| 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 | 38.2 | Very low | 41 | Very low | 251 Ų | 251 | 138.4 Ų | 138.4 | 100% | 1.236 | 80% | 0.797 | S | S | * | * | 0 | 110.1 | 0 | -73.1 | -179 | -179.5 | 0 | 0 | 107.5 | |||||
| 2 | A | 35.8 | Very low | 41.5 | Very low | 105 Ų | 105 | 133.8 Ų | 133.8 | 87% | 0.868 | 77% | 0.773 | S | S | * | * | trans | -80.6 | 137.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | A | 35.2 | Very low | 41.9 | Very low | 101 Ų | 101 | 134.7 Ų | 134.7 | 84% | 0.835 | 77% | 0.766 | S | S | * | * | trans | -136.5 | 115 | 160.6 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 4 | T | 37.7 | Very low | 42.4 | Very low | 140 Ų | 140 | 129 Ų | 129 | 86% | 0.859 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 120.9 | -177.9 | 44.8 | 0 | 0 | 0 | 0 | 110.8 | ||
| 5 | L | 41.1 | Very low | 42.7 | Very low | 179 Ų | 179 | 131.7 Ų | 131.7 | 94% | 0.937 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 128.1 | 164.7 | -75.3 | 167.3 | 0 | 0 | 0 | 109.3 | ||
| 6 | G | 34.6 | Very low | 43.4 | Very low | 65 Ų | 65 | 129.4 Ų | 129.4 | 67% | 0.67 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 131.6 | -165.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | G8 | G6-G8 PolarHBondContact O-N 2.7Š|
| 7 | S | 50.1 | Low | 43.9 | Very low | 92 Ų | 92 | 125.8 Ų | 125.8 | 64% | 0.643 | 70% | 0.702 | S | S | * | * | S | Bend | 35.4 | 1.6 | 125.5 | -162.5 | 0 | 0 | 0 | 0 | 123.2 | |||
| 8 | G | 42.1 | Very low | 44.3 | Very low | 53 Ų | 53 | 121.9 Ų | 121.9 | 55% | 0.546 | 69% | 0.688 | S | S | . | * | S | Bend | trans | -93.8 | -27.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | G6 | G6-G8 PolarHBondContact O-N 2.7Š|
| 9 | E | 47.8 | Very low | 44.7 | Very low | 164 Ų | 164 | 120.5 Ų | 120.5 | 77% | 0.766 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -95.8 | -7 | -168.8 | -63.6 | 179 | 153.6 | 0 | 0 | 113.9 | T12 | E9-T12 PolarHBondContact O-OG1 3.46Š|
| 10 | R | 48.6 | Very low | 44.8 | Very low | 183 Ų | 183 | 124 Ų | 124 | 69% | 0.691 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -76.5 | -20.2 | 179.4 | -91.7 | 175.6 | 53.7 | -133.4 | -6.3 | 114.5 | A14 | R10-A14 WeakPolarHBondContact O-CB 3.26Å; R10-A14 PolarHBondContact O-N 3.33Å |
| 11 | W | 39.6 | Very low | 44.8 | Very low | 189 Ų | 189 | 126.7 Ų | 126.7 | 72% | 0.716 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -88.4 | -28.3 | -176.8 | -65.8 | 100.9 | 0 | 0 | 0 | 112.9 | Y15 | W11-Y15 VanDerWaalsContact O-CB 3.3Å; W11-Y15 WeakPolarHBondContact O-CB 3.35Å; W11-Y15 PolarHBondContact O-N 2.71Å; W11-Y15 VanDerWaalsContact O-N 3.07Å |
| 12 | T | 47.8 | Very low | 44.8 | Very low | 83 Ų | 83 | 121 Ų | 121 | 51% | 0.509 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -74.6 | -41.7 | 177.7 | 48.8 | 0 | 0 | 0 | 0 | 111.1 | E9 Y15 I16 | E9-T12 PolarHBondContact O-OG1 3.46Å; T12-Y15 PolarHBondContact O-N 2.86Å; T12-I16 WeakPolarHBondContact O-CB 3.3Å; T12-I16 VanDerWaalsContact O-CG1 3.26Å; T12-I16 WeakPolarHBondContact O-CG1 3.27Å; T12-I16 PolarHBondContact O-N 3.07Å |
| 13 | E | 46.4 | Very low | 44.7 | Very low | 146 Ų | 146 | 125.3 Ų | 125.3 | 68% | 0.682 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -66.6 | -39.8 | 173.3 | -76.2 | -165.9 | 149.1 | 0 | 0 | 112.4 | Y15 I16 D17 | E13-Y15 VanDerWaalsContact C-N 3.31Å; E13-Y15 PolarHBondContact O-N 2.81Å; E13-I16 PolarHBondContact O-N 3.41Å; E13-D17 VanDerWaalsContact O-CB 3.27Å; E13-D17 WeakPolarHBondContact O-CB 3.27Å; E13-D17 PolarHBondContact O-N 2.89Å |
| 14 | A | 48.8 | Very low | 44.6 | Very low | 55 Ų | 55 | 130 Ų | 130 | 46% | 0.455 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -65.7 | -32.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R10 A18 | R10-A14 WeakPolarHBondContact O-CB 3.26Å; R10-A14 PolarHBondContact O-N 3.33Å; A14-A18 VanDerWaalsContact O-CB 3.27Å; A14-A18 WeakPolarHBondContact O-CB 3.5Å; A14-A18 PolarHBondContact O-N 3.11Å |
| 15 | Y | 47.2 | Very low | 44.4 | Very low | 170 Ų | 170 | 128.8 Ų | 128.8 | 67% | 0.667 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -74.3 | -41.3 | 175.8 | -174.1 | -102.3 | 0 | 0 | 0 | 112 | W11 T12 E13 D17 A18 V19 | W11-Y15 VanDerWaalsContact O-CB 3.3Å; W11-Y15 WeakPolarHBondContact O-CB 3.35Å; W11-Y15 PolarHBondContact O-N 2.71Å; W11-Y15 VanDerWaalsContact O-N 3.07Å; T12-Y15 PolarHBondContact O-N 2.86Å; E13-Y15 VanDerWaalsContact C-N 3.31Å; E13-Y15 PolarHBondContact O-N 2.81Å; Y15-D17 VanDerWaalsContact C-N 3.34Å; Y15-A18 PolarHBondContact O-N 3.49Å; Y15-V19 HydrophobicContact CE1-CG2 4.33Å; Y15-V19 VanDerWaalsContact O-CG2 3.31Å; Y15-V19 WeakPolarHBondContact O-CG2 3.4Å; Y15-V19 PolarHBondContact O-N 3.31Å |
| 16 | I | 54.1 | Low | 44 | Very low | 95 Ų | 95 | 129 Ų | 129 | 49% | 0.487 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -66.8 | -37.2 | 176.1 | -67.8 | 168.1 | 0 | 0 | 0 | 110.9 | T12 E13 V19 R20 | T12-I16 WeakPolarHBondContact O-CB 3.3Å; T12-I16 VanDerWaalsContact O-CG1 3.26Å; T12-I16 WeakPolarHBondContact O-CG1 3.27Å; T12-I16 PolarHBondContact O-N 3.07Å; E13-I16 PolarHBondContact O-N 3.41Å; I16-V19 PolarHBondContact O-N 3.47Å; I16-R20 PolarHBondContact O-N 3.19Å; I16-R20 VanDerWaalsContact O-N 3.07Å |
| 17 | D | 51.1 | Low | 43.8 | Very low | 68 Ų | 68 | 133.6 Ų | 133.6 | 36% | 0.364 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -74.5 | -29.7 | 177.9 | -160 | 52.9 | 0 | 0 | 0 | 112.8 | E13 Y15 R20 R21 | E13-D17 VanDerWaalsContact O-CB 3.27Å; E13-D17 WeakPolarHBondContact O-CB 3.27Å; E13-D17 PolarHBondContact O-N 2.89Å; Y15-D17 VanDerWaalsContact C-N 3.34Å; D17-R20 PolarHBondContact O-N 3.39Å; D17-R21 PolarHBondContact O-N 3.06Å; D17-R21 IonicContact OD2-CZ 3.44Å; D17-R21 IonicContact OD2-NE 3.33Å; D17-R21 PolarHBondContact OD2-NE 3.16Å; D17-R21 IonicContact OD2-NH2 2.7Å; D17-R21 PolarHBondContact OD2-NH2 3.38Å |
| 18 | A | 50.5 | Low | 42.8 | Very low | 55 Ų | 55 | 135.5 Ų | 135.5 | 46% | 0.455 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -70.5 | -35.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | A14 Y15 N22 | A14-A18 VanDerWaalsContact O-CB 3.27Å; A14-A18 WeakPolarHBondContact O-CB 3.5Å; A14-A18 PolarHBondContact O-N 3.11Å; Y15-A18 PolarHBondContact O-N 3.49Å; A18-N22 PolarHBondContact O-N 3.4Å |
| 19 | V | 52.1 | Low | 42.7 | Very low | 95 Ų | 95 | 138.8 Ų | 138.8 | 58% | 0.576 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -70.1 | -34.5 | 173.8 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | Y15 I16 | Y15-V19 HydrophobicContact CE1-CG2 4.33Å; Y15-V19 VanDerWaalsContact O-CG2 3.31Å; Y15-V19 WeakPolarHBondContact O-CG2 3.4Å; Y15-V19 PolarHBondContact O-N 3.31Å; I16-V19 PolarHBondContact O-N 3.47Å |
| 20 | R | 47.9 | Very low | 41.8 | Very low | 190 Ų | 190 | 136.6 Ų | 136.6 | 72% | 0.717 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -72.6 | -26.1 | 178.2 | -144.4 | -176.1 | -71.3 | 175.9 | -1.8 | 113.4 | I16 D17 | I16-R20 PolarHBondContact O-N 3.19Å; I16-R20 VanDerWaalsContact O-N 3.07Å; D17-R20 PolarHBondContact O-N 3.39Å |
| 21 | R | 43.7 | Very low | 40.8 | Very low | 182 Ų | 182 | 136.9 Ų | 136.9 | 69% | 0.687 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -83 | -18 | 177.7 | -84.1 | -173.9 | -99.8 | 154.4 | -8.8 | 114.7 | D17 K23 | D17-R21 PolarHBondContact O-N 3.06Å; D17-R21 IonicContact OD2-CZ 3.44Å; D17-R21 IonicContact OD2-NE 3.33Å; D17-R21 PolarHBondContact OD2-NE 3.16Å; D17-R21 IonicContact OD2-NH2 2.7Å; D17-R21 PolarHBondContact OD2-NH2 3.38Å; R21-K23 PolarHBondContact O-N 2.96Å |
| 22 | N | 38.8 | Very low | 40.1 | Very low | 130 Ų | 130 | 133 Ų | 133 | 70% | 0.695 | 69% | 0.688 | S | S | * | * | trans | -84.8 | 69.6 | 177.5 | -136.2 | 27.3 | 0 | 0 | 0 | 110.3 | A18 Y24 | A18-N22 PolarHBondContact O-N 3.4Å; N22-Y24 PolarHBondContact O-N 2.98Å; N22-Y24 VanDerWaalsContact O-N 3.12Å | ||
| 23 | K | 33.1 | Very low | 39.2 | Very low | 197 Ų | 197 | 137.6 Ų | 137.6 | 86% | 0.857 | 70% | 0.704 | S | S | * | * | trans | -68.6 | 102.5 | 174.2 | -135.8 | -176.7 | -175.4 | -169.9 | 0 | 108.1 | R21 | R21-K23 PolarHBondContact O-N 2.96Š| ||
| 24 | Y | 32.8 | Very low | 38.4 | Very low | 200 Ų | 200 | 138.1 Ų | 138.1 | 78% | 0.784 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 136.7 | 157.3 | -93.4 | -94.9 | 0 | 0 | 0 | 107.9 | N22 E26 | N22-Y24 PolarHBondContact O-N 2.98Å; N22-Y24 VanDerWaalsContact O-N 3.12Å; Y24-E26 PolarHBondContact O-N 2.9Å |
| 25 | P | 34.5 | Very low | 37.8 | Very low | 114 Ų | 114 | 141 Ų | 141 | 74% | 0.74 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 129.9 | 171.3 | 26.3 | -29.6 | 0 | 0 | 0 | 109.3 | ||
| 26 | E | 31.7 | Very low | 36.8 | Very low | 183 Ų | 183 | 139 Ų | 139 | 86% | 0.855 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 131.5 | 164.9 | -71 | -179.3 | 156.5 | 0 | 0 | 108.9 | Y24 | Y24-E26 PolarHBondContact O-N 2.9Š|
| 27 | D | 31.5 | Very low | 35.4 | Very low | 161 Ų | 161 | 137.4 Ų | 137.4 | 86% | 0.861 | 74% | 0.741 | S | S | * | * | trans | -139.5 | 125.1 | 152.4 | -84.3 | -40 | 0 | 0 | 0 | 108.3 | ||||
| 28 | T | 29.6 | Very low | 34.3 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | trans | -128.2 | 166.7 | 167.6 | 57.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 29 | P | 39 | Very low | 33.3 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | -121.6 | 148.1 | -60.1 | 34 | -19.8 | 0 | 0 | 0 | 109.5 | |||||
| 30 | S | 28.6 | Very low | 32.7 | Very low | 119 Ų | 119 | 146.5 Ų | 146.5 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -127.5 | 113.5 | 162.4 | 64.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 31 | E | 27.2 | Very low | 31.8 | Very low | 188 Ų | 188 | 143.5 Ų | 143.5 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | trans | -47 | 135 | 168.1 | -65.2 | 168.1 | 133.7 | 0 | 0 | 111.3 | ||||
| 32 | S | 26.8 | Very low | 31.3 | Very low | 107 Ų | 107 | 140.5 Ų | 140.5 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | 167.3 | 119.9 | 116.3 | 45.6 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 33 | H | 28.5 | Very low | 31.1 | Very low | 181 Ų | 181 | 143.5 Ų | 143.5 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | trans | 53.4 | 101 | 146.5 | -70.7 | -63.6 | 0 | 0 | 0 | 120.7 | ||||
| 34 | D | 28.6 | Very low | 30.9 | Very low | 156 Ų | 156 | 138.5 Ų | 138.5 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | -55 | 140.8 | 129.5 | -79.7 | -39.2 | 0 | 0 | 0 | 109.3 | |||||
| 35 | P | 37.4 | Very low | 30.8 | Very low | 116 Ų | 116 | 138.1 Ų | 138.1 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | -145.6 | 155.4 | 82.6 | 36.8 | -19 | 0 | 0 | 0 | 116.5 | |||||
| 36 | C | 25.6 | Very low | 30.7 | Very low | 128 Ų | 128 | 142.3 Ų | 142.3 | 87% | 0.865 | 82% | 0.819 | S | S | * | * | trans | 86.6 | 121.5 | 143 | -167.3 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 37 | G | 24.9 | Very low | 30.7 | Very low | 61 Ų | 61 | 141.1 Ų | 141.1 | 63% | 0.629 | 81% | 0.813 | S | S | * | * | 113.8 | 111.7 | 110.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 38 | C | 28.5 | Very low | 30.9 | Very low | 130 Ų | 130 | 142.3 Ų | 142.3 | 88% | 0.878 | 81% | 0.811 | S | S | * | * | trans | -17.6 | 137.3 | 161.3 | -65.7 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 39 | C | 29.2 | Very low | 30.8 | Very low | 123 Ų | 123 | 144.1 Ų | 144.1 | 83% | 0.831 | 81% | 0.808 | S | S | * | * | trans | -127.2 | 97.8 | 155.3 | -82.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 40 | N | 38.3 | Very low | 30.3 | Very low | 156 Ų | 156 | 143.3 Ų | 143.3 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -56.4 | 126.3 | 148.5 | -86.7 | -35.2 | 0 | 0 | 0 | 108.8 | ||||
| 41 | C | 30.4 | Very low | 30.5 | Very low | 128 Ų | 128 | 145.3 Ų | 145.3 | 87% | 0.865 | 80% | 0.801 | S | S | * | * | trans | -133.9 | 80.9 | 161.3 | -84.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 42 | V | 32.8 | Very low | 30.6 | Very low | 118 Ų | 118 | 143.8 Ų | 143.8 | 72% | 0.715 | 80% | 0.799 | S | S | * | * | trans | -101.9 | 127.3 | 161.7 | 165.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 43 | K | 33.3 | Very low | 30.7 | Very low | 193 Ų | 193 | 147.2 Ų | 147.2 | 84% | 0.839 | 80% | 0.803 | S | S | * | * | trans | 81.9 | 130.6 | 164.5 | -67.8 | 161.4 | -173.1 | -178.7 | 0 | 118.3 | ||||
| 44 | A | 29.1 | Very low | 30.5 | Very low | 92 Ų | 92 | 148.6 Ų | 148.6 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | trans | 126.9 | 125.8 | 154.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 45 | Q | 31.8 | Very low | 30.4 | Very low | 192 Ų | 192 | 147.7 Ų | 147.7 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | cis | -154.2 | 152.2 | 17 | -63.4 | 176.8 | -37.8 | 0 | 0 | 108.9 | ||||
| 46 | K | 32 | Very low | 30.3 | Very low | 202 Ų | 202 | 150.2 Ų | 150.2 | 88% | 0.878 | 80% | 0.803 | S | S | * | * | trans | -103.4 | 104.8 | 168.9 | -152.7 | 178.3 | -171.8 | 178.8 | 0 | 108.1 | ||||
| 47 | E | 31.7 | Very low | 30.6 | Very low | 158 Ų | 158 | 150.7 Ų | 150.7 | 74% | 0.738 | 80% | 0.802 | S | S | * | * | trans | 11.8 | 141.6 | 151 | -51.6 | 175.9 | 157.3 | 0 | 0 | 122 | ||||
| 48 | K | 35.7 | Very low | 30.7 | Very low | 186 Ų | 186 | 159.5 Ų | 159.5 | 81% | 0.809 | 82% | 0.816 | S | S | * | * | 160.1 | 151.3 | 105.5 | -86.8 | -177.3 | -175.1 | 177.1 | 0 | 109.7 | |||||
| 49 | K | 28.1 | Very low | 31.1 | Very low | 171 Ų | 171 | 163 Ų | 163 | 74% | 0.743 | 82% | 0.82 | S | S | * | * | cis | 178.2 | 139.3 | -6.1 | 178.7 | -174.3 | -175.2 | -163.7 | 0 | 106.1 | ||||
| 50 | S | 27.7 | Very low | 31.2 | Very low | 105 Ų | 105 | 160.5 Ų | 160.5 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | trans | 163.2 | 108.7 | 143 | 46.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 51 | E | 32.3 | Very low | 31.2 | Very low | 160 Ų | 160 | 162.6 Ų | 162.6 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | 80.2 | 109.9 | 90.1 | -118.9 | 165.7 | -135.9 | 0 | 0 | 112.4 | |||||
| 52 | N | 29.4 | Very low | 31.6 | Very low | 157 Ų | 157 | 159.7 Ų | 159.7 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | 161 | 163.6 | 122.3 | -71.4 | -12.5 | 0 | 0 | 0 | 113.8 | |||||
| 53 | E | 28.8 | Very low | 32 | Very low | 178 Ų | 178 | 159.4 Ų | 159.4 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | trans | -95 | 156 | -145 | -162.7 | 157.5 | 104.1 | 0 | 0 | 116 | ||||
| 54 | W | 24.6 | Very low | 32.9 | Very low | 211 Ų | 211 | 152.9 Ų | 152.9 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | trans | 61.9 | 107.5 | 156.5 | -105.6 | 58 | 0 | 0 | 0 | 121.3 | ||||
| 55 | T | 27.3 | Very low | 34.4 | Very low | 137 Ų | 137 | 156 Ų | 156 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | -168.4 | 137.1 | 113.5 | 17.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 56 | Q | 35.3 | Very low | 36 | Very low | 168 Ų | 168 | 150.7 Ų | 150.7 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | -63.5 | 165.3 | 177.5 | -85 | 170.9 | -19.8 | 0 | 0 | 112.8 | ||||
| 57 | T | 31.2 | Very low | 38.4 | Very low | 139 Ų | 139 | 143.8 Ų | 143.8 | 85% | 0.853 | 74% | 0.744 | S | S | * | * | trans | 75.6 | 92.8 | 170.7 | 25.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 58 | R | 27.3 | Very low | 40.5 | Very low | 245 Ų | 245 | 143.5 Ų | 143.5 | 93% | 0.925 | 74% | 0.742 | S | S | * | * | -157.8 | 116.2 | 127.8 | -107.4 | 168 | 179.5 | -151.1 | -2.2 | 109.7 | G60 | R58-G60 PolarHBondContact O-N 2.72Š| |||
| 59 | Q | 37.5 | Very low | 42.5 | Very low | 205 Ų | 205 | 142.2 Ų | 142.2 | 96% | 0.958 | 74% | 0.739 | S | S | * | * | trans | -50.4 | 120.9 | 153.2 | -74.6 | 168 | -29.7 | 0 | 0 | 106.9 | ||||
| 60 | G | 30.2 | Very low | 44.9 | Very low | 69 Ų | 69 | 136.6 Ų | 136.6 | 71% | 0.711 | 72% | 0.716 | S | S | * | * | trans | -148.2 | 96.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | R58 G62 | R58-G60 PolarHBondContact O-N 2.72Å; G60-G62 VanDerWaalsContact C-N 3.33Å; G60-G62 PolarHBondContact O-N 3.11Å | ||
| 61 | E | 39 | Very low | 47.3 | Very low | 200 Ų | 200 | 133.5 Ų | 133.5 | 94% | 0.935 | 69% | 0.691 | S | S | * | * | trans | -56.4 | 90.4 | 175 | -67.9 | 163 | 135.6 | 0 | 0 | 110.2 | S63 | E61-S63 VanDerWaalsContact C-N 3.34Å; E61-S63 PolarHBondContact O-N 2.79Å | ||
| 62 | G | 37.7 | Very low | 49.7 | Very low | 68 Ų | 68 | 130.7 Ų | 130.7 | 70% | 0.701 | 68% | 0.68 | S | S | * | * | trans | -81.9 | 88 | 156.6 | 0 | 0 | 0 | 0 | 0 | 107.4 | G60 S64 | G60-G62 VanDerWaalsContact C-N 3.33Å; G60-G62 PolarHBondContact O-N 3.11Å; G62-S64 PolarHBondContact O-N 2.98Å | ||
| 63 | S | 42.4 | Very low | 52.1 | Low | 111 Ų | 111 | 123.7 Ų | 123.7 | 78% | 0.776 | 65% | 0.645 | S | S | * | * | trans | -42.9 | 105.4 | 176.4 | -177.7 | 0 | 0 | 0 | 0 | 110.5 | E61 M65 | E61-S63 VanDerWaalsContact C-N 3.34Å; E61-S63 PolarHBondContact O-N 2.79Å; S63-M65 PolarHBondContact O-N 2.97Å; S63-M65 VanDerWaalsContact O-N 3.14Å | ||
| 64 | S | 52 | Low | 54.5 | Low | 57 Ų | 57 | 115.4 Ų | 115.4 | 40% | 0.399 | 61% | 0.606 | S | S | . | * | trans | -63.6 | 112.3 | 175.2 | 173.5 | 0 | 0 | 0 | 0 | 107.7 | G62 Y66 | G62-S64 PolarHBondContact O-N 2.98Å; S64-Y66 PolarHBondContact O-N 3.46Å; S64-Y66 WeakPolarHBondContact OG-CD2 3.28Å; S64-Y66 WeakPolarHBondContact OG-CE1 3.26Å; S64-Y66 WeakPolarHBondContact OG-CE2 3.25Å; S64-Y66 PolarHBondContact OG-O 3.3Å | ||
| 65 | M | 60 | Low | 57.2 | Low | 157 Ų | 157 | 109.8 Ų | 109.8 | 77% | 0.773 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -62.3 | 12.1 | 175.7 | -75 | -165.8 | 79.6 | 0 | 0 | 114.2 | S63 C115 | S63-M65 PolarHBondContact O-N 2.97Å; S63-M65 VanDerWaalsContact O-N 3.14Å; M65-C115 HydrophobicContact CB-CB 4.46Å |
| 66 | Y | 66.8 | Low | 59.8 | Low | 81 Ų | 81 | 109.3 Ų | 109.3 | 32% | 0.318 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -141.8 | 144.2 | -179.8 | 53.2 | -98.4 | 0 | 0 | 0 | 110.2 | S64 L71 A116 | S64-Y66 PolarHBondContact O-N 3.46Å; S64-Y66 WeakPolarHBondContact OG-CD2 3.28Å; S64-Y66 WeakPolarHBondContact OG-CE1 3.26Å; S64-Y66 WeakPolarHBondContact OG-CE2 3.25Å; S64-Y66 PolarHBondContact OG-O 3.3Å; Y66-L71 HydrophobicContact CD2-CD1 3.68Å; Y66-L71 HydrophobicContact CD2-CD2 4.12Å; Y66-L71 HydrophobicContact CD2-CG 3.48Å; Y66-L71 VanDerWaalsContact CD2-CG 3.48Å; Y66-L71 HydrophobicContact CE2-CD1 3.15Å; Y66-L71 HydrophobicContact CE2-CD2 3.91Å; Y66-L71 HydrophobicContact CE2-CG 3.44Å; Y66-L71 VanDerWaalsContact CE2-CG 3.44Å; Y66-A116 HydrophobicContact CG-CB 4.08Å |
| 67 | S | 81.1 | Confident | 62.1 | Low | 57 Ų | 57 | 101.4 Ų | 101.4 | 40% | 0.399 | 54% | 0.535 | S | S | . | . | trans | -72.9 | 147.6 | 173.8 | 168.2 | 0 | 0 | 0 | 0 | 111 | E69 Q70 L71 | S67-E69 PolarHBondContact O-N 2.91Å; S67-E69 PolarHBondContact OG-N 2.55Å; S67-Q70 WeakPolarHBondContact O-CA 3.44Å; S67-Q70 WeakPolarHBondContact O-CB 3.37Å; S67-Q70 PolarHBondContact O-N 3.48Å; S67-L71 PolarHBondContact O-N 3.42Å | ||
| 68 | E | 76.3 | Confident | 64.3 | Low | 152 Ų | 152 | 100.6 Ų | 100.6 | 71% | 0.71 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -56.5 | -35.1 | 174.1 | -172.6 | 174.3 | -176.8 | 0 | 0 | 111.7 | Q70 L71 L72 | E68-Q70 VanDerWaalsContact C-N 3.31Å; E68-Q70 PolarHBondContact O-N 3.45Å; E68-L71 PolarHBondContact O-N 3.05Å; E68-L72 HydrophobicContact CG-CD1 4.42Å; E68-L72 WeakPolarHBondContact O-CG 3.41Å; E68-L72 PolarHBondContact O-N 3.4Å |
| 69 | E | 76.9 | Confident | 66.7 | Low | 159 Ų | 159 | 96.7 Ų | 96.7 | 74% | 0.743 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.1 | -35.3 | 174.4 | -61.5 | -175.1 | 171 | 0 | 0 | 112.5 | S67 G73 | S67-E69 PolarHBondContact O-N 2.91Å; S67-E69 PolarHBondContact OG-N 2.55Å; E69-G73 PolarHBondContact O-N 2.82Å |
| 70 | Q | 78.9 | Confident | 68.6 | Low | 53 Ų | 53 | 88.2 Ų | 88.2 | 25% | 0.248 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -69.2 | -40.9 | 178.8 | -69.4 | 174.5 | -43.1 | 0 | 0 | 110.8 | S67 E68 G73 V74 K113 A116 | S67-Q70 WeakPolarHBondContact O-CA 3.44Å; S67-Q70 WeakPolarHBondContact O-CB 3.37Å; S67-Q70 PolarHBondContact O-N 3.48Å; E68-Q70 VanDerWaalsContact C-N 3.31Å; E68-Q70 PolarHBondContact O-N 3.45Å; Q70-G73 PolarHBondContact O-N 2.92Å; Q70-V74 WeakPolarHBondContact O-CG2 3.44Å; Q70-V74 PolarHBondContact O-N 3.36Å; Q70-K113 PolarHBondContact NE2-O 3.02Å; Q70-A116 HydrophobicContact CB-CB 4.28Å |
| 71 | L | 79 | Confident | 70.4 | Confident | 40 Ų | 40 | 94.9 Ų | 94.9 | 21% | 0.209 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -61.4 | -50 | 173.3 | -86.7 | 179.7 | 0 | 0 | 0 | 112.4 | Y66 S67 E68 G73 V74 Q75 A116 P117 | Y66-L71 HydrophobicContact CD2-CD1 3.68Å; Y66-L71 HydrophobicContact CD2-CD2 4.12Å; Y66-L71 HydrophobicContact CD2-CG 3.48Å; Y66-L71 VanDerWaalsContact CD2-CG 3.48Å; Y66-L71 HydrophobicContact CE2-CD1 3.15Å; Y66-L71 HydrophobicContact CE2-CD2 3.91Å; Y66-L71 HydrophobicContact CE2-CG 3.44Å; Y66-L71 VanDerWaalsContact CE2-CG 3.44Å; S67-L71 PolarHBondContact O-N 3.42Å; E68-L71 PolarHBondContact O-N 3.05Å; L71-G73 PolarHBondContact O-N 3.07Å; L71-V74 PolarHBondContact O-N 2.96Å; L71-Q75 WeakPolarHBondContact O-CG 3.39Å; L71-Q75 PolarHBondContact O-N 3.42Å; L71-A116 HydrophobicContact CD2-CB 4.19Å; L71-P117 HydrophobicContact CD2-CG 3.63Å |
| 72 | L | 81.1 | Confident | 72.5 | Confident | 101 Ų | 101 | 88.4 Ų | 88.4 | 53% | 0.529 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.9 | -38.1 | 179.8 | -70.4 | 172.9 | 0 | 0 | 0 | 111.1 | E68 Q75 R76 | E68-L72 HydrophobicContact CG-CD1 4.42Å; E68-L72 WeakPolarHBondContact O-CG 3.41Å; E68-L72 PolarHBondContact O-N 3.4Å; L72-Q75 PolarHBondContact O-N 3.25Å; L72-R76 WeakPolarHBondContact O-CB 3.43Å; L72-R76 PolarHBondContact O-N 3.14Å |
| 73 | G | 80.8 | Confident | 74.9 | Confident | 10 Ų | 10 | 87 Ų | 87 | 10% | 0.103 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -61.9 | -46.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | E69 Q70 L71 R76 I77 | E69-G73 PolarHBondContact O-N 2.82Å; Q70-G73 PolarHBondContact O-N 2.92Å; L71-G73 PolarHBondContact O-N 3.07Å; G73-R76 PolarHBondContact O-N 3.28Å; G73-I77 PolarHBondContact O-N 3.32Å; G73-I77 VanDerWaalsContact O-N 3.16Å |
| 74 | V | 80.2 | Confident | 77 | Confident | 3 Ų | 3 | 82.6 Ų | 82.6 | 2% | 0.018 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 177.7 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | Q70 L71 R76 I77 K78 F109 A116 G118 A119 A122 | Q70-V74 WeakPolarHBondContact O-CG2 3.44Å; Q70-V74 PolarHBondContact O-N 3.36Å; L71-V74 PolarHBondContact O-N 2.96Å; V74-R76 VanDerWaalsContact C-N 3.3Å; V74-R76 PolarHBondContact O-N 3.4Å; V74-I77 PolarHBondContact O-N 2.92Å; V74-K78 HydrophobicContact CG1-CD 4.01Å; V74-K78 HydrophobicContact CG1-CG 4.46Å; V74-K78 WeakPolarHBondContact O-CG 3.46Å; V74-K78 PolarHBondContact O-N 3.48Å; V74-F109 HydrophobicContact CB-CE1 4.44Å; V74-F109 HydrophobicContact CG2-CD1 3.83Å; V74-F109 HydrophobicContact CG2-CE1 3.66Å; V74-A116 HydrophobicContact CG2-CB 4.27Å; V74-G118 VanDerWaalsContact CG1-C 3.47Å; V74-G118 WeakPolarHBondContact CG1-O 3.34Å; V74-A119 HydrophobicContact CG2-CB 4.07Å; V74-A122 HydrophobicContact CG1-CB 4.18Å; V74-A122 HydrophobicContact CG2-CB 4.35Å |
| 75 | Q | 79.9 | Confident | 78.7 | Confident | 93 Ų | 93 | 84.5 Ų | 84.5 | 44% | 0.435 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.7 | -37.1 | 177.6 | -72.4 | -178.3 | 11.5 | 0 | 0 | 112.3 | L71 L72 K79 | L71-Q75 WeakPolarHBondContact O-CG 3.39Å; L71-Q75 PolarHBondContact O-N 3.42Å; L72-Q75 PolarHBondContact O-N 3.25Å; Q75-K79 WeakPolarHBondContact O-CB 3.48Å; Q75-K79 VanDerWaalsContact O-CG 3.25Å; Q75-K79 WeakPolarHBondContact O-CG 3.12Å; Q75-K79 PolarHBondContact O-N 3.19Å; Q75-K79 VanDerWaalsContact O-N 3.07Å |
