolarHBondContact O-N 3.44Å; A165-L167 PolarHBondContact O-N 2.93Å; A165-L167 VanDerWaalsContact O-N 3.14Å; A165-G168 PolarHBondContact O-N 3.43Å |
| 166 | K | 98.1 | Very high | 98.2 | Very high | 163 Ų | 163 | 63.8 Ų | 63.8 | 71% | 0.709 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -59.1 | -26 | 179.5 | -74.7 | 168.9 | -177 | 176 | 0 | 114.2 | D162 | D162-K166 WeakPolarHBondContact O-CB 3.42Å; D162-K166 WeakPolarHBondContact O-CD 3.41Å; D162-K166 VanDerWaalsContact O-CG 3.23Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.42Å |
| 167 | L | 97.9 | Very high | 98.3 | Very high | 24 Ų | 24 | 62.6 Ų | 62.6 | 13% | 0.126 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -107.8 | -0.1 | -175.7 | -62 | -175.8 | 0 | 0 | 0 | 114.1 | Q141 A144 L145 L163 A164 A165 L169 | Q141-L167 HydrophobicContact CG-CB 4.32Å; Q141-L167 PolarHBondContact NE2-O 3.45Å; A144-L167 HydrophobicContact CB-CD1 4.09Å; A144-L167 HydrophobicContact CB-CD2 3.65Å; A144-L167 HydrophobicContact CB-CG 4.46Å; L145-L167 HydrophobicContact CD1-CD1 4.5Å; L145-L167 HydrophobicContact CD2-CD1 3.99Å; L145-L167 HydrophobicContact CG-CD1 3.77Å; L163-L167 HydrophobicContact CD1-CD1 3.83Å; L163-L167 HydrophobicContact CD1-CG 4.22Å; L163-L167 HydrophobicContact CG-CD1 4.11Å; L163-L167 WeakPolarHBondContact O-CB 3.49Å; L163-L167 WeakPolarHBondContact O-CG 3.38Å; L163-L167 PolarHBondContact O-N 3.44Å; A164-L167 PolarHBondContact O-N 2.95Å; A165-L167 PolarHBondContact O-N 2.93Å; A165-L167 VanDerWaalsContact O-N 3.14Å; L167-L169 VanDerWaalsContact C-N 3.26Å; L167-L169 HydrophobicContact CB-CD1 4.1Å; L167-L169 HydrophobicContact CB-CG 3.99Å; L167-L169 HydrophobicContact CD1-CD1 4.44Å; L167-L169 PolarHBondContact O-N 3.33Å |
| 168 | G | 98.1 | Very high | 98.3 | Very high | 69 Ų | 69 | 57.8 Ų | 57.8 | 71% | 0.711 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.6 | 31.2 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A164 A165 | A164-G168 PolarHBondContact O-N 3.39Å; A164-G168 VanDerWaalsContact O-N 3.13Å; A165-G168 PolarHBondContact O-N 3.43Å |
| 169 | L | 98 | Very high | 98.3 | Very high | 21 Ų | 21 | 57.5 Ų | 57.5 | 11% | 0.11 | 32% | 0.317 | C | S | . | . | trans | -111.6 | 159.9 | -178.9 | -62.6 | -177.2 | 0 | 0 | 0 | 110.9 | Y137 L145 A164 L167 Q173 V174 | Y137-L169 HydrophobicContact CD1-CD1 3.99Å; Y137-L169 HydrophobicContact CD1-CD2 3.8Å; Y137-L169 HydrophobicContact CE1-CD1 3.96Å; Y137-L169 HydrophobicContact CE1-CD2 3.79Å; L145-L169 HydrophobicContact CD1-CD1 4.24Å; A164-L169 CarbonylContact C-O 3.42Å; A164-L169 VanDerWaalsContact CB-O 3.31Å; A164-L169 WeakPolarHBondContact CB-O 3.36Å; A164-L169 PolarHBondContact O-N 3.26Å; L167-L169 VanDerWaalsContact C-N 3.26Å; L167-L169 HydrophobicContact CB-CD1 4.1Å; L167-L169 HydrophobicContact CB-CG 3.99Å; L167-L169 HydrophobicContact CD1-CD1 4.44Å; L167-L169 PolarHBondContact O-N 3.33Å; L169-Q173 HydrophobicContact CB-CB 4.49Å; L169-V174 HydrophobicContact CB-CG2 4.22Å; L169-V174 HydrophobicContact CD1-CG2 4.47Å | ||
| 170 | T | 98.3 | Very high | 98.3 | Very high | 74 Ų | 74 | 59.9 Ų | 59.9 | 45% | 0.454 | 33% | 0.332 | S | S | . | . | trans | -78.8 | 150.4 | 168.6 | 62.9 | 0 | 0 | 0 | 0 | 111.2 | T172 Q173 V174 | T170-T172 PolarHBondContact O-N 3.28Å; T170-T172 VanDerWaalsContact O-N 3.13Å; T170-Q173 WeakPolarHBondContact O-CB 3.32Å; T170-Q173 PolarHBondContact O-N 3.45Å; T170-Q173 WeakPolarHBondContact OG1-CB 3.44Å; T170-Q173 WeakPolarHBondContact OG1-CG 3.46Å; T170-Q173 PolarHBondContact OG1-N 3.13Å; T170-Q173 VanDerWaalsContact OG1-N 3.15Å; T170-Q173 PolarHBondContact OG1-OE1 3.06Å; T170-V174 PolarHBondContact O-N 3.07Å; T170-V174 VanDerWaalsContact O-N 3.13Å | ||
| 171 | Q | 98.4 | Very high | 98.2 | Very high | 85 Ų | 85 | 60.2 Ų | 60.2 | 40% | 0.397 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -54.5 | -33.3 | 172.7 | -63.8 | -174.3 | 26.5 | 0 | 0 | 112.3 | R160 A164 K175 | R160-Q171 WeakPolarHBondContact CD-O 3.45Å; R160-Q171 HydrophobicContact CG-CB 4.36Å; A164-Q171 HydrophobicContact CB-CG 4.1Å; Q171-K175 VanDerWaalsContact O-CB 3.29Å; Q171-K175 WeakPolarHBondContact O-CB 3.39Å; Q171-K175 PolarHBondContact O-N 3.44Å |
| 172 | T | 98.2 | Very high | 98.2 | Very high | 90 Ų | 90 | 62.1 Ų | 62.1 | 55% | 0.552 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -67 | -42.5 | 176.4 | -59.3 | 0 | 0 | 0 | 0 | 112.2 | T170 K175 I176 | T170-T172 PolarHBondContact O-N 3.28Å; T170-T172 VanDerWaalsContact O-N 3.13Å; T172-K175 PolarHBondContact O-N 2.86Å; T172-I176 HydrophobicContact CG2-CD1 3.86Å; T172-I176 HydrophobicContact CG2-CG1 4.48Å; T172-I176 WeakPolarHBondContact O-CB 3.5Å; T172-I176 VanDerWaalsContact O-CG1 3.29Å; T172-I176 WeakPolarHBondContact O-CG1 3.37Å; T172-I176 PolarHBondContact O-N 2.92Å |