| 76 | R | 83.1 | Confident | 79.9 | Confident | 127 Ų | 127 | 77.5 Ų | 77.5 | 48% | 0.479 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.5 | -51.7 | 175.4 | -170.1 | -172.4 | 77.1 | -151.8 | 3.9 | 111 | L72 G73 V74 K78 K79 C80 | L72-R76 WeakPolarHBondContact O-CB 3.43Å; L72-R76 PolarHBondContact O-N 3.14Å; G73-R76 PolarHBondContact O-N 3.28Å; V74-R76 VanDerWaalsContact C-N 3.3Å; V74-R76 PolarHBondContact O-N 3.4Å; R76-K78 VanDerWaalsContact C-N 3.28Å; R76-K78 PolarHBondContact O-N 3.22Å; R76-K79 PolarHBondContact O-N 2.75Å; R76-C80 PolarHBondContact O-N 2.96Å; R76-C80 PolarHBondContact O-SG 3.1Å |
| 77 | I | 82 | Confident | 80.9 | Confident | 3 Ų | 3 | 73.9 Ų | 73.9 | 2% | 0.015 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.5 | -39.2 | -178.8 | -68.1 | 162.5 | 0 | 0 | 0 | 111.1 | G73 V74 K79 C80 I86 F109 A122 A125 I126 | G73-I77 PolarHBondContact O-N 3.32Å; G73-I77 VanDerWaalsContact O-N 3.16Å; V74-I77 PolarHBondContact O-N 2.92Å; I77-K79 VanDerWaalsContact C-N 3.28Å; I77-K79 PolarHBondContact O-N 3.38Å; I77-C80 PolarHBondContact O-N 2.86Å; I77-I86 HydrophobicContact CG2-CG2 4.16Å; I77-F109 HydrophobicContact CD1-CD1 4.08Å; I77-F109 HydrophobicContact CD1-CD2 3.74Å; I77-F109 HydrophobicContact CD1-CE1 3.78Å; I77-F109 HydrophobicContact CD1-CE2 3.41Å; I77-F109 VanDerWaalsContact CD1-CE2 3.41Å; I77-F109 HydrophobicContact CD1-CG 4.06Å; I77-F109 HydrophobicContact CD1-CZ 3.43Å; I77-F109 VanDerWaalsContact CD1-CZ 3.43Å; I77-A122 HydrophobicContact CB-CB 4.04Å; I77-A122 HydrophobicContact CD1-CB 4.07Å; I77-A122 HydrophobicContact CG2-CB 3.84Å; I77-A125 HydrophobicContact CG2-CB 3.99Å; I77-I126 HydrophobicContact CD1-CD1 3.6Å; I77-I126 HydrophobicContact CD1-CG1 4.09Å; I77-I126 HydrophobicContact CG2-CG1 4.48Å |
| 78 | K | 77.5 | Confident | 81.2 | Confident | 122 Ų | 122 | 74.1 Ų | 74.1 | 53% | 0.53 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -69.5 | -23.2 | 176.6 | -70.2 | -175.9 | 70.2 | 153.7 | 0 | 113.9 | V74 R76 D121 | V74-K78 HydrophobicContact CG1-CD 4.01Å; V74-K78 HydrophobicContact CG1-CG 4.46Å; V74-K78 WeakPolarHBondContact O-CG 3.46Å; V74-K78 PolarHBondContact O-N 3.48Å; R76-K78 VanDerWaalsContact C-N 3.28Å; R76-K78 PolarHBondContact O-N 3.22Å; K78-D121 IonicContact NZ-OD2 2.89Å; K78-D121 PolarHBondContact NZ-OD2 3.36Å |
| 79 | K | 78.1 | Confident | 81.8 | Confident | 163 Ų | 163 | 68.3 Ų | 68.3 | 71% | 0.709 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -85.4 | -30.4 | 176.8 | -76.6 | 174.9 | -178.2 | 179.8 | 0 | 112.4 | Q75 R76 I77 R81 | Q75-K79 WeakPolarHBondContact O-CB 3.48Å; Q75-K79 VanDerWaalsContact O-CG 3.25Å; Q75-K79 WeakPolarHBondContact O-CG 3.12Å; Q75-K79 PolarHBondContact O-N 3.19Å; Q75-K79 VanDerWaalsContact O-N 3.07Å; R76-K79 PolarHBondContact O-N 2.75Å; I77-K79 VanDerWaalsContact C-N 3.28Å; I77-K79 PolarHBondContact O-N 3.38Å; K79-R81 PolarHBondContact O-N 3.48Å |
| 80 | C | 77.1 | Confident | 82.3 | Confident | 27 Ų | 27 | 64.5 Ų | 64.5 | 18% | 0.182 | 32% | 0.319 | C | S | . | . | trans | -64.9 | 130.9 | 175.7 | -67.8 | 0 | 0 | 0 | 0 | 110 | R76 I77 E85 I86 | R76-C80 PolarHBondContact O-N 2.96Å; R76-C80 PolarHBondContact O-SG 3.1Å; I77-C80 PolarHBondContact O-N 2.86Å; C80-E85 HydrophobicContact CB-CB 4Å; C80-I86 HydrophobicContact CB-CG1 3.72Å | ||
| 81 | R | 69.3 | Low | 82.6 | Confident | 209 Ų | 209 | 68.5 Ų | 68.5 | 79% | 0.789 | 33% | 0.332 | S | S | * | . | trans | -94.1 | -43.3 | 175.2 | -66.9 | -178.6 | 177.5 | 177.6 | -2.2 | 110.1 | K79 | K79-R81 PolarHBondContact O-N 3.48Š| ||
| 82 | N | 82.9 | Confident | 83 | Confident | 63 Ų | 63 | 73.5 Ų | 73.5 | 34% | 0.337 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -76 | 139.7 | -176.2 | -60.3 | -39.7 | 0 | 0 | 0 | 113.8 | Y84 E85 I86 Y142 D147 | N82-Y84 VanDerWaalsContact C-N 3.31Å; N82-Y84 PolarHBondContact O-N 3.46Å; N82-E85 HydrophobicContact CB-CB 4.17Å; N82-E85 HydrophobicContact CB-CG 3.94Å; N82-E85 PolarHBondContact ND2-OE1 3.09Å; N82-E85 PolarHBondContact O-N 3.13Å; N82-E85 VanDerWaalsContact O-N 3.14Å; N82-I86 WeakPolarHBondContact O-CG1 3.36Å; N82-I86 PolarHBondContact O-N 3.46Å; N82-Y142 WeakPolarHBondContact CA-OH 3.23Å; N82-D147 VanDerWaalsContact CA-OD2 3.26Å; N82-D147 WeakPolarHBondContact CA-OD2 3.32Å |
| 83 | Y | 87.3 | Confident | 83.2 | Confident | 38 Ų | 38 | 68.8 Ų | 68.8 | 15% | 0.149 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.9 | -35.5 | 175.9 | -66.6 | -36 | 0 | 0 | 0 | 113.3 | I86 L87 A129 V132 Y142 | Y83-I86 HydrophobicContact CD1-CD1 4.06Å; Y83-I86 PolarHBondContact O-N 3.12Å; Y83-L87 PolarHBondContact O-N 3.05Å; Y83-L87 VanDerWaalsContact O-N 3.08Å; Y83-A129 HydrophobicContact CD1-CB 3.59Å; Y83-A129 HydrophobicContact CG-CB 3.94Å; Y83-V132 HydrophobicContact CD2-CB 4.08Å; Y83-V132 HydrophobicContact CD2-CG1 3.98Å; Y83-V132 HydrophobicContact CE2-CB 3.96Å; Y83-V132 HydrophobicContact CE2-CG1 3.87Å; Y83-V132 HydrophobicContact CE2-CG2 3.91Å; Y83-Y142 HydrophobicContact CD2-CD1 4.08Å; Y83-Y142 AromaticContact CD2-CD2 3.5Å; Y83-Y142 HydrophobicContact CD2-CD2 3.5Å; Y83-Y142 VanDerWaalsContact CD2-CD2 3.5Å; Y83-Y142 AromaticContact CD2-CE1 3.78Å; Y83-Y142 HydrophobicContact CD2-CE1 3.78Å; Y83-Y142 AromaticContact CD2-CE2 3.16Å; Y83-Y142 HydrophobicContact CD2-CE2 3.16Å; Y83-Y142 AromaticContact CD2-CG 3.94Å; Y83-Y142 HydrophobicContact CD2-CG 3.94Å; Y83-Y142 AromaticContact CD2-CZ 3.31Å; Y83-Y142 AromaticContact CE2-CD2 3.49Å; Y83-Y142 HydrophobicContact CE2-CD2 3.49Å; Y83-Y142 VanDerWaalsContact CE2-CD2 3.49Å; Y83-Y142 AromaticContact CE2-CE2 3.32Å; Y83-Y142 HydrophobicContact CE2-CE2 3.32Å; Y83-Y142 HydrophobicContact CE2-CG 4.26Å; Y83-Y142 AromaticContact CE2-CZ 3.98Å; Y83-Y142 HydrophobicContact CG-CE1 4.32Å; Y83-Y142 HydrophobicContact CG-CE2 4.04Å; Y83-Y142 AromaticContact CG-CZ 3.82Å; Y83-Y142 PolarHBondContact N-OH 2.81Å |
| 84 | Y | 87.9 | Confident | 83.6 | Confident | 20 Ų | 20 | 70.9 Ų | 70.9 | 8% | 0.078 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 174.7 | -64.2 | -76.6 | 0 | 0 | 0 | 112.2 | N82 L87 G88 V89 S90 R91 L133 R139 Y142 D143 | N82-Y84 VanDerWaalsContact C-N 3.31Å; N82-Y84 PolarHBondContact O-N 3.46Å; Y84-L87 PolarHBondContact O-N 2.98Å; Y84-G88 WeakPolarHBondContact O-CA 3.48Å; Y84-G88 PolarHBondContact O-N 3.07Å; Y84-V89 HydrophobicContact CD1-CG2 4.07Å; Y84-V89 PolarHBondContact O-N 3.4Å; Y84-S90 WeakPolarHBondContact CD1-O 3.35Å; Y84-R91 HydrophobicContact CD2-CG 4.38Å; Y84-R91 HydrophobicContact CE1-CG 4.44Å; Y84-R91 HydrophobicContact CE2-CG 3.96Å; Y84-L133 HydrophobicContact CD1-CD1 3.85Å; Y84-L133 HydrophobicContact CD1-CD2 4.38Å; Y84-L133 HydrophobicContact CD2-CD2 4.44Å; Y84-L133 HydrophobicContact CE1-CD1 3.92Å; Y84-L133 HydrophobicContact CE1-CD2 3.73Å; Y84-L133 HydrophobicContact CE1-CG 4.42Å; Y84-L133 HydrophobicContact CE2-CD2 3.8Å; Y84-L133 HydrophobicContact CG-CD1 4.21Å; Y84-L133 WeakPolarHBondContact OH-CD2 3.31Å; Y84-R139 PolarHBondContact OH-NE 3.44Å; Y84-Y142 HydrophobicContact CD2-CE1 4.05Å; Y84-Y142 HydrophobicContact CE2-CD1 4.07Å; Y84-Y142 AromaticContact CE2-CE1 3.77Å; Y84-Y142 HydrophobicContact CE2-CE1 3.77Å; Y84-D143 PolarHBondContact OH-OD1 3.25Å; Y84-D143 PolarHBondContact OH-OD2 2.79Å |
| 85 | E | 86.3 | Confident | 83.8 | Confident | 96 Ų | 96 | 74 Ų | 74 | 45% | 0.449 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -71.6 | -37.9 | 177.2 | -68.8 | 174.1 | -162.9 | 0 | 0 | 112.1 | C80 N82 L87 G88 | C80-E85 HydrophobicContact CB-CB 4Å; N82-E85 HydrophobicContact CB-CB 4.17Å; N82-E85 HydrophobicContact CB-CG 3.94Å; N82-E85 PolarHBondContact ND2-OE1 3.09Å; N82-E85 PolarHBondContact O-N 3.13Å; N82-E85 VanDerWaalsContact O-N 3.14Å; E85-L87 VanDerWaalsContact C-N 3.31Å; E85-L87 PolarHBondContact O-N 3.03Å; E85-G88 PolarHBondContact O-N 3.44Å; E85-G88 VanDerWaalsContact O-N 3.1Å |
| 86 | I | 86.4 | Confident | 84 | Confident | 10 Ų | 10 | 76 Ų | 76 | 5% | 0.051 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.8 | -45 | 174.6 | -71.5 | 164.3 | 0 | 0 | 0 | 110.3 | I77 C80 N82 Y83 G88 L105 I126 A129 | I77-I86 HydrophobicContact CG2-CG2 4.16Å; C80-I86 HydrophobicContact CB-CG1 3.72Å; N82-I86 WeakPolarHBondContact O-CG1 3.36Å; N82-I86 PolarHBondContact O-N 3.46Å; Y83-I86 HydrophobicContact CD1-CD1 4.06Å; Y83-I86 PolarHBondContact O-N 3.12Å; I86-G88 VanDerWaalsContact C-N 3.33Å; I86-L105 WeakPolarHBondContact O-CD1 3.5Å; I86-I126 HydrophobicContact CG2-CG1 4.1Å; I86-A129 HydrophobicContact CB-CB 4.21Å; I86-A129 HydrophobicContact CG2-CB 3.89Å |
| 87 | L | 87.3 | Confident | 84.2 | Confident | 6 Ų | 6 | 74.8 Ų | 74.8 | 3% | 0.031 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -78.4 | -16.2 | 176.1 | -66.2 | -176.6 | 0 | 0 | 0 | 113.4 | Y83 Y84 E85 V89 L98 L105 I126 A129 F130 L133 | Y83-L87 PolarHBondContact O-N 3.05Å; Y83-L87 VanDerWaalsContact O-N 3.08Å; Y84-L87 PolarHBondContact O-N 2.98Å; E85-L87 VanDerWaalsContact C-N 3.31Å; E85-L87 PolarHBondContact O-N 3.03Å; L87-V89 HydrophobicContact CB-CG1 4.45Å; L87-V89 HydrophobicContact CB-CG2 3.97Å; L87-L98 HydrophobicContact CD1-CD2 3.78Å; L87-L105 HydrophobicContact CD2-CD1 4.26Å; L87-L105 WeakPolarHBondContact O-CD1 3.45Å; L87-I126 HydrophobicContact CD2-CG2 4.04Å; L87-A129 HydrophobicContact CD1-CB 4.36Å; L87-A129 HydrophobicContact CD2-CB 4.26Å; L87-A129 HydrophobicContact CG-CB 3.95Å; L87-F130 HydrophobicContact CD1-CB 4.38Å; L87-F130 HydrophobicContact CD2-CB 4.45Å; L87-L133 HydrophobicContact CD1-CD1 3.83Å |
| 88 | G | 86.3 | Confident | 84.5 | Confident | 61 Ų | 61 | 74.7 Ų | 74.7 | 63% | 0.629 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.5 | 38.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y84 E85 I86 | Y84-G88 WeakPolarHBondContact O-CA 3.48Å; Y84-G88 PolarHBondContact O-N 3.07Å; E85-G88 PolarHBondContact O-N 3.44Å; E85-G88 VanDerWaalsContact O-N 3.1Å; I86-G88 VanDerWaalsContact C-N 3.33Å |
| 89 | V | 89.5 | Confident | 85 | Confident | 31 Ų | 31 | 71.8 Ų | 71.8 | 19% | 0.188 | 36% | 0.36 | C | S | . | . | trans | -121.6 | 160.4 | -179.2 | -63.6 | 0 | 0 | 0 | 0 | 111.1 | Y84 L87 A93 L98 A101 | Y84-V89 HydrophobicContact CD1-CG2 4.07Å; Y84-V89 PolarHBondContact O-N 3.4Å; L87-V89 HydrophobicContact CB-CG1 4.45Å; L87-V89 HydrophobicContact CB-CG2 3.97Å; V89-A93 HydrophobicContact CB-CB 3.9Å; V89-A93 HydrophobicContact CG2-CB 4.16Å; V89-L98 HydrophobicContact CG2-CD2 3.82Å; V89-A101 HydrophobicContact CG1-CB 3.51Å | ||
| 90 | S | 88.4 | Confident | 85.4 | Confident | 78 Ų | 78 | 71.1 Ų | 71.1 | 55% | 0.545 | 36% | 0.358 | S | S | . | . | trans | -71.2 | 158 | 172.4 | -171.3 | 0 | 0 | 0 | 0 | 111.2 | Y84 D92 A93 | Y84-S90 WeakPolarHBondContact CD1-O 3.35Å; S90-D92 PolarHBondContact O-N 3.01Å; S90-A93 WeakPolarHBondContact O-CB 3.39Å; S90-A93 PolarHBondContact O-N 3.35Å; S90-A93 VanDerWaalsContact O-N 3.09Å | ||
| 91 | R | 85.4 | Confident | 85.9 | Confident | 137 Ų | 137 | 70.7 Ų | 70.7 | 52% | 0.517 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -31 | 173.2 | -167.7 | 177.8 | -175.7 | -174.7 | 1.5 | 112.3 | Y84 A93 R139 D143 | Y84-R91 HydrophobicContact CD2-CG 4.38Å; Y84-R91 HydrophobicContact CE1-CG 4.44Å; Y84-R91 HydrophobicContact CE2-CG 3.96Å; R91-A93 VanDerWaalsContact C-N 3.25Å; R91-A93 PolarHBondContact O-N 3Å; R91-R139 PolarHBondContact O-NH2 2.91Å; R91-D143 IonicContact CZ-OD1 3.32Å; R91-D143 IonicContact NE-OD1 2.86Å; R91-D143 PolarHBondContact NE-OD1 2.87Å; R91-D143 PolarHBondContact NH2-O 2.71Å; R91-D143 VanDerWaalsContact NH2-O 3.11Å; R91-D143 IonicContact NH2-OD1 2.89Å; R91-D143 PolarHBondContact NH2-OD1 3.48Å |
| 92 | D | 85.6 | Confident | 86.8 | Confident | 145 Ų | 145 | 60.8 Ų | 60.8 | 78% | 0.775 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | 11.2 | 177.8 | -54.9 | -46.8 | 0 | 0 | 0 | 113.4 | S90 | S90-D92 PolarHBondContact O-N 3.01Š|
| 93 | A | 86.3 | Confident | 87 | Confident | 3 Ų | 3 | 62.5 Ų | 62.5 | 3% | 0.025 | 32% | 0.32 | C | S | . | . | trans | -62.2 | 140.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V89 S90 R91 E97 R139 | V89-A93 HydrophobicContact CB-CB 3.9Å; V89-A93 HydrophobicContact CG2-CB 4.16Å; S90-A93 WeakPolarHBondContact O-CB 3.39Å; S90-A93 PolarHBondContact O-N 3.35Å; S90-A93 VanDerWaalsContact O-N 3.09Å; R91-A93 VanDerWaalsContact C-N 3.25Å; R91-A93 PolarHBondContact O-N 3Å; A93-E97 WeakPolarHBondContact CA-OE2 3.29Å; A93-E97 HydrophobicContact CB-CB 4.32Å; A93-R139 PolarHBondContact O-NH1 3.23Å; A93-R139 PolarHBondContact O-NH2 2.85Å | ||
| 94 | S | 88.7 | Confident | 87.1 | Confident | 54 Ų | 54 | 67.2 Ų | 67.2 | 38% | 0.378 | 34% | 0.342 | S | S | . | . | trans | -75.8 | 160 | 175.2 | 66.4 | 0 | 0 | 0 | 0 | 111.9 | E96 E97 L98 | S94-E96 PolarHBondContact O-N 3.16Å; S94-E97 PolarHBondContact N-OE2 3.46Å; S94-E97 VanDerWaalsContact N-OE2 3.13Å; S94-E97 WeakPolarHBondContact O-CB 3.39Å; S94-E97 PolarHBondContact O-N 3.43Å; S94-E97 WeakPolarHBondContact OG-CG 3.36Å; S94-E97 PolarHBondContact OG-N 3.48Å; S94-L98 PolarHBondContact O-N 3.21Å | ||
| 95 | D | 85.4 | Confident | 87 | Confident | 67 Ų | 67 | 67 Ų | 67 | 36% | 0.358 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -58.9 | -32 | 178.4 | -66 | -9 | 0 | 0 | 0 | 112.7 | K99 R139 | D95-K99 WeakPolarHBondContact O-CB 3.35Å; D95-K99 VanDerWaalsContact O-CG 3.27Å; D95-K99 WeakPolarHBondContact O-CG 3.35Å; D95-K99 PolarHBondContact O-N 2.82Å; D95-R139 IonicContact OD1-NH1 4Å |
| 96 | E | 84.2 | Confident | 87 | Confident | 135 Ų | 135 | 62.4 Ų | 62.4 | 63% | 0.631 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -68.5 | -39.4 | 176.3 | -63.3 | -169.8 | 175.5 | 0 | 0 | 112 | S94 K99 K100 | S94-E96 PolarHBondContact O-N 3.16Å; E96-K99 PolarHBondContact O-N 3.33Å; E96-K100 WeakPolarHBondContact O-CB 3.3Å; E96-K100 PolarHBondContact O-N 2.96Å |
| 97 | E | 86.4 | Confident | 86.9 | Confident | 103 Ų | 103 | 65.5 Ų | 65.5 | 48% | 0.481 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -67.6 | -42 | 175.8 | -72.4 | 173 | 165.8 | 0 | 0 | 111.5 | A93 S94 K99 K100 A101 | A93-E97 WeakPolarHBondContact CA-OE2 3.29Å; A93-E97 HydrophobicContact CB-CB 4.32Å; S94-E97 PolarHBondContact N-OE2 3.46Å; S94-E97 VanDerWaalsContact N-OE2 3.13Å; S94-E97 WeakPolarHBondContact O-CB 3.39Å; S94-E97 PolarHBondContact O-N 3.43Å; S94-E97 WeakPolarHBondContact OG-CG 3.36Å; S94-E97 PolarHBondContact OG-N 3.48Å; E97-K99 PolarHBondContact O-N 3.16Å; E97-K100 PolarHBondContact O-N 2.91Å; E97-A101 WeakPolarHBondContact O-CB 3.22Å; E97-A101 PolarHBondContact O-N 3.2Å |
| 98 | L | 88.5 | Confident | 86.7 | Confident | 1 Ų | 1 | 71 Ų | 71 | 1% | 0.005 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.7 | -47.6 | 173.2 | -72.5 | 169.9 | 0 | 0 | 0 | 111.1 | L87 V89 S94 K100 A101 Y102 F130 L133 | L87-L98 HydrophobicContact CD1-CD2 3.78Å; V89-L98 HydrophobicContact CG2-CD2 3.82Å; S94-L98 PolarHBondContact O-N 3.21Å; L98-K100 VanDerWaalsContact C-N 3.33Å; L98-K100 PolarHBondContact O-N 2.89Å; L98-A101 PolarHBondContact O-N 3.3Å; L98-Y102 WeakPolarHBondContact O-CB 3.39Å; L98-Y102 PolarHBondContact O-N 3.21Å; L98-F130 HydrophobicContact CB-CD2 4.41Å; L98-F130 HydrophobicContact CB-CE2 4.16Å; L98-L133 HydrophobicContact CD1-CB 4.16Å; L98-L133 HydrophobicContact CD2-CB 4.07Å; L98-L133 HydrophobicContact CD2-CD1 4.04Å |
| 99 | K | 87 | Confident | 86.7 | Confident | 60 Ų | 60 | 68.6 Ų | 68.6 | 26% | 0.261 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.6 | -38.9 | 176.6 | -74.2 | 169.5 | -176.7 | 177.3 | 0 | 112.1 | D95 E96 E97 R103 F130 | D95-K99 WeakPolarHBondContact O-CB 3.35Å; D95-K99 VanDerWaalsContact O-CG 3.27Å; D95-K99 WeakPolarHBondContact O-CG 3.35Å; D95-K99 PolarHBondContact O-N 2.82Å; E96-K99 PolarHBondContact O-N 3.33Å; E97-K99 PolarHBondContact O-N 3.16Å; K99-R103 WeakPolarHBondContact O-CB 3.22Å; K99-R103 WeakPolarHBondContact O-CG 3.46Å; K99-R103 PolarHBondContact O-N 3.43Å; K99-R103 VanDerWaalsContact O-N 3.11Å; K99-R103 PolarHBondContact O-NE 2.98Å; K99-R103 VanDerWaalsContact O-NE 3.14Å; K99-F130 HydrophobicContact CB-CE2 4.42Å; K99-F130 HydrophobicContact CG-CE2 3.91Å; K99-F130 HydrophobicContact CG-CZ 3.75Å |
| 100 | K | 86.9 | Confident | 86.4 | Confident | 149 Ų | 149 | 68.8 Ų | 68.8 | 65% | 0.648 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -68.8 | -42.3 | 178.3 | -170.8 | 178.3 | -179.6 | -179.9 | 0 | 111.8 | E96 E97 L98 K104 | E96-K100 WeakPolarHBondContact O-CB 3.3Å; E96-K100 PolarHBondContact O-N 2.96Å; E97-K100 PolarHBondContact O-N 2.91Å; L98-K100 VanDerWaalsContact C-N 3.33Å; L98-K100 PolarHBondContact O-N 2.89Å; K100-K104 PolarHBondContact O-N 3.02Å |
| 101 | A | 88.6 | Confident | 85.9 | Confident | 18 Ų | 18 | 67.4 Ų | 67.4 | 15% | 0.149 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.3 | -47.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | V89 E97 L98 R103 K104 L105 | V89-A101 HydrophobicContact CG1-CB 3.51Å; E97-A101 WeakPolarHBondContact O-CB 3.22Å; E97-A101 PolarHBondContact O-N 3.2Å; L98-A101 PolarHBondContact O-N 3.3Å; A101-R103 PolarHBondContact O-N 3.05Å; A101-K104 PolarHBondContact O-N 3.35Å; A101-L105 WeakPolarHBondContact O-CG 3.33Å; A101-L105 PolarHBondContact O-N 3.35Å |
| 102 | Y | 88.4 | Confident | 85.6 | Confident | 1 Ų | 1 | 67.2 Ų | 67.2 | 0% | 0.004 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -56.6 | -50.2 | 176 | 176.1 | -107.2 | 0 | 0 | 0 | 111.8 | L98 K104 L105 A106 I126 F130 L175 F179 | L98-Y102 WeakPolarHBondContact O-CB 3.39Å; L98-Y102 PolarHBondContact O-N 3.21Å; Y102-K104 VanDerWaalsContact C-N 3.3Å; Y102-K104 PolarHBondContact O-N 3.08Å; Y102-L105 PolarHBondContact O-N 2.96Å; Y102-A106 HydrophobicContact CE1-CB 4.37Å; Y102-A106 HydrophobicContact CE2-CB 4.19Å; Y102-A106 WeakPolarHBondContact O-CB 3.37Å; Y102-A106 PolarHBondContact O-N 3.26Å; Y102-I126 HydrophobicContact CD2-CG2 3.75Å; Y102-I126 HydrophobicContact CE2-CG2 3.99Å; Y102-F130 VanDerWaalsContact CB-CD2 3.49Å; Y102-F130 HydrophobicContact CD1-CD1 4.21Å; Y102-F130 HydrophobicContact CD1-CE1 4.39Å; Y102-F130 HydrophobicContact CD1-CG 4.27Å; Y102-F130 HydrophobicContact CD2-CB 3.55Å; Y102-F130 HydrophobicContact CD2-CD1 4.27Å; Y102-F130 HydrophobicContact CD2-CD2 4.38Å; Y102-F130 AromaticContact CD2-CG 3.8Å; Y102-F130 HydrophobicContact CD2-CG 3.8Å; Y102-F130 HydrophobicContact CE2-CB 4.17Å; Y102-F130 HydrophobicContact CG-CB 3.96Å; Y102-F130 HydrophobicContact CG-CD1 4.07Å; Y102-F130 AromaticContact CG-CD2 3.91Å; Y102-F130 HydrophobicContact CG-CD2 3.91Å; Y102-F130 HydrophobicContact CG-CE2 4.46Å; Y102-F130 AromaticContact CG-CG 3.68Å; Y102-F130 HydrophobicContact CG-CG 3.68Å; Y102-L175 HydrophobicContact CE1-CD2 4.19Å; Y102-L175 HydrophobicContact CE1-CG 4.09Å; Y102-L175 HydrophobicContact CE2-CD2 3.89Å; Y102-L175 WeakPolarHBondContact OH-CD2 3.44Å; Y102-L175 WeakPolarHBondContact OH-CG 3.45Å; Y102-F179 HydrophobicContact CD1-CD2 4.3Å; Y102-F179 HydrophobicContact CE1-CB 4.39Å; Y102-F179 HydrophobicContact CE1-CD2 4.37Å; Y102-F179 HydrophobicContact CE1-CG 4.37Å |
| 103 | R | 86.4 | Confident | 85.3 | Confident | 100 Ų | 100 | 67.1 Ų | 67.1 | 38% | 0.377 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -50.2 | -49.5 | 175.9 | -86.7 | -179.7 | -85.6 | -145 | 11.5 | 113.2 | K99 A101 L107 F179 F180 | K99-R103 WeakPolarHBondContact O-CB 3.22Å; K99-R103 WeakPolarHBondContact O-CG 3.46Å; K99-R103 PolarHBondContact O-N 3.43Å; K99-R103 VanDerWaalsContact O-N 3.11Å; K99-R103 PolarHBondContact O-NE 2.98Å; K99-R103 VanDerWaalsContact O-NE 3.14Å; A101-R103 PolarHBondContact O-N 3.05Å; R103-L107 WeakPolarHBondContact O-CG 3.3Å; R103-L107 PolarHBondContact O-N 3.44Å; R103-F179 HydrophobicContact CB-CE1 4.47Å; R103-F179 HydrophobicContact CG-CD1 3.72Å; R103-F179 HydrophobicContact CG-CE1 3Å; R103-F179 HydrophobicContact CG-CE2 4Å; R103-F179 HydrophobicContact CG-CZ 3.16Å; R103-F180 HydrophobicContact CB-CZ 4.21Å; R103-F180 HydrophobicContact CG-CE1 4.47Å; R103-F180 HydrophobicContact CG-CZ 3.9Å |
| 104 | K | 88.4 | Confident | 84.9 | Confident | 137 Ų | 137 | 67.1 Ų | 67.1 | 60% | 0.596 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -67 | -40.2 | -175.7 | -174.4 | 178.7 | 179.8 | -178.9 | 0 | 111.3 | K100 A101 Y102 K108 | K100-K104 PolarHBondContact O-N 3.02Å; A101-K104 PolarHBondContact O-N 3.35Å; Y102-K104 VanDerWaalsContact C-N 3.3Å; Y102-K104 PolarHBondContact O-N 3.08Å; K104-K108 VanDerWaalsContact O-CG 3.23Å; K104-K108 WeakPolarHBondContact O-CG 3.46Å; K104-K108 PolarHBondContact O-N 3.41Å |
| 105 | L | 87.4 | Confident | 84.3 | Confident | 14 Ų | 14 | 68 Ų | 68 | 7% | 0.073 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -76.9 | -42.6 | -179.3 | -70 | 172.8 | 0 | 0 | 0 | 112 | I86 L87 A101 Y102 L107 K108 F109 I126 | I86-L105 WeakPolarHBondContact O-CD1 3.5Å; L87-L105 HydrophobicContact CD2-CD1 4.26Å; L87-L105 WeakPolarHBondContact O-CD1 3.45Å; A101-L105 WeakPolarHBondContact O-CG 3.33Å; A101-L105 PolarHBondContact O-N 3.35Å; Y102-L105 PolarHBondContact O-N 2.96Å; L105-L107 VanDerWaalsContact C-N 3.29Å; L105-L107 PolarHBondContact O-N 3.05Å; L105-K108 PolarHBondContact O-N 3.3Å; L105-F109 HydrophobicContact CD2-CD2 4.28Å; L105-F109 HydrophobicContact CD2-CE2 3.94Å; L105-F109 WeakPolarHBondContact O-CD2 3.49Å; L105-F109 PolarHBondContact O-N 3.46Å; L105-I126 HydrophobicContact CB-CD1 3.88Å; L105-I126 HydrophobicContact CB-CG1 4.35Å; L105-I126 HydrophobicContact CB-CG2 3.99Å |
| 106 | A | 85.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.2 | -39.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y102 H110 F123 F176 F180 | Y102-A106 HydrophobicContact CE1-CB 4.37Å; Y102-A106 HydrophobicContact CE2-CB 4.19Å; Y102-A106 WeakPolarHBondContact O-CB 3.37Å; Y102-A106 PolarHBondContact O-N 3.26Å; A106-H110 WeakPolarHBondContact O-CB 3.36Å; A106-H110 PolarHBondContact O-N 2.99Å; A106-F123 HydrophobicContact CB-CE2 4.08Å; A106-F176 HydrophobicContact CB-CD2 3.94Å; A106-F176 HydrophobicContact CB-CE2 4.18Å; A106-F180 HydrophobicContact CB-CE2 4.36Å |
| 107 | L | 85.3 | Confident | 83.6 | Confident | 76 Ų | 76 | 62.4 Ų | 62.4 | 40% | 0.398 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -69.3 | -32.1 | 174.4 | -71.7 | 171.2 | 0 | 0 | 0 | 113.6 | R103 L105 F176 F180 | R103-L107 WeakPolarHBondContact O-CG 3.3Å; R103-L107 PolarHBondContact O-N 3.44Å; L105-L107 VanDerWaalsContact C-N 3.29Å; L105-L107 PolarHBondContact O-N 3.05Å; L107-F176 HydrophobicContact CD2-CE2 4.4Å; L107-F176 HydrophobicContact CD2-CZ 4.4Å; L107-F180 HydrophobicContact CD1-CE1 4.01Å; L107-F180 HydrophobicContact CD1-CZ 4.19Å; L107-F180 HydrophobicContact CD2-CD1 4.47Å; L107-F180 HydrophobicContact CD2-CE1 4.02Å; L107-F180 HydrophobicContact CD2-CZ 4.21Å; L107-F180 HydrophobicContact CG-CE1 4.03Å; L107-F180 HydrophobicContact CG-CZ 3.9Å |
| 108 | K | 83.6 | Confident | 83.2 | Confident | 120 Ų | 120 | 58.5 Ų | 58.5 | 52% | 0.522 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -79.2 | -32.8 | -179.2 | -77 | -179.5 | 175.5 | -146.9 | 0 | 113.2 | K104 L105 | K104-K108 VanDerWaalsContact O-CG 3.23Å; K104-K108 WeakPolarHBondContact O-CG 3.46Å; K104-K108 PolarHBondContact O-N 3.41Å; L105-K108 PolarHBondContact O-N 3.3Å |
| 109 | F | 84.3 | Confident | 82.6 | Confident | 12 Ų | 12 | 58.6 Ų | 58.6 | 5% | 0.053 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -108.5 | 12.7 | -176.7 | -68 | -81.2 | 0 | 0 | 0 | 112.9 | V74 I77 L105 N114 A122 I126 | V74-F109 HydrophobicContact CB-CE1 4.44Å; V74-F109 HydrophobicContact CG2-CD1 3.83Å; V74-F109 HydrophobicContact CG2-CE1 3.66Å; I77-F109 HydrophobicContact CD1-CD1 4.08Å; I77-F109 HydrophobicContact CD1-CD2 3.74Å; I77-F109 HydrophobicContact CD1-CE1 3.78Å; I77-F109 HydrophobicContact CD1-CE2 3.41Å; I77-F109 VanDerWaalsContact CD1-CE2 3.41Å; I77-F109 HydrophobicContact CD1-CG 4.06Å; I77-F109 HydrophobicContact CD1-CZ 3.43Å; I77-F109 VanDerWaalsContact CD1-CZ 3.43Å; L105-F109 HydrophobicContact CD2-CD2 4.28Å; L105-F109 HydrophobicContact CD2-CE2 3.94Å; L105-F109 WeakPolarHBondContact O-CD2 3.49Å; L105-F109 PolarHBondContact O-N 3.46Å; F109-N114 WeakPolarHBondContact CD1-ND2 3.41Å; F109-A122 HydrophobicContact CD1-CB 4.34Å; F109-I126 HydrophobicContact CB-CD1 3.91Å; F109-I126 HydrophobicContact CD2-CD1 3.67Å; F109-I126 HydrophobicContact CE2-CD1 4.48Å; F109-I126 HydrophobicContact CG-CD1 3.92Å |