| 173 | Q | 98 | Very high | 98.2 | Very high | 48 Ų | 48 | 61.5 Ų | 61.5 | 22% | 0.224 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.7 | -46.4 | 174 | -80.4 | 162.1 | -53.1 | 0 | 0 | 111.5 | Y137 L169 T170 I176 W177 | Y137-Q173 HydrophobicContact CE1-CB 4.26Å; Y137-Q173 HydrophobicContact CE1-CG 4.39Å; Y137-Q173 WeakPolarHBondContact OH-CB 3.28Å; L169-Q173 HydrophobicContact CB-CB 4.49Å; T170-Q173 WeakPolarHBondContact O-CB 3.32Å; T170-Q173 PolarHBondContact O-N 3.45Å; T170-Q173 WeakPolarHBondContact OG1-CB 3.44Å; T170-Q173 WeakPolarHBondContact OG1-CG 3.46Å; T170-Q173 PolarHBondContact OG1-N 3.13Å; T170-Q173 VanDerWaalsContact OG1-N 3.15Å; T170-Q173 PolarHBondContact OG1-OE1 3.06Å; Q173-I176 PolarHBondContact O-N 3.02Å; Q173-W177 WeakPolarHBondContact O-CB 3.42Å; Q173-W177 PolarHBondContact O-N 3.02Å |
| 174 | V | 98.4 | Very high | 98.1 | Very high | 1 Ų | 1 | 67.8 Ų | 67.8 | 1% | 0.006 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -60.3 | -47 | 174.9 | -179.3 | 0 | 0 | 0 | 0 | 110.6 | L145 L155 R160 L163 A164 L169 T170 I176 W177 F178 | L145-V174 HydrophobicContact CD2-CG1 4.33Å; L155-V174 HydrophobicContact CD1-CG1 4.04Å; R160-V174 HydrophobicContact CG-CB 4.12Å; R160-V174 HydrophobicContact CG-CG1 3.92Å; L163-V174 HydrophobicContact CD2-CG1 4.08Å; A164-V174 HydrophobicContact CB-CG2 4.01Å; L169-V174 HydrophobicContact CB-CG2 4.22Å; L169-V174 HydrophobicContact CD1-CG2 4.47Å; T170-V174 PolarHBondContact O-N 3.07Å; T170-V174 VanDerWaalsContact O-N 3.13Å; V174-I176 VanDerWaalsContact C-N 3.34Å; V174-I176 PolarHBondContact O-N 3.31Å; V174-W177 PolarHBondContact O-N 3.01Å; V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.94Å; V174-F178 WeakPolarHBondContact O-CD2 3.49Å; V174-F178 PolarHBondContact O-N 3.35Å |
| 175 | K | 98.3 | Very high | 97.9 | Very high | 108 Ų | 108 | 71.9 Ų | 71.9 | 47% | 0.47 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -57.5 | -42.4 | 176.7 | -172.6 | -170.2 | 173 | -177.9 | 0 | 112.3 | Q171 T172 Q179 | Q171-K175 VanDerWaalsContact O-CB 3.29Å; Q171-K175 WeakPolarHBondContact O-CB 3.39Å; Q171-K175 PolarHBondContact O-N 3.44Å; T172-K175 PolarHBondContact O-N 2.86Å; K175-Q179 WeakPolarHBondContact O-CG 3.19Å; K175-Q179 PolarHBondContact O-N 2.93Å; K175-Q179 PolarHBondContact O-NE2 2.97Å |
| 176 | I | 98.3 | Very high | 97.7 | Very high | 81 Ų | 81 | 75.2 Ų | 75.2 | 42% | 0.415 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -70 | -44.5 | 178.5 | -70 | 167.7 | 0 | 0 | 0 | 110.5 | T172 Q173 V174 F178 Q179 N180 | T172-I176 HydrophobicContact CG2-CD1 3.86Å; T172-I176 HydrophobicContact CG2-CG1 4.48Å; T172-I176 WeakPolarHBondContact O-CB 3.5Å; T172-I176 VanDerWaalsContact O-CG1 3.29Å; T172-I176 WeakPolarHBondContact O-CG1 3.37Å; T172-I176 PolarHBondContact O-N 2.92Å; Q173-I176 PolarHBondContact O-N 3.02Å; V174-I176 VanDerWaalsContact C-N 3.34Å; V174-I176 PolarHBondContact O-N 3.31Å; I176-F178 PolarHBondContact O-N 3.24Å; I176-Q179 PolarHBondContact O-N 3.2Å; I176-N180 VanDerWaalsContact O-CG 3.31Å; I176-N180 PolarHBondContact O-N 3.37Å |
| 177 | W | 98.3 | Very high | 97.6 | Very high | 26 Ų | 26 | 74.1 Ų | 74.1 | 10% | 0.098 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.5 | -46.2 | 178.4 | -172.5 | 102.8 | 0 | 0 | 0 | 111.5 | Y137 L145 H146 F149 Q173 V174 Q179 N180 K181 | Y137-W177 AromaticContact CD2-CD1 3.91Å; Y137-W177 AromaticContact CE2-CD1 3.72Å; L145-W177 VanDerWaalsContact C-CH2 3.46Å; L145-W177 HydrophobicContact CB-CD2 4.02Å; L145-W177 HydrophobicContact CB-CE3 4.03Å; L145-W177 HydrophobicContact CB-CH2 3.63Å; L145-W177 HydrophobicContact CB-CZ2 3.58Å; L145-W177 HydrophobicContact CB-CZ3 3.86Å; L145-W177 HydrophobicContact CD1-CD2 4Å; L145-W177 HydrophobicContact CD1-CG 3.99Å; L145-W177 HydrophobicContact CD2-CD2 4.36Å; L145-W177 HydrophobicContact CD2-CE3 4.27Å; L145-W177 HydrophobicContact CG-CD2 4.36Å; L145-W177 WeakPolarHBondContact O-CH2 3.33Å; L145-W177 WeakPolarHBondContact O-CZ3 3.49Å; H146-W177 AromaticContact CD2-CH2 3.5Å; H146-W177 VanDerWaalsContact CD2-CH2 3.5Å; H146-W177 WeakPolarHBondContact CD2-CH2 3.4Å; H146-W177 AromaticContact CD2-CZ2 3.46Å; H146-W177 VanDerWaalsContact CD2-CZ2 3.46Å; H146-W177 WeakPolarHBondContact CD2-CZ2 3.38Å; H146-W177 AromaticContact NE2-CZ2 3.59Å; F149-W177 HydrophobicContact CB-CH2 4.26Å; F149-W177 HydrophobicContact CB-CZ3 4.09Å; F149-W177 HydrophobicContact CD2-CZ3 4.39Å; F149-W177 HydrophobicContact CG-CZ3 4.45Å; Q173-W177 WeakPolarHBondContact O-CB 3.42Å; Q173-W177 PolarHBondContact O-N 3.02Å; V174-W177 PolarHBondContact O-N 3.01Å; W177-Q179 PolarHBondContact O-N 3.4Å; W177-N180 PolarHBondContact O-N 3.35Å; W177-K181 HydrophobicContact CE3-CB 4.11Å; W177-K181 HydrophobicContact CH2-CB 4.21Å; W177-K181 HydrophobicContact CH2-CD 3.94Å; W177-K181 HydrophobicContact CH2-CG 3.9Å; W177-K181 HydrophobicContact CZ2-CD 4.3Å; W177-K181 HydrophobicContact CZ3-CB 3.87Å; W177-K181 HydrophobicContact CZ3-CD 4.44Å; W177-K181 HydrophobicContact CZ3-CG 3.9Å; W177-K181 WeakPolarHBondContact O-CB 3.37Å; W177-K181 PolarHBondContact O-N 3.09Å |