| 110 | H | 83.4 | Confident | 82.3 | Confident | 34 Ų | 34 | 59 Ų | 59 | 16% | 0.157 | 30% | 0.303 | C | S | . | . | trans | -59 | 133.3 | 175.2 | -166 | -88.4 | 0 | 0 | 0 | 110.2 | A106 D112 K113 N114 F176 | A106-H110 WeakPolarHBondContact O-CB 3.36Å; A106-H110 PolarHBondContact O-N 2.99Å; H110-D112 IonicContact CE1-OD1 3.92Å; H110-D112 IonicContact CE1-OD2 3.72Å; H110-D112 PolarHBondContact CE1-OD2 3.43Å; H110-D112 VanDerWaalsContact CE1-OD2 3.24Å; H110-D112 VanDerWaalsContact ND1-CB 3.34Å; H110-D112 WeakPolarHBondContact ND1-CB 3.27Å; H110-D112 PolarHBondContact ND1-N 3.37Å; H110-D112 VanDerWaalsContact ND1-N 3.14Å; H110-D112 IonicContact ND1-OD1 3.24Å; H110-D112 IonicContact ND1-OD2 2.81Å; H110-D112 PolarHBondContact O-N 3.06Å; H110-D112 VanDerWaalsContact O-N 3.14Å; H110-K113 PolarHBondContact O-N 3.2Å; H110-N114 PolarHBondContact O-N 2.94Å; H110-F176 AromaticContact CD2-CE1 3.86Å; H110-F176 AromaticContact CD2-CE2 3.88Å; H110-F176 AromaticContact CD2-CZ 3.67Å; H110-F176 AromaticContact NE2-CE1 3.82Å | ||
| 111 | P | 79.7 | Confident | 82 | Confident | 49 Ų | 49 | 55.9 Ų | 55.9 | 32% | 0.318 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.8 | -31.1 | -176.8 | 22.1 | -33.9 | 0 | 0 | 0 | 113.2 | K113 | P111-K113 VanDerWaalsContact C-N 3.33Å; P111-K113 PolarHBondContact O-N 3.02Å |
| 112 | D | 79 | Confident | 81.7 | Confident | 133 Ų | 133 | 55 Ų | 55 | 71% | 0.711 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.2 | -22.8 | 177.5 | -59.2 | -1.7 | 0 | 0 | 0 | 114.1 | H110 | H110-D112 IonicContact CE1-OD1 3.92Å; H110-D112 IonicContact CE1-OD2 3.72Å; H110-D112 PolarHBondContact CE1-OD2 3.43Å; H110-D112 VanDerWaalsContact CE1-OD2 3.24Å; H110-D112 VanDerWaalsContact ND1-CB 3.34Å; H110-D112 WeakPolarHBondContact ND1-CB 3.27Å; H110-D112 PolarHBondContact ND1-N 3.37Å; H110-D112 VanDerWaalsContact ND1-N 3.14Å; H110-D112 IonicContact ND1-OD1 3.24Å; H110-D112 IonicContact ND1-OD2 2.81Å; H110-D112 PolarHBondContact O-N 3.06Å; H110-D112 VanDerWaalsContact O-N 3.14Å |
| 113 | K | 77.4 | Confident | 81.5 | Confident | 144 Ų | 144 | 55.1 Ų | 55.1 | 63% | 0.626 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.7 | -20.6 | -176.5 | -65.7 | -170.3 | 177.7 | -172 | 0 | 113.3 | Q70 H110 P111 | Q70-K113 PolarHBondContact NE2-O 3.02Å; H110-K113 PolarHBondContact O-N 3.2Å; P111-K113 VanDerWaalsContact C-N 3.33Å; P111-K113 PolarHBondContact O-N 3.02Å |
| 114 | N | 78.4 | Confident | 81.5 | Confident | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.016 | 29% | 0.289 | C | S | . | . | trans | -124.9 | 98.3 | -177.5 | -172.2 | -11.2 | 0 | 0 | 0 | 110.2 | F109 H110 A116 A119 | F109-N114 WeakPolarHBondContact CD1-ND2 3.41Å; H110-N114 PolarHBondContact O-N 2.94Å; N114-A116 PolarHBondContact O-N 3.22Å; N114-A116 WeakPolarHBondContact OD1-CB 3.5Å; N114-A116 PolarHBondContact OD1-N 3.45Å; N114-A119 HydrophobicContact CB-CB 4.22Å; N114-A119 VanDerWaalsContact O-CB 3.27Å; N114-A119 WeakPolarHBondContact O-CB 3.46Å | ||
| 115 | C | 76.9 | Confident | 81.3 | Confident | 71 Ų | 71 | 49.8 Ų | 49.8 | 48% | 0.48 | 27% | 0.271 | S | S | . | . | trans | -86.4 | 13.2 | 177.8 | -60.6 | 0 | 0 | 0 | 0 | 113.2 | M65 | M65-C115 HydrophobicContact CB-CB 4.46Š| ||
| 116 | A | 77.2 | Confident | 81.2 | Confident | 4 Ų | 4 | 49.1 Ų | 49.1 | 3% | 0.033 | 27% | 0.267 | C | S | . | . | S | Bend | trans | -66.4 | 143.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y66 Q70 L71 V74 N114 G118 A119 | Y66-A116 HydrophobicContact CG-CB 4.08Å; Q70-A116 HydrophobicContact CB-CB 4.28Å; L71-A116 HydrophobicContact CD2-CB 4.19Å; V74-A116 HydrophobicContact CG2-CB 4.27Å; N114-A116 PolarHBondContact O-N 3.22Å; N114-A116 WeakPolarHBondContact OD1-CB 3.5Å; N114-A116 PolarHBondContact OD1-N 3.45Å; A116-G118 PolarHBondContact O-N 2.93Å; A116-G118 VanDerWaalsContact O-N 3.14Å; A116-A119 VanDerWaalsContact O-CB 3.27Å; A116-A119 WeakPolarHBondContact O-CB 3.44Å; A116-A119 PolarHBondContact O-N 3.23Å |
| 117 | P | 77.6 | Confident | 81.2 | Confident | 82 Ų | 82 | 49.1 Ų | 49.1 | 53% | 0.532 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | 119.8 | 176.9 | 24.2 | -34.6 | 0 | 0 | 0 | 111 | L71 | L71-P117 HydrophobicContact CD2-CG 3.63Š|
| 118 | G | 77.8 | Confident | 81.2 | Confident | 21 Ų | 21 | 48 Ų | 48 | 22% | 0.216 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 90 | 5.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | V74 A116 T120 D121 A122 | V74-G118 VanDerWaalsContact CG1-C 3.47Å; V74-G118 WeakPolarHBondContact CG1-O 3.34Å; A116-G118 PolarHBondContact O-N 2.93Å; A116-G118 VanDerWaalsContact O-N 3.14Å; G118-T120 VanDerWaalsContact C-N 3.27Å; G118-T120 PolarHBondContact O-N 2.83Å; G118-D121 PolarHBondContact O-N 3.2Å; G118-D121 VanDerWaalsContact O-N 3.16Å; G118-A122 PolarHBondContact O-N 3.14Å |
| 119 | A | 76.4 | Confident | 81.3 | Confident | 3 Ų | 3 | 42.2 Ų | 42.2 | 3% | 0.025 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58 | -38.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V74 N114 A116 D121 A122 F123 | V74-A119 HydrophobicContact CG2-CB 4.07Å; N114-A119 HydrophobicContact CB-CB 4.22Å; N114-A119 VanDerWaalsContact O-CB 3.27Å; N114-A119 WeakPolarHBondContact O-CB 3.46Å; A116-A119 VanDerWaalsContact O-CB 3.27Å; A116-A119 WeakPolarHBondContact O-CB 3.44Å; A116-A119 PolarHBondContact O-N 3.23Å; A119-D121 PolarHBondContact O-N 3.23Å; A119-A122 PolarHBondContact O-N 2.88Å; A119-F123 WeakPolarHBondContact O-CB 3.47Å; A119-F123 PolarHBondContact O-N 3.28Å |
| 120 | T | 79.4 | Confident | 81.5 | Confident | 69 Ų | 69 | 42 Ų | 42 | 42% | 0.423 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.3 | -41 | 175 | -46.9 | 0 | 0 | 0 | 0 | 112.5 | G118 F123 K124 | G118-T120 VanDerWaalsContact C-N 3.27Å; G118-T120 PolarHBondContact O-N 2.83Å; T120-F123 PolarHBondContact O-N 3.05Å; T120-K124 VanDerWaalsContact O-CG 3.32Å; T120-K124 WeakPolarHBondContact O-CG 3.39Å; T120-K124 PolarHBondContact O-N 3.22Å |
| 121 | D | 81.9 | Confident | 81.6 | Confident | 83 Ų | 83 | 40.6 Ų | 40.6 | 44% | 0.444 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -67.5 | -42 | 178 | -61.6 | -19.9 | 0 | 0 | 0 | 110.8 | K78 G118 A119 K124 A125 | K78-D121 IonicContact NZ-OD2 2.89Å; K78-D121 PolarHBondContact NZ-OD2 3.36Å; G118-D121 PolarHBondContact O-N 3.2Å; G118-D121 VanDerWaalsContact O-N 3.16Å; A119-D121 PolarHBondContact O-N 3.23Å; D121-K124 PolarHBondContact O-N 3.44Å; D121-A125 PolarHBondContact O-N 3.47Å |
| 122 | A | 82.1 | Confident | 81.8 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.2 | -40.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | V74 I77 F109 G118 A119 A125 I126 | V74-A122 HydrophobicContact CG1-CB 4.18Å; V74-A122 HydrophobicContact CG2-CB 4.35Å; I77-A122 HydrophobicContact CB-CB 4.04Å; I77-A122 HydrophobicContact CD1-CB 4.07Å; I77-A122 HydrophobicContact CG2-CB 3.84Å; F109-A122 HydrophobicContact CD1-CB 4.34Å; G118-A122 PolarHBondContact O-N 3.14Å; A119-A122 PolarHBondContact O-N 2.88Å; A122-A125 PolarHBondContact O-N 2.93Å; A122-I126 WeakPolarHBondContact O-CD1 3.28Å; A122-I126 VanDerWaalsContact O-CG1 3.28Å; A122-I126 WeakPolarHBondContact O-CG1 3.45Å; A122-I126 PolarHBondContact O-N 3.46Å |
| 123 | F | 84.6 | Confident | 82.2 | Confident | 3 Ų | 3 | 32 Ų | 32 | 1% | 0.013 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.8 | -43.4 | 175.2 | -176.2 | -103.3 | 0 | 0 | 0 | 111.8 | A106 A119 T120 A125 I126 G127 P172 E173 F176 | A106-F123 HydrophobicContact CB-CE2 4.08Å; A119-F123 WeakPolarHBondContact O-CB 3.47Å; A119-F123 PolarHBondContact O-N 3.28Å; T120-F123 PolarHBondContact O-N 3.05Å; F123-A125 PolarHBondContact O-N 3.28Å; F123-I126 PolarHBondContact O-N 3.28Å; F123-G127 PolarHBondContact O-N 3.34Å; F123-P172 HydrophobicContact CD1-CB 4.07Å; F123-P172 HydrophobicContact CE1-CB 3.77Å; F123-E173 HydrophobicContact CE1-CG 4.48Å; F123-F176 HydrophobicContact CE2-CD2 4.41Å; F123-F176 HydrophobicContact CZ-CB 4.12Å; F123-F176 HydrophobicContact CZ-CD2 4.26Å; F123-F176 HydrophobicContact CZ-CG 4.37Å |
| 124 | K | 84.6 | Confident | 82.5 | Confident | 97 Ų | 97 | 25.9 Ų | 25.9 | 42% | 0.422 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -61.6 | -43.4 | 174.3 | -72.8 | 174.3 | 178.1 | -179.3 | 0 | 112.3 | T120 D121 I126 G127 N128 P172 | T120-K124 VanDerWaalsContact O-CG 3.32Å; T120-K124 WeakPolarHBondContact O-CG 3.39Å; T120-K124 PolarHBondContact O-N 3.22Å; D121-K124 PolarHBondContact O-N 3.44Å; K124-I126 VanDerWaalsContact C-N 3.33Å; K124-I126 PolarHBondContact O-N 3.35Å; K124-G127 PolarHBondContact O-N 2.95Å; K124-N128 WeakPolarHBondContact O-CB 3.27Å; K124-N128 VanDerWaalsContact O-CG 3.3Å; K124-N128 PolarHBondContact O-N 2.96Å; K124-P172 HydrophobicContact CB-CG 4.41Å; K124-P172 HydrophobicContact CG-CG 4.23Å |
| 125 | A | 84.4 | Confident | 82.7 | Confident | 27 Ų | 27 | 26 Ų | 26 | 22% | 0.223 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.2 | -41.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | I77 D121 A122 F123 A129 | I77-A125 HydrophobicContact CG2-CB 3.99Å; D121-A125 PolarHBondContact O-N 3.47Å; A122-A125 PolarHBondContact O-N 2.93Å; F123-A125 PolarHBondContact O-N 3.28Å; A125-A129 VanDerWaalsContact O-CB 3.3Å; A125-A129 WeakPolarHBondContact O-CB 3.06Å; A125-A129 PolarHBondContact O-N 2.95Å |
| 126 | I | 86.3 | Confident | 83.1 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.6 | -45.5 | 175.1 | -68.2 | 159 | 0 | 0 | 0 | 111.3 | I77 I86 L87 Y102 L105 F109 A122 F123 K124 A129 F130 | I77-I126 HydrophobicContact CD1-CD1 3.6Å; I77-I126 HydrophobicContact CD1-CG1 4.09Å; I77-I126 HydrophobicContact CG2-CG1 4.48Å; I86-I126 HydrophobicContact CG2-CG1 4.1Å; L87-I126 HydrophobicContact CD2-CG2 4.04Å; Y102-I126 HydrophobicContact CD2-CG2 3.75Å; Y102-I126 HydrophobicContact CE2-CG2 3.99Å; L105-I126 HydrophobicContact CB-CD1 3.88Å; L105-I126 HydrophobicContact CB-CG1 4.35Å; L105-I126 HydrophobicContact CB-CG2 3.99Å; F109-I126 HydrophobicContact CB-CD1 3.91Å; F109-I126 HydrophobicContact CD2-CD1 3.67Å; F109-I126 HydrophobicContact CE2-CD1 4.48Å; F109-I126 HydrophobicContact CG-CD1 3.92Å; A122-I126 WeakPolarHBondContact O-CD1 3.28Å; A122-I126 VanDerWaalsContact O-CG1 3.28Å; A122-I126 WeakPolarHBondContact O-CG1 3.45Å; A122-I126 PolarHBondContact O-N 3.46Å; F123-I126 PolarHBondContact O-N 3.28Å; K124-I126 VanDerWaalsContact C-N 3.33Å; K124-I126 PolarHBondContact O-N 3.35Å; I126-A129 PolarHBondContact O-N 2.95Å; I126-F130 PolarHBondContact O-N 3.43Å; I126-F130 VanDerWaalsContact O-N 3.07Å |
| 127 | G | 85.6 | Confident | 83.2 | Confident | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.1 | -46.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F123 K124 F130 A131 | F123-G127 PolarHBondContact O-N 3.34Å; K124-G127 PolarHBondContact O-N 2.95Å; G127-F130 PolarHBondContact O-N 2.84Å; G127-A131 WeakPolarHBondContact O-CB 3.27Å; G127-A131 PolarHBondContact O-N 3.35Å |
| 128 | N | 83.8 | Confident | 83.4 | Confident | 51 Ų | 51 | 27.1 Ų | 27.1 | 27% | 0.273 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -63.3 | -45.7 | 177.8 | -71 | -7.5 | 0 | 0 | 0 | 111.8 | K124 F130 A131 V132 | K124-N128 WeakPolarHBondContact O-CB 3.27Å; K124-N128 VanDerWaalsContact O-CG 3.3Å; K124-N128 PolarHBondContact O-N 2.96Å; N128-F130 VanDerWaalsContact C-N 3.3Å; N128-F130 PolarHBondContact O-N 3.5Å; N128-A131 PolarHBondContact O-N 3.29Å; N128-V132 WeakPolarHBondContact O-CG2 2.85Å; N128-V132 PolarHBondContact O-N 3.31Å |
| 129 | A | 87.2 | Confident | 83.9 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.9 | -44.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y83 I86 L87 A125 I126 L133 | Y83-A129 HydrophobicContact CD1-CB 3.59Å; Y83-A129 HydrophobicContact CG-CB 3.94Å; I86-A129 HydrophobicContact CB-CB 4.21Å; I86-A129 HydrophobicContact CG2-CB 3.89Å; L87-A129 HydrophobicContact CD1-CB 4.36Å; L87-A129 HydrophobicContact CD2-CB 4.26Å; L87-A129 HydrophobicContact CG-CB 3.95Å; A125-A129 VanDerWaalsContact O-CB 3.3Å; A125-A129 WeakPolarHBondContact O-CB 3.06Å; A125-A129 PolarHBondContact O-N 2.95Å; I126-A129 PolarHBondContact O-N 2.95Å; A129-L133 VanDerWaalsContact O-CB 3.3Å; A129-L133 WeakPolarHBondContact O-CB 3.41Å; A129-L133 VanDerWaalsContact O-CG 3.22Å; A129-L133 WeakPolarHBondContact O-CG 3.05Å; A129-L133 PolarHBondContact O-N 3.37Å |
| 130 | F | 87.7 | Confident | 84.2 | Confident | 7 Ų | 7 | 33.3 Ų | 33.3 | 3% | 0.031 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -68.8 | -42.5 | 177.4 | -178.1 | -98.6 | 0 | 0 | 0 | 112.5 | L87 L98 K99 Y102 I126 G127 N128 V132 L133 S134 L175 F192 | L87-F130 HydrophobicContact CD1-CB 4.38Å; L87-F130 HydrophobicContact CD2-CB 4.45Å; L98-F130 HydrophobicContact CB-CD2 4.41Å; L98-F130 HydrophobicContact CB-CE2 4.16Å; K99-F130 HydrophobicContact CB-CE2 4.42Å; K99-F130 HydrophobicContact CG-CE2 3.91Å; K99-F130 HydrophobicContact CG-CZ 3.75Å; Y102-F130 VanDerWaalsContact CB-CD2 3.49Å; Y102-F130 HydrophobicContact CD1-CD1 4.21Å; Y102-F130 HydrophobicContact CD1-CE1 4.39Å; Y102-F130 HydrophobicContact CD1-CG 4.27Å; Y102-F130 HydrophobicContact CD2-CB 3.55Å; Y102-F130 HydrophobicContact CD2-CD1 4.27Å; Y102-F130 HydrophobicContact CD2-CD2 4.38Å; Y102-F130 AromaticContact CD2-CG 3.8Å; Y102-F130 HydrophobicContact CD2-CG 3.8Å; Y102-F130 HydrophobicContact CE2-CB 4.17Å; Y102-F130 HydrophobicContact CG-CB 3.96Å; Y102-F130 HydrophobicContact CG-CD1 4.07Å; Y102-F130 AromaticContact CG-CD2 3.91Å; Y102-F130 HydrophobicContact CG-CD2 3.91Å; Y102-F130 HydrophobicContact CG-CE2 4.46Å; Y102-F130 AromaticContact CG-CG 3.68Å; Y102-F130 HydrophobicContact CG-CG 3.68Å; I126-F130 PolarHBondContact O-N 3.43Å; I126-F130 VanDerWaalsContact O-N 3.07Å; G127-F130 PolarHBondContact O-N 2.84Å; N128-F130 VanDerWaalsContact C-N 3.3Å; N128-F130 PolarHBondContact O-N 3.5Å; F130-V132 VanDerWaalsContact C-N 3.28Å; F130-V132 PolarHBondContact O-N 3.06Å; F130-L133 PolarHBondContact O-N 3.02Å; F130-S134 WeakPolarHBondContact O-CB 3.36Å; F130-S134 PolarHBondContact O-N 3.42Å; F130-S134 PolarHBondContact O-OG 3.14Å; F130-L175 HydrophobicContact CD1-CD1 4.2Å; F130-L175 HydrophobicContact CD1-CD2 3.76Å; F130-L175 HydrophobicContact CD1-CG 4.45Å; F130-L175 HydrophobicContact CE1-CD1 4.18Å; F130-F192 HydrophobicContact CE1-CE2 4.16Å; F130-F192 HydrophobicContact CE1-CZ 4.44Å |
| 131 | A | 84.7 | Confident | 84.2 | Confident | 4 Ų | 4 | 36.3 Ų | 36.3 | 3% | 0.033 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.2 | -36.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | G127 N128 A168 F192 | G127-A131 WeakPolarHBondContact O-CB 3.27Å; G127-A131 PolarHBondContact O-N 3.35Å; N128-A131 PolarHBondContact O-N 3.29Å; A131-A168 HydrophobicContact CB-CB 3.51Å; A131-F192 HydrophobicContact CB-CE1 4.39Å |
| 132 | V | 84.3 | Confident | 84.3 | Confident | 3 Ų | 3 | 32.9 Ų | 32.9 | 2% | 0.018 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -74.6 | -49.2 | 175.4 | 176.9 | 0 | 0 | 0 | 0 | 110.9 | Y83 N128 F130 S134 K138 R139 Y142 F166 | Y83-V132 HydrophobicContact CD2-CB 4.08Å; Y83-V132 HydrophobicContact CD2-CG1 3.98Å; Y83-V132 HydrophobicContact CE2-CB 3.96Å; Y83-V132 HydrophobicContact CE2-CG1 3.87Å; Y83-V132 HydrophobicContact CE2-CG2 3.91Å; N128-V132 WeakPolarHBondContact O-CG2 2.85Å; N128-V132 PolarHBondContact O-N 3.31Å; F130-V132 VanDerWaalsContact C-N 3.28Å; F130-V132 PolarHBondContact O-N 3.06Å; V132-S134 PolarHBondContact O-N 3.01Å; V132-K138 HydrophobicContact CG1-CB 4.26Å; V132-R139 PolarHBondContact O-N 2.89Å; V132-Y142 HydrophobicContact CG1-CD2 4.49Å; V132-Y142 HydrophobicContact CG1-CG 4.2Å; V132-F166 HydrophobicContact CG1-CD1 4.07Å; V132-F166 HydrophobicContact CG1-CE1 4.02Å; V132-F166 HydrophobicContact CG2-CD1 4.02Å |
| 133 | L | 86.8 | Confident | 84.4 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -74.4 | -22.8 | -173.9 | -66.6 | -180 | 0 | 0 | 0 | 114.4 | Y84 L87 L98 A129 F130 R139 Y142 | Y84-L133 HydrophobicContact CD1-CD1 3.85Å; Y84-L133 HydrophobicContact CD1-CD2 4.38Å; Y84-L133 HydrophobicContact CD2-CD2 4.44Å; Y84-L133 HydrophobicContact CE1-CD1 3.92Å; Y84-L133 HydrophobicContact CE1-CD2 3.73Å; Y84-L133 HydrophobicContact CE1-CG 4.42Å; Y84-L133 HydrophobicContact CE2-CD2 3.8Å; Y84-L133 HydrophobicContact CG-CD1 4.21Å; Y84-L133 WeakPolarHBondContact OH-CD2 3.31Å; L87-L133 HydrophobicContact CD1-CD1 3.83Å; L98-L133 HydrophobicContact CD1-CB 4.16Å; L98-L133 HydrophobicContact CD2-CB 4.07Å; L98-L133 HydrophobicContact CD2-CD1 4.04Å; A129-L133 VanDerWaalsContact O-CB 3.3Å; A129-L133 WeakPolarHBondContact O-CB 3.41Å; A129-L133 VanDerWaalsContact O-CG 3.22Å; A129-L133 WeakPolarHBondContact O-CG 3.05Å; A129-L133 PolarHBondContact O-N 3.37Å; F130-L133 PolarHBondContact O-N 3.02Å; L133-R139 HydrophobicContact CD2-CG 4.19Å; L133-Y142 HydrophobicContact CD2-CD1 3.98Å; L133-Y142 HydrophobicContact CD2-CE1 4.32Å |
| 134 | S | 84.4 | Confident | 84.2 | Confident | 15 Ų | 15 | 41.4 Ų | 41.4 | 11% | 0.105 | 21% | 0.205 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | -14.8 | 179.7 | 59.9 | 0 | 0 | 0 | 0 | 114 | F130 V132 F192 | F130-S134 WeakPolarHBondContact O-CB 3.36Å; F130-S134 PolarHBondContact O-N 3.42Å; F130-S134 PolarHBondContact O-OG 3.14Å; V132-S134 PolarHBondContact O-N 3.01Å; S134-F192 WeakPolarHBondContact OG-CD2 2.97Å; S134-F192 WeakPolarHBondContact OG-CE2 3.11Å |
| 135 | N | 83.4 | Confident | 83.5 | Confident | 4 Ų | 4 | 44.6 Ų | 44.6 | 2% | 0.021 | 22% | 0.216 | C | C | . | . | S | Bend | trans | -95.5 | 121.9 | 171.8 | -176.5 | -25.7 | 0 | 0 | 0 | 109.2 | D137 K138 R139 F192 | N135-D137 VanDerWaalsContact C-N 3.27Å; N135-D137 PolarHBondContact O-N 2.95Å; N135-D137 WeakPolarHBondContact OD1-CB 3.11Å; N135-D137 PolarHBondContact OD1-N 2.89Å; N135-K138 HydrophobicContact CB-CB 3.99Å; N135-K138 HydrophobicContact CB-CD 4.24Å; N135-K138 HydrophobicContact CB-CG 4.03Å; N135-K138 PolarHBondContact O-N 3.12Å; N135-R139 WeakPolarHBondContact O-CB 3.41Å; N135-R139 PolarHBondContact O-N 3.28Å; N135-F192 HydrophobicContact CB-CB 3.56Å; N135-F192 HydrophobicContact CB-CG 4.37Å; N135-F192 PolarHBondContact ND2-O 3.24Å |
| 136 | P | 83.8 | Confident | 82.6 | Confident | 70 Ų | 70 | 45.1 Ų | 45.1 | 46% | 0.455 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.4 | -37.8 | 179.7 | 24.7 | -34.5 | 0 | 0 | 0 | 112.9 | L140 | P136-L140 WeakPolarHBondContact O-CB 3.39Å; P136-L140 PolarHBondContact O-N 3.35Å |
| 137 | D | 80.8 | Confident | 81.2 | Confident | 68 Ų | 68 | 47.5 Ų | 47.5 | 36% | 0.364 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -70.6 | -42.5 | -179.1 | -63.7 | -25.3 | 0 | 0 | 0 | 111.3 | N135 R141 N194 | N135-D137 VanDerWaalsContact C-N 3.27Å; N135-D137 PolarHBondContact O-N 2.95Å; N135-D137 WeakPolarHBondContact OD1-CB 3.11Å; N135-D137 PolarHBondContact OD1-N 2.89Å; D137-R141 WeakPolarHBondContact O-CG 3.46Å; D137-R141 PolarHBondContact O-N 2.92Å; D137-R141 VanDerWaalsContact O-N 3.16Å; D137-N194 PolarHBondContact OD2-ND2 3.3Å; D137-N194 VanDerWaalsContact OD2-ND2 3.12Å |
| 138 | K | 82.3 | Confident | 79.4 | Confident | 44 Ų | 44 | 54.9 Ų | 54.9 | 19% | 0.191 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -74 | -35.3 | 178.4 | -59.8 | -175.8 | 179.1 | -172 | 0 | 111.6 | V132 N135 R141 Y142 D169 | V132-K138 HydrophobicContact CG1-CB 4.26Å; N135-K138 HydrophobicContact CB-CB 3.99Å; N135-K138 HydrophobicContact CB-CD 4.24Å; N135-K138 HydrophobicContact CB-CG 4.03Å; N135-K138 PolarHBondContact O-N 3.12Å; K138-R141 PolarHBondContact O-N 3.35Å; K138-Y142 WeakPolarHBondContact O-CB 3.2Å; K138-Y142 PolarHBondContact O-N 3.23Å; K138-D169 IonicContact NZ-OD2 3.68Å; K138-D169 PolarHBondContact NZ-OD2 3.05Å |
| 139 | R | 86.6 | Confident | 77.5 | Confident | 40 Ų | 40 | 60.1 Ų | 60.1 | 15% | 0.151 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.2 | -46.6 | 172.4 | -178.9 | 177.4 | 176.4 | 167.3 | 3.2 | 110.8 | Y84 R91 A93 D95 V132 L133 N135 R141 Y142 D143 | Y84-R139 PolarHBondContact OH-NE 3.44Å; R91-R139 PolarHBondContact O-NH2 2.91Å; A93-R139 PolarHBondContact O-NH1 3.23Å; A93-R139 PolarHBondContact O-NH2 2.85Å; D95-R139 IonicContact OD1-NH1 4Å; V132-R139 PolarHBondContact O-N 2.89Å; L133-R139 HydrophobicContact CD2-CG 4.19Å; N135-R139 WeakPolarHBondContact O-CB 3.41Å; N135-R139 PolarHBondContact O-N 3.28Å; R139-R141 PolarHBondContact O-N 3.07Å; R139-Y142 PolarHBondContact O-N 2.64Å; R139-D143 IonicContact NE-OD2 3.36Å; R139-D143 WeakPolarHBondContact O-CB 3.37Å; R139-D143 PolarHBondContact O-N 3.11Å |
| 140 | L | 83.6 | Confident | 75.1 | Confident | 113 Ų | 113 | 64.2 Ų | 64.2 | 59% | 0.592 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -59.6 | -46.5 | 177.3 | -175.4 | 68.9 | 0 | 0 | 0 | 111.6 | P136 Y142 D143 E144 | P136-L140 WeakPolarHBondContact O-CB 3.39Å; P136-L140 PolarHBondContact O-N 3.35Å; L140-Y142 PolarHBondContact O-N 3.05Å; L140-D143 PolarHBondContact O-N 3.32Å; L140-E144 WeakPolarHBondContact O-CB 3.37Å; L140-E144 PolarHBondContact O-N 3.02Å |
| 141 | R | 80.3 | Confident | 72.6 | Confident | 133 Ų | 133 | 69.6 Ų | 69.6 | 50% | 0.502 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.3 | -43.2 | 175.4 | -69.6 | 178.6 | -172.6 | -172.8 | 3.8 | 112 | D137 K138 R139 D143 E144 Y145 F166 | D137-R141 WeakPolarHBondContact O-CG 3.46Å; D137-R141 PolarHBondContact O-N 2.92Å; D137-R141 VanDerWaalsContact O-N 3.16Å; K138-R141 PolarHBondContact O-N 3.35Å; R139-R141 PolarHBondContact O-N 3.07Å; R141-D143 VanDerWaalsContact C-N 3.33Å; R141-D143 PolarHBondContact O-N 2.89Å; R141-E144 PolarHBondContact O-N 3.2Å; R141-Y145 VanDerWaalsContact O-CD2 3.29Å; R141-Y145 WeakPolarHBondContact O-CD2 3.48Å; R141-Y145 PolarHBondContact O-N 3.26Å; R141-F166 HydrophobicContact CB-CZ 4.35Å |
| 142 | Y | 82.9 | Confident | 70.1 | Confident | 11 Ų | 11 | 77.8 Ų | 77.8 | 4% | 0.043 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -63.1 | -40.1 | 176.4 | 179.4 | -104 | 0 | 0 | 0 | 112.1 | N82 Y83 Y84 V132 L133 K138 R139 L140 E144 G146 D147 F166 | N82-Y142 WeakPolarHBondContact CA-OH 3.23Å; Y83-Y142 HydrophobicContact CD2-CD1 4.08Å; Y83-Y142 AromaticContact CD2-CD2 3.5Å; Y83-Y142 HydrophobicContact CD2-CD2 3.5Å; Y83-Y142 VanDerWaalsContact CD2-CD2 3.5Å; Y83-Y142 AromaticContact CD2-CE1 3.78Å; Y83-Y142 HydrophobicContact CD2-CE1 3.78Å; Y83-Y142 AromaticContact CD2-CE2 3.16Å; Y83-Y142 HydrophobicContact CD2-CE2 3.16Å; Y83-Y142 AromaticContact CD2-CG 3.94Å; Y83-Y142 HydrophobicContact CD2-CG 3.94Å; Y83-Y142 AromaticContact CD2-CZ 3.31Å; Y83-Y142 AromaticContact CE2-CD2 3.49Å; Y83-Y142 HydrophobicContact CE2-CD2 3.49Å; Y83-Y142 VanDerWaalsContact CE2-CD2 3.49Å; Y83-Y142 AromaticContact CE2-CE2 3.32Å; Y83-Y142 HydrophobicContact CE2-CE2 3.32Å; Y83-Y142 HydrophobicContact CE2-CG 4.26Å; Y83-Y142 AromaticContact CE2-CZ 3.98Å; Y83-Y142 HydrophobicContact CG-CE1 4.32Å; Y83-Y142 HydrophobicContact CG-CE2 4.04Å; Y83-Y142 AromaticContact CG-CZ 3.82Å; Y83-Y142 PolarHBondContact N-OH 2.81Å; Y84-Y142 HydrophobicContact CD2-CE1 4.05Å; Y84-Y142 HydrophobicContact CE2-CD1 4.07Å; Y84-Y142 AromaticContact CE2-CE1 3.77Å; Y84-Y142 HydrophobicContact CE2-CE1 3.77Å; V132-Y142 HydrophobicContact CG1-CD2 4.49Å; V132-Y142 HydrophobicContact CG1-CG 4.2Å; L133-Y142 HydrophobicContact CD2-CD1 3.98Å; L133-Y142 HydrophobicContact CD2-CE1 4.32Å; K138-Y142 WeakPolarHBondContact O-CB 3.2Å; K138-Y142 PolarHBondContact O-N 3.23Å; R139-Y142 PolarHBondContact O-N 2.64Å; L140-Y142 PolarHBondContact O-N 3.05Å; Y142-E144 VanDerWaalsContact C-N 3.31Å; Y142-E144 PolarHBondContact O-N 3.45Å; Y142-G146 VanDerWaalsContact O-CA 3.28Å; Y142-G146 WeakPolarHBondContact O-CA 3.3Å; Y142-G146 PolarHBondContact O-N 3.14Å; Y142-D147 HydrophobicContact CE2-CB 4.16Å; Y142-D147 PolarHBondContact OH-OD2 2.92Å; Y142-F166 HydrophobicContact CD2-CE1 4.42Å |