| 178 | F | 98.6 | Very high | 97.2 | Very high | 9 Ų | 9 | 77.6 Ų | 77.6 | 4% | 0.039 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.4 | -36.8 | 177.8 | -91.1 | -101.1 | 0 | 0 | 0 | 112.9 | L145 R148 F149 T152 L155 L163 V174 I176 R182 | L145-F178 HydrophobicContact CD2-CE2 3.95Å; R148-F178 HydrophobicContact CG-CZ 4.34Å; F149-F178 HydrophobicContact CB-CE1 4.18Å; F149-F178 HydrophobicContact CB-CZ 4.36Å; F149-F178 AromaticContact CD2-CD1 3.88Å; F149-F178 HydrophobicContact CD2-CD1 3.88Å; F149-F178 AromaticContact CD2-CE1 3.82Å; F149-F178 HydrophobicContact CD2-CE1 3.82Å; T152-F178 WeakPolarHBondContact O-CE1 3.36Å; L155-F178 HydrophobicContact CD1-CD1 4.39Å; L155-F178 HydrophobicContact CD1-CD2 4.07Å; L155-F178 HydrophobicContact CD1-CE1 3.93Å; L155-F178 HydrophobicContact CD1-CE2 3.57Å; L155-F178 HydrophobicContact CD1-CG 4.48Å; L155-F178 HydrophobicContact CD1-CZ 3.5Å; L155-F178 VanDerWaalsContact CD1-CZ 3.5Å; L155-F178 HydrophobicContact CD2-CE1 4.42Å; L155-F178 HydrophobicContact CD2-CZ 4.46Å; L155-F178 HydrophobicContact CG-CD1 4.2Å; L155-F178 HydrophobicContact CG-CE1 3.78Å; L155-F178 HydrophobicContact CG-CE2 4.34Å; L155-F178 HydrophobicContact CG-CZ 3.88Å; L163-F178 HydrophobicContact CD2-CE2 3.92Å; L163-F178 HydrophobicContact CD2-CZ 4.24Å; V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.94Å; V174-F178 WeakPolarHBondContact O-CD2 3.49Å; V174-F178 PolarHBondContact O-N 3.35Å; I176-F178 PolarHBondContact O-N 3.24Å; F178-R182 WeakPolarHBondContact O-CB 3.45Å; F178-R182 WeakPolarHBondContact O-CG 3.49Å; F178-R182 PolarHBondContact O-N 3.45Å |
| 179 | Q | 98.4 | Very high | 96.7 | Very high | 81 Ų | 81 | 79.6 Ų | 79.6 | 38% | 0.379 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.5 | -47.7 | 172.3 | -76.5 | 170.5 | 96.5 | 0 | 0 | 111.6 | K175 I176 W177 K181 R182 S183 | K175-Q179 WeakPolarHBondContact O-CG 3.19Å; K175-Q179 PolarHBondContact O-N 2.93Å; K175-Q179 PolarHBondContact O-NE2 2.97Å; I176-Q179 PolarHBondContact O-N 3.2Å; W177-Q179 PolarHBondContact O-N 3.4Å; Q179-K181 VanDerWaalsContact C-N 3.34Å; Q179-K181 PolarHBondContact O-N 3.41Å; Q179-R182 PolarHBondContact O-N 3.02Å; Q179-S183 PolarHBondContact O-N 2.83Å; Q179-S183 PolarHBondContact O-OG 2.89Å |
| 180 | N | 97.9 | Very high | 95.9 | Very high | 104 Ų | 104 | 86.9 Ų | 86.9 | 56% | 0.556 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -61.9 | -42.1 | 178.6 | -69 | -14.8 | 0 | 0 | 0 | 111.6 | I176 W177 S183 K184 | I176-N180 VanDerWaalsContact O-CG 3.31Å; I176-N180 PolarHBondContact O-N 3.37Å; W177-N180 PolarHBondContact O-N 3.35Å; N180-S183 PolarHBondContact O-N 2.86Å; N180-K184 PolarHBondContact O-N 3.28Å |
| 181 | K | 97.8 | Very high | 94.7 | Very high | 60 Ų | 60 | 90.4 Ų | 90.4 | 26% | 0.261 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.6 | -46.6 | 177 | -171.4 | 70.5 | 176.8 | -172.7 | 0 | 111.5 | H146 F149 W177 Q179 K184 Y185 | H146-K181 PolarHBondContact CD2-NZ 2.91Å; H146-K181 PolarHBondContact NE2-NZ 3Å; F149-K181 HydrophobicContact CD1-CD 4.46Å; F149-K181 HydrophobicContact CD1-CG 3.78Å; F149-K181 HydrophobicContact CD2-CB 4.17Å; F149-K181 HydrophobicContact CD2-CG 3.6Å; F149-K181 HydrophobicContact CE1-CG 3.77Å; F149-K181 HydrophobicContact CE2-CB 4.05Å; F149-K181 HydrophobicContact CE2-CG 3.6Å; F149-K181 HydrophobicContact CG-CG 3.7Å; F149-K181 HydrophobicContact CZ-CB 4.46Å; F149-K181 HydrophobicContact CZ-CG 3.69Å; W177-K181 HydrophobicContact CE3-CB 4.11Å; W177-K181 HydrophobicContact CH2-CB 4.21Å; W177-K181 HydrophobicContact CH2-CD 3.94Å; W177-K181 HydrophobicContact CH2-CG 3.9Å; W177-K181 HydrophobicContact CZ2-CD 4.3Å; W177-K181 HydrophobicContact CZ3-CB 3.87Å; W177-K181 HydrophobicContact CZ3-CD 4.44Å; W177-K181 HydrophobicContact CZ3-CG 3.9Å; W177-K181 WeakPolarHBondContact O-CB 3.37Å; W177-K181 PolarHBondContact O-N 3.09Å; Q179-K181 VanDerWaalsContact C-N 3.34Å; Q179-K181 PolarHBondContact O-N 3.41Å; K181-K184 PolarHBondContact O-N 3.43Å; K181-Y185 WeakPolarHBondContact O-CB 3.15Å; K181-Y185 PolarHBondContact O-N 2.84Å |