| 143 | D | 85.4 | Confident | 67.8 | Low | 46 Ų | 46 | 84.3 Ų | 84.3 | 25% | 0.246 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -68 | -28.5 | 177.1 | -85.3 | -43.3 | 0 | 0 | 0 | 113.3 | Y84 R91 R139 L140 R141 | Y84-D143 PolarHBondContact OH-OD1 3.25Å; Y84-D143 PolarHBondContact OH-OD2 2.79Å; R91-D143 IonicContact CZ-OD1 3.32Å; R91-D143 IonicContact NE-OD1 2.86Å; R91-D143 PolarHBondContact NE-OD1 2.87Å; R91-D143 PolarHBondContact NH2-O 2.71Å; R91-D143 VanDerWaalsContact NH2-O 3.11Å; R91-D143 IonicContact NH2-OD1 2.89Å; R91-D143 PolarHBondContact NH2-OD1 3.48Å; R139-D143 IonicContact NE-OD2 3.36Å; R139-D143 WeakPolarHBondContact O-CB 3.37Å; R139-D143 PolarHBondContact O-N 3.11Å; L140-D143 PolarHBondContact O-N 3.32Å; R141-D143 VanDerWaalsContact C-N 3.33Å; R141-D143 PolarHBondContact O-N 2.89Å |
| 144 | E | 79.1 | Confident | 65.2 | Low | 135 Ų | 135 | 87.9 Ų | 87.9 | 63% | 0.631 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -83.5 | -45.1 | -179.8 | -172.4 | 176.2 | -162.6 | 0 | 0 | 112.8 | L140 R141 Y142 | L140-E144 WeakPolarHBondContact O-CB 3.37Å; L140-E144 PolarHBondContact O-N 3.02Å; R141-E144 PolarHBondContact O-N 3.2Å; Y142-E144 VanDerWaalsContact C-N 3.31Å; Y142-E144 PolarHBondContact O-N 3.45Å |
| 145 | Y | 70.8 | Confident | 63.1 | Low | 164 Ų | 164 | 92.5 Ų | 92.5 | 64% | 0.643 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -95.7 | -14.7 | -176 | -65.6 | -80.5 | 0 | 0 | 0 | 113.8 | R141 | R141-Y145 VanDerWaalsContact O-CD2 3.29Å; R141-Y145 WeakPolarHBondContact O-CD2 3.48Å; R141-Y145 PolarHBondContact O-N 3.26Å |
| 146 | G | 64.1 | Low | 60.9 | Low | 38 Ų | 38 | 104 Ų | 104 | 39% | 0.392 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.5 | 178.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y142 E148 | Y142-G146 VanDerWaalsContact O-CA 3.28Å; Y142-G146 WeakPolarHBondContact O-CA 3.3Å; Y142-G146 PolarHBondContact O-N 3.14Å; G146-E148 PolarHBondContact O-N 3.36Å; G146-E148 VanDerWaalsContact O-N 3.11Å |
| 147 | D | 57.2 | Low | 58.4 | Low | 50 Ų | 50 | 105.1 Ų | 105.1 | 27% | 0.267 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | 24.8 | 177.3 | -130.1 | -37.5 | 0 | 0 | 0 | 113 | N82 Y142 Q149 | N82-D147 VanDerWaalsContact CA-OD2 3.26Å; N82-D147 WeakPolarHBondContact CA-OD2 3.32Å; Y142-D147 HydrophobicContact CE2-CB 4.16Å; Y142-D147 PolarHBondContact OH-OD2 2.92Å; D147-Q149 VanDerWaalsContact C-N 3.3Å; D147-Q149 PolarHBondContact O-N 2.83Å |
| 148 | E | 47.9 | Very low | 56.1 | Low | 157 Ų | 157 | 112.9 Ų | 112.9 | 73% | 0.734 | 57% | 0.569 | S | S | * | * | trans | -64.9 | 99.7 | 175.3 | -75.6 | -163 | 163.2 | 0 | 0 | 107.7 | G146 V150 | G146-E148 PolarHBondContact O-N 3.36Å; G146-E148 VanDerWaalsContact O-N 3.11Å; E148-V150 HydrophobicContact CB-CG2 4.26Å; E148-V150 WeakPolarHBondContact O-CG2 3.39Å; E148-V150 PolarHBondContact O-N 3.25Å | ||
| 149 | Q | 44.8 | Very low | 53.6 | Low | 161 Ų | 161 | 116.6 Ų | 116.6 | 75% | 0.752 | 60% | 0.598 | S | S | * | * | trans | -55.6 | 87.8 | 152.5 | -72.1 | -169.2 | 6.9 | 0 | 0 | 106.7 | D147 T151 | D147-Q149 VanDerWaalsContact C-N 3.3Å; D147-Q149 PolarHBondContact O-N 2.83Å; Q149-T151 PolarHBondContact O-N 3.09Å | ||
| 150 | V | 35.8 | Very low | 51.1 | Low | 85 Ų | 85 | 125.1 Ų | 125.1 | 52% | 0.515 | 63% | 0.632 | S | S | . | * | trans | -65.8 | 85.1 | 169.1 | 177.2 | 0 | 0 | 0 | 0 | 106.4 | E148 F152 | E148-V150 HydrophobicContact CB-CG2 4.26Å; E148-V150 WeakPolarHBondContact O-CG2 3.39Å; E148-V150 PolarHBondContact O-N 3.25Å; V150-F152 HydrophobicContact CB-CD2 4.36Å; V150-F152 HydrophobicContact CG1-CB 3.79Å; V150-F152 HydrophobicContact CG1-CD2 2.87Å; V150-F152 HydrophobicContact CG1-CE2 3.4Å; V150-F152 VanDerWaalsContact CG1-CE2 3.4Å; V150-F152 HydrophobicContact CG1-CG 3.55Å; V150-F152 HydrophobicContact CG1-CZ 4.49Å; V150-F152 PolarHBondContact O-N 3.45Å | ||
| 151 | T | 36.8 | Very low | 48.7 | Very low | 120 Ų | 120 | 126 Ų | 126 | 74% | 0.736 | 64% | 0.637 | S | S | * | * | trans | -69.7 | 65.7 | 155.3 | 39.4 | 0 | 0 | 0 | 0 | 106.9 | Q149 T153 | Q149-T151 PolarHBondContact O-N 3.09Å; T151-T153 PolarHBondContact O-N 3.16Å | ||
| 152 | F | 30.9 | Very low | 46.7 | Very low | 177 Ų | 177 | 129.8 Ų | 129.8 | 78% | 0.776 | 65% | 0.652 | S | S | * | * | trans | -68.6 | 93.6 | 164.2 | -99.1 | -55.8 | 0 | 0 | 0 | 107.2 | V150 A154 | V150-F152 HydrophobicContact CB-CD2 4.36Å; V150-F152 HydrophobicContact CG1-CB 3.79Å; V150-F152 HydrophobicContact CG1-CD2 2.87Å; V150-F152 HydrophobicContact CG1-CE2 3.4Å; V150-F152 VanDerWaalsContact CG1-CE2 3.4Å; V150-F152 HydrophobicContact CG1-CG 3.55Å; V150-F152 HydrophobicContact CG1-CZ 4.49Å; V150-F152 PolarHBondContact O-N 3.45Å; F152-A154 PolarHBondContact O-N 2.89Å | ||
| 153 | T | 37.2 | Very low | 44.7 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 85% | 0.853 | 69% | 0.685 | S | S | * | * | trans | -71.9 | 76.9 | 157.3 | 41.5 | 0 | 0 | 0 | 0 | 107.9 | T151 | T151-T153 PolarHBondContact O-N 3.16Š| ||
| 154 | A | 31.4 | Very low | 42.8 | Very low | 75 Ų | 75 | 145.5 Ų | 145.5 | 62% | 0.62 | 71% | 0.71 | S | S | * | * | trans | -103.5 | 121.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | F152 | F152-A154 PolarHBondContact O-N 2.89Š| ||
| 155 | P | 39.5 | Very low | 41.1 | Very low | 112 Ų | 112 | 144 Ų | 144 | 73% | 0.727 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -81.1 | 132.6 | -179.6 | 31.8 | -29.8 | 0 | 0 | 0 | 109.7 | ||
| 156 | R | 37.8 | Very low | 39.8 | Very low | 245 Ų | 245 | 139.6 Ų | 139.6 | 93% | 0.925 | 69% | 0.69 | S | S | * | * | S | Bend | trans | 82.2 | 65.7 | 169.7 | -50.9 | -173 | 167.3 | 104.4 | -0.4 | 117.1 | ||
| 157 | A | 31.3 | Very low | 39.1 | Very low | 95 Ų | 95 | 143 Ų | 143 | 79% | 0.785 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -153.2 | 147.4 | 145.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||
| 158 | R | 31.8 | Very low | 38.9 | Very low | 231 Ų | 231 | 141.6 Ų | 141.6 | 87% | 0.872 | 69% | 0.691 | S | S | * | * | trans | -56.3 | 143.8 | -175.9 | -62.7 | -159 | 174.7 | -144 | 0.9 | 111.3 | Y160 | R158-Y160 VanDerWaalsContact C-N 3.32Å; R158-Y160 PolarHBondContact O-N 2.96Å | ||
| 159 | P | 31.5 | Very low | 39.3 | Very low | 122 Ų | 122 | 140.7 Ų | 140.7 | 79% | 0.792 | 69% | 0.691 | S | S | * | * | trans | -77.9 | 83.3 | -170.3 | 33.3 | -33.3 | 0 | 0 | 0 | 109.9 | N161 | P159-N161 PolarHBondContact O-N 3.01Š| ||
| 160 | Y | 32.1 | Very low | 40.1 | Very low | 219 Ų | 219 | 135.3 Ų | 135.3 | 86% | 0.859 | 67% | 0.667 | S | S | * | * | trans | -72.7 | 106.8 | 153.8 | -97.2 | -93.5 | 0 | 0 | 0 | 106.7 | R158 Y162 | R158-Y160 VanDerWaalsContact C-N 3.32Å; R158-Y160 PolarHBondContact O-N 2.96Å; Y160-Y162 PolarHBondContact O-N 2.94Å | ||
| 161 | N | 33.6 | Very low | 41.7 | Very low | 131 Ų | 131 | 134.7 Ų | 134.7 | 70% | 0.701 | 66% | 0.664 | S | S | * | * | trans | -53.4 | 100.6 | 174.1 | -89.6 | -25.3 | 0 | 0 | 0 | 110.2 | P159 Y163 R164 | P159-N161 PolarHBondContact O-N 3.01Å; N161-Y163 PolarHBondContact O-N 3.43Å; N161-Y163 VanDerWaalsContact O-N 3.09Å; N161-R164 PolarHBondContact O-N 2.73Å | ||
| 162 | Y | 38.3 | Very low | 43.2 | Very low | 212 Ų | 212 | 129.7 Ų | 129.7 | 83% | 0.831 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -63.3 | -6.3 | 167.8 | -134.2 | -93.1 | 0 | 0 | 0 | 112.7 | Y160 R164 | Y160-Y162 PolarHBondContact O-N 2.94Å; Y162-R164 PolarHBondContact O-N 3.14Å |
| 163 | Y | 42.2 | Very low | 45 | Very low | 187 Ų | 187 | 124.9 Ų | 124.9 | 73% | 0.733 | 61% | 0.613 | S | S | * | * | G | 310 helix | trans | -64.9 | -14.6 | 173.5 | -138.1 | -93.8 | 0 | 0 | 0 | 114 | N161 | N161-Y163 PolarHBondContact O-N 3.43Å; N161-Y163 VanDerWaalsContact O-N 3.09Å |
| 164 | R | 43.9 | Very low | 46.5 | Very low | 201 Ų | 201 | 123.1 Ų | 123.1 | 76% | 0.758 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -88.1 | -8.5 | -171.5 | -150.2 | 178.6 | 176.7 | -169.2 | -8.1 | 114.7 | N161 Y162 | N161-R164 PolarHBondContact O-N 2.73Å; Y162-R164 PolarHBondContact O-N 3.14Å |
| 165 | D | 43.9 | Very low | 48.4 | Very low | 102 Ų | 102 | 119.9 Ų | 119.9 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -90.6 | -18.2 | -175.9 | -146.7 | 36.8 | 0 | 0 | 0 | 113.2 | ||
| 166 | F | 43.7 | Very low | 50.1 | Low | 73 Ų | 73 | 115.8 Ų | 115.8 | 32% | 0.32 | 54% | 0.538 | S | S | . | . | S | Bend | trans | -114.1 | 2.5 | 173.1 | -83.9 | -85.1 | 0 | 0 | 0 | 113.5 | V132 R141 Y142 A168 | V132-F166 HydrophobicContact CG1-CD1 4.07Å; V132-F166 HydrophobicContact CG1-CE1 4.02Å; V132-F166 HydrophobicContact CG2-CD1 4.02Å; R141-F166 HydrophobicContact CB-CZ 4.35Å; Y142-F166 HydrophobicContact CD2-CE1 4.42Å; F166-A168 PolarHBondContact O-N 2.94Å |
| 167 | E | 49.4 | Very low | 51.9 | Low | 110 Ų | 110 | 108.8 Ų | 108.8 | 51% | 0.514 | 52% | 0.519 | S | S | . | . | S | Bend | trans | -74.6 | 124.5 | 172.9 | -160.4 | 165.4 | -161.7 | 0 | 0 | 108.4 | D169 | E167-D169 PolarHBondContact O-N 2.96Š|
| 168 | A | 53.7 | Low | 53.9 | Low | 19 Ų | 19 | 106.6 Ų | 106.6 | 16% | 0.157 | 50% | 0.496 | C | S | . | . | trans | -56.1 | 127.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | A131 F166 I170 | A131-A168 HydrophobicContact CB-CB 3.51Å; F166-A168 PolarHBondContact O-N 2.94Å; A168-I170 VanDerWaalsContact CB-O 3.3Å; A168-I170 WeakPolarHBondContact CB-O 3.37Å; A168-I170 PolarHBondContact O-N 3.46Å | ||
| 169 | D | 55.6 | Low | 55.7 | Low | 139 Ų | 139 | 97.1 Ų | 97.1 | 74% | 0.743 | 46% | 0.461 | S | S | * | . | S | Bend | trans | -62.5 | -6 | 175.1 | -58.1 | -64.8 | 0 | 0 | 0 | 112.7 | K138 E167 | K138-D169 IonicContact NZ-OD2 3.68Å; K138-D169 PolarHBondContact NZ-OD2 3.05Å; E167-D169 PolarHBondContact O-N 2.96Å |
| 170 | I | 60.9 | Low | 57.7 | Low | 48 Ų | 48 | 94.9 Ų | 94.9 | 25% | 0.246 | 44% | 0.439 | C | S | . | . | S | Bend | trans | -127.7 | 130 | -177.2 | -56.8 | 177.1 | 0 | 0 | 0 | 107.7 | A168 E174 L175 F192 | A168-I170 VanDerWaalsContact CB-O 3.3Å; A168-I170 WeakPolarHBondContact CB-O 3.37Å; A168-I170 PolarHBondContact O-N 3.46Å; I170-E174 HydrophobicContact CG2-CB 3.71Å; I170-E174 HydrophobicContact CG2-CG 3.7Å; I170-L175 HydrophobicContact CG2-CB 4.11Å; I170-F192 HydrophobicContact CD1-CE1 3.97Å |
| 171 | T | 70.3 | Confident | 59.2 | Low | 72 Ų | 72 | 86.5 Ų | 86.5 | 44% | 0.442 | 42% | 0.419 | S | S | . | . | trans | -65.4 | 147.9 | 176.6 | 59.7 | 0 | 0 | 0 | 0 | 111 | E173 E174 L175 | T171-E173 WeakPolarHBondContact CB-OE2 3.5Å; T171-E173 PolarHBondContact O-N 2.83Å; T171-E173 VanDerWaalsContact O-N 3.11Å; T171-E174 PolarHBondContact O-N 2.94Å; T171-E174 WeakPolarHBondContact OG1-CB 3.33Å; T171-E174 PolarHBondContact OG1-N 2.89Å; T171-L175 WeakPolarHBondContact O-CB 3.14Å; T171-L175 PolarHBondContact O-N 3.2Å | ||
| 172 | P | 68 | Low | 60 | Low | 14 Ų | 14 | 83.9 Ų | 83.9 | 9% | 0.091 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -53.3 | -32.8 | 175.9 | -28.8 | 37 | 0 | 0 | 0 | 113.3 | F123 K124 F176 | F123-P172 HydrophobicContact CD1-CB 4.07Å; F123-P172 HydrophobicContact CE1-CB 3.77Å; K124-P172 HydrophobicContact CB-CG 4.41Å; K124-P172 HydrophobicContact CG-CG 4.23Å; P172-F176 WeakPolarHBondContact O-CB 3.35Å; P172-F176 PolarHBondContact O-N 2.94Å |
| 173 | E | 69.4 | Low | 60.4 | Low | 76 Ų | 76 | 81.6 Ų | 81.6 | 36% | 0.355 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -70.1 | -41.2 | 175.2 | -59.9 | 78.7 | -170.8 | 0 | 0 | 112.1 | F123 T171 F176 N177 | F123-E173 HydrophobicContact CE1-CG 4.48Å; T171-E173 WeakPolarHBondContact CB-OE2 3.5Å; T171-E173 PolarHBondContact O-N 2.83Å; T171-E173 VanDerWaalsContact O-N 3.11Å; E173-F176 WeakPolarHBondContact O-CB 3.43Å; E173-F176 PolarHBondContact O-N 2.8Å; E173-N177 WeakPolarHBondContact O-CB 3.4Å; E173-N177 PolarHBondContact O-N 3.28Å; E173-N177 PolarHBondContact O-ND2 3.06Å |
| 174 | E | 67.8 | Low | 60.6 | Low | 103 Ų | 103 | 77 Ų | 77 | 48% | 0.481 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -69.5 | -39.4 | 175.4 | -174.4 | 173.4 | -165.4 | 0 | 0 | 111.7 | I170 T171 F176 N177 V178 | I170-E174 HydrophobicContact CG2-CB 3.71Å; I170-E174 HydrophobicContact CG2-CG 3.7Å; T171-E174 PolarHBondContact O-N 2.94Å; T171-E174 WeakPolarHBondContact OG1-CB 3.33Å; T171-E174 PolarHBondContact OG1-N 2.89Å; E174-F176 VanDerWaalsContact C-N 3.32Å; E174-F176 PolarHBondContact O-N 2.86Å; E174-N177 PolarHBondContact O-N 2.96Å; E174-V178 WeakPolarHBondContact O-CB 3.07Å; E174-V178 VanDerWaalsContact O-CG2 3.24Å; E174-V178 WeakPolarHBondContact O-CG2 3.43Å; E174-V178 PolarHBondContact O-N 3.37Å |
| 175 | L | 72.5 | Confident | 60.8 | Low | 6 Ų | 6 | 70.8 Ų | 70.8 | 3% | 0.031 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 171.1 | 178.3 | 63.8 | 0 | 0 | 0 | 111.3 | Y102 F130 I170 T171 F179 F192 | Y102-L175 HydrophobicContact CE1-CD2 4.19Å; Y102-L175 HydrophobicContact CE1-CG 4.09Å; Y102-L175 HydrophobicContact CE2-CD2 3.89Å; Y102-L175 WeakPolarHBondContact OH-CD2 3.44Å; Y102-L175 WeakPolarHBondContact OH-CG 3.45Å; F130-L175 HydrophobicContact CD1-CD1 4.2Å; F130-L175 HydrophobicContact CD1-CD2 3.76Å; F130-L175 HydrophobicContact CD1-CG 4.45Å; F130-L175 HydrophobicContact CE1-CD1 4.18Å; I170-L175 HydrophobicContact CG2-CB 4.11Å; T171-L175 WeakPolarHBondContact O-CB 3.14Å; T171-L175 PolarHBondContact O-N 3.2Å; L175-F179 WeakPolarHBondContact O-CB 3.5Å; L175-F179 PolarHBondContact O-N 3.11Å; L175-F192 HydrophobicContact CD1-CZ 3.79Å |
| 176 | F | 74.4 | Confident | 60.8 | Low | 26 Ų | 26 | 73.1 Ų | 73.1 | 11% | 0.114 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63.9 | -44.1 | 173.8 | -176.9 | -90.1 | 0 | 0 | 0 | 111.8 | A106 L107 H110 F123 P172 E173 E174 V178 F179 F180 | A106-F176 HydrophobicContact CB-CD2 3.94Å; A106-F176 HydrophobicContact CB-CE2 4.18Å; L107-F176 HydrophobicContact CD2-CE2 4.4Å; L107-F176 HydrophobicContact CD2-CZ 4.4Å; H110-F176 AromaticContact CD2-CE1 3.86Å; H110-F176 AromaticContact CD2-CE2 3.88Å; H110-F176 AromaticContact CD2-CZ 3.67Å; H110-F176 AromaticContact NE2-CE1 3.82Å; F123-F176 HydrophobicContact CE2-CD2 4.41Å; F123-F176 HydrophobicContact CZ-CB 4.12Å; F123-F176 HydrophobicContact CZ-CD2 4.26Å; F123-F176 HydrophobicContact CZ-CG 4.37Å; P172-F176 WeakPolarHBondContact O-CB 3.35Å; P172-F176 PolarHBondContact O-N 2.94Å; E173-F176 WeakPolarHBondContact O-CB 3.43Å; E173-F176 PolarHBondContact O-N 2.8Å; E174-F176 VanDerWaalsContact C-N 3.32Å; E174-F176 PolarHBondContact O-N 2.86Å; F176-V178 VanDerWaalsContact C-N 3.34Å; F176-V178 PolarHBondContact O-N 3.19Å; F176-F179 CarbonylContact O-C 3.51Å; F176-F179 WeakPolarHBondContact O-CA 3.5Å; F176-F179 PolarHBondContact O-N 3.14Å; F176-F180 HydrophobicContact CD1-CB 4.34Å; F176-F180 HydrophobicContact CD1-CD2 4.16Å; F176-F180 AromaticContact CD2-CD2 3.31Å; F176-F180 HydrophobicContact CD2-CD2 3.31Å; F176-F180 AromaticContact CD2-CE2 3.55Å; F176-F180 HydrophobicContact CD2-CE2 3.55Å; F176-F180 HydrophobicContact CD2-CG 4.35Å; F176-F180 HydrophobicContact CE1-CB 3.91Å; F176-F180 HydrophobicContact CE1-CD2 4.04Å; F176-F180 HydrophobicContact CE1-CG 4.21Å; F176-F180 HydrophobicContact CE2-CB 4.48Å; F176-F180 AromaticContact CE2-CD2 3.18Å; F176-F180 HydrophobicContact CE2-CD2 3.18Å; F176-F180 AromaticContact CE2-CE2 3.37Å; F176-F180 HydrophobicContact CE2-CE2 3.37Å; F176-F180 AromaticContact CE2-CG 3.9Å; F176-F180 HydrophobicContact CE2-CG 3.9Å; F176-F180 HydrophobicContact CE2-CZ 4.21Å; F176-F180 AromaticContact CG-CD2 3.82Å; F176-F180 HydrophobicContact CG-CD2 3.82Å; F176-F180 HydrophobicContact CG-CE2 4.45Å; F176-F180 HydrophobicContact CZ-CB 3.99Å; F176-F180 AromaticContact CZ-CD2 3.56Å; F176-F180 HydrophobicContact CZ-CD2 3.56Å; F176-F180 HydrophobicContact CZ-CE2 4.15Å; F176-F180 AromaticContact CZ-CG 3.82Å; F176-F180 HydrophobicContact CZ-CG 3.82Å; F176-F180 WeakPolarHBondContact O-CB 3.24Å; F176-F180 WeakPolarHBondContact O-CD2 3.34Å; F176-F180 PolarHBondContact O-N 2.83Å |
| 177 | N | 75.8 | Confident | 61.1 | Low | 99 Ų | 99 | 71.9 Ų | 71.9 | 53% | 0.529 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66 | -36.5 | 178.3 | -71 | -25.6 | 0 | 0 | 0 | 112.3 | E173 E174 F179 G181 | E173-N177 WeakPolarHBondContact O-CB 3.4Å; E173-N177 PolarHBondContact O-N 3.28Å; E173-N177 PolarHBondContact O-ND2 3.06Å; E174-N177 PolarHBondContact O-N 2.96Å; N177-F179 VanDerWaalsContact C-N 3.29Å; N177-F179 PolarHBondContact O-N 3.49Å; N177-G181 WeakPolarHBondContact O-CA 3.43Å; N177-G181 PolarHBondContact O-N 2.87Å |
| 178 | V | 73.6 | Confident | 60.8 | Low | 48 Ų | 48 | 73.3 Ų | 73.3 | 29% | 0.291 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.2 | -43.5 | 170.4 | 168.4 | 0 | 0 | 0 | 0 | 109.5 | E174 F176 F184 M191 | E174-V178 WeakPolarHBondContact O-CB 3.07Å; E174-V178 VanDerWaalsContact O-CG2 3.24Å; E174-V178 WeakPolarHBondContact O-CG2 3.43Å; E174-V178 PolarHBondContact O-N 3.37Å; F176-V178 VanDerWaalsContact C-N 3.34Å; F176-V178 PolarHBondContact O-N 3.19Å; V178-F184 HydrophobicContact CG1-CE2 4.24Å; V178-F184 WeakPolarHBondContact O-CD2 3.32Å; V178-F184 WeakPolarHBondContact O-CE2 3.07Å; V178-M191 HydrophobicContact CG1-CE 3.11Å; V178-M191 HydrophobicContact CG1-SD 3.65Å |
| 179 | F | 69.1 | Low | 60.4 | Low | 32 Ų | 32 | 76.4 Ų | 76.4 | 14% | 0.14 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -70 | -40.5 | -179.8 | -154 | -72.1 | 0 | 0 | 0 | 115.4 | Y102 R103 L175 F176 N177 F184 | Y102-F179 HydrophobicContact CD1-CD2 4.3Å; Y102-F179 HydrophobicContact CE1-CB 4.39Å; Y102-F179 HydrophobicContact CE1-CD2 4.37Å; Y102-F179 HydrophobicContact CE1-CG 4.37Å; R103-F179 HydrophobicContact CB-CE1 4.47Å; R103-F179 HydrophobicContact CG-CD1 3.72Å; R103-F179 HydrophobicContact CG-CE1 3Å; R103-F179 HydrophobicContact CG-CE2 4Å; R103-F179 HydrophobicContact CG-CZ 3.16Å; L175-F179 WeakPolarHBondContact O-CB 3.5Å; L175-F179 PolarHBondContact O-N 3.11Å; F176-F179 CarbonylContact O-C 3.51Å; F176-F179 WeakPolarHBondContact O-CA 3.5Å; F176-F179 PolarHBondContact O-N 3.14Å; N177-F179 VanDerWaalsContact C-N 3.29Å; N177-F179 PolarHBondContact O-N 3.49Å; F179-F184 VanDerWaalsContact CA-CE2 3.49Å; F179-F184 HydrophobicContact CB-CE2 4.42Å; F179-F184 HydrophobicContact CD2-CE2 4.23Å; F179-F184 HydrophobicContact CD2-CZ 4.08Å; F179-F184 HydrophobicContact CE2-CZ 4.18Å; F179-F184 HydrophobicContact CG-CE2 4.4Å |
| 180 | F | 72.9 | Confident | 59.9 | Low | 75 Ų | 75 | 75.2 Ų | 75.2 | 33% | 0.329 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -122.4 | -9.2 | -167.8 | -64.9 | -82.3 | 0 | 0 | 0 | 114 | R103 A106 L107 F176 G182 | R103-F180 HydrophobicContact CB-CZ 4.21Å; R103-F180 HydrophobicContact CG-CE1 4.47Å; R103-F180 HydrophobicContact CG-CZ 3.9Å; A106-F180 HydrophobicContact CB-CE2 4.36Å; L107-F180 HydrophobicContact CD1-CE1 4.01Å; L107-F180 HydrophobicContact CD1-CZ 4.19Å; L107-F180 HydrophobicContact CD2-CD1 4.47Å; L107-F180 HydrophobicContact CD2-CE1 4.02Å; L107-F180 HydrophobicContact CD2-CZ 4.21Å; L107-F180 HydrophobicContact CG-CE1 4.03Å; L107-F180 HydrophobicContact CG-CZ 3.9Å; F176-F180 HydrophobicContact CD1-CB 4.34Å; F176-F180 HydrophobicContact CD1-CD2 4.16Å; F176-F180 AromaticContact CD2-CD2 3.31Å; F176-F180 HydrophobicContact CD2-CD2 3.31Å; F176-F180 AromaticContact CD2-CE2 3.55Å; F176-F180 HydrophobicContact CD2-CE2 3.55Å; F176-F180 HydrophobicContact CD2-CG 4.35Å; F176-F180 HydrophobicContact CE1-CB 3.91Å; F176-F180 HydrophobicContact CE1-CD2 4.04Å; F176-F180 HydrophobicContact CE1-CG 4.21Å; F176-F180 HydrophobicContact CE2-CB 4.48Å; F176-F180 AromaticContact CE2-CD2 3.18Å; F176-F180 HydrophobicContact CE2-CD2 3.18Å; F176-F180 AromaticContact CE2-CE2 3.37Å; F176-F180 HydrophobicContact CE2-CE2 3.37Å; F176-F180 AromaticContact CE2-CG 3.9Å; F176-F180 HydrophobicContact CE2-CG 3.9Å; F176-F180 HydrophobicContact CE2-CZ 4.21Å; F176-F180 AromaticContact CG-CD2 3.82Å; F176-F180 HydrophobicContact CG-CD2 3.82Å; F176-F180 HydrophobicContact CG-CE2 4.45Å; F176-F180 HydrophobicContact CZ-CB 3.99Å; F176-F180 AromaticContact CZ-CD2 3.56Å; F176-F180 HydrophobicContact CZ-CD2 3.56Å; F176-F180 HydrophobicContact CZ-CE2 4.15Å; F176-F180 AromaticContact CZ-CG 3.82Å; F176-F180 HydrophobicContact CZ-CG 3.82Å; F176-F180 WeakPolarHBondContact O-CB 3.24Å; F176-F180 WeakPolarHBondContact O-CD2 3.34Å; F176-F180 PolarHBondContact O-N 2.83Å; F180-G182 VanDerWaalsContact C-N 3.33Å; F180-G182 PolarHBondContact O-N 3.06Å |
| 181 | G | 63.3 | Low | 59.4 | Low | 43 Ų | 43 | 76.3 Ų | 76.3 | 44% | 0.443 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -89.6 | 24.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | N177 H183 | N177-G181 WeakPolarHBondContact O-CA 3.43Å; N177-G181 PolarHBondContact O-N 2.87Å; G181-H183 PolarHBondContact O-N 3Å; G181-H183 PolarHBondContact O-ND1 3.47Å |
| 182 | G | 50.4 | Low | 58.6 | Low | 76 Ų | 76 | 74.3 Ų | 74.3 | 78% | 0.784 | 42% | 0.419 | S | S | * | . | S | Bend | trans | 76.7 | 8.8 | 166.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | F180 | F180-G182 VanDerWaalsContact C-N 3.33Å; F180-G182 PolarHBondContact O-N 3.06Å |
| 183 | H | 46.6 | Very low | 57.3 | Low | 164 Ų | 164 | 77.1 Ų | 77.1 | 76% | 0.759 | 44% | 0.439 | S | S | * | . | trans | -110.6 | 43 | 179.1 | -75.3 | 73.8 | 0 | 0 | 0 | 112.7 | G181 P185 | G181-H183 PolarHBondContact O-N 3Å; G181-H183 PolarHBondContact O-ND1 3.47Å; H183-P185 VanDerWaalsContact O-CD 3.32Å; H183-P185 WeakPolarHBondContact O-CD 3.04Å | ||
| 184 | F | 47.8 | Very low | 56 | Low | 91 Ų | 91 | 78.5 Ų | 78.5 | 40% | 0.399 | 45% | 0.449 | S | S | . | . | trans | -85.9 | 116.2 | 172.2 | -112 | -99.4 | 0 | 0 | 0 | 110.3 | V178 F179 T186 M191 | V178-F184 HydrophobicContact CG1-CE2 4.24Å; V178-F184 WeakPolarHBondContact O-CD2 3.32Å; V178-F184 WeakPolarHBondContact O-CE2 3.07Å; F179-F184 VanDerWaalsContact CA-CE2 3.49Å; F179-F184 HydrophobicContact CB-CE2 4.42Å; F179-F184 HydrophobicContact CD2-CE2 4.23Å; F179-F184 HydrophobicContact CD2-CZ 4.08Å; F179-F184 HydrophobicContact CE2-CZ 4.18Å; F179-F184 HydrophobicContact CG-CE2 4.4Å; F184-T186 PolarHBondContact O-N 2.81Å; F184-M191 HydrophobicContact CE1-CE 4.21Å; F184-M191 HydrophobicContact CE2-CE 3.82Å; F184-M191 HydrophobicContact CZ-CE 3.66Å; F184-M191 HydrophobicContact CZ-SD 4.04Å | ||
| 185 | P | 47 | Very low | 54.6 | Low | 71 Ų | 71 | 79.7 Ų | 79.7 | 46% | 0.461 | 46% | 0.463 | S | S | . | . | trans | -65.8 | 123.3 | 158.2 | -4.6 | 22.6 | 0 | 0 | 0 | 106.3 | H183 G187 I189 | H183-P185 VanDerWaalsContact O-CD 3.32Å; H183-P185 WeakPolarHBondContact O-CD 3.04Å; P185-G187 PolarHBondContact O-N 2.76Å; P185-I189 HydrophobicContact CB-CD1 3.63Å; P185-I189 HydrophobicContact CG-CD1 3.6Å | ||
| 186 | T | 45.4 | Very low | 52.7 | Low | 151 Ų | 151 | 85.1 Ų | 85.1 | 93% | 0.926 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -65.6 | 84.4 | 174.6 | 52.5 | 0 | 0 | 0 | 0 | 109.3 | F184 | F184-T186 PolarHBondContact O-N 2.81Š|
| 187 | G | 48.7 | Very low | 50.9 | Low | 47 Ų | 47 | 91.9 Ų | 91.9 | 49% | 0.485 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -173.6 | 153.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | P185 I189 | P185-G187 PolarHBondContact O-N 2.76Å; G187-I189 PolarHBondContact O-N 3.22Å |
| 188 | N | 43.5 | Very low | 49 | Very low | 139 Ų | 139 | 93.6 Ų | 93.6 | 74% | 0.743 | 54% | 0.543 | S | S | * | . | trans | -68.7 | 80.3 | 170.3 | -79.8 | -20.7 | 0 | 0 | 0 | 109.3 | ||||
| 189 | I | 44.5 | Very low | 47 | Very low | 85 Ų | 85 | 95.7 Ų | 95.7 | 44% | 0.436 | 57% | 0.565 | S | S | . | * | trans | -93 | 121.6 | 172.2 | -69.5 | 167.1 | 0 | 0 | 0 | 107.6 | P185 G187 M191 | P185-I189 HydrophobicContact CB-CD1 3.63Å; P185-I189 HydrophobicContact CG-CD1 3.6Å; G187-I189 PolarHBondContact O-N 3.22Å; I189-M191 VanDerWaalsContact C-N 3.25Å; I189-M191 HydrophobicContact CG2-CG 4.32Å; I189-M191 PolarHBondContact O-N 3.45Å | ||
| 190 | H | 45.3 | Very low | 45.5 | Very low | 114 Ų | 114 | 101.1 Ų | 101.1 | 53% | 0.528 | 59% | 0.591 | S | S | . | * | trans | -67.6 | 88.5 | 164.3 | -64.9 | -79.2 | 0 | 0 | 0 | 107.6 | F192 S193 | H190-F192 PolarHBondContact O-N 2.75Å; H190-S193 PolarHBondContact O-N 3.37Å | ||
| 191 | M | 51.7 | Low | 43.9 | Very low | 70 Ų | 70 | 106.1 Ų | 106.1 | 35% | 0.345 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.2 | -4.6 | -178.1 | -90.1 | 178.8 | 165.8 | 0 | 0 | 114.7 | V178 F184 I189 | V178-M191 HydrophobicContact CG1-CE 3.11Å; V178-M191 HydrophobicContact CG1-SD 3.65Å; F184-M191 HydrophobicContact CE1-CE 4.21Å; F184-M191 HydrophobicContact CE2-CE 3.82Å; F184-M191 HydrophobicContact CZ-CE 3.66Å; F184-M191 HydrophobicContact CZ-SD 4.04Å; I189-M191 VanDerWaalsContact C-N 3.25Å; I189-M191 HydrophobicContact CG2-CG 4.32Å; I189-M191 PolarHBondContact O-N 3.45Å |
| 192 | F | 52.5 | Low | 42.7 | Very low | 31 Ų | 31 | 115.6 Ų | 115.6 | 14% | 0.136 | 63% | 0.633 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -132.1 | 2.2 | -171.1 | -58.6 | -81.8 | 0 | 0 | 0 | 114.5 | F130 A131 S134 N135 I170 L175 H190 N194 | F130-F192 HydrophobicContact CE1-CE2 4.16Å; F130-F192 HydrophobicContact CE1-CZ 4.44Å; A131-F192 HydrophobicContact CB-CE1 4.39Å; S134-F192 WeakPolarHBondContact OG-CD2 2.97Å; S134-F192 WeakPolarHBondContact OG-CE2 3.11Å; N135-F192 HydrophobicContact CB-CB 3.56Å; N135-F192 HydrophobicContact CB-CG 4.37Å; N135-F192 PolarHBondContact ND2-O 3.24Å; I170-F192 HydrophobicContact CD1-CE1 3.97Å; L175-F192 HydrophobicContact CD1-CZ 3.79Å; H190-F192 PolarHBondContact O-N 2.75Å; F192-N194 PolarHBondContact O-N 3.31Å |
| 193 | S | 40.6 | Very low | 41.9 | Very low | 72 Ų | 72 | 122.9 Ų | 122.9 | 50% | 0.503 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -74 | 99.8 | 176.8 | 65.6 | 0 | 0 | 0 | 0 | 109.7 | H190 | H190-S193 PolarHBondContact O-N 3.37Š|
| 194 | N | 42.2 | Very low | 41.4 | Very low | 105 Ų | 105 | 125.8 Ų | 125.8 | 56% | 0.561 | 64% | 0.641 | S | S | * | * | trans | 47.4 | 84.3 | 156.6 | -55.8 | -25.3 | 0 | 0 | 0 | 114 | D137 F192 T196 | D137-N194 PolarHBondContact OD2-ND2 3.3Å; D137-N194 VanDerWaalsContact OD2-ND2 3.12Å; F192-N194 PolarHBondContact O-N 3.31Å; N194-T196 VanDerWaalsContact C-N 3.27Å; N194-T196 PolarHBondContact O-N 3.31Å | ||
| 195 | V | 38.5 | Very low | 40.7 | Very low | 128 Ų | 128 | 132 Ų | 132 | 78% | 0.776 | 66% | 0.662 | S | S | * | * | trans | -60.6 | 96.9 | 160.8 | 178 | 0 | 0 | 0 | 0 | 107.1 | D197 | V195-D197 PolarHBondContact O-N 3.23Š| ||
| 196 | T | 32.3 | Very low | 40.1 | Very low | 120 Ų | 120 | 136.5 Ų | 136.5 | 74% | 0.736 | 68% | 0.676 | S | S | * | * | trans | -63 | 100.6 | 161.7 | 47.7 | 0 | 0 | 0 | 0 | 107.7 | N194 D198 | N194-T196 VanDerWaalsContact C-N 3.27Å; N194-T196 PolarHBondContact O-N 3.31Å; T196-D198 PolarHBondContact O-N 3.37Å | ||
| 197 | D | 36.9 | Very low | 39.5 | Very low | 169 Ų | 169 | 140.2 Ų | 140.2 | 90% | 0.904 | 67% | 0.673 | S | S | * | * | S | Bend | trans | 43.4 | 11.8 | 141.4 | -111.2 | -10.2 | 0 | 0 | 0 | 122.1 | V195 | V195-D197 PolarHBondContact O-N 3.23Š|
| 198 | D | 36.1 | Very low | 38.8 | Very low | 135 Ų | 135 | 146.5 Ų | 146.5 | 72% | 0.722 | 69% | 0.69 | S | S | * | * | trans | -141.6 | 50 | -174.1 | -143.6 | 7.5 | 0 | 0 | 0 | 114.5 | T196 | T196-D198 PolarHBondContact O-N 3.37Š| ||
| 199 | A | 30.8 | Very low | 38.7 | Very low | 91 Ų | 91 | 148.2 Ų | 148.2 | 75% | 0.752 | 69% | 0.693 | S | S | * | * | trans | -123.5 | 85.6 | 169 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 200 | H | 37.8 | Very low | 38.3 | Very low | 146 Ų | 146 | 155 Ų | 155 | 68% | 0.676 | 71% | 0.714 | S | S | * | * | trans | -65.5 | 127.4 | 174 | -93.5 | -62.6 | 0 | 0 | 0 | 113.4 | ||||
| 201 | Y | 40.7 | Very low | 38 | Very low | 180 Ų | 180 | 155.9 Ų | 155.9 | 71% | 0.706 | 73% | 0.727 | S | S | * | * | trans | 64.6 | 101.8 | 149.9 | -65.8 | -75.4 | 0 | 0 | 0 | 121.3 | ||||
| 202 | Y | 37.4 | Very low | 37.2 | Very low | 242 Ų | 242 | 160.2 Ų | 160.2 | 95% | 0.949 | 75% | 0.746 | S | S | * | * | -148 | 87.1 | 120 | -79.8 | -69.5 | 0 | 0 | 0 | 111.1 | R204 | Y202-R204 PolarHBondContact O-N 3.46Š| |||
| 203 | R | 34.5 | Very low | 36.6 | Very low | 230 Ų | 230 | 165.4 Ų | 165.4 | 87% | 0.868 | 78% | 0.781 | S | S | * | * | trans | -80.8 | 92.9 | 171.6 | -171.8 | -178.9 | -104.2 | 170.7 | -4.8 | 109.4 | R205 | R203-R205 PolarHBondContact O-N 2.74Š| ||
| 204 | R | 34.7 | Very low | 36.3 | Very low | 225 Ų | 225 | 169.6 Ų | 169.6 | 85% | 0.849 | 79% | 0.792 | S | S | * | * | trans | -72.2 | 112.8 | 171.3 | -167.7 | 177.6 | -96.8 | 171.2 | -6 | 109.4 | Y202 H206 | Y202-R204 PolarHBondContact O-N 3.46Å; R204-H206 PolarHBondContact O-N 3.23Å | ||
| 205 | R | 33.3 | Very low | 36.2 | Very low | 221 Ų | 221 | 174.8 Ų | 174.8 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -82.1 | 105 | -176.7 | -144.3 | -178.7 | -165.5 | 173.7 | 3.5 | 109.2 | R203 | R203-R205 PolarHBondContact O-N 2.74Š| ||
| 206 | H | 34.3 | Very low | 36 | Very low | 166 Ų | 166 | 177 Ų | 177 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -109 | 98.7 | 158.1 | -87 | -69.9 | 0 | 0 | 0 | 108.5 | R204 H208 | R204-H206 PolarHBondContact O-N 3.23Å; H206-H208 PolarHBondContact O-N 3.31Å | ||
| 207 | R | 32.4 | Very low | 36.2 | Very low | 229 Ų | 229 | 180.6 Ų | 180.6 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | trans | -86.9 | 99.6 | 171 | -171.9 | 177.2 | -158.8 | 173.4 | 4.5 | 107.3 | E209 | R207-E209 PolarHBondContact O-N 3.25Š| ||
| 208 | H | 35.8 | Very low | 36.3 | Very low | 178 Ų | 178 | 181.7 Ų | 181.7 | 82% | 0.824 | 82% | 0.82 | S | S | * | * | trans | -71.5 | 115.5 | 160.2 | -100 | -70.5 | 0 | 0 | 0 | 108.5 | H206 R210 | H206-H208 PolarHBondContact O-N 3.31Å; H208-R210 PolarHBondContact O-N 2.85Å | ||
| 209 | E | 39.4 | Very low | 36.4 | Very low | 176 Ų | 176 | 184.1 Ų | 184.1 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | trans | -54.3 | 116.7 | 162.3 | -166 | 173.4 | 176.1 | 0 | 0 | 109.2 | R207 | R207-E209 PolarHBondContact O-N 3.25Š| ||
| 210 | R | 36.1 | Very low | 37 | Very low | 228 Ų | 228 | 188.9 Ų | 188.9 | 86% | 0.86 | 83% | 0.833 | S | S | * | * | trans | -136.2 | 102.6 | 164.3 | -118.7 | -176.3 | -170.4 | -168.4 | 3.1 | 108.7 | H208 Q212 | H208-R210 PolarHBondContact O-N 2.85Å; R210-Q212 PolarHBondContact O-N 3.3Å | ||
| 211 | T | 39.6 | Very low | 37.3 | Very low | 131 Ų | 131 | 190.7 Ų | 190.7 | 80% | 0.804 | 84% | 0.84 | S | S | * | * | trans | -48.3 | 116.2 | 160.9 | -19.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 212 | Q | 34.8 | Very low | 37.5 | Very low | 161 Ų | 161 | 187.2 Ų | 187.2 | 75% | 0.752 | 84% | 0.839 | S | S | * | * | trans | -127.7 | 107.6 | 161.8 | -96.1 | -177 | -4.5 | 0 | 0 | 108.2 | R210 Q214 | R210-Q212 PolarHBondContact O-N 3.3Å; Q212-Q214 PolarHBondContact O-N 3.25Å | ||
| 213 | T | 40.5 | Very low | 38.2 | Very low | 141 Ų | 141 | 184.8 Ų | 184.8 | 87% | 0.865 | 84% | 0.836 | S | S | * | * | trans | -52.5 | 107.8 | 157.5 | 34.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 214 | Q | 33.7 | Very low | 39.4 | Very low | 159 Ų | 159 | 177.6 Ų | 177.6 | 74% | 0.743 | 82% | 0.818 | S | S | * | * | trans | -131.9 | 119.8 | 153.1 | -90.5 | -179.6 | -16.7 | 0 | 0 | 108.2 | Q212 E216 | Q212-Q214 PolarHBondContact O-N 3.25Å; Q214-E216 PolarHBondContact O-N 2.94Å | ||
| 215 | K | 40.7 | Very low | 40.6 | Very low | 215 Ų | 215 | 171.7 Ų | 171.7 | 94% | 0.935 | 81% | 0.807 | S | S | * | * | trans | -62.6 | 110.8 | 164.4 | -74.1 | 173.7 | 171.6 | -179.2 | 0 | 107.2 | ||||
| 216 | E | 33.8 | Very low | 42.1 | Very low | 174 Ų | 174 | 168.9 Ų | 168.9 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | trans | -134.1 | 143.1 | 156.8 | -75.5 | -175.5 | 169.4 | 0 | 0 | 107.2 | Q214 | Q214-E216 PolarHBondContact O-N 2.94Š| ||
| 217 | E | 36.5 | Very low | 43.8 | Very low | 195 Ų | 195 | 164 Ų | 164 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | trans | -63 | 146.4 | -157.3 | -67 | 156.8 | 150.3 | 0 | 0 | 113.4 | E219 | E217-E219 PolarHBondContact O-N 2.98Å; E217-E219 VanDerWaalsContact O-N 3.08Å | ||
| 218 | E | 40.2 | Very low | 45.5 | Very low | 192 Ų | 192 | 155.5 Ų | 155.5 | 90% | 0.897 | 76% | 0.761 | S | S | * | * | trans | -56.5 | 105.8 | 165.9 | -91.2 | 169.8 | 143 | 0 | 0 | 110.3 | ||||
| 219 | E | 37.1 | Very low | 47.1 | Very low | 187 Ų | 187 | 153.5 Ų | 153.5 | 87% | 0.874 | 75% | 0.75 | S | S | * | * | trans | -122.3 | 97.5 | 147.3 | -100.6 | -166.8 | 164.2 | 0 | 0 | 108.4 | E217 K221 | E217-E219 PolarHBondContact O-N 2.98Å; E217-E219 VanDerWaalsContact O-N 3.08Å; E219-K221 PolarHBondContact O-N 3.23Å | ||
| 220 | E | 43.4 | Very low | 49.1 | Very low | 190 Ų | 190 | 150.8 Ų | 150.8 | 89% | 0.888 | 74% | 0.74 | S | S | * | * | trans | -58.4 | 101.7 | 167.4 | -77.5 | -169.3 | 135 | 0 | 0 | 110 | ||||
| 221 | K | 43.5 | Very low | 51 | Low | 185 Ų | 185 | 147.1 Ų | 147.1 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | trans | -100.5 | 122.1 | 155.8 | -108.1 | 176.3 | -179.7 | 168.3 | 0 | 108.6 | E219 Q223 | E219-K221 PolarHBondContact O-N 3.23Å; K221-Q223 PolarHBondContact O-N 3.01Å | ||
| 222 | P | 46.5 | Very low | 53.1 | Low | 107 Ų | 107 | 146 Ų | 146 | 70% | 0.695 | 72% | 0.721 | S | S | * | * | trans | -60.6 | 131.1 | -177.8 | 24.2 | -31.7 | 0 | 0 | 0 | 109 | T224 | P222-T224 PolarHBondContact O-N 2.9Š| ||
| 223 | Q | 52.1 | Low | 55.6 | Low | 190 Ų | 190 | 143 Ų | 143 | 89% | 0.888 | 71% | 0.71 | S | S | * | * | trans | -65.3 | 85.8 | 173.3 | -63.7 | -172.9 | 2.2 | 0 | 0 | 108.3 | K221 T225 | K221-Q223 PolarHBondContact O-N 3.01Å; Q223-T225 PolarHBondContact O-N 3.38Å | ||
| 224 | T | 59.5 | Low | 57.9 | Low | 80 Ų | 80 | 140 Ų | 140 | 49% | 0.491 | 69% | 0.693 | S | S | . | * | trans | -65.5 | 129 | 173.7 | 57.6 | 0 | 0 | 0 | 0 | 108 | P222 Y226 S227 | P222-T224 PolarHBondContact O-N 2.9Å; T224-Y226 PolarHBondContact O-N 3.28Å; T224-S227 PolarHBondContact O-N 3.31Å; T224-S227 PolarHBondContact O-OG 2.88Å | ||
| 225 | T | 60.4 | Low | 60.5 | Low | 101 Ų | 101 | 136.7 Ų | 136.7 | 62% | 0.62 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -44.8 | -20.8 | 175.9 | 48.9 | 0 | 0 | 0 | 0 | 114.3 | Q223 S227 A228 F229 | Q223-T225 PolarHBondContact O-N 3.38Å; T225-S227 VanDerWaalsContact C-N 3.33Å; T225-S227 PolarHBondContact O-N 3.19Å; T225-A228 PolarHBondContact O-N 2.81Å; T225-F229 WeakPolarHBondContact O-CD2 3.34Å |
| 226 | Y | 64.6 | Low | 62.9 | Low | 161 Ų | 161 | 131.1 Ų | 131.1 | 63% | 0.631 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -58.8 | -27.8 | 173.1 | -61.3 | -68 | 0 | 0 | 0 | 115.6 | T224 A228 F229 I230 | T224-Y226 PolarHBondContact O-N 3.28Å; Y226-A228 VanDerWaalsContact C-N 3.34Å; Y226-A228 PolarHBondContact O-N 3.29Å; Y226-F229 PolarHBondContact O-N 3.35Å; Y226-I230 WeakPolarHBondContact O-CG1 3.2Å; Y226-I230 PolarHBondContact O-N 3.46Å |
| 227 | S | 68.5 | Low | 65.7 | Low | 63 Ų | 63 | 125.8 Ų | 125.8 | 44% | 0.441 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -68.9 | -31.4 | 179.7 | 65.7 | 0 | 0 | 0 | 0 | 113.1 | T224 T225 Q231 | T224-S227 PolarHBondContact O-N 3.31Å; T224-S227 PolarHBondContact O-OG 2.88Å; T225-S227 VanDerWaalsContact C-N 3.33Å; T225-S227 PolarHBondContact O-N 3.19Å; S227-Q231 WeakPolarHBondContact O-CG 3.41Å; S227-Q231 PolarHBondContact O-N 3.48Å |
| 228 | A | 68.6 | Low | 68.3 | Low | 51 Ų | 51 | 122 Ų | 122 | 42% | 0.421 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -70.2 | -36.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | T225 Y226 Q231 L232 | T225-A228 PolarHBondContact O-N 2.81Å; Y226-A228 VanDerWaalsContact C-N 3.34Å; Y226-A228 PolarHBondContact O-N 3.29Å; A228-Q231 PolarHBondContact O-N 2.9Å; A228-L232 PolarHBondContact O-N 2.04Å |
| 229 | F | 70.9 | Confident | 70.7 | Confident | 136 Ų | 136 | 116.9 Ų | 116.9 | 60% | 0.596 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.7 | -38.5 | 176.6 | -68.2 | -74.1 | 0 | 0 | 0 | 112.3 | T225 Y226 Q231 L232 L233 | T225-F229 WeakPolarHBondContact O-CD2 3.34Å; Y226-F229 PolarHBondContact O-N 3.35Å; F229-Q231 VanDerWaalsContact C-N 3.3Å; F229-Q231 PolarHBondContact O-N 3.15Å; F229-L232 PolarHBondContact O-N 3.39Å; F229-L233 PolarHBondContact O-N 2.93Å; F229-L233 VanDerWaalsContact O-N 3.15Å |
| 230 | I | 80.6 | Confident | 73.4 | Confident | 119 Ų | 119 | 111.8 Ų | 111.8 | 61% | 0.61 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.3 | -33.6 | 177.4 | -64.8 | 167.7 | 0 | 0 | 0 | 111.2 | Y226 P234 | Y226-I230 WeakPolarHBondContact O-CG1 3.2Å; Y226-I230 PolarHBondContact O-N 3.46Å; I230-P234 WeakPolarHBondContact O-CD 3.32Å |
| 231 | Q | 76.4 | Confident | 75.7 | Confident | 152 Ų | 152 | 107.1 Ų | 107.1 | 71% | 0.71 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70.5 | -27.9 | 176.3 | -73.2 | 178.7 | 3.3 | 0 | 0 | 113.6 | S227 A228 F229 | S227-Q231 WeakPolarHBondContact O-CG 3.41Å; S227-Q231 PolarHBondContact O-N 3.48Å; A228-Q231 PolarHBondContact O-N 2.9Å; F229-Q231 VanDerWaalsContact C-N 3.3Å; F229-Q231 PolarHBondContact O-N 3.15Å |
| 232 | L | 82.8 | Confident | 77.9 | Confident | 107 Ų | 107 | 100.9 Ų | 100.9 | 56% | 0.56 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -87.6 | -17.7 | 178.4 | -68 | 174.3 | 0 | 0 | 0 | 113.2 | A228 F229 V235 L236 | A228-L232 PolarHBondContact O-N 2.04Å; F229-L232 PolarHBondContact O-N 3.39Å; L232-V235 PolarHBondContact O-N 2.92Å; L232-L236 WeakPolarHBondContact O-CB 3.33Å; L232-L236 PolarHBondContact O-N 3.36Å |
| 233 | L | 88.5 | Confident | 80 | Confident | 99 Ų | 99 | 99.1 Ų | 99.1 | 52% | 0.518 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -55.1 | -44.9 | -177.6 | -162.5 | 157.5 | 0 | 0 | 0 | 113.3 | F229 V235 L236 V237 | F229-L233 PolarHBondContact O-N 2.93Å; F229-L233 VanDerWaalsContact O-N 3.15Å; L233-V235 PolarHBondContact O-N 2.85Å; L233-L236 PolarHBondContact O-N 3.49Å; L233-V237 HydrophobicContact CD2-CG2 3.73Å; L233-V237 WeakPolarHBondContact O-CB 3.36Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.03Å; L233-V237 PolarHBondContact O-N 3.29Å |
| 234 | P | 88.6 | Confident | 81.7 | Confident | 77 Ų | 77 | 94 Ų | 94 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 178.8 | -21.2 | 33.3 | 0 | 0 | 0 | 113.3 | I230 I238 | I230-P234 WeakPolarHBondContact O-CD 3.32Å; P234-I238 WeakPolarHBondContact O-CG1 3.34Å; P234-I238 PolarHBondContact O-N 3.4Å; P234-I238 VanDerWaalsContact O-N 3.14Å |
| 235 | V | 88.4 | Confident | 83 | Confident | 89 Ų | 89 | 94 Ų | 94 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.5 | -43.9 | 177.3 | 179.3 | 0 | 0 | 0 | 0 | 110 | L232 L233 V237 I238 V239 | L232-V235 PolarHBondContact O-N 2.92Å; L233-V235 PolarHBondContact O-N 2.85Å; V235-V237 VanDerWaalsContact C-N 3.33Å; V235-V237 PolarHBondContact O-N 3.46Å; V235-I238 PolarHBondContact O-N 2.88Å; V235-V239 WeakPolarHBondContact O-CG2 3.4Å; V235-V239 PolarHBondContact O-N 3.06Å |
| 236 | L | 90.1 | Very high | 84 | Confident | 98 Ų | 98 | 95.5 Ų | 95.5 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -39.6 | 178.7 | -167.9 | 152.8 | 0 | 0 | 0 | 111 | L232 L233 V239 I240 | L232-L236 WeakPolarHBondContact O-CB 3.33Å; L232-L236 PolarHBondContact O-N 3.36Å; L233-L236 PolarHBondContact O-N 3.49Å; L236-V239 PolarHBondContact O-N 3.32Å; L236-I240 HydrophobicContact CD2-CD1 3.3Å; L236-I240 HydrophobicContact CD2-CG1 3.98Å; L236-I240 HydrophobicContact CG-CD1 4.45Å; L236-I240 WeakPolarHBondContact O-CB 3.44Å; L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.24Å; L236-I240 PolarHBondContact O-N 3.47Å |
| 237 | V | 93.3 | Very high | 84.7 | Confident | 62 Ų | 62 | 94.6 Ų | 94.6 | 38% | 0.376 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 174.3 | 168.1 | 0 | 0 | 0 | 0 | 111.7 | L233 V235 V239 I240 I241 | L233-V237 HydrophobicContact CD2-CG2 3.73Å; L233-V237 WeakPolarHBondContact O-CB 3.36Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.03Å; L233-V237 PolarHBondContact O-N 3.29Å; V235-V237 VanDerWaalsContact C-N 3.33Å; V235-V237 PolarHBondContact O-N 3.46Å; V237-V239 VanDerWaalsContact C-N 3.35Å; V237-V239 PolarHBondContact O-N 3.33Å; V237-I240 PolarHBondContact O-N 3.4Å; V237-I241 HydrophobicContact CG1-CD1 3.62Å; V237-I241 HydrophobicContact CG1-CG1 4.29Å; V237-I241 WeakPolarHBondContact O-CB 3.32Å; V237-I241 VanDerWaalsContact O-CG1 3.22Å; V237-I241 WeakPolarHBondContact O-CG1 3.16Å; V237-I241 PolarHBondContact O-N 3.33Å |
| 238 | I | 90.3 | Very high | 85.1 | Confident | 116 Ų | 116 | 97.8 Ų | 97.8 | 60% | 0.595 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.8 | -42.3 | 177.3 | -67.1 | 165 | 0 | 0 | 0 | 111.1 | P234 V235 I241 S242 | P234-I238 WeakPolarHBondContact O-CG1 3.34Å; P234-I238 PolarHBondContact O-N 3.4Å; P234-I238 VanDerWaalsContact O-N 3.14Å; V235-I238 PolarHBondContact O-N 2.88Å; I238-I241 PolarHBondContact O-N 3.27Å; I238-S242 WeakPolarHBondContact O-CB 3.4Å; I238-S242 PolarHBondContact O-N 3.49Å |
| 239 | V | 91.6 | Very high | 85.3 | Confident | 84 Ų | 84 | 98.6 Ų | 98.6 | 51% | 0.509 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 176.4 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | V235 L236 V237 S242 V243 | V235-V239 WeakPolarHBondContact O-CG2 3.4Å; V235-V239 PolarHBondContact O-N 3.06Å; L236-V239 PolarHBondContact O-N 3.32Å; V237-V239 VanDerWaalsContact C-N 3.35Å; V237-V239 PolarHBondContact O-N 3.33Å; V239-S242 PolarHBondContact O-N 2.94Å; V239-V243 VanDerWaalsContact O-CG2 3.3Å; V239-V243 WeakPolarHBondContact O-CG2 3.34Å; V239-V243 PolarHBondContact O-N 3.46Å |
| 240 | I | 92.8 | Very high | 85.4 | Confident | 81 Ų | 81 | 98.3 Ų | 98.3 | 42% | 0.415 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.4 | -46.5 | 176.1 | -74.8 | -176.9 | 0 | 0 | 0 | 110.9 | L236 V237 S242 V243 I244 | L236-I240 HydrophobicContact CD2-CD1 3.3Å; L236-I240 HydrophobicContact CD2-CG1 3.98Å; L236-I240 HydrophobicContact CG-CD1 4.45Å; L236-I240 WeakPolarHBondContact O-CB 3.44Å; L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.24Å; L236-I240 PolarHBondContact O-N 3.47Å; V237-I240 PolarHBondContact O-N 3.4Å; I240-S242 VanDerWaalsContact C-N 3.33Å; I240-S242 PolarHBondContact O-N 3.43Å; I240-V243 PolarHBondContact O-N 3.2Å; I240-I244 HydrophobicContact CG2-CD1 3.41Å; I240-I244 VanDerWaalsContact CG2-CD1 3.41Å; I240-I244 HydrophobicContact CG2-CG1 4.09Å; I240-I244 WeakPolarHBondContact O-CB 3.29Å; I240-I244 VanDerWaalsContact O-CG1 3.22Å; I240-I244 WeakPolarHBondContact O-CG1 3.47Å; I240-I244 PolarHBondContact O-N 3.22Å |
| 241 | I | 92.6 | Very high | 85.2 | Confident | 92 Ų | 92 | 98 Ų | 98 | 47% | 0.472 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 177.7 | -69.7 | 166.5 | 0 | 0 | 0 | 109.8 | V237 I238 V243 I244 T245 | V237-I241 HydrophobicContact CG1-CD1 3.62Å; V237-I241 HydrophobicContact CG1-CG1 4.29Å; V237-I241 WeakPolarHBondContact O-CB 3.32Å; V237-I241 VanDerWaalsContact O-CG1 3.22Å; V237-I241 WeakPolarHBondContact O-CG1 3.16Å; V237-I241 PolarHBondContact O-N 3.33Å; I238-I241 PolarHBondContact O-N 3.27Å; I241-V243 PolarHBondContact O-N 3.32Å; I241-I244 PolarHBondContact O-N 3.22Å; I241-T245 HydrophobicContact CG2-CG2 4.19Å; I241-T245 WeakPolarHBondContact O-CB 3.44Å; I241-T245 VanDerWaalsContact O-CG2 3.24Å; I241-T245 WeakPolarHBondContact O-CG2 3.5Å; I241-T245 PolarHBondContact O-N 2.9Å; I241-T245 PolarHBondContact O-OG1 3.24Å; I241-T245 VanDerWaalsContact O-OG1 3.11Å |
| 242 | S | 89 | Confident | 85.7 | Confident | 53 Ų | 53 | 94.4 Ų | 94.4 | 37% | 0.371 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -58.6 | -45.7 | 177.4 | -175.9 | 0 | 0 | 0 | 0 | 111.9 | I238 V239 I240 T245 Q246 | I238-S242 WeakPolarHBondContact O-CB 3.4Å; I238-S242 PolarHBondContact O-N 3.49Å; V239-S242 PolarHBondContact O-N 2.94Å; I240-S242 VanDerWaalsContact C-N 3.33Å; I240-S242 PolarHBondContact O-N 3.43Å; S242-T245 WeakPolarHBondContact CA-OG1 3.49Å; S242-T245 PolarHBondContact O-N 2.94Å; S242-T245 PolarHBondContact O-OG1 3.31Å; S242-Q246 WeakPolarHBondContact O-CG 3.44Å; S242-Q246 PolarHBondContact O-N 3Å; S242-Q246 VanDerWaalsContact O-N 3.08Å; S242-Q246 PolarHBondContact OG-NE2 3.01Å |
| 243 | V | 89.8 | Confident | 85.9 | Confident | 71 Ų | 71 | 91.4 Ų | 91.4 | 43% | 0.43 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.8 | -43.6 | 177.5 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | V239 I240 I241 T245 Q246 L247 | V239-V243 VanDerWaalsContact O-CG2 3.3Å; V239-V243 WeakPolarHBondContact O-CG2 3.34Å; V239-V243 PolarHBondContact O-N 3.46Å; I240-V243 PolarHBondContact O-N 3.2Å; I241-V243 PolarHBondContact O-N 3.32Å; V243-T245 VanDerWaalsContact C-N 3.34Å; V243-T245 PolarHBondContact O-N 2.9Å; V243-Q246 PolarHBondContact O-N 2.88Å; V243-L247 HydrophobicContact CG1-CD1 3.98Å; V243-L247 HydrophobicContact CG1-CG 4.41Å; V243-L247 WeakPolarHBondContact O-CG 3.44Å; V243-L247 PolarHBondContact O-N 2.92Å |
| 244 | I | 88.3 | Confident | 86.1 | Confident | 82 Ų | 82 | 88 Ų | 88 | 42% | 0.421 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.5 | -42.1 | 177.3 | -70.7 | 173.8 | 0 | 0 | 0 | 110.5 | I240 I241 Q246 L247 L248 | I240-I244 HydrophobicContact CG2-CD1 3.41Å; I240-I244 VanDerWaalsContact CG2-CD1 3.41Å; I240-I244 HydrophobicContact CG2-CG1 4.09Å; I240-I244 WeakPolarHBondContact O-CB 3.29Å; I240-I244 VanDerWaalsContact O-CG1 3.22Å; I240-I244 WeakPolarHBondContact O-CG1 3.47Å; I240-I244 PolarHBondContact O-N 3.22Å; I241-I244 PolarHBondContact O-N 3.22Å; I244-Q246 VanDerWaalsContact C-N 3.3Å; I244-Q246 PolarHBondContact O-N 3.45Å; I244-L247 PolarHBondContact O-N 3.35Å; I244-L248 HydrophobicContact CG2-CD1 3.64Å; I244-L248 HydrophobicContact CG2-CG 4.23Å; I244-L248 WeakPolarHBondContact O-CB 3.48Å; I244-L248 WeakPolarHBondContact O-CG 3.39Å; I244-L248 PolarHBondContact O-N 3.34Å |
| 245 | T | 86.4 | Confident | 86.3 | Confident | 81 Ų | 81 | 84.9 Ų | 84.9 | 50% | 0.497 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.3 | -35.8 | 176.5 | 57 | 0 | 0 | 0 | 0 | 112.3 | I241 S242 V243 A249 | I241-T245 HydrophobicContact CG2-CG2 4.19Å; I241-T245 WeakPolarHBondContact O-CB 3.44Å; I241-T245 VanDerWaalsContact O-CG2 3.24Å; I241-T245 WeakPolarHBondContact O-CG2 3.5Å; I241-T245 PolarHBondContact O-N 2.9Å; I241-T245 PolarHBondContact O-OG1 3.24Å; I241-T245 VanDerWaalsContact O-OG1 3.11Å; S242-T245 WeakPolarHBondContact CA-OG1 3.49Å; S242-T245 PolarHBondContact O-N 2.94Å; S242-T245 PolarHBondContact O-OG1 3.31Å; V243-T245 VanDerWaalsContact C-N 3.34Å; V243-T245 PolarHBondContact O-N 2.9Å; T245-A249 WeakPolarHBondContact O-CB 3.38Å; T245-A249 PolarHBondContact O-N 3.29Å |
| 246 | Q | 81.4 | Confident | 86.5 | Confident | 132 Ų | 132 | 82.1 Ų | 82.1 | 62% | 0.617 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -70.6 | -35.1 | 174.2 | -69.8 | 171.8 | 33.3 | 0 | 0 | 112.5 | S242 V243 I244 | S242-Q246 WeakPolarHBondContact O-CG 3.44Å; S242-Q246 PolarHBondContact O-N 3Å; S242-Q246 VanDerWaalsContact O-N 3.08Å; S242-Q246 PolarHBondContact OG-NE2 3.01Å; V243-Q246 PolarHBondContact O-N 2.88Å; I244-Q246 VanDerWaalsContact C-N 3.3Å; I244-Q246 PolarHBondContact O-N 3.45Å |
| 247 | L | 80.1 | Confident | 86.6 | Confident | 141 Ų | 141 | 82.1 Ų | 82.1 | 74% | 0.738 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -73.5 | -30 | 176.5 | -69.7 | 172.7 | 0 | 0 | 0 | 112.9 | V243 I244 | V243-L247 HydrophobicContact CG1-CD1 3.98Å; V243-L247 HydrophobicContact CG1-CG 4.41Å; V243-L247 WeakPolarHBondContact O-CG 3.44Å; V243-L247 PolarHBondContact O-N 2.92Å; I244-L247 PolarHBondContact O-N 3.35Å |
| 248 | L | 76.9 | Confident | 86.6 | Confident | 131 Ų | 131 | 85.8 Ų | 85.8 | 69% | 0.686 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -89.2 | -6.9 | 176.1 | -67.8 | 174.4 | 0 | 0 | 0 | 113.4 | I244 T250 | I244-L248 HydrophobicContact CG2-CD1 3.64Å; I244-L248 HydrophobicContact CG2-CG 4.23Å; I244-L248 WeakPolarHBondContact O-CB 3.48Å; I244-L248 WeakPolarHBondContact O-CG 3.39Å; I244-L248 PolarHBondContact O-N 3.34Å; L248-T250 PolarHBondContact O-N 3.35Å |