| 182 | R | 97.6 | Very high | 92.9 | Very high | 72 Ų | 72 | 88.2 Ų | 88.2 | 27% | 0.272 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.1 | -41.5 | 174.3 | -75 | -169.4 | -74.1 | 124.3 | -0.5 | 112.9 | F149 Q153 Y154 F178 Q179 Y185 K186 | F149-R182 HydrophobicContact CE2-CG 3.72Å; F149-R182 HydrophobicContact CZ-CG 4.14Å; Q153-R182 VanDerWaalsContact O-CD 3.28Å; Q153-R182 WeakPolarHBondContact O-CD 3.26Å; Y154-R182 PolarHBondContact OH-NH1 3.32Å; F178-R182 WeakPolarHBondContact O-CB 3.45Å; F178-R182 WeakPolarHBondContact O-CG 3.49Å; F178-R182 PolarHBondContact O-N 3.45Å; Q179-R182 PolarHBondContact O-N 3.02Å; R182-Y185 PolarHBondContact O-N 3.36Å; R182-K186 WeakPolarHBondContact O-CB 3.5Å; R182-K186 PolarHBondContact O-N 3.07Å |
| 183 | S | 97.8 | Very high | 90.7 | Very high | 74 Ų | 74 | 87.8 Ų | 87.8 | 52% | 0.517 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 176.3 | -68.9 | 0 | 0 | 0 | 0 | 112.2 | Q179 N180 K187 | Q179-S183 PolarHBondContact O-N 2.83Å; Q179-S183 PolarHBondContact O-OG 2.89Å; N180-S183 PolarHBondContact O-N 2.86Å; S183-K187 WeakPolarHBondContact O-CB 3.49Å; S183-K187 PolarHBondContact O-N 3.21Å; S183-K187 VanDerWaalsContact O-N 3.09Å |
| 184 | K | 95.9 | Very high | 88.1 | Confident | 147 Ų | 147 | 89 Ų | 89 | 64% | 0.639 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.8 | -46.3 | 172.5 | -175 | 176.2 | 178.8 | 178.9 | 0 | 111.2 | N180 K181 K187 I188 | N180-K184 PolarHBondContact O-N 3.28Å; K181-K184 PolarHBondContact O-N 3.43Å; K184-K187 PolarHBondContact O-N 3.24Å; K184-K187 VanDerWaalsContact O-N 3.16Å; K184-I188 PolarHBondContact O-N 2.63Å |
| 185 | Y | 94.9 | Very high | 85.5 | Confident | 91 Ų | 91 | 93.5 Ų | 93.5 | 36% | 0.357 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.5 | -48 | 179.9 | -171 | -98.6 | 0 | 0 | 0 | 112.3 | F149 K181 R182 K187 I188 M189 | F149-Y185 HydrophobicContact CE1-CD2 4.45Å; K181-Y185 WeakPolarHBondContact O-CB 3.15Å; K181-Y185 PolarHBondContact O-N 2.84Å; R182-Y185 PolarHBondContact O-N 3.36Å; Y185-K187 VanDerWaalsContact C-N 3.3Å; Y185-K187 PolarHBondContact O-N 3.48Å; Y185-I188 HydrophobicContact CD2-CD1 4.32Å; Y185-I188 WeakPolarHBondContact O-CG1 3.11Å; Y185-I188 PolarHBondContact O-N 3.25Å; Y185-M189 HydrophobicContact CD1-CG 4.01Å; Y185-M189 HydrophobicContact CE1-CG 3.75Å; Y185-M189 HydrophobicContact CE1-SD 3.66Å; Y185-M189 HydrophobicContact CE2-CG 4.47Å; Y185-M189 HydrophobicContact CE2-SD 4.38Å; Y185-M189 HydrophobicContact CG-CG 4.49Å; Y185-M189 VanDerWaalsContact CZ-SD 3.58Å; Y185-M189 WeakPolarHBondContact O-CG 3.04Å; Y185-M189 PolarHBondContact O-N 3.27Å; Y185-M189 PolarHBondContact OH-SD 3.16Å |
| 186 | K | 95.5 | Very high | 82.7 | Confident | 152 Ų | 152 | 97.5 Ų | 97.5 | 66% | 0.661 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.7 | -38 | 174.6 | -172.4 | 177.2 | 68.2 | 172.9 | 0 | 112.3 | R182 K190 | R182-K186 WeakPolarHBondContact O-CB 3.5Å; R182-K186 PolarHBondContact O-N 3.07Å; K186-K190 WeakPolarHBondContact O-CB 3.34Å; K186-K190 PolarHBondContact O-N 3Å |
| 187 | K | 94 | Very high | 80.1 | Confident | 140 Ų | 140 | 96.6 Ų | 96.6 | 61% | 0.609 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.2 | -46.6 | 177.6 | -170 | 178 | 178.7 | -179.6 | 0 | 111.5 | S183 K184 Y185 K190 H191 | S183-K187 WeakPolarHBondContact O-CB 3.49Å; S183-K187 PolarHBondContact O-N 3.21Å; S183-K187 VanDerWaalsContact O-N 3.09Å; K184-K187 PolarHBondContact O-N 3.24Å; K184-K187 VanDerWaalsContact O-N 3.16Å; Y185-K187 VanDerWaalsContact C-N 3.3Å; Y185-K187 PolarHBondContact O-N 3.48Å; K187-K190 PolarHBondContact O-N 3.24Å; K187-H191 WeakPolarHBondContact O-CB 3.32Å; K187-H191 PolarHBondContact O-CD2 3.43Å; K187-H191 VanDerWaalsContact O-CD2 3.25Å; K187-H191 PolarHBondContact O-N 3.35Å |
| 188 | I | 90.6 | Very high | 77.3 | Confident | 97 Ų | 97 | 103 Ų | 103 | 50% | 0.497 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.6 | -42.9 | 178.8 | 61.6 | 175.2 | 0 | 0 | 0 | 111.6 | K184 Y185 K190 H191 G192 | K184-I188 PolarHBondContact O-N 2.63Å; Y185-I188 HydrophobicContact CD2-CD1 4.32Å; Y185-I188 WeakPolarHBondContact O-CG1 3.11Å; Y185-I188 PolarHBondContact O-N 3.25Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 3.06Å; I188-H191 PolarHBondContact O-N 3.28Å; I188-G192 PolarHBondContact O-N 3.38Å |