| 249 | A | 72.5 | Confident | 86.5 | Confident | 67 Ų | 67 | 84.8 Ų | 84.8 | 55% | 0.554 | 46% | 0.459 | S | S | * | . | trans | -65.1 | 97.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | T245 | T245-A249 WeakPolarHBondContact O-CB 3.38Å; T245-A249 PolarHBondContact O-N 3.29Å | ||
| 250 | T | 72.4 | Confident | 86.2 | Confident | 130 Ų | 130 | 84.2 Ų | 84.2 | 80% | 0.798 | 46% | 0.458 | S | S | * | . | P | Polyproline II helix | trans | -70.2 | 129.9 | 170.7 | 53.7 | 0 | 0 | 0 | 0 | 108.8 | L248 | L248-T250 PolarHBondContact O-N 3.35Š|
| 251 | N | 76.9 | Confident | 85.8 | Confident | 113 Ų | 113 | 86.4 Ų | 86.4 | 60% | 0.604 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -56.5 | 142.4 | 173.1 | -67 | -53.2 | 0 | 0 | 0 | 110 | ||
| 252 | P | 86.2 | Confident | 85.4 | Confident | 76 Ų | 76 | 85.5 Ų | 85.5 | 49% | 0.494 | 47% | 0.471 | S | S | . | . | P | Polyproline II helix | trans | -60.4 | 156.3 | 178.8 | 24 | -32.4 | 0 | 0 | 0 | 111.6 | Y254 Y264 | P252-Y254 VanDerWaalsContact C-N 3.25Å; P252-Y254 PolarHBondContact O-N 3.08Å; P252-Y264 WeakPolarHBondContact O-CE1 3.25Å; P252-Y264 VanDerWaalsContact O-CZ 3.29Å; P252-Y264 PolarHBondContact O-OH 2.97Å |
| 253 | P | 87.9 | Confident | 85.2 | Confident | 45 Ų | 45 | 84.5 Ų | 84.5 | 29% | 0.292 | 47% | 0.47 | S | S | . | . | S | Bend | trans | -73 | -15 | -177.6 | 24.2 | -29.8 | 0 | 0 | 0 | 114.3 | Y287 L295 | P253-Y287 HydrophobicContact CB-CE2 3.75Å; P253-Y287 WeakPolarHBondContact CB-OH 3.24Å; P253-L295 HydrophobicContact CG-CD1 4.17Å |
| 254 | Y | 92.4 | Very high | 85.2 | Confident | 28 Ų | 28 | 81.5 Ų | 81.5 | 11% | 0.11 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 170.3 | -179.6 | 64.4 | -90.2 | 0 | 0 | 0 | 112 | P252 F278 L295 I299 D302 | P252-Y254 VanDerWaalsContact C-N 3.25Å; P252-Y254 PolarHBondContact O-N 3.08Å; Y254-F278 CarbonylContact C-O 3.59Å; Y254-F278 WeakPolarHBondContact CA-O 3.45Å; Y254-L295 HydrophobicContact CD1-CD1 3.82Å; Y254-L295 HydrophobicContact CD1-CG 4.37Å; Y254-L295 HydrophobicContact CE1-CD1 3.66Å; Y254-L295 HydrophobicContact CE1-CG 4.5Å; Y254-I299 HydrophobicContact CD1-CD1 3.96Å; Y254-I299 HydrophobicContact CD1-CG1 3.74Å; Y254-I299 HydrophobicContact CD2-CD1 4.29Å; Y254-I299 HydrophobicContact CD2-CG1 3.74Å; Y254-I299 HydrophobicContact CE1-CD1 4.29Å; Y254-I299 HydrophobicContact CE1-CG1 3.6Å; Y254-I299 HydrophobicContact CE2-CB 4.38Å; Y254-I299 HydrophobicContact CE2-CG1 3.61Å; Y254-I299 HydrophobicContact CG-CD1 3.97Å; Y254-I299 HydrophobicContact CG-CG1 3.82Å; Y254-D302 PolarHBondContact OH-OD2 3.14Å |
| 255 | S | 94 | Very high | 85.3 | Confident | 11 Ų | 11 | 80.4 Ų | 80.4 | 8% | 0.077 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.6 | 138.4 | 168.2 | 174 | 0 | 0 | 0 | 0 | 109.9 | F257 F278 | S255-F257 WeakPolarHBondContact CB-O 3.5Å; S255-F257 PolarHBondContact O-N 3.12Å; S255-F257 PolarHBondContact OG-N 3.04Å; S255-F257 PolarHBondContact OG-O 3.32Å; S255-F278 PolarHBondContact N-O 3.22Å; S255-F278 PolarHBondContact O-N 3.43Å |
| 256 | L | 92.7 | Very high | 85.5 | Confident | 31 Ų | 31 | 79.5 Ų | 79.5 | 16% | 0.162 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -69.5 | -15.1 | 173.6 | -64.4 | 176 | 0 | 0 | 0 | 112.8 | V275 I299 Y303 | L256-V275 HydrophobicContact CD2-CG1 4.31Å; L256-I299 HydrophobicContact CD2-CG2 3.92Å; L256-Y303 HydrophobicContact CD1-CD2 4.43Å; L256-Y303 HydrophobicContact CD2-CD2 4.36Å |
| 257 | F | 91.6 | Very high | 86.1 | Confident | 98 Ų | 98 | 76.6 Ų | 76.6 | 43% | 0.43 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -123.9 | 150.7 | -179.4 | -51.1 | -77.6 | 0 | 0 | 0 | 110.9 | S255 K259 Y306 | S255-F257 WeakPolarHBondContact CB-O 3.5Å; S255-F257 PolarHBondContact O-N 3.12Å; S255-F257 PolarHBondContact OG-N 3.04Å; S255-F257 PolarHBondContact OG-O 3.32Å; F257-K259 PolarHBondContact O-N 2.98Å; F257-Y306 HydrophobicContact CE1-CE1 4.36Å; F257-Y306 HydrophobicContact CE2-CE2 4.27Å; F257-Y306 HydrophobicContact CZ-CD1 4.36Å; F257-Y306 HydrophobicContact CZ-CD2 4.22Å; F257-Y306 AromaticContact CZ-CE1 3.82Å; F257-Y306 HydrophobicContact CZ-CE1 3.82Å; F257-Y306 AromaticContact CZ-CE2 3.65Å; F257-Y306 HydrophobicContact CZ-CE2 3.65Å; F257-Y306 AromaticContact CZ-CZ 3.44Å; F257-Y306 VanDerWaalsContact CZ-CZ 3.44Å |
| 258 | Y | 91.9 | Very high | 86.7 | Confident | 139 Ų | 139 | 73.1 Ų | 73.1 | 55% | 0.545 | 41% | 0.411 | S | S | . | . | trans | -60.8 | 123.8 | 174.2 | 178.7 | -101.1 | 0 | 0 | 0 | 110.6 | T265 F278 | Y258-T265 HydrophobicContact CE2-CG2 4.46Å; Y258-F278 AromaticContact CD2-CD1 3.9Å; Y258-F278 HydrophobicContact CD2-CD1 3.9Å; Y258-F278 AromaticContact CD2-CE1 3.86Å; Y258-F278 HydrophobicContact CD2-CE1 3.86Å; Y258-F278 HydrophobicContact CG-CE1 4.35Å; Y258-F278 VanDerWaalsContact N-CD2 3.29Å; Y258-F278 VanDerWaalsContact N-CE2 3.31Å | ||
| 259 | K | 88.8 | Confident | 87.6 | Confident | 94 Ų | 94 | 72.8 Ų | 72.8 | 41% | 0.409 | 41% | 0.406 | S | S | . | . | B | Isolated β-bridge | trans | -140.1 | 91.9 | 178.5 | -68.1 | -176.1 | -177.5 | 179.6 | 0 | 109.9 | F257 T261 L262 Y264 | F257-K259 PolarHBondContact O-N 2.98Å; K259-T261 VanDerWaalsContact C-N 3.26Å; K259-T261 PolarHBondContact O-N 3.22Å; K259-L262 HydrophobicContact CB-CD1 4.48Å; K259-L262 HydrophobicContact CD-CD1 3.81Å; K259-L262 PolarHBondContact O-N 2.91Å; K259-Y264 HydrophobicContact CB-CD2 4.14Å; K259-Y264 PolarHBondContact O-N 2.85Å |
| 260 | S | 84.8 | Confident | 88.6 | Confident | 72 Ų | 72 | 69.7 Ų | 69.7 | 50% | 0.503 | 38% | 0.38 | S | S | . | . | G | 310 helix | trans | -62.4 | -32.2 | 179.2 | 57.5 | 0 | 0 | 0 | 0 | 113.3 | L262 G263 | S260-L262 PolarHBondContact O-N 3.43Å; S260-G263 PolarHBondContact O-N 2.87Å |
| 261 | T | 85.3 | Confident | 89.4 | Confident | 128 Ų | 128 | 69.9 Ų | 69.9 | 79% | 0.785 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -64 | -26.8 | -179.4 | 53.1 | 0 | 0 | 0 | 0 | 113.5 | K259 | K259-T261 VanDerWaalsContact C-N 3.26Å; K259-T261 PolarHBondContact O-N 3.22Å |
| 262 | L | 83.3 | Confident | 89.8 | Confident | 72 Ų | 72 | 70.5 Ų | 70.5 | 38% | 0.377 | 38% | 0.375 | S | S | . | . | G | 310 helix | trans | -101.7 | 2.9 | -180 | -62.2 | 175.9 | 0 | 0 | 0 | 112.6 | K259 S260 Y264 | K259-L262 HydrophobicContact CB-CD1 4.48Å; K259-L262 HydrophobicContact CD-CD1 3.81Å; K259-L262 PolarHBondContact O-N 2.91Å; S260-L262 PolarHBondContact O-N 3.43Å; L262-Y264 VanDerWaalsContact C-N 3.31Å; L262-Y264 HydrophobicContact CB-CD2 3.6Å; L262-Y264 HydrophobicContact CB-CE2 3.43Å; L262-Y264 VanDerWaalsContact CB-CE2 3.43Å; L262-Y264 HydrophobicContact CB-CG 4.49Å; L262-Y264 HydrophobicContact CD1-CD2 4.22Å; L262-Y264 HydrophobicContact CD1-CE2 3.67Å; L262-Y264 HydrophobicContact CG-CE2 4.19Å; L262-Y264 PolarHBondContact O-N 3.35Å |
| 263 | G | 84.7 | Confident | 89.9 | Confident | 33 Ų | 33 | 69.3 Ų | 69.3 | 34% | 0.34 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 78.8 | 6.8 | -179 | 0 | 0 | 0 | 0 | 0 | 115.1 | S260 T265 | S260-G263 PolarHBondContact O-N 2.87Å; G263-T265 VanDerWaalsContact C-N 3.35Å; G263-T265 PolarHBondContact O-N 3.5Å |
| 264 | Y | 90.4 | Very high | 90 | Very high | 7 Ų | 7 | 73.8 Ų | 73.8 | 3% | 0.027 | 38% | 0.381 | C | S | . | . | B | Isolated β-bridge | trans | -80 | 81 | 174.9 | -52.3 | -56.2 | 0 | 0 | 0 | 110.8 | P252 K259 L262 V279 | P252-Y264 WeakPolarHBondContact O-CE1 3.25Å; P252-Y264 VanDerWaalsContact O-CZ 3.29Å; P252-Y264 PolarHBondContact O-OH 2.97Å; K259-Y264 HydrophobicContact CB-CD2 4.14Å; K259-Y264 PolarHBondContact O-N 2.85Å; L262-Y264 VanDerWaalsContact C-N 3.31Å; L262-Y264 HydrophobicContact CB-CD2 3.6Å; L262-Y264 HydrophobicContact CB-CE2 3.43Å; L262-Y264 VanDerWaalsContact CB-CE2 3.43Å; L262-Y264 HydrophobicContact CB-CG 4.49Å; L262-Y264 HydrophobicContact CD1-CD2 4.22Å; L262-Y264 HydrophobicContact CD1-CE2 3.67Å; L262-Y264 HydrophobicContact CG-CE2 4.19Å; L262-Y264 PolarHBondContact O-N 3.35Å; Y264-V279 WeakPolarHBondContact CA-O 3.27Å |
| 265 | T | 90.9 | Very high | 90 | Very high | 60 Ų | 60 | 72.6 Ų | 72.6 | 37% | 0.368 | 38% | 0.377 | S | S | . | . | trans | -106.3 | -22.3 | -176.7 | 56.2 | 0 | 0 | 0 | 0 | 113.6 | Y258 G263 V279 | Y258-T265 HydrophobicContact CE2-CG2 4.46Å; G263-T265 VanDerWaalsContact C-N 3.35Å; G263-T265 PolarHBondContact O-N 3.5Å; T265-V279 PolarHBondContact N-O 2.84Å | ||
| 266 | I | 91.5 | Very high | 90 | Very high | 62 Ų | 62 | 74.8 Ų | 74.8 | 32% | 0.318 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90 | 117.2 | -174.2 | -57.6 | -178.7 | 0 | 0 | 0 | 108.6 | R268 F278 V279 K281 | I266-R268 HydrophobicContact CG2-CG 4.33Å; I266-F278 CarbonylContact O-C 3.59Å; I266-F278 VanDerWaalsContact O-CA 3.29Å; I266-F278 WeakPolarHBondContact O-CA 3.36Å; I266-V279 HydrophobicContact CB-CG2 3.95Å; I266-V279 HydrophobicContact CG2-CG2 4.19Å; I266-V279 PolarHBondContact N-O 3.3Å; I266-V279 VanDerWaalsContact N-O 3.14Å; I266-V279 PolarHBondContact O-N 3.46Å; I266-K281 HydrophobicContact CD1-CB 4.46Å; I266-K281 HydrophobicContact CD1-CG 4.22Å |
| 267 | S | 93.9 | Very high | 90.1 | Very high | 71 Ų | 71 | 73.3 Ų | 73.3 | 50% | 0.497 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.8 | 134.2 | 174.8 | -169.5 | 0 | 0 | 0 | 0 | 110.4 | ||
| 268 | R | 92.8 | Very high | 90.3 | Very high | 68 Ų | 68 | 70.3 Ų | 70.3 | 26% | 0.257 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.9 | 164.6 | 174.7 | -63.9 | -170.9 | 72.9 | 138.8 | 2.2 | 109.8 | I266 P276 Y277 V279 D284 | I266-R268 HydrophobicContact CG2-CG 4.33Å; R268-P276 CarbonylContact O-C 3.54Å; R268-P276 VanDerWaalsContact O-CA 3.31Å; R268-P276 WeakPolarHBondContact O-CA 3.35Å; R268-Y277 HydrophobicContact CB-CD1 4.21Å; R268-Y277 HydrophobicContact CB-CD2 4.37Å; R268-Y277 HydrophobicContact CB-CE1 3.71Å; R268-Y277 HydrophobicContact CB-CE2 3.88Å; R268-Y277 PolarHBondContact N-O 2.77Å; R268-Y277 WeakPolarHBondContact O-CD1 3.35Å; R268-Y277 PolarHBondContact O-N 2.93Å; R268-V279 HydrophobicContact CG-CG2 4.2Å; R268-D284 IonicContact CZ-OD1 3.76Å; R268-D284 IonicContact NH1-OD1 2.65Å; R268-D284 PolarHBondContact NH1-OD1 2.91Å |
| 269 | E | 94.6 | Very high | 90.4 | Very high | 123 Ų | 123 | 63.8 Ų | 63.8 | 58% | 0.575 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 144.3 | 177.2 | -67.3 | 177.9 | -179.2 | 0 | 0 | 110 | V275 | E269-V275 WeakPolarHBondContact CA-O 3.05Å |
| 270 | T | 93.7 | Very high | 90.6 | Very high | 3 Ų | 3 | 62.1 Ų | 62.1 | 2% | 0.018 | 34% | 0.34 | C | S | . | . | trans | -74.5 | 152.2 | 177.2 | 67.3 | 0 | 0 | 0 | 0 | 111.2 | N272 Q274 V275 Y277 E296 I299 E300 | T270-N272 PolarHBondContact O-N 3.43Å; T270-Q274 VanDerWaalsContact O-CA 3.24Å; T270-Q274 WeakPolarHBondContact O-CA 3.37Å; T270-Q274 PolarHBondContact O-N 2.87Å; T270-Q274 PolarHBondContact OG1-N 3.43Å; T270-V275 HydrophobicContact CG2-CB 4.1Å; T270-V275 PolarHBondContact N-O 3.43Å; T270-V275 VanDerWaalsContact N-O 3.15Å; T270-V275 PolarHBondContact OG1-N 2.86Å; T270-Y277 HydrophobicContact CG2-CD1 3.85Å; T270-Y277 HydrophobicContact CG2-CE1 3.79Å; T270-E296 HydrophobicContact CG2-CB 4.17Å; T270-E296 HydrophobicContact CG2-CG 4.17Å; T270-I299 HydrophobicContact CG2-CB 4.28Å; T270-I299 HydrophobicContact CG2-CG2 3.86Å; T270-E300 WeakPolarHBondContact CB-OE1 3.49Å; T270-E300 HydrophobicContact CG2-CG 3.99Å; T270-E300 PolarHBondContact OG1-OE1 2.93Å | ||
| 271 | Q | 88.8 | Confident | 90.8 | Very high | 133 Ų | 133 | 66.4 Ų | 66.4 | 62% | 0.621 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -34.3 | -174.8 | -71.2 | 169.3 | 25.6 | 0 | 0 | 114.3 | E296 | Q271-E296 VanDerWaalsContact CG-OE2 3.27Å; Q271-E296 WeakPolarHBondContact CG-OE2 3.47Å; Q271-E296 PolarHBondContact N-OE2 2.92Å; Q271-E296 VanDerWaalsContact N-OE2 3.15Å |
| 272 | N | 86.1 | Confident | 90.9 | Very high | 126 Ų | 126 | 64.9 Ų | 64.9 | 67% | 0.674 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.6 | -53.7 | -168 | -177.6 | 38.5 | 0 | 0 | 0 | 111.8 | T270 E300 | T270-N272 PolarHBondContact O-N 3.43Å; N272-E300 WeakPolarHBondContact CB-OE1 3.28Å; N272-E300 PolarHBondContact N-OE1 3.39Å; N272-E300 PolarHBondContact ND2-OE2 3.04Å |
| 273 | L | 87.3 | Confident | 91.3 | Very high | 52 Ų | 52 | 61.5 Ų | 61.5 | 27% | 0.272 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 0.4 | -179.2 | -65.3 | 179.3 | 0 | 0 | 0 | 114.4 | V275 E300 I304 L351 | L273-V275 HydrophobicContact CB-CG2 3.73Å; L273-V275 PolarHBondContact O-N 3.42Å; L273-E300 HydrophobicContact CB-CG 4.09Å; L273-E300 HydrophobicContact CD1-CB 3.99Å; L273-E300 HydrophobicContact CD1-CG 4.02Å; L273-E300 HydrophobicContact CG-CG 4.26Å; L273-E300 PolarHBondContact N-OE1 3.28Å; L273-I304 HydrophobicContact CD1-CD1 4.04Å; L273-I304 HydrophobicContact CD1-CG1 4.49Å; L273-L351 HydrophobicContact CD2-CD2 4.33Å |
| 274 | Q | 91.2 | Very high | 91.5 | Very high | 138 Ų | 138 | 63.5 Ų | 63.5 | 65% | 0.645 | 32% | 0.322 | S | S | * | . | trans | 51.3 | 39.5 | -178.2 | -63.3 | 178.9 | -20.6 | 0 | 0 | 112.4 | T270 P276 | T270-Q274 VanDerWaalsContact O-CA 3.24Å; T270-Q274 WeakPolarHBondContact O-CA 3.37Å; T270-Q274 PolarHBondContact O-N 2.87Å; T270-Q274 PolarHBondContact OG1-N 3.43Å; Q274-P276 WeakPolarHBondContact O-CD 3.42Å | ||
| 275 | V | 92.9 | Very high | 91.4 | Very high | 3 Ų | 3 | 70.6 Ų | 70.6 | 2% | 0.018 | 35% | 0.353 | C | S | . | . | trans | -77.5 | 124.1 | -178.7 | 175.2 | 0 | 0 | 0 | 0 | 108.8 | L256 E269 T270 L273 Y277 I299 E300 Y303 | L256-V275 HydrophobicContact CD2-CG1 4.31Å; E269-V275 WeakPolarHBondContact CA-O 3.05Å; T270-V275 HydrophobicContact CG2-CB 4.1Å; T270-V275 PolarHBondContact N-O 3.43Å; T270-V275 VanDerWaalsContact N-O 3.15Å; T270-V275 PolarHBondContact OG1-N 2.86Å; L273-V275 HydrophobicContact CB-CG2 3.73Å; L273-V275 PolarHBondContact O-N 3.42Å; V275-Y277 WeakPolarHBondContact O-CD1 3.36Å; V275-Y277 PolarHBondContact O-N 3.37Å; V275-I299 HydrophobicContact CG1-CG2 4.48Å; V275-E300 HydrophobicContact CG2-CG 4.42Å; V275-Y303 HydrophobicContact CB-CD1 4.34Å; V275-Y303 HydrophobicContact CB-CG 4.31Å; V275-Y303 HydrophobicContact CG1-CD1 3.88Å; V275-Y303 HydrophobicContact CG1-CD2 3.5Å; V275-Y303 VanDerWaalsContact CG1-CD2 3.5Å; V275-Y303 HydrophobicContact CG1-CE1 4.35Å; V275-Y303 HydrophobicContact CG1-CE2 4.01Å; V275-Y303 HydrophobicContact CG1-CG 3.41Å; V275-Y303 VanDerWaalsContact CG1-CG 3.41Å; V275-Y303 HydrophobicContact CG2-CD1 3.46Å; V275-Y303 VanDerWaalsContact CG2-CD1 3.46Å; V275-Y303 HydrophobicContact CG2-CE1 3.88Å; V275-Y303 HydrophobicContact CG2-CG 3.86Å | ||
| 276 | P | 93.9 | Very high | 91.2 | Very high | 57 Ų | 57 | 71 Ų | 71 | 37% | 0.37 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 129.6 | 176.4 | 28.8 | -33.6 | 0 | 0 | 0 | 110.8 | R268 Q274 | R268-P276 CarbonylContact O-C 3.54Å; R268-P276 VanDerWaalsContact O-CA 3.31Å; R268-P276 WeakPolarHBondContact O-CA 3.35Å; Q274-P276 WeakPolarHBondContact O-CD 3.42Å |
| 277 | Y | 94.7 | Very high | 91 | Very high | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 155.5 | 175.5 | 68.4 | -83.2 | 0 | 0 | 0 | 111.2 | R268 T270 V275 V279 F283 E296 I299 | R268-Y277 HydrophobicContact CB-CD1 4.21Å; R268-Y277 HydrophobicContact CB-CD2 4.37Å; R268-Y277 HydrophobicContact CB-CE1 3.71Å; R268-Y277 HydrophobicContact CB-CE2 3.88Å; R268-Y277 PolarHBondContact N-O 2.77Å; R268-Y277 WeakPolarHBondContact O-CD1 3.35Å; R268-Y277 PolarHBondContact O-N 2.93Å; T270-Y277 HydrophobicContact CG2-CD1 3.85Å; T270-Y277 HydrophobicContact CG2-CE1 3.79Å; V275-Y277 WeakPolarHBondContact O-CD1 3.36Å; V275-Y277 PolarHBondContact O-N 3.37Å; Y277-V279 HydrophobicContact CD2-CG1 3.5Å; Y277-V279 HydrophobicContact CE2-CG1 3.42Å; Y277-V279 VanDerWaalsContact CE2-CG1 3.42Å; Y277-F283 HydrophobicContact CE2-CE1 4.41Å; Y277-F283 HydrophobicContact CE2-CZ 4.05Å; Y277-E296 PolarHBondContact OH-OE1 3.36Å; Y277-I299 HydrophobicContact CD1-CD1 4.23Å; Y277-I299 HydrophobicContact CD1-CG2 4.25Å; Y277-I299 HydrophobicContact CD2-CD1 3.71Å; Y277-I299 HydrophobicContact CE1-CD1 4.3Å; Y277-I299 HydrophobicContact CE2-CD1 3.8Å; Y277-I299 HydrophobicContact CG-CD1 3.95Å; Y277-I299 HydrophobicContact CG-CG2 4.23Å |
| 278 | F | 95.1 | Very high | 90.9 | Very high | 36 Ų | 36 | 75.9 Ų | 75.9 | 16% | 0.158 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 133.5 | -175.2 | -61.5 | -92.7 | 0 | 0 | 0 | 110.8 | Y254 S255 Y258 I266 | Y254-F278 CarbonylContact C-O 3.59Å; Y254-F278 WeakPolarHBondContact CA-O 3.45Å; S255-F278 PolarHBondContact N-O 3.22Å; S255-F278 PolarHBondContact O-N 3.43Å; Y258-F278 AromaticContact CD2-CD1 3.9Å; Y258-F278 HydrophobicContact CD2-CD1 3.9Å; Y258-F278 AromaticContact CD2-CE1 3.86Å; Y258-F278 HydrophobicContact CD2-CE1 3.86Å; Y258-F278 HydrophobicContact CG-CE1 4.35Å; Y258-F278 VanDerWaalsContact N-CD2 3.29Å; Y258-F278 VanDerWaalsContact N-CE2 3.31Å; I266-F278 CarbonylContact O-C 3.59Å; I266-F278 VanDerWaalsContact O-CA 3.29Å; I266-F278 WeakPolarHBondContact O-CA 3.36Å |
| 279 | V | 94.4 | Very high | 90.8 | Very high | 1 Ų | 1 | 75.5 Ų | 75.5 | 1% | 0.006 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 166 | -176.8 | -59.1 | 0 | 0 | 0 | 0 | 112 | Y264 T265 I266 R268 Y277 F283 | Y264-V279 WeakPolarHBondContact CA-O 3.27Å; T265-V279 PolarHBondContact N-O 2.84Å; I266-V279 HydrophobicContact CB-CG2 3.95Å; I266-V279 HydrophobicContact CG2-CG2 4.19Å; I266-V279 PolarHBondContact N-O 3.3Å; I266-V279 VanDerWaalsContact N-O 3.14Å; I266-V279 PolarHBondContact O-N 3.46Å; R268-V279 HydrophobicContact CG-CG2 4.2Å; Y277-V279 HydrophobicContact CD2-CG1 3.5Å; Y277-V279 HydrophobicContact CE2-CG1 3.42Å; Y277-V279 VanDerWaalsContact CE2-CG1 3.42Å; V279-F283 HydrophobicContact CB-CB 3.79Å; V279-F283 HydrophobicContact CB-CD1 4.21Å; V279-F283 HydrophobicContact CB-CD2 3.65Å; V279-F283 HydrophobicContact CB-CE2 4.24Å; V279-F283 HydrophobicContact CB-CG 3.62Å; V279-F283 HydrophobicContact CG1-CD1 4.15Å; V279-F283 HydrophobicContact CG1-CD2 3.52Å; V279-F283 HydrophobicContact CG1-CE1 4.2Å; V279-F283 HydrophobicContact CG1-CE2 3.58Å; V279-F283 HydrophobicContact CG1-CG 3.8Å; V279-F283 HydrophobicContact CG1-CZ 3.92Å; V279-F283 HydrophobicContact CG2-CB 3.75Å; V279-F283 HydrophobicContact CG2-CD1 3.95Å; V279-F283 HydrophobicContact CG2-CD2 4.29Å; V279-F283 HydrophobicContact CG2-CG 3.74Å |
| 280 | D | 91.6 | Very high | 90.7 | Very high | 59 Ų | 59 | 73.1 Ų | 73.1 | 32% | 0.316 | 39% | 0.386 | S | S | . | . | trans | -77.6 | 174.6 | 175.1 | 82.1 | -8.5 | 0 | 0 | 0 | 112 | N282 F283 | D280-N282 VanDerWaalsContact C-N 3.26Å; D280-N282 PolarHBondContact O-N 2.93Å; D280-N282 PolarHBondContact OD1-N 3.45Å; D280-F283 WeakPolarHBondContact O-CB 3.37Å; D280-F283 WeakPolarHBondContact OD1-CA 3.48Å; D280-F283 WeakPolarHBondContact OD1-CB 3.36Å; D280-F283 PolarHBondContact OD1-N 3.33Å | ||
| 281 | K | 89.7 | Confident | 90.6 | Very high | 163 Ų | 163 | 75.5 Ų | 75.5 | 71% | 0.709 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | -16.5 | 179.6 | -61.1 | -179.3 | -178.6 | 178.8 | 0 | 113.8 | I266 | I266-K281 HydrophobicContact CD1-CB 4.46Å; I266-K281 HydrophobicContact CD1-CG 4.22Å |
| 282 | N | 87.9 | Confident | 90.8 | Very high | 95 Ų | 95 | 70.1 Ų | 70.1 | 51% | 0.508 | 38% | 0.378 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | -2.9 | -176.5 | -70.3 | -34.9 | 0 | 0 | 0 | 112.8 | D280 D284 K285 A286 | D280-N282 VanDerWaalsContact C-N 3.26Å; D280-N282 PolarHBondContact O-N 2.93Å; D280-N282 PolarHBondContact OD1-N 3.45Å; N282-D284 VanDerWaalsContact C-N 3.32Å; N282-D284 PolarHBondContact O-N 2.97Å; N282-K285 WeakPolarHBondContact O-CB 3.41Å; N282-K285 PolarHBondContact O-N 3.5Å; N282-A286 PolarHBondContact O-N 3.02Å |
| 283 | F | 90.5 | Very high | 91.2 | Very high | 2 Ų | 2 | 69 Ų | 69 | 1% | 0.009 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -53.1 | -45.8 | -175.9 | -175.6 | -95.9 | 0 | 0 | 0 | 113.2 | Y277 V279 D280 K285 A286 Y287 L292 L295 | Y277-F283 HydrophobicContact CE2-CE1 4.41Å; Y277-F283 HydrophobicContact CE2-CZ 4.05Å; V279-F283 HydrophobicContact CB-CB 3.79Å; V279-F283 HydrophobicContact CB-CD1 4.21Å; V279-F283 HydrophobicContact CB-CD2 3.65Å; V279-F283 HydrophobicContact CB-CE2 4.24Å; V279-F283 HydrophobicContact CB-CG 3.62Å; V279-F283 HydrophobicContact CG1-CD1 4.15Å; V279-F283 HydrophobicContact CG1-CD2 3.52Å; V279-F283 HydrophobicContact CG1-CE1 4.2Å; V279-F283 HydrophobicContact CG1-CE2 3.58Å; V279-F283 HydrophobicContact CG1-CG 3.8Å; V279-F283 HydrophobicContact CG1-CZ 3.92Å; V279-F283 HydrophobicContact CG2-CB 3.75Å; V279-F283 HydrophobicContact CG2-CD1 3.95Å; V279-F283 HydrophobicContact CG2-CD2 4.29Å; V279-F283 HydrophobicContact CG2-CG 3.74Å; D280-F283 WeakPolarHBondContact O-CB 3.37Å; D280-F283 WeakPolarHBondContact OD1-CA 3.48Å; D280-F283 WeakPolarHBondContact OD1-CB 3.36Å; D280-F283 PolarHBondContact OD1-N 3.33Å; F283-K285 PolarHBondContact O-N 3.27Å; F283-K285 VanDerWaalsContact O-N 3.1Å; F283-A286 PolarHBondContact O-N 3.46Å; F283-Y287 AromaticContact CD2-CD2 3.71Å; F283-Y287 HydrophobicContact CD2-CD2 3.71Å; F283-Y287 HydrophobicContact CD2-CE2 4.28Å; F283-Y287 AromaticContact CE2-CD2 3.57Å; F283-Y287 HydrophobicContact CE2-CD2 3.57Å; F283-Y287 HydrophobicContact CE2-CE2 4.17Å; F283-Y287 HydrophobicContact CE2-CG 4.11Å; F283-Y287 HydrophobicContact CG-CD2 4.42Å; F283-Y287 HydrophobicContact CZ-CD2 4.19Å; F283-Y287 HydrophobicContact CZ-CG 4.31Å; F283-Y287 PolarHBondContact O-N 3.41Å; F283-L292 HydrophobicContact CE1-CD1 3.68Å; F283-L292 HydrophobicContact CZ-CD1 3.8Å; F283-L295 HydrophobicContact CE2-CD2 3.47Å; F283-L295 VanDerWaalsContact CE2-CD2 3.47Å; F283-L295 HydrophobicContact CZ-CD2 3.59Å |
| 284 | D | 89.1 | Confident | 91.4 | Very high | 75 Ų | 75 | 71.2 Ų | 71.2 | 40% | 0.401 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.8 | -23.5 | 179.5 | -72.2 | -52.5 | 0 | 0 | 0 | 113.2 | R268 N282 R288 | R268-D284 IonicContact CZ-OD1 3.76Å; R268-D284 IonicContact NH1-OD1 2.65Å; R268-D284 PolarHBondContact NH1-OD1 2.91Å; N282-D284 VanDerWaalsContact C-N 3.32Å; N282-D284 PolarHBondContact O-N 2.97Å; D284-R288 WeakPolarHBondContact O-CG 3.38Å; D284-R288 PolarHBondContact O-NE 2.98Å; D284-R288 PolarHBondContact O-NH2 3.39Å |
| 285 | K | 88.3 | Confident | 91.5 | Very high | 156 Ų | 156 | 65.5 Ų | 65.5 | 68% | 0.678 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -83.7 | -30 | 176.5 | -62.4 | 177.5 | -178.1 | 172 | 0 | 111.9 | N282 F283 | N282-K285 WeakPolarHBondContact O-CB 3.41Å; N282-K285 PolarHBondContact O-N 3.5Å; F283-K285 PolarHBondContact O-N 3.27Å; F283-K285 VanDerWaalsContact O-N 3.1Å |
| 286 | A | 86.4 | Confident | 91.6 | Very high | 69 Ų | 69 | 65.7 Ų | 65.7 | 57% | 0.57 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -88 | -36.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | N282 F283 | N282-A286 PolarHBondContact O-N 3.02Å; F283-A286 PolarHBondContact O-N 3.46Å |
| 287 | Y | 89.2 | Confident | 91.6 | Very high | 71 Ų | 71 | 69.6 Ų | 69.6 | 28% | 0.278 | 37% | 0.366 | S | S | . | . | trans | -123.9 | 117.9 | -174.8 | -62.4 | -83.9 | 0 | 0 | 0 | 111 | P253 F283 L295 | P253-Y287 HydrophobicContact CB-CE2 3.75Å; P253-Y287 WeakPolarHBondContact CB-OH 3.24Å; F283-Y287 AromaticContact CD2-CD2 3.71Å; F283-Y287 HydrophobicContact CD2-CD2 3.71Å; F283-Y287 HydrophobicContact CD2-CE2 4.28Å; F283-Y287 AromaticContact CE2-CD2 3.57Å; F283-Y287 HydrophobicContact CE2-CD2 3.57Å; F283-Y287 HydrophobicContact CE2-CE2 4.17Å; F283-Y287 HydrophobicContact CE2-CG 4.11Å; F283-Y287 HydrophobicContact CG-CD2 4.42Å; F283-Y287 HydrophobicContact CZ-CD2 4.19Å; F283-Y287 HydrophobicContact CZ-CG 4.31Å; F283-Y287 PolarHBondContact O-N 3.41Å; Y287-L295 HydrophobicContact CD1-CB 4.38Å; Y287-L295 HydrophobicContact CD1-CD2 3.75Å; Y287-L295 HydrophobicContact CD2-CD2 4.1Å; Y287-L295 HydrophobicContact CE1-CD2 3.91Å; Y287-L295 HydrophobicContact CE2-CD2 4.25Å; Y287-L295 HydrophobicContact CG-CD2 3.85Å | ||