| 189 | M | 87.6 | Confident | 74.6 | Confident | 110 Ų | 110 | 111.2 Ų | 111.2 | 54% | 0.542 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.8 | -38.6 | 179.2 | -62.7 | -107.4 | 74.2 | 0 | 0 | 112.4 | Y185 | Y185-M189 HydrophobicContact CD1-CG 4.01Å; Y185-M189 HydrophobicContact CE1-CG 3.75Å; Y185-M189 HydrophobicContact CE1-SD 3.66Å; Y185-M189 HydrophobicContact CE2-CG 4.47Å; Y185-M189 HydrophobicContact CE2-SD 4.38Å; Y185-M189 HydrophobicContact CG-CG 4.49Å; Y185-M189 VanDerWaalsContact CZ-SD 3.58Å; Y185-M189 WeakPolarHBondContact O-CG 3.04Å; Y185-M189 PolarHBondContact O-N 3.27Å; Y185-M189 PolarHBondContact OH-SD 3.16Å |
| 190 | K | 81.8 | Confident | 72.1 | Confident | 174 Ų | 174 | 114.1 Ų | 114.1 | 76% | 0.757 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -75.3 | -24.7 | -179.9 | -172.1 | 178.7 | 175.9 | -168.9 | 0 | 113.7 | K186 K187 I188 | K186-K190 WeakPolarHBondContact O-CB 3.34Å; K186-K190 PolarHBondContact O-N 3Å; K187-K190 PolarHBondContact O-N 3.24Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 3.06Å |
| 191 | H | 73.5 | Confident | 69.3 | Low | 148 Ų | 148 | 116.4 Ų | 116.4 | 69% | 0.685 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -109.5 | 3.5 | -174.9 | -72.4 | -76.7 | 0 | 0 | 0 | 114.3 | K187 I188 | K187-H191 WeakPolarHBondContact O-CB 3.32Å; K187-H191 PolarHBondContact O-CD2 3.43Å; K187-H191 VanDerWaalsContact O-CD2 3.25Å; K187-H191 PolarHBondContact O-N 3.35Å; I188-H191 PolarHBondContact O-N 3.28Å |
| 192 | G | 59.5 | Low | 66.6 | Low | 40 Ų | 40 | 118.5 Ų | 118.5 | 41% | 0.412 | 64% | 0.643 | S | S | . | * | trans | -152.2 | 32.1 | -167.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | I188 G194 | I188-G192 PolarHBondContact O-N 3.38Å; G192-G194 PolarHBondContact O-N 3.4Å | ||
| 193 | G | 52.1 | Low | 64.3 | Low | 80 Ų | 80 | 119.8 Ų | 119.8 | 83% | 0.825 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | 36.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 194 | G | 43.6 | Very low | 61.9 | Low | 74 Ų | 74 | 122.2 Ų | 122.2 | 76% | 0.763 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -167.8 | 26.3 | -168.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | G192 | G192-G194 PolarHBondContact O-N 3.4Š|
| 195 | S | 42.7 | Very low | 59.4 | Low | 96 Ų | 96 | 120.7 Ų | 120.7 | 67% | 0.671 | 69% | 0.688 | S | S | * | * | trans | -147.1 | 75.9 | 171 | 63.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 196 | E | 40.2 | Very low | 57.4 | Low | 191 Ų | 191 | 124.7 Ų | 124.7 | 89% | 0.893 | 71% | 0.714 | S | S | * | * | trans | -60 | 131.4 | 166.5 | -57.1 | -68.3 | 111.5 | 0 | 0 | 108.9 | ||||
| 197 | G | 43.8 | Very low | 55.2 | Low | 63 Ų | 63 | 121.7 Ų | 121.7 | 65% | 0.649 | 71% | 0.712 | S | S | * | * | trans | 135.1 | 119.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 198 | E | 40 | Very low | 53.1 | Low | 161 Ų | 161 | 121.6 Ų | 121.6 | 75% | 0.752 | 73% | 0.726 | S | S | * | * | trans | 55.4 | 82.5 | 146.7 | -51 | -63 | 78.4 | 0 | 0 | 118 | ||||
| 199 | H | 41.8 | Very low | 51.1 | Low | 181 Ų | 181 | 122.3 Ų | 122.3 | 84% | 0.838 | 74% | 0.738 | S | S | * | * | trans | -130.4 | 48.4 | 151.4 | -154.8 | 66 | 0 | 0 | 0 | 113.2 | ||||
| 200 | L | 45.7 | Very low | 48.9 | Very low | 141 Ų | 141 | 121.7 Ų | 121.7 | 74% | 0.738 | 75% | 0.745 | S | S | * | * | trans | -84.5 | 174.6 | 136.9 | -65.7 | 171.8 | 0 | 0 | 0 | 108 | ||||
| 201 | H | 38.9 | Very low | 47.5 | Very low | 152 Ų | 152 | 118.9 Ų | 118.9 | 70% | 0.704 | 74% | 0.744 | S | S | * | * | trans | 77.6 | 103.3 | -172.7 | -48 | -177.1 | 0 | 0 | 0 | 110.8 | ||||
| 202 | S | 41.6 | Very low | 46.4 | Very low | 104 Ų | 104 | 116.9 Ų | 116.9 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | 47.8 | 105.2 | 54.4 | -160.1 | 0 | 0 | 0 | 0 | 112 | |||||
| 203 | S | 48.2 | Very low | 46.1 | Very low | 100 Ų | 100 | 122.5 Ų | 122.5 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | S | Bend | trans | 43.5 | 117.6 | 155.4 | 54.3 | 0 | 0 | 0 | 0 | 118.9 | ||
| 204 | S | 48.3 | Very low | 46.2 | Very low | 124 Ų | 124 | 124.1 Ų | 124.1 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | 83.5 | 88 | 157.5 | -47.6 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 205 | S | 42.7 | Very low | 46.5 | Very low | 116 Ų | 116 | 127.9 Ų | 127.9 | 81% | 0.811 | 77% | 0.767 | S | S | * | * | trans | -157.1 | 110.6 | 137.5 | 52 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 206 | I | 52.4 | Low | 46.9 | Very low | 174 Ų | 174 | 131.7 Ų | 131.7 | 89% | 0.892 | 78% | 0.779 | S | S | * | * | trans | -40.5 | 128 | 156 | 35.3 | 169.6 | 0 | 0 | 0 | 112.4 | ||||
| 207 | S | 49.3 | Very low | 47.5 | Very low | 89 Ų | 89 | 132.3 Ų | 132.3 | 62% | 0.622 | 77% | 0.773 | S | S | * | * | trans | -83.4 | 136.2 | 170 | -175.7 | 0 | 0 | 0 | 0 | 109.8 | C209 | S207-C209 PolarHBondContact O-N 2.8Š| ||
| 208 | P | 50.3 | Low | 47.2 | Very low | 139 Ų | 139 | 136.1 Ų | 136.1 | 90% | 0.903 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -76.5 | 8.8 | -167.6 | 31.3 | -37.3 | 0 | 0 | 0 | 115.2 | ||
| 209 | C | 48.3 | Very low | 47.5 | Very low | 112 Ų | 112 | 134.3 Ų | 134.3 | 76% | 0.757 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -141.6 | 67.5 | -178.2 | -161.9 | 0 | 0 | 0 | 0 | 112.2 | S207 | S207-C209 PolarHBondContact O-N 2.8Š|
| 210 | S | 42.7 | Very low | 47.6 | Very low | 96 Ų | 96 | 129.7 Ų | 129.7 | 67% | 0.671 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -150.1 | 131.9 | 165.5 | -72.3 | 0 | 0 | 0 | 0 | 110 | ||
| 211 | P | 51.8 | Low | 47.8 | Very low | 116 Ų | 116 | 131.5 Ų | 131.5 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | trans | -65.7 | 142.8 | 179.5 | 28 | -34.3 | 0 | 0 | 0 | 110.5 | L213 | P211-L213 PolarHBondContact O-N 3.12Å; P211-L213 VanDerWaalsContact O-N 3.13Å | ||
| 212 | A | 50.9 | Low | 48.1 | Very low | 105 Ų | 105 | 127.9 Ų | 127.9 | 87% | 0.868 | 77% | 0.765 | S | S | * | * | trans | -61.5 | 114.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 213 | L | 53.4 | Low | 48.1 | Very low | 159 Ų | 159 | 128.4 Ų | 128.4 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | trans | -87.1 | 123.9 | 167.4 | -68.8 | 173.2 | 0 | 0 | 0 | 108.8 | P211 Q215 | P211-L213 PolarHBondContact O-N 3.12Å; P211-L213 VanDerWaalsContact O-N 3.13Å; L213-Q215 PolarHBondContact O-N 3.37Å | ||
| 214 | P | 53.6 | Low | 47.9 | Very low | 114 Ų | 114 | 132.7 Ų | 132.7 | 74% | 0.74 | 77% | 0.77 | S | S | * | * | trans | -66.6 | 135 | 176.7 | 26.7 | -33 | 0 | 0 | 0 | 110.8 | L216 | P214-L216 PolarHBondContact O-N 3.21Š| ||
| 215 | Q | 50.3 | Low | 47.7 | Very low | 152 Ų | 152 | 130.9 Ų | 130.9 | 71% | 0.71 | 77% | 0.77 | S | S | * | * | trans | -70.8 | 88.7 | 176.4 | -71.3 | -173.5 | -82.2 | 0 | 0 | 110.8 | L213 W217 | L213-Q215 PolarHBondContact O-N 3.37Å; Q215-W217 PolarHBondContact O-N 3.33Å | ||
| 216 | L | 50.8 | Low | 47.7 | Very low | 177 Ų | 177 | 128.9 Ų | 128.9 | 93% | 0.927 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 41.6 | -178.5 | -163.6 | 67.9 | 0 | 0 | 0 | 114 | P214 | P214-L216 PolarHBondContact O-N 3.21Š|
| 217 | W | 53.2 | Low | 47.4 | Very low | 203 Ų | 203 | 127 Ų | 127 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.3 | -8.2 | 174.1 | 75 | -84.6 | 0 | 0 | 0 | 114.1 | Q215 V219 | Q215-W217 PolarHBondContact O-N 3.33Å; W217-V219 PolarHBondContact O-N 3.4Å |
| 218 | E | 37.1 | Very low | 47.3 | Very low | 143 Ų | 143 | 130.9 Ų | 130.9 | 67% | 0.668 | 77% | 0.77 | S | S | * | * | trans | -90.4 | 91.7 | 169.9 | -160.2 | -152.4 | 146.1 | 0 | 0 | 110.8 | S220 | E218-S220 VanDerWaalsContact C-N 3.31Å; E218-S220 PolarHBondContact O-N 3.16Å; E218-S220 VanDerWaalsContact O-N 3.12Å; E218-S220 VanDerWaalsContact OE1-CB 3.25Å; E218-S220 WeakPolarHBondContact OE1-CB 3.25Å; E218-S220 PolarHBondContact OE1-OG 3.13Å | ||
| 219 | V | 46.9 | Very low | 47.3 | Very low | 124 Ų | 124 | 132.3 Ų | 132.3 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | trans | -82.2 | 81.3 | 168 | 179 | 0 | 0 | 0 | 0 | 108.9 | W217 M221 | W217-V219 PolarHBondContact O-N 3.4Å; V219-M221 PolarHBondContact O-N 3.17Å | ||
| 220 | S | 43.2 | Very low | 47.3 | Very low | 83 Ų | 83 | 133 Ų | 133 | 58% | 0.58 | 77% | 0.768 | S | S | * | * | trans | -87 | 93.3 | 167.6 | -90.3 | 0 | 0 | 0 | 0 | 110.2 | E218 A222 | E218-S220 VanDerWaalsContact C-N 3.31Å; E218-S220 PolarHBondContact O-N 3.16Å; E218-S220 VanDerWaalsContact O-N 3.12Å; E218-S220 VanDerWaalsContact OE1-CB 3.25Å; E218-S220 WeakPolarHBondContact OE1-CB 3.25Å; E218-S220 PolarHBondContact OE1-OG 3.13Å; S220-A222 VanDerWaalsContact C-N 3.3Å; S220-A222 PolarHBondContact O-N 2.55Å | ||
| 221 | M | 50.1 | Low | 47.4 | Very low | 180 Ų | 180 | 135.2 Ų | 135.2 | 89% | 0.887 | 77% | 0.772 | S | S | * | * | trans | -75.5 | 75.5 | 178.2 | 49.9 | -168.1 | 151.8 | 0 | 0 | 112 | V219 | V219-M221 PolarHBondContact O-N 3.17Š| ||
| 222 | A | 45.8 | Very low | 47.2 | Very low | 76 Ų | 76 | 136.6 Ų | 136.6 | 63% | 0.628 | 77% | 0.773 | S | S | * | * | trans | -146.3 | 140.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | S220 | S220-A222 VanDerWaalsContact C-N 3.3Å; S220-A222 PolarHBondContact O-N 2.55Å | ||
| 223 | T | 39.8 | Very low | 47.2 | Very low | 115 Ų | 115 | 141.6 Ų | 141.6 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | trans | 80.3 | 103.3 | 167.1 | 72.1 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 224 | K | 45.1 | Very low | 47.1 | Very low | 190 Ų | 190 | 142.3 Ų | 142.3 | 83% | 0.826 | 77% | 0.772 | S | S | * | * | trans | 51.2 | 94.7 | 130.4 | 76.5 | -148.1 | 173.4 | -172.8 | 0 | 120.3 | ||||