| 288 | R | 91.1 | Very high | 91.6 | Very high | 163 Ų | 163 | 72.8 Ų | 72.8 | 62% | 0.615 | 39% | 0.385 | S | S | * | . | trans | -148.4 | 145.1 | 179 | -68.2 | -170.6 | 178.5 | 123.1 | 2.9 | 111.2 | D284 A290 S291 | D284-R288 WeakPolarHBondContact O-CG 3.38Å; D284-R288 PolarHBondContact O-NE 2.98Å; D284-R288 PolarHBondContact O-NH2 3.39Å; R288-A290 PolarHBondContact O-N 3.36Å; R288-S291 PolarHBondContact N-OG 3.38Å; R288-S291 PolarHBondContact O-N 3.31Å; R288-S291 PolarHBondContact O-OG 3Å; R288-S291 VanDerWaalsContact O-OG 3.1Å | ||
| 289 | G | 91.2 | Very high | 91.6 | Very high | 60 Ų | 60 | 71 Ų | 71 | 62% | 0.619 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.7 | -122.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S291 L292 H293 | G289-S291 PolarHBondContact O-N 3.04Å; G289-L292 WeakPolarHBondContact O-CB 3.4Å; G289-L292 PolarHBondContact O-N 3.31Å; G289-H293 PolarHBondContact O-N 3.49Å; G289-H293 VanDerWaalsContact O-N 3.16Å |
| 290 | A | 91.8 | Very high | 91.6 | Very high | 74 Ų | 74 | 72 Ų | 72 | 61% | 0.612 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -61.3 | -40.8 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R288 L292 H293 D294 | R288-A290 PolarHBondContact O-N 3.36Å; A290-L292 VanDerWaalsContact C-N 3.26Å; A290-L292 PolarHBondContact O-N 3.25Å; A290-H293 WeakPolarHBondContact O-CB 3.33Å; A290-H293 PolarHBondContact O-N 2.9Å; A290-H293 VanDerWaalsContact O-N 3.13Å; A290-D294 PolarHBondContact O-N 3.44Å |
| 291 | S | 91.1 | Very high | 91.7 | Very high | 53 Ų | 53 | 75.4 Ų | 75.4 | 37% | 0.371 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -67.9 | -27.8 | 179.6 | 63.4 | 0 | 0 | 0 | 0 | 113 | R288 G289 L295 | R288-S291 PolarHBondContact N-OG 3.38Å; R288-S291 PolarHBondContact O-N 3.31Å; R288-S291 PolarHBondContact O-OG 3Å; R288-S291 VanDerWaalsContact O-OG 3.1Å; G289-S291 PolarHBondContact O-N 3.04Å; S291-L295 WeakPolarHBondContact O-CB 3.36Å; S291-L295 PolarHBondContact O-N 3.1Å |
| 292 | L | 93.1 | Very high | 91.9 | Very high | 19 Ų | 19 | 70.7 Ų | 70.7 | 10% | 0.099 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -70.6 | -42.5 | 172 | 179.1 | 64.4 | 0 | 0 | 0 | 110.6 | F283 G289 A290 L295 E296 | F283-L292 HydrophobicContact CE1-CD1 3.68Å; F283-L292 HydrophobicContact CZ-CD1 3.8Å; G289-L292 WeakPolarHBondContact O-CB 3.4Å; G289-L292 PolarHBondContact O-N 3.31Å; A290-L292 VanDerWaalsContact C-N 3.26Å; A290-L292 PolarHBondContact O-N 3.25Å; L292-L295 PolarHBondContact O-N 2.89Å; L292-E296 HydrophobicContact CD1-CG 4.26Å; L292-E296 HydrophobicContact CG-CG 4.42Å; L292-E296 WeakPolarHBondContact O-CB 3.43Å; L292-E296 WeakPolarHBondContact O-CG 3.44Å; L292-E296 PolarHBondContact O-N 3.33Å |
| 293 | H | 93.8 | Very high | 92.2 | Very high | 103 Ų | 103 | 68.3 Ų | 68.3 | 48% | 0.477 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 178.5 | -175 | 70.2 | 0 | 0 | 0 | 112.2 | G289 A290 L295 E296 K297 | G289-H293 PolarHBondContact O-N 3.49Å; G289-H293 VanDerWaalsContact O-N 3.16Å; A290-H293 WeakPolarHBondContact O-CB 3.33Å; A290-H293 PolarHBondContact O-N 2.9Å; A290-H293 VanDerWaalsContact O-N 3.13Å; H293-L295 VanDerWaalsContact C-N 3.31Å; H293-L295 PolarHBondContact O-N 3.1Å; H293-E296 PolarHBondContact O-N 3.42Å; H293-K297 WeakPolarHBondContact O-CB 3.46Å; H293-K297 PolarHBondContact O-N 3.13Å |
| 294 | D | 93.1 | Very high | 92.4 | Very high | 99 Ų | 99 | 70.4 Ų | 70.4 | 53% | 0.529 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.8 | -37.7 | 176.6 | -70.1 | -27.9 | 0 | 0 | 0 | 112.2 | A290 T298 | A290-D294 PolarHBondContact O-N 3.44Å; D294-T298 PolarHBondContact O-N 3.32Å; D294-T298 PolarHBondContact O-OG1 3.09Å |
| 295 | L | 93.3 | Very high | 92.6 | Very high | 17 Ų | 17 | 70.2 Ų | 70.2 | 9% | 0.089 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -67.4 | -46.6 | 175.1 | -176 | 65.7 | 0 | 0 | 0 | 111.5 | P253 Y254 F283 Y287 S291 L292 H293 K297 T298 I299 | P253-L295 HydrophobicContact CG-CD1 4.17Å; Y254-L295 HydrophobicContact CD1-CD1 3.82Å; Y254-L295 HydrophobicContact CD1-CG 4.37Å; Y254-L295 HydrophobicContact CE1-CD1 3.66Å; Y254-L295 HydrophobicContact CE1-CG 4.5Å; F283-L295 HydrophobicContact CE2-CD2 3.47Å; F283-L295 VanDerWaalsContact CE2-CD2 3.47Å; F283-L295 HydrophobicContact CZ-CD2 3.59Å; Y287-L295 HydrophobicContact CD1-CB 4.38Å; Y287-L295 HydrophobicContact CD1-CD2 3.75Å; Y287-L295 HydrophobicContact CD2-CD2 4.1Å; Y287-L295 HydrophobicContact CE1-CD2 3.91Å; Y287-L295 HydrophobicContact CE2-CD2 4.25Å; Y287-L295 HydrophobicContact CG-CD2 3.85Å; S291-L295 WeakPolarHBondContact O-CB 3.36Å; S291-L295 PolarHBondContact O-N 3.1Å; L292-L295 PolarHBondContact O-N 2.89Å; H293-L295 VanDerWaalsContact C-N 3.31Å; H293-L295 PolarHBondContact O-N 3.1Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 3.21Å; L295-T298 CarbonylContact O-C 3.57Å; L295-T298 WeakPolarHBondContact O-CA 3.45Å; L295-T298 WeakPolarHBondContact O-CB 3.47Å; L295-T298 PolarHBondContact O-N 3.05Å; L295-I299 HydrophobicContact CD2-CD1 4.49Å; L295-I299 HydrophobicContact CG-CD1 3.99Å; L295-I299 HydrophobicContact CG-CG1 4.48Å; L295-I299 WeakPolarHBondContact O-CG1 3.48Å; L295-I299 PolarHBondContact O-N 2.79Å |
| 296 | E | 94.8 | Very high | 92.9 | Very high | 8 Ų | 8 | 66.7 Ų | 66.7 | 4% | 0.037 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.1 | -39.3 | 177 | -75.3 | -177.9 | -179.6 | 0 | 0 | 111.8 | T270 Q271 Y277 L292 H293 T298 I299 E300 | T270-E296 HydrophobicContact CG2-CB 4.17Å; T270-E296 HydrophobicContact CG2-CG 4.17Å; Q271-E296 VanDerWaalsContact CG-OE2 3.27Å; Q271-E296 WeakPolarHBondContact CG-OE2 3.47Å; Q271-E296 PolarHBondContact N-OE2 2.92Å; Q271-E296 VanDerWaalsContact N-OE2 3.15Å; Y277-E296 PolarHBondContact OH-OE1 3.36Å; L292-E296 HydrophobicContact CD1-CG 4.26Å; L292-E296 HydrophobicContact CG-CG 4.42Å; L292-E296 WeakPolarHBondContact O-CB 3.43Å; L292-E296 WeakPolarHBondContact O-CG 3.44Å; L292-E296 PolarHBondContact O-N 3.33Å; H293-E296 PolarHBondContact O-N 3.42Å; E296-T298 VanDerWaalsContact C-N 3.26Å; E296-T298 PolarHBondContact O-N 3.39Å; E296-I299 WeakPolarHBondContact O-CB 3.34Å; E296-I299 PolarHBondContact O-N 2.94Å; E296-E300 WeakPolarHBondContact O-CB 3.33Å; E296-E300 VanDerWaalsContact O-CG 3.32Å; E296-E300 WeakPolarHBondContact O-CG 3.33Å; E296-E300 PolarHBondContact O-N 3.48Å |
| 297 | K | 94 | Very high | 93.3 | Very high | 139 Ų | 139 | 63.4 Ų | 63.4 | 60% | 0.604 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -60.5 | -37.5 | 172.9 | -174.3 | 177.9 | -177.9 | 178.2 | 0 | 112.4 | H293 L295 K301 | H293-K297 WeakPolarHBondContact O-CB 3.46Å; H293-K297 PolarHBondContact O-N 3.13Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 3.21Å; K297-K301 PolarHBondContact O-N 2.71Å; K297-K301 VanDerWaalsContact O-N 3.13Å |
| 298 | T | 94.2 | Very high | 93.6 | Very high | 66 Ų | 66 | 64.4 Ų | 64.4 | 41% | 0.405 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -69.5 | -43.9 | 175.6 | -53.2 | 0 | 0 | 0 | 0 | 110.8 | D294 L295 E296 E300 K301 D302 | D294-T298 PolarHBondContact O-N 3.32Å; D294-T298 PolarHBondContact O-OG1 3.09Å; L295-T298 CarbonylContact O-C 3.57Å; L295-T298 WeakPolarHBondContact O-CA 3.45Å; L295-T298 WeakPolarHBondContact O-CB 3.47Å; L295-T298 PolarHBondContact O-N 3.05Å; E296-T298 VanDerWaalsContact C-N 3.26Å; E296-T298 PolarHBondContact O-N 3.39Å; T298-E300 VanDerWaalsContact C-N 3.33Å; T298-E300 PolarHBondContact O-N 3.45Å; T298-K301 WeakPolarHBondContact O-CB 3.32Å; T298-K301 PolarHBondContact O-N 2.9Å; T298-D302 PolarHBondContact O-N 3.38Å |
| 299 | I | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 175.3 | -67.4 | 165.1 | 0 | 0 | 0 | 110.9 | Y254 L256 T270 V275 Y277 L295 E296 K301 D302 Y303 | Y254-I299 HydrophobicContact CD1-CD1 3.96Å; Y254-I299 HydrophobicContact CD1-CG1 3.74Å; Y254-I299 HydrophobicContact CD2-CD1 4.29Å; Y254-I299 HydrophobicContact CD2-CG1 3.74Å; Y254-I299 HydrophobicContact CE1-CD1 4.29Å; Y254-I299 HydrophobicContact CE1-CG1 3.6Å; Y254-I299 HydrophobicContact CE2-CB 4.38Å; Y254-I299 HydrophobicContact CE2-CG1 3.61Å; Y254-I299 HydrophobicContact CG-CD1 3.97Å; Y254-I299 HydrophobicContact CG-CG1 3.82Å; L256-I299 HydrophobicContact CD2-CG2 3.92Å; T270-I299 HydrophobicContact CG2-CB 4.28Å; T270-I299 HydrophobicContact CG2-CG2 3.86Å; V275-I299 HydrophobicContact CG1-CG2 4.48Å; Y277-I299 HydrophobicContact CD1-CD1 4.23Å; Y277-I299 HydrophobicContact CD1-CG2 4.25Å; Y277-I299 HydrophobicContact CD2-CD1 3.71Å; Y277-I299 HydrophobicContact CE1-CD1 4.3Å; Y277-I299 HydrophobicContact CE2-CD1 3.8Å; Y277-I299 HydrophobicContact CG-CD1 3.95Å; Y277-I299 HydrophobicContact CG-CG2 4.23Å; L295-I299 HydrophobicContact CD2-CD1 4.49Å; L295-I299 HydrophobicContact CG-CD1 3.99Å; L295-I299 HydrophobicContact CG-CG1 4.48Å; L295-I299 WeakPolarHBondContact O-CG1 3.48Å; L295-I299 PolarHBondContact O-N 2.79Å; E296-I299 WeakPolarHBondContact O-CB 3.34Å; E296-I299 PolarHBondContact O-N 2.94Å; I299-K301 VanDerWaalsContact C-N 3.34Å; I299-K301 PolarHBondContact O-N 3Å; I299-D302 PolarHBondContact O-N 3.32Å; I299-Y303 WeakPolarHBondContact O-CB 3.32Å; I299-Y303 PolarHBondContact O-N 2.93Å |
| 300 | E | 94 | Very high | 94.1 | Very high | 20 Ų | 20 | 57.9 Ų | 57.9 | 9% | 0.093 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 178.3 | -76.7 | -177 | 177 | 0 | 0 | 112 | T270 N272 L273 V275 E296 T298 Y303 I304 | T270-E300 WeakPolarHBondContact CB-OE1 3.49Å; T270-E300 HydrophobicContact CG2-CG 3.99Å; T270-E300 PolarHBondContact OG1-OE1 2.93Å; N272-E300 WeakPolarHBondContact CB-OE1 3.28Å; N272-E300 PolarHBondContact N-OE1 3.39Å; N272-E300 PolarHBondContact ND2-OE2 3.04Å; L273-E300 HydrophobicContact CB-CG 4.09Å; L273-E300 HydrophobicContact CD1-CB 3.99Å; L273-E300 HydrophobicContact CD1-CG 4.02Å; L273-E300 HydrophobicContact CG-CG 4.26Å; L273-E300 PolarHBondContact N-OE1 3.28Å; V275-E300 HydrophobicContact CG2-CG 4.42Å; E296-E300 WeakPolarHBondContact O-CB 3.33Å; E296-E300 VanDerWaalsContact O-CG 3.32Å; E296-E300 WeakPolarHBondContact O-CG 3.33Å; E296-E300 PolarHBondContact O-N 3.48Å; T298-E300 VanDerWaalsContact C-N 3.33Å; T298-E300 PolarHBondContact O-N 3.45Å; E300-Y303 PolarHBondContact O-N 3.17Å; E300-I304 WeakPolarHBondContact O-CD1 3.27Å; E300-I304 VanDerWaalsContact O-CG1 3.27Å; E300-I304 WeakPolarHBondContact O-CG1 3.49Å; E300-I304 PolarHBondContact O-N 3.01Å |
| 301 | K | 93.7 | Very high | 94.3 | Very high | 132 Ų | 132 | 55.2 Ų | 55.2 | 57% | 0.574 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62 | -50.9 | 174.8 | -178.6 | 179.4 | 174.8 | 175.5 | 0 | 111.4 | K297 T298 I299 Y303 I304 D305 | K297-K301 PolarHBondContact O-N 2.71Å; K297-K301 VanDerWaalsContact O-N 3.13Å; T298-K301 WeakPolarHBondContact O-CB 3.32Å; T298-K301 PolarHBondContact O-N 2.9Å; I299-K301 VanDerWaalsContact C-N 3.34Å; I299-K301 PolarHBondContact O-N 3Å; K301-Y303 PolarHBondContact O-N 3.43Å; K301-I304 WeakPolarHBondContact O-CB 3.21Å; K301-I304 PolarHBondContact O-N 2.86Å; K301-I304 VanDerWaalsContact O-N 3.12Å; K301-D305 PolarHBondContact O-N 3.39Å |
| 302 | D | 94.7 | Very high | 94.6 | Very high | 63 Ų | 63 | 60.6 Ų | 60.6 | 34% | 0.337 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.4 | -37.2 | 179.5 | -74 | -0.3 | 0 | 0 | 0 | 111.8 | Y254 T298 I299 D305 Y306 | Y254-D302 PolarHBondContact OH-OD2 3.14Å; T298-D302 PolarHBondContact O-N 3.38Å; I299-D302 PolarHBondContact O-N 3.32Å; D302-D305 PolarHBondContact O-N 3.01Å; D302-Y306 VanDerWaalsContact O-CB 3.32Å; D302-Y306 WeakPolarHBondContact O-CB 3.2Å; D302-Y306 PolarHBondContact O-N 3.21Å |
| 303 | Y | 94.6 | Very high | 94.8 | Very high | 45 Ų | 45 | 65.3 Ų | 65.3 | 18% | 0.176 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65 | -43 | 175.7 | -178.7 | -104.8 | 0 | 0 | 0 | 112.1 | L256 V275 I299 E300 K301 Y306 I307 L351 | L256-Y303 HydrophobicContact CD1-CD2 4.43Å; L256-Y303 HydrophobicContact CD2-CD2 4.36Å; V275-Y303 HydrophobicContact CB-CD1 4.34Å; V275-Y303 HydrophobicContact CB-CG 4.31Å; V275-Y303 HydrophobicContact CG1-CD1 3.88Å; V275-Y303 HydrophobicContact CG1-CD2 3.5Å; V275-Y303 VanDerWaalsContact CG1-CD2 3.5Å; V275-Y303 HydrophobicContact CG1-CE1 4.35Å; V275-Y303 HydrophobicContact CG1-CE2 4.01Å; V275-Y303 HydrophobicContact CG1-CG 3.41Å; V275-Y303 VanDerWaalsContact CG1-CG 3.41Å; V275-Y303 HydrophobicContact CG2-CD1 3.46Å; V275-Y303 VanDerWaalsContact CG2-CD1 3.46Å; V275-Y303 HydrophobicContact CG2-CE1 3.88Å; V275-Y303 HydrophobicContact CG2-CG 3.86Å; I299-Y303 WeakPolarHBondContact O-CB 3.32Å; I299-Y303 PolarHBondContact O-N 2.93Å; E300-Y303 PolarHBondContact O-N 3.17Å; K301-Y303 PolarHBondContact O-N 3.43Å; Y303-Y306 WeakPolarHBondContact O-CB 3.39Å; Y303-Y306 PolarHBondContact O-N 3.41Å; Y303-I307 HydrophobicContact CD1-CG1 4.22Å; Y303-I307 HydrophobicContact CD2-CG1 4.4Å; Y303-I307 HydrophobicContact CE1-CD1 4.48Å; Y303-I307 HydrophobicContact CE1-CG1 3.83Å; Y303-I307 HydrophobicContact CE2-CD1 4.15Å; Y303-I307 HydrophobicContact CE2-CG1 4.03Å; Y303-I307 HydrophobicContact CG-CG1 4.5Å; Y303-I307 WeakPolarHBondContact O-CB 3.29Å; Y303-I307 VanDerWaalsContact O-CG1 3.29Å; Y303-I307 WeakPolarHBondContact O-CG1 3.49Å; Y303-I307 PolarHBondContact O-N 2.84Å; Y303-L351 HydrophobicContact CD1-CD1 4.44Å; Y303-L351 HydrophobicContact CE1-CD1 4.07Å |
| 304 | I | 93.3 | Very high | 94.9 | Very high | 47 Ų | 47 | 61.6 Ų | 61.6 | 24% | 0.241 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.8 | -47.1 | 175.2 | -68.7 | 163.5 | 0 | 0 | 0 | 110.1 | L273 E300 K301 Y306 I307 Q308 | L273-I304 HydrophobicContact CD1-CD1 4.04Å; L273-I304 HydrophobicContact CD1-CG1 4.49Å; E300-I304 WeakPolarHBondContact O-CD1 3.27Å; E300-I304 VanDerWaalsContact O-CG1 3.27Å; E300-I304 WeakPolarHBondContact O-CG1 3.49Å; E300-I304 PolarHBondContact O-N 3.01Å; K301-I304 WeakPolarHBondContact O-CB 3.21Å; K301-I304 PolarHBondContact O-N 2.86Å; K301-I304 VanDerWaalsContact O-N 3.12Å; I304-Y306 VanDerWaalsContact C-N 3.31Å; I304-Y306 PolarHBondContact O-N 2.95Å; I304-I307 PolarHBondContact O-N 3.13Å; I304-Q308 HydrophobicContact CG2-CG 4.37Å; I304-Q308 WeakPolarHBondContact O-CB 3.25Å; I304-Q308 VanDerWaalsContact O-CG 3.32Å; I304-Q308 WeakPolarHBondContact O-CG 3.45Å; I304-Q308 PolarHBondContact O-N 3.21Å |
| 305 | D | 94.1 | Very high | 95 | Very high | 70 Ų | 70 | 63.5 Ų | 63.5 | 37% | 0.374 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.8 | -39.6 | 179.5 | -69.6 | -12.9 | 0 | 0 | 0 | 111.3 | K301 D302 Q308 T309 | K301-D305 PolarHBondContact O-N 3.39Å; D302-D305 PolarHBondContact O-N 3.01Å; D305-Q308 PolarHBondContact O-N 3.36Å; D305-T309 WeakPolarHBondContact O-CB 3.36Å; D305-T309 PolarHBondContact O-N 2.57Å; D305-T309 PolarHBondContact O-OG1 2.93Å |
| 306 | Y | 95.2 | Very high | 95.2 | Very high | 82 Ų | 82 | 66.3 Ų | 66.3 | 32% | 0.322 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.6 | -48.3 | 172.8 | 166.4 | -102.4 | 0 | 0 | 0 | 112.1 | F257 D302 Y303 I304 T309 S310 | F257-Y306 HydrophobicContact CE1-CE1 4.36Å; F257-Y306 HydrophobicContact CE2-CE2 4.27Å; F257-Y306 HydrophobicContact CZ-CD1 4.36Å; F257-Y306 HydrophobicContact CZ-CD2 4.22Å; F257-Y306 AromaticContact CZ-CE1 3.82Å; F257-Y306 HydrophobicContact CZ-CE1 3.82Å; F257-Y306 AromaticContact CZ-CE2 3.65Å; F257-Y306 HydrophobicContact CZ-CE2 3.65Å; F257-Y306 AromaticContact CZ-CZ 3.44Å; F257-Y306 VanDerWaalsContact CZ-CZ 3.44Å; D302-Y306 VanDerWaalsContact O-CB 3.32Å; D302-Y306 WeakPolarHBondContact O-CB 3.2Å; D302-Y306 PolarHBondContact O-N 3.21Å; Y303-Y306 WeakPolarHBondContact O-CB 3.39Å; Y303-Y306 PolarHBondContact O-N 3.41Å; I304-Y306 VanDerWaalsContact C-N 3.31Å; I304-Y306 PolarHBondContact O-N 2.95Å; Y306-T309 PolarHBondContact O-N 3.37Å; Y306-S310 WeakPolarHBondContact CE2-OG 3.26Å; Y306-S310 VanDerWaalsContact O-CB 3.25Å; Y306-S310 WeakPolarHBondContact O-CB 3.42Å; Y306-S310 PolarHBondContact O-N 3.37Å; Y306-S310 PolarHBondContact O-OG 3.35Å |
| 307 | I | 94.8 | Very high | 95.2 | Very high | 1 Ų | 1 | 70.9 Ų | 70.9 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -66.7 | -39.4 | -179.1 | -69.3 | -65.1 | 0 | 0 | 0 | 110.9 | Y303 I304 S310 C311 N344 K347 L348 L351 | Y303-I307 HydrophobicContact CD1-CG1 4.22Å; Y303-I307 HydrophobicContact CD2-CG1 4.4Å; Y303-I307 HydrophobicContact CE1-CD1 4.48Å; Y303-I307 HydrophobicContact CE1-CG1 3.83Å; Y303-I307 HydrophobicContact CE2-CD1 4.15Å; Y303-I307 HydrophobicContact CE2-CG1 4.03Å; Y303-I307 HydrophobicContact CG-CG1 4.5Å; Y303-I307 WeakPolarHBondContact O-CB 3.29Å; Y303-I307 VanDerWaalsContact O-CG1 3.29Å; Y303-I307 WeakPolarHBondContact O-CG1 3.49Å; Y303-I307 PolarHBondContact O-N 2.84Å; I304-I307 PolarHBondContact O-N 3.13Å; I307-S310 PolarHBondContact O-N 2.9Å; I307-C311 VanDerWaalsContact O-CB 3.28Å; I307-C311 WeakPolarHBondContact O-CB 3.32Å; I307-C311 PolarHBondContact O-N 2.7Å; I307-N344 WeakPolarHBondContact CG2-O 3.41Å; I307-K347 HydrophobicContact CD1-CD 4.2Å; I307-K347 HydrophobicContact CG2-CB 4.33Å; I307-L348 HydrophobicContact CG2-CB 3.72Å; I307-L348 HydrophobicContact CG2-CD1 4.12Å; I307-L348 HydrophobicContact CG2-CG 4.46Å; I307-L351 HydrophobicContact CG2-CD1 4.48Å |
| 308 | Q | 94.5 | Very high | 95.3 | Very high | 92 Ų | 92 | 67.2 Ų | 67.2 | 43% | 0.43 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.4 | -50.8 | 174.2 | -74.9 | 180 | 8.9 | 0 | 0 | 111.8 | I304 D305 S310 C311 W312 L348 | I304-Q308 HydrophobicContact CG2-CG 4.37Å; I304-Q308 WeakPolarHBondContact O-CB 3.25Å; I304-Q308 VanDerWaalsContact O-CG 3.32Å; I304-Q308 WeakPolarHBondContact O-CG 3.45Å; I304-Q308 PolarHBondContact O-N 3.21Å; D305-Q308 PolarHBondContact O-N 3.36Å; Q308-S310 VanDerWaalsContact C-N 3.31Å; Q308-S310 PolarHBondContact O-N 2.71Å; Q308-C311 PolarHBondContact O-N 3.44Å; Q308-W312 PolarHBondContact O-N 2.89Å; Q308-L348 HydrophobicContact CG-CD1 3.57Å; Q308-L348 HydrophobicContact CG-CD2 4.08Å |
| 309 | T | 96.3 | Very high | 95.4 | Very high | 71 Ų | 71 | 66.4 Ų | 66.4 | 44% | 0.436 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63 | -40.3 | 179.4 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | D305 Y306 W312 K313 | D305-T309 WeakPolarHBondContact O-CB 3.36Å; D305-T309 PolarHBondContact O-N 2.57Å; D305-T309 PolarHBondContact O-OG1 2.93Å; Y306-T309 PolarHBondContact O-N 3.37Å; T309-W312 PolarHBondContact O-N 3.49Å; T309-K313 WeakPolarHBondContact O-CG 3.32Å; T309-K313 PolarHBondContact O-N 3.42Å |
| 310 | S | 96.3 | Very high | 95.5 | Very high | 15 Ų | 15 | 70.9 Ų | 70.9 | 11% | 0.105 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -68.4 | -42.8 | 178.9 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | Y306 I307 Q308 W312 K313 E314 | Y306-S310 WeakPolarHBondContact CE2-OG 3.26Å; Y306-S310 VanDerWaalsContact O-CB 3.25Å; Y306-S310 WeakPolarHBondContact O-CB 3.42Å; Y306-S310 PolarHBondContact O-N 3.37Å; Y306-S310 PolarHBondContact O-OG 3.35Å; I307-S310 PolarHBondContact O-N 2.9Å; Q308-S310 VanDerWaalsContact C-N 3.31Å; Q308-S310 PolarHBondContact O-N 2.71Å; S310-W312 VanDerWaalsContact C-N 3.32Å; S310-W312 PolarHBondContact O-N 2.75Å; S310-K313 WeakPolarHBondContact O-CB 3.45Å; S310-K313 PolarHBondContact O-N 3.37Å; S310-E314 WeakPolarHBondContact O-CG 3.24Å; S310-E314 PolarHBondContact O-N 3.2Å |
| 311 | C | 97.1 | Very high | 95.5 | Very high | 18 Ų | 18 | 71.1 Ų | 71.1 | 12% | 0.122 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -60.2 | -42.5 | 172.6 | 169.8 | 0 | 0 | 0 | 0 | 111.8 | I307 Q308 K313 E314 K315 C345 L348 | I307-C311 VanDerWaalsContact O-CB 3.28Å; I307-C311 WeakPolarHBondContact O-CB 3.32Å; I307-C311 PolarHBondContact O-N 2.7Å; Q308-C311 PolarHBondContact O-N 3.44Å; C311-K313 VanDerWaalsContact C-N 3.32Å; C311-K313 PolarHBondContact O-N 3.03Å; C311-E314 PolarHBondContact O-N 3.31Å; C311-K315 WeakPolarHBondContact O-CB 3.46Å; C311-K315 PolarHBondContact O-N 3.15Å; C311-C345 WeakPolarHBondContact CA-SG 3.36Å; C311-C345 HydrophobicContact CB-CB 3.95Å; C311-C345 WeakPolarHBondContact CB-SG 3.22Å; C311-C345 PolarHBondContact O-SG 3.25Å; C311-C345 VanDerWaalsContact O-SG 3.33Å; C311-C345 WeakPolarHBondContact SG-CA 3.43Å; C311-C345 WeakPolarHBondContact SG-CB 3.37Å; C311-C345 CovalentContact SG-SG 2.04Å; C311-C345 PolarHBondContact SG-SG 3.36Å; C311-L348 HydrophobicContact CB-CD2 4.19Å |
| 312 | W | 96.4 | Very high | 95.6 | Very high | 166 Ų | 166 | 68.2 Ų | 68.2 | 63% | 0.629 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -59.4 | -44.1 | 176 | -177.4 | 85.3 | 0 | 0 | 0 | 111.5 | Q308 T309 S310 K315 Q316 | Q308-W312 PolarHBondContact O-N 2.89Å; T309-W312 PolarHBondContact O-N 3.49Å; S310-W312 VanDerWaalsContact C-N 3.32Å; S310-W312 PolarHBondContact O-N 2.75Å; W312-K315 PolarHBondContact O-N 3.26Å; W312-Q316 WeakPolarHBondContact O-CB 3.49Å; W312-Q316 PolarHBondContact O-N 3.37Å |
| 313 | K | 97.1 | Very high | 95.7 | Very high | 117 Ų | 117 | 70.2 Ų | 70.2 | 51% | 0.509 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 175.3 | -71.8 | 174.2 | -179.6 | 177.3 | 0 | 112.7 | T309 S310 C311 K315 Q316 Q317 | T309-K313 WeakPolarHBondContact O-CG 3.32Å; T309-K313 PolarHBondContact O-N 3.42Å; S310-K313 WeakPolarHBondContact O-CB 3.45Å; S310-K313 PolarHBondContact O-N 3.37Å; C311-K313 VanDerWaalsContact C-N 3.32Å; C311-K313 PolarHBondContact O-N 3.03Å; K313-K315 VanDerWaalsContact C-N 3.35Å; K313-K315 PolarHBondContact O-N 3.33Å; K313-Q316 PolarHBondContact O-N 3.31Å; K313-Q317 WeakPolarHBondContact O-CG 3.33Å; K313-Q317 PolarHBondContact O-N 3.46Å |
| 314 | E | 96.2 | Very high | 95.8 | Very high | 26 Ų | 26 | 71.7 Ų | 71.7 | 12% | 0.121 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 177 | -72.5 | 177.2 | 174 | 0 | 0 | 111.6 | S310 C311 Q316 Q317 K318 L342 E343 N344 C345 | S310-E314 WeakPolarHBondContact O-CG 3.24Å; S310-E314 PolarHBondContact O-N 3.2Å; C311-E314 PolarHBondContact O-N 3.31Å; E314-Q316 VanDerWaalsContact C-N 3.33Å; E314-Q316 PolarHBondContact O-N 3.42Å; E314-Q317 PolarHBondContact O-N 2.83Å; E314-K318 PolarHBondContact O-N 3.37Å; E314-L342 HydrophobicContact CB-CD2 3.61Å; E314-L342 VanDerWaalsContact OE2-CA 3.27Å; E314-L342 WeakPolarHBondContact OE2-CA 3.5Å; E314-E343 PolarHBondContact OE2-N 3.42Å; E314-N344 WeakPolarHBondContact OE1-CB 3.29Å; E314-N344 PolarHBondContact OE1-N 3.45Å; E314-N344 PolarHBondContact OE1-ND2 3.1Å; E314-N344 PolarHBondContact OE2-N 2.82Å; E314-N344 VanDerWaalsContact OE2-N 3.09Å; E314-C345 PolarHBondContact OE2-N 3.21Å |
| 315 | K | 95.9 | Very high | 95.9 | Very high | 138 Ų | 138 | 69.8 Ų | 69.8 | 60% | 0.6 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -63.6 | -41.4 | 177.1 | -173 | 179.8 | 180 | -177.3 | 0 | 111.4 | C311 W312 K313 K318 S319 | C311-K315 WeakPolarHBondContact O-CB 3.46Å; C311-K315 PolarHBondContact O-N 3.15Å; W312-K315 PolarHBondContact O-N 3.26Å; K313-K315 VanDerWaalsContact C-N 3.35Å; K313-K315 PolarHBondContact O-N 3.33Å; K315-K318 PolarHBondContact O-N 2.85Å; K315-S319 WeakPolarHBondContact O-CB 3.36Å; K315-S319 PolarHBondContact O-N 2.88Å |
| 316 | Q | 96.5 | Very high | 95.9 | Very high | 76 Ų | 76 | 69.2 Ų | 69.2 | 36% | 0.355 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.8 | -49.1 | 176.6 | -176.2 | 62.1 | 20.4 | 0 | 0 | 110.9 | W312 K313 E314 K318 S319 E320 | W312-Q316 WeakPolarHBondContact O-CB 3.49Å; W312-Q316 PolarHBondContact O-N 3.37Å; K313-Q316 PolarHBondContact O-N 3.31Å; E314-Q316 VanDerWaalsContact C-N 3.33Å; E314-Q316 PolarHBondContact O-N 3.42Å; Q316-K318 VanDerWaalsContact C-N 3.32Å; Q316-K318 PolarHBondContact O-N 2.91Å; Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 VanDerWaalsContact O-N 3.15Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.34Å; Q316-E320 PolarHBondContact NE2-OE1 3.26Å; Q316-E320 WeakPolarHBondContact O-CG 3.46Å; Q316-E320 PolarHBondContact O-N 3.2Å |
| 317 | Q | 96 | Very high | 96 | Very high | 104 Ų | 104 | 71.4 Ų | 71.4 | 49% | 0.486 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -58.1 | -43.1 | 176.5 | -74.3 | 178.6 | -17.6 | 0 | 0 | 112.4 | K313 E314 E320 L321 L340 | K313-Q317 WeakPolarHBondContact O-CG 3.33Å; K313-Q317 PolarHBondContact O-N 3.46Å; E314-Q317 PolarHBondContact O-N 2.83Å; Q317-E320 PolarHBondContact O-N 3.39Å; Q317-L321 WeakPolarHBondContact O-CG 3.27Å; Q317-L321 PolarHBondContact O-N 3.48Å; Q317-L340 HydrophobicContact CB-CD1 4.45Å |