| 225 | G | 44 | Very low | 46.8 | Very low | 85 Ų | 85 | 143.2 Ų | 143.2 | 88% | 0.876 | 77% | 0.771 | S | S | * | * | 67.6 | 96.5 | 122 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 226 | A | 42.1 | Very low | 46.8 | Very low | 75 Ų | 75 | 139.8 Ų | 139.8 | 62% | 0.62 | 76% | 0.764 | S | S | * | * | trans | -153.4 | 144.5 | 146.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | M228 | A226-M228 PolarHBondContact O-N 2.92Š| ||
| 227 | P | 46.9 | Very low | 46.8 | Very low | 133 Ų | 133 | 139.5 Ų | 139.5 | 86% | 0.864 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 117.5 | -177.4 | 30.6 | -32.9 | 0 | 0 | 0 | 111.4 | ||
| 228 | M | 47.9 | Very low | 46.6 | Very low | 171 Ų | 171 | 132 Ų | 132 | 84% | 0.842 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 125.1 | 175.1 | -72.1 | -69 | 152.5 | 0 | 0 | 111 | A226 | A226-M228 PolarHBondContact O-N 2.92Š|
| 229 | H | 49.6 | Very low | 47.4 | Very low | 170 Ų | 170 | 132.3 Ų | 132.3 | 79% | 0.787 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 130.3 | -177.7 | -154.4 | -104.5 | 0 | 0 | 0 | 110.8 | N231 | H229-N231 VanDerWaalsContact C-N 3.28Å; H229-N231 PolarHBondContact O-N 3.49Å |
| 230 | P | 47.6 | Very low | 47.4 | Very low | 125 Ų | 125 | 136.8 Ų | 136.8 | 81% | 0.812 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 6.5 | -157.3 | 27.8 | -36.1 | 0 | 0 | 0 | 117.1 | ||
| 231 | N | 45.1 | Very low | 47.2 | Very low | 143 Ų | 143 | 142.1 Ų | 142.1 | 77% | 0.765 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.7 | 10.2 | -158.6 | -136.8 | 31.9 | 0 | 0 | 0 | 117.5 | H229 | H229-N231 VanDerWaalsContact C-N 3.28Å; H229-N231 PolarHBondContact O-N 3.49Å |
| 232 | N | 47.6 | Very low | 47.3 | Very low | 145 Ų | 145 | 139.2 Ų | 139.2 | 78% | 0.775 | 75% | 0.749 | S | S | * | * | trans | -112.3 | 7.7 | -168.3 | -132.6 | 56.3 | 0 | 0 | 0 | 117 | ||||
| 233 | Y | 52.2 | Low | 47.3 | Very low | 210 Ų | 210 | 141.5 Ų | 141.5 | 82% | 0.824 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -11.5 | -174.6 | -172.7 | -107.1 | 0 | 0 | 0 | 115.2 | ||
| 234 | M | 51.3 | Low | 48 | Very low | 174 Ų | 174 | 143.6 Ų | 143.6 | 86% | 0.857 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.8 | 3.6 | -169.3 | -78.5 | -171.7 | 65.6 | 0 | 0 | 116.9 | ||
| 235 | N | 46.3 | Very low | 48.4 | Very low | 133 Ų | 133 | 141 Ų | 141 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | trans | -102.6 | 0.7 | -171.2 | -145.8 | 9.6 | 0 | 0 | 0 | 116.1 | F237 | N235-F237 VanDerWaalsContact C-N 3.26Å; N235-F237 PolarHBondContact O-N 3Å | ||
| 236 | S | 49.4 | Very low | 48.8 | Very low | 81 Ų | 81 | 144.5 Ų | 144.5 | 57% | 0.566 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | 15.9 | -173.2 | -47.3 | 0 | 0 | 0 | 0 | 115.7 | H239 | S236-H239 PolarHBondContact O-CD2 2.96Å; S236-H239 PolarHBondContact O-NE2 2.98Å |
| 237 | F | 51.9 | Low | 49.1 | Very low | 170 Ų | 170 | 149.3 Ų | 149.3 | 75% | 0.746 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | -9.2 | 177.9 | -66.8 | -74.2 | 0 | 0 | 0 | 113.7 | N235 H239 | N235-F237 VanDerWaalsContact C-N 3.26Å; N235-F237 PolarHBondContact O-N 3Å; F237-H239 PolarHBondContact O-N 3.05Å; F237-H239 VanDerWaalsContact O-N 3.16Å |
| 238 | G | 48.8 | Very low | 49.2 | Very low | 45 Ų | 45 | 151.1 Ų | 151.1 | 46% | 0.464 | 74% | 0.742 | S | S | . | * | G | 310 helix | trans | -66.1 | -16.4 | -175 | 0 | 0 | 0 | 0 | 0 | 115.5 | W240 Y241 | G238-W240 PolarHBondContact O-N 2.84Å; G238-W240 VanDerWaalsContact O-N 3.13Å; G238-Y241 PolarHBondContact O-N 3.22Å |
| 239 | H | 54.9 | Low | 49.4 | Very low | 150 Ų | 150 | 148.1 Ų | 148.1 | 69% | 0.694 | 74% | 0.735 | S | S | * | * | G | 310 helix | trans | -68 | -14.3 | -172.3 | -35.5 | -59.5 | 0 | 0 | 0 | 114.8 | S236 F237 | S236-H239 PolarHBondContact O-CD2 2.96Å; S236-H239 PolarHBondContact O-NE2 2.98Å; F237-H239 PolarHBondContact O-N 3.05Å; F237-H239 VanDerWaalsContact O-N 3.16Å |
| 240 | W | 45.5 | Very low | 49.3 | Very low | 218 Ų | 218 | 148.4 Ų | 148.4 | 83% | 0.826 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -96.3 | -3 | -175.6 | -63.4 | 89.9 | 0 | 0 | 0 | 114.2 | G238 | G238-W240 PolarHBondContact O-N 2.84Å; G238-W240 VanDerWaalsContact O-N 3.13Å |
| 241 | Y | 40 | Very low | 49.2 | Very low | 196 Ų | 196 | 150 Ų | 150 | 77% | 0.769 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -125.2 | 122.8 | 173.5 | -79.6 | -88.5 | 0 | 0 | 0 | 109.7 | G238 N243 | G238-Y241 PolarHBondContact O-N 3.22Å; Y241-N243 PolarHBondContact O-N 3.32Å |
| 242 | P | 51.3 | Low | 49.1 | Very low | 118 Ų | 118 | 150.1 Ų | 150.1 | 77% | 0.766 | 73% | 0.733 | S | S | * | * | trans | -62.8 | 105.3 | 170.8 | -21.7 | 33.8 | 0 | 0 | 0 | 110.2 | H244 | P242-H244 PolarHBondContact O-N 3.46Š| ||
| 243 | N | 45.5 | Very low | 49.4 | Very low | 125 Ų | 125 | 147.1 Ų | 147.1 | 67% | 0.668 | 73% | 0.729 | S | S | * | * | trans | -74.6 | 95.8 | 178.2 | -174.8 | 23 | 0 | 0 | 0 | 110.1 | Y241 H245 | Y241-N243 PolarHBondContact O-N 3.32Å; N243-H245 VanDerWaalsContact CG-ND1 3.32Å; N243-H245 PolarHBondContact ND2-ND1 2.79Å; N243-H245 PolarHBondContact O-N 3.33Å; N243-H245 PolarHBondContact OD1-CE1 3.48Å; N243-H245 PolarHBondContact OD1-ND1 3.4Å | ||
| 244 | H | 55.9 | Low | 49.5 | Very low | 159 Ų | 159 | 146 Ų | 146 | 74% | 0.736 | 73% | 0.733 | S | S | * | * | trans | -72.5 | 68.3 | 177.6 | -107.8 | -95.7 | 0 | 0 | 0 | 111.8 | P242 H246 | P242-H244 PolarHBondContact O-N 3.46Å; H244-H246 AromaticContact ND1-ND1 3.9Å; H244-H246 PolarHBondContact O-N 3.04Å | ||
| 245 | H | 53.5 | Low | 49.7 | Very low | 135 Ų | 135 | 146.4 Ų | 146.4 | 63% | 0.625 | 73% | 0.733 | S | S | * | * | trans | -87.1 | 84.9 | 165.6 | -86.6 | 53.8 | 0 | 0 | 0 | 109.7 | N243 H247 | N243-H245 VanDerWaalsContact CG-ND1 3.32Å; N243-H245 PolarHBondContact ND2-ND1 2.79Å; N243-H245 PolarHBondContact O-N 3.33Å; N243-H245 PolarHBondContact OD1-CE1 3.48Å; N243-H245 PolarHBondContact OD1-ND1 3.4Å; H245-H247 PolarHBondContact O-N 3.13Å; H245-H247 VanDerWaalsContact O-N 3.13Å | ||
| 246 | H | 51.6 | Low | 49.9 | Very low | 158 Ų | 158 | 150.5 Ų | 150.5 | 73% | 0.731 | 74% | 0.739 | S | S | * | * | trans | -67.9 | 104.1 | 165.7 | -98.2 | 43.7 | 0 | 0 | 0 | 109.5 | H244 H248 | H244-H246 AromaticContact ND1-ND1 3.9Å; H244-H246 PolarHBondContact O-N 3.04Å; H246-H248 PolarHBondContact O-N 3.13Å | ||
| 247 | H | 48.2 | Very low | 50.3 | Low | 176 Ų | 176 | 152.1 Ų | 152.1 | 82% | 0.815 | 75% | 0.747 | S | S | * | * | trans | -76.5 | 112.8 | 157.9 | -86 | 61 | 0 | 0 | 0 | 108 | H245 | H245-H247 PolarHBondContact O-N 3.13Å; H245-H247 VanDerWaalsContact O-N 3.13Å | ||
| 248 | H | 49.4 | Very low | 50.5 | Low | 172 Ų | 172 | 151.9 Ų | 151.9 | 80% | 0.796 | 75% | 0.748 | S | S | * | * | trans | -100.2 | 118.7 | 171.3 | -158.9 | -72.6 | 0 | 0 | 0 | 108.9 | H246 | H246-H248 PolarHBondContact O-N 3.13Š| ||
| 249 | P | 52.3 | Low | 50.6 | Low | 108 Ų | 108 | 157.8 Ų | 157.8 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | trans | -74.8 | 176.4 | 172.4 | 31.2 | -32.8 | 0 | 0 | 0 | 111.9 | ||||
| 250 | H | 47.1 | Very low | 50.5 | Low | 175 Ų | 175 | 163 Ų | 163 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | -81 | -179.5 | -162.8 | -173.8 | 68.4 | 0 | 0 | 0 | 115.1 | ||||
| 251 | Q | 46.2 | Very low | 50.8 | Low | 159 Ų | 159 | 160.3 Ų | 160.3 | 74% | 0.743 | 80% | 0.795 | S | S | * | * | trans | 85.4 | 139.9 | 177.5 | -54.2 | 172 | 15.7 | 0 | 0 | 114.7 | ||||
| 252 | D | 41.3 | Very low | 51.4 | Low | 145 Ų | 145 | 158.4 Ų | 158.4 | 78% | 0.775 | 80% | 0.796 | S | S | * | * | cis | -147.1 | 171.9 | 0.3 | -139 | -55.1 | 0 | 0 | 0 | 112 | ||||
| 253 | A | 55.1 | Low | 51.4 | Low | 82 Ų | 82 | 160.7 Ų | 160.7 | 68% | 0.678 | 80% | 0.798 | S | S | * | * | trans | -80.8 | 136.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 254 | M | 53.3 | Low | 51.7 | Low | 186 Ų | 186 | 162.8 Ų | 162.8 | 92% | 0.916 | 81% | 0.806 | S | S | * | * | trans | -138.4 | 138.1 | 159.1 | -74.2 | -158.2 | 166.1 | 0 | 0 | 111.7 | ||||
| 255 | Q | 56.1 | Low | 51.4 | Low | 183 Ų | 183 | 163 Ų | 163 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 142.7 | -170.7 | -75.8 | 81.1 | -0.7 | 0 | 0 | 113.6 | ||
| 256 | R | 50 | Low | 51.3 | Low | 220 Ų | 220 | 164.9 Ų | 164.9 | 83% | 0.83 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 122.3 | 166.9 | 178.4 | 176.8 | 178 | 153.5 | -1.4 | 109.4 | ||
| 257 | P | 58.6 | Low | 51.3 | Low | 114 Ų | 114 | 165.4 Ų | 165.4 | 74% | 0.74 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 133.4 | 169 | -13.2 | 28.1 | 0 | 0 | 0 | 110 | ||
| 258 | Q | 56.2 | Low | 51.5 | Low | 165 Ų | 165 | 164.5 Ų | 164.5 | 77% | 0.771 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -81 | 135.3 | 160.5 | -72.3 | -81.8 | 73.4 | 0 | 0 | 108 | ||
| 259 | L | 50.8 | Low | 51.7 | Low | 170 Ų | 170 | 163.9 Ų | 163.9 | 89% | 0.89 | 83% | 0.833 | S | S | * | * | trans | -108.9 | 137.8 | 159.7 | -84.5 | 167 | 0 | 0 | 0 | 108.2 | ||||
| 260 | M | 53.5 | Low | 51.6 | Low | 260 Ų | 260 | 169 Ų | 169 | 100% | 1.281 | 85% | 0.845 | S | S | * | * | trans | -85 | 0 | 179.5 | -64.1 | 161.7 | 69.2 | 0 | 0 | 110.6 |
Retrieved 260 of 260 residues in 38.6 ms
(Link to these results)