| 318 | K | 96.2 | Very high | 96 | Very high | 62 Ų | 62 | 79 Ų | 79 | 27% | 0.27 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.5 | -47.8 | 175.4 | -173.9 | 165.1 | -177.5 | 151.9 | 0 | 111.4 | E314 K315 Q316 E320 L321 T322 A337 L340 L342 | E314-K318 PolarHBondContact O-N 3.37Å; K315-K318 PolarHBondContact O-N 2.85Å; Q316-K318 VanDerWaalsContact C-N 3.32Å; Q316-K318 PolarHBondContact O-N 2.91Å; K318-E320 VanDerWaalsContact C-N 3.34Å; K318-E320 PolarHBondContact O-N 2.81Å; K318-L321 PolarHBondContact O-N 3.11Å; K318-T322 PolarHBondContact O-N 2.74Å; K318-T322 PolarHBondContact O-OG1 3.29Å; K318-A337 WeakPolarHBondContact CE-O 3.46Å; K318-L340 HydrophobicContact CB-CD2 4.31Å; K318-L340 PolarHBondContact NZ-O 2.98Å; K318-L342 HydrophobicContact CB-CD2 4.38Å; K318-L342 HydrophobicContact CD-CD1 4.25Å; K318-L342 HydrophobicContact CD-CD2 4.21Å; K318-L342 HydrophobicContact CD-CG 4.36Å |
| 319 | S | 95.4 | Very high | 96 | Very high | 50 Ų | 50 | 85.7 Ų | 85.7 | 35% | 0.35 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 179.3 | -170.8 | 0 | 0 | 0 | 0 | 112.1 | K315 Q316 T322 N323 | K315-S319 WeakPolarHBondContact O-CB 3.36Å; K315-S319 PolarHBondContact O-N 2.88Å; Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 VanDerWaalsContact O-N 3.15Å; S319-T322 PolarHBondContact O-N 3.32Å; S319-N323 WeakPolarHBondContact O-CB 3.24Å; S319-N323 PolarHBondContact O-N 3.42Å; S319-N323 PolarHBondContact O-ND2 3.48Å |
| 320 | E | 96.5 | Very high | 96 | Very high | 93 Ų | 93 | 85.3 Ų | 85.3 | 44% | 0.435 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 177 | -75.4 | 172.4 | -174.6 | 0 | 0 | 111.1 | Q316 Q317 K318 T322 N323 L324 | Q316-E320 WeakPolarHBondContact CG-OE1 3.34Å; Q316-E320 PolarHBondContact NE2-OE1 3.26Å; Q316-E320 WeakPolarHBondContact O-CG 3.46Å; Q316-E320 PolarHBondContact O-N 3.2Å; Q317-E320 PolarHBondContact O-N 3.39Å; K318-E320 VanDerWaalsContact C-N 3.34Å; K318-E320 PolarHBondContact O-N 2.81Å; E320-T322 VanDerWaalsContact C-N 3.34Å; E320-T322 PolarHBondContact O-N 3.31Å; E320-N323 PolarHBondContact O-N 3.44Å; E320-L324 WeakPolarHBondContact O-CB 3.46Å; E320-L324 VanDerWaalsContact O-CG 3.24Å; E320-L324 WeakPolarHBondContact O-CG 3.37Å; E320-L324 PolarHBondContact O-N 3.44Å |
| 321 | L | 95.9 | Very high | 96 | Very high | 26 Ų | 26 | 89.3 Ų | 89.3 | 14% | 0.136 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 175.7 | -70.5 | 171.9 | 0 | 0 | 0 | 112.1 | Q317 K318 A325 L333 K336 A337 L340 | Q317-L321 WeakPolarHBondContact O-CG 3.27Å; Q317-L321 PolarHBondContact O-N 3.48Å; K318-L321 PolarHBondContact O-N 3.11Å; L321-A325 VanDerWaalsContact O-CB 3.29Å; L321-A325 WeakPolarHBondContact O-CB 3.12Å; L321-A325 PolarHBondContact O-N 3.3Å; L321-L333 HydrophobicContact CD2-CD2 4.36Å; L321-K336 HydrophobicContact CD1-CD 4.41Å; L321-K336 HydrophobicContact CD1-CG 4.24Å; L321-K336 HydrophobicContact CD2-CD 4.36Å; L321-A337 HydrophobicContact CB-CB 3.73Å; L321-L340 HydrophobicContact CD1-CD1 3.88Å |
| 322 | T | 95.5 | Very high | 95.9 | Very high | 70 Ų | 70 | 98 Ų | 98 | 43% | 0.429 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.1 | -42.9 | 176 | -57.8 | 0 | 0 | 0 | 0 | 111.9 | K318 S319 E320 A325 G326 A337 | K318-T322 PolarHBondContact O-N 2.74Å; K318-T322 PolarHBondContact O-OG1 3.29Å; S319-T322 PolarHBondContact O-N 3.32Å; E320-T322 VanDerWaalsContact C-N 3.34Å; E320-T322 PolarHBondContact O-N 3.31Å; T322-A325 PolarHBondContact O-N 2.81Å; T322-G326 PolarHBondContact O-N 3.3Å; T322-A337 WeakPolarHBondContact OG1-CB 3.46Å |
| 323 | N | 95.6 | Very high | 95.8 | Very high | 106 Ų | 106 | 92.1 Ų | 92.1 | 57% | 0.567 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.3 | -44.3 | 178.4 | -70.9 | -19.8 | 0 | 0 | 0 | 111.4 | S319 E320 G326 L327 | S319-N323 WeakPolarHBondContact O-CB 3.24Å; S319-N323 PolarHBondContact O-N 3.42Å; S319-N323 PolarHBondContact O-ND2 3.48Å; E320-N323 PolarHBondContact O-N 3.44Å; N323-G326 PolarHBondContact O-N 3.34Å; N323-L327 PolarHBondContact O-N 3.24Å |
| 324 | L | 96.7 | Very high | 95.7 | Very high | 75 Ų | 75 | 90.5 Ų | 90.5 | 39% | 0.393 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -63 | -41.8 | 175.4 | -70.6 | 171.4 | 0 | 0 | 0 | 111.5 | E320 G326 L327 Y328 L333 | E320-L324 WeakPolarHBondContact O-CB 3.46Å; E320-L324 VanDerWaalsContact O-CG 3.24Å; E320-L324 WeakPolarHBondContact O-CG 3.37Å; E320-L324 PolarHBondContact O-N 3.44Å; L324-G326 VanDerWaalsContact C-N 3.29Å; L324-G326 PolarHBondContact O-N 3.13Å; L324-L327 PolarHBondContact O-N 3.44Å; L324-Y328 HydrophobicContact CD2-CD2 4.48Å; L324-Y328 HydrophobicContact CD2-CE2 3.98Å; L324-Y328 WeakPolarHBondContact O-CD2 3.22Å; L324-Y328 PolarHBondContact O-N 3.38Å; L324-L333 HydrophobicContact CB-CD1 4.32Å |
| 325 | A | 96.5 | Very high | 95.7 | Very high | 8 Ų | 8 | 94.8 Ų | 94.8 | 7% | 0.066 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -59.8 | -40.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L321 T322 R329 D330 L333 K334 | L321-A325 VanDerWaalsContact O-CB 3.29Å; L321-A325 WeakPolarHBondContact O-CB 3.12Å; L321-A325 PolarHBondContact O-N 3.3Å; T322-A325 PolarHBondContact O-N 2.81Å; A325-R329 WeakPolarHBondContact O-CA 3.34Å; A325-R329 PolarHBondContact O-N 3.16Å; A325-D330 PolarHBondContact O-N 3.19Å; A325-L333 HydrophobicContact CB-CB 3.72Å; A325-K334 HydrophobicContact CB-CB 3.9Å |
| 326 | G | 94.3 | Very high | 95.7 | Very high | 58 Ų | 58 | 94 Ų | 94 | 60% | 0.598 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -66.4 | -40.7 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | T322 N323 L324 | T322-G326 PolarHBondContact O-N 3.3Å; N323-G326 PolarHBondContact O-N 3.34Å; L324-G326 VanDerWaalsContact C-N 3.29Å; L324-G326 PolarHBondContact O-N 3.13Å |
| 327 | L | 96.1 | Very high | 95.6 | Very high | 127 Ų | 127 | 90.5 Ų | 90.5 | 67% | 0.665 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -66 | -46.4 | 180 | -175.7 | 67 | 0 | 0 | 0 | 112.2 | N323 L324 | N323-L327 PolarHBondContact O-N 3.24Å; L324-L327 PolarHBondContact O-N 3.44Å |
| 328 | Y | 95.4 | Very high | 95.5 | Very high | 161 Ų | 161 | 91.2 Ų | 91.2 | 63% | 0.631 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -93.4 | -4.8 | -176.4 | -66.4 | -72.6 | 0 | 0 | 0 | 114 | L324 D330 | L324-Y328 HydrophobicContact CD2-CD2 4.48Å; L324-Y328 HydrophobicContact CD2-CE2 3.98Å; L324-Y328 WeakPolarHBondContact O-CD2 3.22Å; L324-Y328 PolarHBondContact O-N 3.38Å; Y328-D330 PolarHBondContact O-N 3.34Å |
| 329 | R | 94.7 | Very high | 95.5 | Very high | 232 Ų | 232 | 92.2 Ų | 92.2 | 88% | 0.875 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.9 | 35.2 | -172.9 | -57.4 | -177.1 | 178.8 | -175.8 | -0.3 | 112.9 | A325 | A325-R329 WeakPolarHBondContact O-CA 3.34Å; A325-R329 PolarHBondContact O-N 3.16Å |
| 330 | D | 96.1 | Very high | 95.5 | Very high | 63 Ų | 63 | 91.7 Ų | 91.7 | 34% | 0.337 | 45% | 0.446 | S | S | . | . | trans | -93.5 | 112.9 | -179.4 | -173.6 | -5.7 | 0 | 0 | 0 | 110.8 | A325 Y328 R332 L333 K334 | A325-D330 PolarHBondContact O-N 3.19Å; Y328-D330 PolarHBondContact O-N 3.34Å; D330-R332 VanDerWaalsContact C-N 3.25Å; D330-R332 PolarHBondContact O-N 2.84Å; D330-R332 WeakPolarHBondContact OD1-CB 3.3Å; D330-R332 PolarHBondContact OD1-N 3.15Å; D330-L333 HydrophobicContact CB-CB 4.38Å; D330-L333 HydrophobicContact CB-CD1 4.08Å; D330-L333 HydrophobicContact CB-CG 4.24Å; D330-L333 PolarHBondContact O-N 3.31Å; D330-K334 PolarHBondContact O-N 3.2Å | ||
| 331 | E | 94.9 | Very high | 95.3 | Very high | 99 Ų | 99 | 95.3 Ų | 95.3 | 46% | 0.463 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.8 | -26.2 | -179.6 | -161.1 | 62.5 | -152.3 | 0 | 0 | 112.3 | K334 Q335 | E331-K334 WeakPolarHBondContact O-CB 3.42Å; E331-K334 PolarHBondContact O-N 3.15Å; E331-K334 IonicContact OE1-NZ 3.96Å; E331-K334 PolarHBondContact OE1-NZ 3.43Å; E331-K334 IonicContact OE2-NZ 3.57Å; E331-Q335 WeakPolarHBondContact O-CG 3.38Å; E331-Q335 PolarHBondContact O-N 3.28Å |
| 332 | R | 95.4 | Very high | 95.3 | Very high | 200 Ų | 200 | 96.5 Ų | 96.5 | 76% | 0.755 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -68.1 | -41.4 | 178.1 | -64.1 | 179.1 | 174.2 | 177.2 | -0.5 | 111.3 | D330 K334 Q335 K336 | D330-R332 VanDerWaalsContact C-N 3.25Å; D330-R332 PolarHBondContact O-N 2.84Å; D330-R332 WeakPolarHBondContact OD1-CB 3.3Å; D330-R332 PolarHBondContact OD1-N 3.15Å; R332-K334 VanDerWaalsContact C-N 3.31Å; R332-Q335 PolarHBondContact O-N 2.8Å; R332-K336 WeakPolarHBondContact O-CB 3.46Å; R332-K336 PolarHBondContact O-N 2.89Å |
| 333 | L | 94.9 | Very high | 95.2 | Very high | 43 Ų | 43 | 98.4 Ų | 98.4 | 23% | 0.225 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -65.8 | -37.6 | 175.6 | -71.4 | 176.9 | 0 | 0 | 0 | 111.2 | L321 L324 A325 D330 K336 A337 | L321-L333 HydrophobicContact CD2-CD2 4.36Å; L324-L333 HydrophobicContact CB-CD1 4.32Å; A325-L333 HydrophobicContact CB-CB 3.72Å; D330-L333 HydrophobicContact CB-CB 4.38Å; D330-L333 HydrophobicContact CB-CD1 4.08Å; D330-L333 HydrophobicContact CB-CG 4.24Å; D330-L333 PolarHBondContact O-N 3.31Å; L333-K336 WeakPolarHBondContact O-CB 3.41Å; L333-K336 PolarHBondContact O-N 3.07Å; L333-A337 PolarHBondContact O-N 3.41Å |
| 334 | K | 95.2 | Very high | 95.2 | Very high | 84 Ų | 84 | 94.5 Ų | 94.5 | 37% | 0.365 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.2 | -49.3 | 175.3 | -174.3 | 172.5 | 155 | -135.4 | 0 | 111.8 | A325 D330 E331 R332 K336 A337 E338 | A325-K334 HydrophobicContact CB-CB 3.9Å; D330-K334 PolarHBondContact O-N 3.2Å; E331-K334 WeakPolarHBondContact O-CB 3.42Å; E331-K334 PolarHBondContact O-N 3.15Å; E331-K334 IonicContact OE1-NZ 3.96Å; E331-K334 PolarHBondContact OE1-NZ 3.43Å; E331-K334 IonicContact OE2-NZ 3.57Å; R332-K334 VanDerWaalsContact C-N 3.31Å; K334-K336 VanDerWaalsContact C-N 3.28Å; K334-K336 PolarHBondContact O-N 3.49Å; K334-A337 WeakPolarHBondContact O-CB 3.37Å; K334-A337 PolarHBondContact O-N 3.2Å; K334-A337 VanDerWaalsContact O-N 3.1Å; K334-E338 WeakPolarHBondContact CE-OE1 3.47Å; K334-E338 WeakPolarHBondContact O-CG 3.36Å; K334-E338 PolarHBondContact O-N 3.19Å |
| 335 | Q | 96.2 | Very high | 95.1 | Very high | 115 Ų | 115 | 92 Ų | 92 | 54% | 0.537 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60.5 | -37.6 | 174.6 | -71.6 | 176.9 | -1.6 | 0 | 0 | 112.2 | E331 R332 E338 S339 | E331-Q335 WeakPolarHBondContact O-CG 3.38Å; E331-Q335 PolarHBondContact O-N 3.28Å; R332-Q335 PolarHBondContact O-N 2.8Å; Q335-E338 PolarHBondContact O-N 3.08Å; Q335-S339 WeakPolarHBondContact O-CB 3.34Å; Q335-S339 PolarHBondContact O-N 3.46Å; Q335-S339 PolarHBondContact O-OG 2.93Å |
| 336 | K | 95.7 | Very high | 95 | Very high | 123 Ų | 123 | 96.7 Ų | 96.7 | 54% | 0.535 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 173.7 | -170.3 | 179.1 | 178.9 | -179.2 | 0 | 112.1 | L321 R332 L333 K334 S339 L340 | L321-K336 HydrophobicContact CD1-CD 4.41Å; L321-K336 HydrophobicContact CD1-CG 4.24Å; L321-K336 HydrophobicContact CD2-CD 4.36Å; R332-K336 WeakPolarHBondContact O-CB 3.46Å; R332-K336 PolarHBondContact O-N 2.89Å; L333-K336 WeakPolarHBondContact O-CB 3.41Å; L333-K336 PolarHBondContact O-N 3.07Å; K334-K336 VanDerWaalsContact C-N 3.28Å; K334-K336 PolarHBondContact O-N 3.49Å; K336-S339 WeakPolarHBondContact CA-OG 3.34Å; K336-S339 PolarHBondContact O-OG 3.19Å; K336-S339 VanDerWaalsContact O-OG 3.1Å; K336-L340 PolarHBondContact O-N 2.94Å |
| 337 | A | 95.3 | Very high | 95 | Very high | 1 Ų | 1 | 98 Ų | 98 | 1% | 0.008 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -66.1 | -39.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | K318 L321 T322 L333 K334 L340 | K318-A337 WeakPolarHBondContact CE-O 3.46Å; L321-A337 HydrophobicContact CB-CB 3.73Å; T322-A337 WeakPolarHBondContact OG1-CB 3.46Å; L333-A337 PolarHBondContact O-N 3.41Å; K334-A337 WeakPolarHBondContact O-CB 3.37Å; K334-A337 PolarHBondContact O-N 3.2Å; K334-A337 VanDerWaalsContact O-N 3.1Å; A337-L340 PolarHBondContact O-N 3.42Å |
| 338 | E | 93.8 | Very high | 94.8 | Very high | 120 Ų | 120 | 93.2 Ų | 93.2 | 56% | 0.561 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -68.4 | -41.5 | 178.8 | -73.4 | 174.1 | -175.6 | 0 | 0 | 112.2 | K334 Q335 L340 | K334-E338 WeakPolarHBondContact CE-OE1 3.47Å; K334-E338 WeakPolarHBondContact O-CG 3.36Å; K334-E338 PolarHBondContact O-N 3.19Å; Q335-E338 PolarHBondContact O-N 3.08Å; E338-L340 VanDerWaalsContact C-N 3.26Å; E338-L340 PolarHBondContact O-N 2.89Å |
| 339 | S | 95.5 | Very high | 94.6 | Very high | 82 Ų | 82 | 88.8 Ų | 88.8 | 57% | 0.573 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -73.2 | -13.8 | 177.9 | 56.7 | 0 | 0 | 0 | 0 | 114.2 | Q335 K336 K341 | Q335-S339 WeakPolarHBondContact O-CB 3.34Å; Q335-S339 PolarHBondContact O-N 3.46Å; Q335-S339 PolarHBondContact O-OG 2.93Å; K336-S339 WeakPolarHBondContact CA-OG 3.34Å; K336-S339 PolarHBondContact O-OG 3.19Å; K336-S339 VanDerWaalsContact O-OG 3.1Å; S339-K341 PolarHBondContact O-N 3.03Å |
| 340 | L | 94.4 | Very high | 94.5 | Very high | 40 Ų | 40 | 83.4 Ų | 83.4 | 21% | 0.209 | 40% | 0.398 | C | S | . | . | trans | -68 | 107.2 | 176.3 | -160.8 | 150 | 0 | 0 | 0 | 109.9 | Q317 K318 L321 K336 A337 E338 L342 | Q317-L340 HydrophobicContact CB-CD1 4.45Å; K318-L340 HydrophobicContact CB-CD2 4.31Å; K318-L340 PolarHBondContact NZ-O 2.98Å; L321-L340 HydrophobicContact CD1-CD1 3.88Å; K336-L340 PolarHBondContact O-N 2.94Å; A337-L340 PolarHBondContact O-N 3.42Å; E338-L340 VanDerWaalsContact C-N 3.26Å; E338-L340 PolarHBondContact O-N 2.89Å; L340-L342 HydrophobicContact CD2-CD2 3.82Å | ||
| 341 | K | 93.8 | Very high | 94.1 | Very high | 168 Ų | 168 | 82 Ų | 82 | 73% | 0.73 | 39% | 0.39 | S | S | * | . | trans | -77.9 | 133.1 | 175.3 | -65.7 | -176.7 | -179.3 | 179.3 | 0 | 109.8 | S339 E343 | S339-K341 PolarHBondContact O-N 3.03Å; K341-E343 HydrophobicContact CB-CG 4.27Å; K341-E343 PolarHBondContact O-N 3.3Å | ||
| 342 | L | 94.8 | Very high | 93.7 | Very high | 52 Ų | 52 | 81 Ų | 81 | 27% | 0.272 | 39% | 0.388 | S | S | . | . | trans | -96.7 | 67.4 | 179.3 | -57 | 172 | 0 | 0 | 0 | 109.4 | E314 K318 L340 N344 C345 E346 | E314-L342 HydrophobicContact CB-CD2 3.61Å; E314-L342 VanDerWaalsContact OE2-CA 3.27Å; E314-L342 WeakPolarHBondContact OE2-CA 3.5Å; K318-L342 HydrophobicContact CB-CD2 4.38Å; K318-L342 HydrophobicContact CD-CD1 4.25Å; K318-L342 HydrophobicContact CD-CD2 4.21Å; K318-L342 HydrophobicContact CD-CG 4.36Å; L340-L342 HydrophobicContact CD2-CD2 3.82Å; L342-N344 PolarHBondContact O-N 2.5Å; L342-C345 HydrophobicContact CB-CB 3.79Å; L342-C345 PolarHBondContact O-N 2.93Å; L342-E346 PolarHBondContact O-N 2.91Å | ||
| 343 | E | 94.4 | Very high | 93 | Very high | 110 Ų | 110 | 73.6 Ų | 73.6 | 51% | 0.514 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | -172.1 | -63.6 | -173.9 | 177.3 | 0 | 0 | 112.4 | E314 K341 C345 E346 K347 | E314-E343 PolarHBondContact OE2-N 3.42Å; K341-E343 HydrophobicContact CB-CG 4.27Å; K341-E343 PolarHBondContact O-N 3.3Å; E343-C345 VanDerWaalsContact C-N 3.34Å; E343-E346 PolarHBondContact O-N 2.65Å; E343-K347 WeakPolarHBondContact O-CG 3.31Å; E343-K347 PolarHBondContact O-N 2.77Å |
| 344 | N | 94.8 | Very high | 92.2 | Very high | 23 Ų | 23 | 77.4 Ų | 77.4 | 12% | 0.123 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -73 | -30.7 | 179.1 | -66.4 | -51.3 | 0 | 0 | 0 | 111.5 | I307 E314 L342 E346 K347 L348 | I307-N344 WeakPolarHBondContact CG2-O 3.41Å; E314-N344 WeakPolarHBondContact OE1-CB 3.29Å; E314-N344 PolarHBondContact OE1-N 3.45Å; E314-N344 PolarHBondContact OE1-ND2 3.1Å; E314-N344 PolarHBondContact OE2-N 2.82Å; E314-N344 VanDerWaalsContact OE2-N 3.09Å; L342-N344 PolarHBondContact O-N 2.5Å; N344-E346 VanDerWaalsContact C-N 3.35Å; N344-K347 PolarHBondContact O-N 2.82Å; N344-L348 WeakPolarHBondContact O-CB 3.33Å; N344-L348 PolarHBondContact O-N 3.28Å |
| 345 | C | 94.9 | Very high | 91.1 | Very high | 24 Ų | 24 | 83.9 Ų | 83.9 | 16% | 0.162 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -66.7 | -35.5 | 170.7 | -64.2 | 0 | 0 | 0 | 0 | 113.1 | C311 E314 L342 E343 L348 S349 | C311-C345 WeakPolarHBondContact CA-SG 3.36Å; C311-C345 HydrophobicContact CB-CB 3.95Å; C311-C345 WeakPolarHBondContact CB-SG 3.22Å; C311-C345 PolarHBondContact O-SG 3.25Å; C311-C345 VanDerWaalsContact O-SG 3.33Å; C311-C345 WeakPolarHBondContact SG-CA 3.43Å; C311-C345 WeakPolarHBondContact SG-CB 3.37Å; C311-C345 CovalentContact SG-SG 2.04Å; C311-C345 PolarHBondContact SG-SG 3.36Å; E314-C345 PolarHBondContact OE2-N 3.21Å; L342-C345 HydrophobicContact CB-CB 3.79Å; L342-C345 PolarHBondContact O-N 2.93Å; E343-C345 VanDerWaalsContact C-N 3.34Å; C345-L348 PolarHBondContact O-N 2.83Å; C345-S349 PolarHBondContact O-N 3.36Å |
| 346 | E | 95.1 | Very high | 89.9 | Confident | 105 Ų | 105 | 88.8 Ų | 88.8 | 49% | 0.491 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67.5 | -39.4 | 173.9 | -164.4 | -166.4 | 144.2 | 0 | 0 | 111.4 | L342 E343 N344 L348 S349 K350 | L342-E346 PolarHBondContact O-N 2.91Å; E343-E346 PolarHBondContact O-N 2.65Å; N344-E346 VanDerWaalsContact C-N 3.35Å; E346-L348 VanDerWaalsContact C-N 3.34Å; E346-S349 PolarHBondContact O-N 3.47Å; E346-S349 PolarHBondContact O-OG 3.32Å; E346-K350 WeakPolarHBondContact O-CG 3.4Å; E346-K350 PolarHBondContact O-N 2.74Å; E346-K350 VanDerWaalsContact O-N 3.13Å; E346-K350 VanDerWaalsContact OE1-CE 3.24Å; E346-K350 WeakPolarHBondContact OE1-CE 3.45Å; E346-K350 IonicContact OE1-NZ 2.71Å; E346-K350 PolarHBondContact OE1-NZ 3.25Å |
| 347 | K | 92.7 | Very high | 88 | Confident | 87 Ų | 87 | 86.5 Ų | 86.5 | 38% | 0.378 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.8 | -43.2 | 171.9 | -68.7 | 171.8 | -170 | 166.4 | 0 | 111.2 | I307 E343 N344 S349 K350 L351 | I307-K347 HydrophobicContact CD1-CD 4.2Å; I307-K347 HydrophobicContact CG2-CB 4.33Å; E343-K347 WeakPolarHBondContact O-CG 3.31Å; E343-K347 PolarHBondContact O-N 2.77Å; N344-K347 PolarHBondContact O-N 2.82Å; K347-S349 PolarHBondContact O-N 3.29Å; K347-K350 PolarHBondContact O-N 3.29Å; K347-L351 WeakPolarHBondContact O-CG 3.38Å; K347-L351 PolarHBondContact O-N 2.96Å |
| 348 | L | 93.6 | Very high | 85.7 | Confident | 26 Ų | 26 | 92.9 Ų | 92.9 | 14% | 0.136 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 177.8 | -173.3 | 60.2 | 0 | 0 | 0 | 112 | I307 Q308 C311 N344 C345 E346 K350 L351 I352 | I307-L348 HydrophobicContact CG2-CB 3.72Å; I307-L348 HydrophobicContact CG2-CD1 4.12Å; I307-L348 HydrophobicContact CG2-CG 4.46Å; Q308-L348 HydrophobicContact CG-CD1 3.57Å; Q308-L348 HydrophobicContact CG-CD2 4.08Å; C311-L348 HydrophobicContact CB-CD2 4.19Å; N344-L348 WeakPolarHBondContact O-CB 3.33Å; N344-L348 PolarHBondContact O-N 3.28Å; C345-L348 PolarHBondContact O-N 2.83Å; E346-L348 VanDerWaalsContact C-N 3.34Å; L348-K350 VanDerWaalsContact C-N 3.34Å; L348-K350 PolarHBondContact O-N 2.99Å; L348-L351 PolarHBondContact O-N 3.1Å; L348-I352 HydrophobicContact CD1-CD1 4.25Å; L348-I352 HydrophobicContact CD1-CG1 4.47Å; L348-I352 HydrophobicContact CG-CD1 3.92Å; L348-I352 WeakPolarHBondContact O-CG1 3.4Å; L348-I352 PolarHBondContact O-N 3.27Å |
| 349 | S | 91.4 | Very high | 85.3 | Confident | 68 Ų | 68 | 91.5 Ų | 91.5 | 48% | 0.476 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.5 | -38 | 179.5 | 68.5 | 0 | 0 | 0 | 0 | 111.9 | C345 E346 K347 I352 G353 | C345-S349 PolarHBondContact O-N 3.36Å; E346-S349 PolarHBondContact O-N 3.47Å; E346-S349 PolarHBondContact O-OG 3.32Å; K347-S349 PolarHBondContact O-N 3.29Å; S349-I352 PolarHBondContact O-N 2.73Å; S349-G353 PolarHBondContact O-N 3.39Å |
| 350 | K | 91.1 | Very high | 84.7 | Confident | 119 Ų | 119 | 92 Ų | 92 | 52% | 0.517 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.3 | -46.5 | 171.9 | -71.4 | 172.6 | -174.1 | 168.4 | 0 | 111.6 | E346 K347 L348 I352 G353 L354 | E346-K350 WeakPolarHBondContact O-CG 3.4Å; E346-K350 PolarHBondContact O-N 2.74Å; E346-K350 VanDerWaalsContact O-N 3.13Å; E346-K350 VanDerWaalsContact OE1-CE 3.24Å; E346-K350 WeakPolarHBondContact OE1-CE 3.45Å; E346-K350 IonicContact OE1-NZ 2.71Å; E346-K350 PolarHBondContact OE1-NZ 3.25Å; K347-K350 PolarHBondContact O-N 3.29Å; L348-K350 VanDerWaalsContact C-N 3.34Å; L348-K350 PolarHBondContact O-N 2.99Å; K350-I352 PolarHBondContact O-N 3.05Å; K350-G353 PolarHBondContact O-N 3.14Å; K350-L354 WeakPolarHBondContact O-CG 3.41Å; K350-L354 PolarHBondContact O-N 3.22Å |
| 351 | L | 87.7 | Confident | 84.2 | Confident | 32 Ų | 32 | 94.9 Ų | 94.9 | 17% | 0.168 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -62.8 | -42 | 177.9 | -69.2 | 171.6 | 0 | 0 | 0 | 112.6 | L273 Y303 I307 K347 L348 G353 L354 R355 | L273-L351 HydrophobicContact CD2-CD2 4.33Å; Y303-L351 HydrophobicContact CD1-CD1 4.44Å; Y303-L351 HydrophobicContact CE1-CD1 4.07Å; I307-L351 HydrophobicContact CG2-CD1 4.48Å; K347-L351 WeakPolarHBondContact O-CG 3.38Å; K347-L351 PolarHBondContact O-N 2.96Å; L348-L351 PolarHBondContact O-N 3.1Å; L351-G353 VanDerWaalsContact C-N 3.33Å; L351-L354 PolarHBondContact O-N 2.95Å; L351-R355 PolarHBondContact O-N 3.27Å |
| 352 | I | 86.3 | Confident | 83.6 | Confident | 79 Ų | 79 | 90.6 Ų | 90.6 | 41% | 0.405 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.9 | -38.4 | 175.6 | -66.7 | 167.8 | 0 | 0 | 0 | 110.9 | L348 S349 K350 R355 R356 | L348-I352 HydrophobicContact CD1-CD1 4.25Å; L348-I352 HydrophobicContact CD1-CG1 4.47Å; L348-I352 HydrophobicContact CG-CD1 3.92Å; L348-I352 WeakPolarHBondContact O-CG1 3.4Å; L348-I352 PolarHBondContact O-N 3.27Å; S349-I352 PolarHBondContact O-N 2.73Å; K350-I352 PolarHBondContact O-N 3.05Å; I352-R355 PolarHBondContact O-N 3.34Å; I352-R356 PolarHBondContact O-N 2.92Å |
| 353 | G | 81.1 | Confident | 82.9 | Confident | 45 Ų | 45 | 93 Ų | 93 | 46% | 0.464 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -46.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S349 K350 L351 R355 R356 G357 | S349-G353 PolarHBondContact O-N 3.39Å; K350-G353 PolarHBondContact O-N 3.14Å; L351-G353 VanDerWaalsContact C-N 3.33Å; G353-R355 VanDerWaalsContact C-N 3.26Å; G353-R355 PolarHBondContact O-N 2.65Å; G353-R356 PolarHBondContact O-N 3.02Å; G353-G357 PolarHBondContact O-N 3.18Å |
| 354 | L | 78.2 | Confident | 82.2 | Confident | 122 Ų | 122 | 91.9 Ų | 91.9 | 64% | 0.639 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.3 | -36.8 | 176.1 | -70.3 | 169.2 | 0 | 0 | 0 | 112.3 | K350 L351 | K350-L354 WeakPolarHBondContact O-CG 3.41Å; K350-L354 PolarHBondContact O-N 3.22Å; L351-L354 PolarHBondContact O-N 2.95Å |
| 355 | R | 71.4 | Confident | 81.3 | Confident | 220 Ų | 220 | 96.8 Ų | 96.8 | 83% | 0.83 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -74.4 | -22.9 | 179.6 | -162.1 | 178.8 | -170.1 | -176.8 | 4.5 | 114.3 | L351 I352 G353 | L351-R355 PolarHBondContact O-N 3.27Å; I352-R355 PolarHBondContact O-N 3.34Å; G353-R355 VanDerWaalsContact C-N 3.26Å; G353-R355 PolarHBondContact O-N 2.65Å |
| 356 | R | 71.8 | Confident | 80.2 | Confident | 218 Ų | 218 | 102.4 Ų | 102.4 | 82% | 0.823 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -89.6 | -18.1 | 179.5 | -94.8 | -176.3 | 170.8 | 142.6 | -2.6 | 113.9 | I352 G353 | I352-R356 PolarHBondContact O-N 2.92Å; G353-R356 PolarHBondContact O-N 3.02Å |
| 357 | G | 56.5 | Low | 79 | Confident | 76 Ų | 76 | 102.2 Ų | 102.2 | 78% | 0.784 | 58% | 0.583 | S | S | * | * | trans | -105 | 7.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | G353 | G353-G357 PolarHBondContact O-N 3.18Š| ||
| 358 | G | 46.3 | Very low | 77.8 | Confident | 134 Ų | 134 | 103.5 Ų | 103.5 | 100% | 1.381 | 60% | 0.602 | S | S | * | * | trans | -106.1 | 0 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 |
Retrieved 358 of 358 residues in 205.8 ms
(Link to these results)