| 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 | 30 | Very low | 32.4 | Very low | 242 Ų | 242 | 152.2 Ų | 152.2 | 100% | 1.192 | 85% | 0.854 | S | S | * | * | 0 | 156.1 | 0 | -72.4 | -170.3 | 179.3 | 0 | 0 | 109 | |||||
| 2 | P | 47.7 | Very low | 32.1 | Very low | 115 Ų | 115 | 146.1 Ų | 146.1 | 75% | 0.747 | 85% | 0.851 | S | S | * | * | cis | -127.9 | -66.2 | 13.4 | 37.1 | -19.8 | 0 | 0 | 0 | 119.1 | ||||
| 3 | K | 32.9 | Very low | 32 | Very low | 188 Ų | 188 | 150.5 Ų | 150.5 | 82% | 0.817 | 86% | 0.858 | S | S | * | * | trans | -146.1 | 162.4 | -143.8 | -82.3 | 155.9 | 175 | 171.8 | 0 | 117 | ||||
| 4 | V | 32.8 | Very low | 32.1 | Very low | 118 Ų | 118 | 154.9 Ų | 154.9 | 72% | 0.715 | 86% | 0.863 | S | S | * | * | cis | -174.3 | 157.7 | -35.2 | 81.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 5 | K | 29.6 | Very low | 32.3 | Very low | 186 Ų | 186 | 152.9 Ų | 152.9 | 81% | 0.809 | 86% | 0.864 | S | S | * | * | trans | 64.7 | 116.9 | 162.9 | -71.6 | 177.2 | -177.9 | -179.6 | 0 | 120.7 | ||||
| 6 | K | 29.8 | Very low | 32.2 | Very low | 196 Ų | 196 | 148.3 Ų | 148.3 | 85% | 0.852 | 86% | 0.86 | S | S | * | * | 37.6 | 157.8 | 112.6 | -82.9 | -167.9 | 178 | -171 | 0 | 121.1 | |||||
| 7 | P | 45.2 | Very low | 32.6 | Very low | 119 Ų | 119 | 149.5 Ų | 149.5 | 77% | 0.773 | 86% | 0.863 | S | S | * | * | cis | -138.4 | 178.2 | -16.4 | 38.5 | -20.4 | 0 | 0 | 0 | 115.3 | ||||
| 8 | K | 27.3 | Very low | 32.9 | Very low | 217 Ų | 217 | 144.2 Ų | 144.2 | 94% | 0.943 | 85% | 0.846 | S | S | * | * | trans | -143.1 | 162.5 | 145.8 | -152.6 | 165.1 | -176.5 | 177.6 | 0 | 110.2 | ||||
| 9 | C | 28.9 | Very low | 33.3 | Very low | 134 Ų | 134 | 147.2 Ų | 147.2 | 91% | 0.905 | 85% | 0.854 | S | S | * | * | trans | -107.9 | 156.9 | -162.1 | -170.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 10 | G | 26 | Very low | 34.5 | Very low | 77 Ų | 77 | 144.3 Ų | 144.3 | 79% | 0.794 | 84% | 0.838 | S | S | * | * | trans | 153.4 | 112 | 155.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 11 | G | 26.1 | Very low | 35.7 | Very low | 82 Ų | 82 | 140.3 Ų | 140.3 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | trans | 119.3 | 109.1 | 149.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 12 | G | 29 | Very low | 36.7 | Very low | 79 Ų | 79 | 134.8 Ų | 134.8 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | trans | 58 | 101.7 | 140.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 13 | E | 30.8 | Very low | 37.4 | Very low | 203 Ų | 203 | 132.5 Ų | 132.5 | 95% | 0.949 | 79% | 0.787 | S | S | * | * | trans | -73.9 | 146.6 | 168.2 | -73.3 | 173.9 | 101.4 | 0 | 0 | 112.7 | ||||
| 14 | K | 33.4 | Very low | 38.7 | Very low | 212 Ų | 212 | 127.6 Ų | 127.6 | 92% | 0.922 | 77% | 0.77 | S | S | * | * | trans | -110.5 | 136.3 | 166.1 | -68.7 | 177.3 | 175.5 | -180 | 0 | 108.5 | ||||
| 15 | S | 35.6 | Very low | 40 | Very low | 126 Ų | 126 | 127.3 Ų | 127.3 | 88% | 0.881 | 76% | 0.761 | S | S | * | * | trans | -114.4 | 111.9 | 159.5 | 42.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 16 | G | 30.7 | Very low | 41.6 | Very low | 78 Ų | 78 | 124.6 Ų | 124.6 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | trans | -106.2 | 142 | 156 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 17 | D | 38.4 | Very low | 43 | Very low | 169 Ų | 169 | 122.1 Ų | 122.1 | 90% | 0.904 | 75% | 0.749 | S | S | * | * | trans | -106.8 | 151.1 | 175 | -160.1 | 6.6 | 0 | 0 | 0 | 110.7 | ||||
| 18 | G | 37.7 | Very low | 43.6 | Very low | 54 Ų | 54 | 123.8 Ų | 123.8 | 56% | 0.557 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 160.5 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V20 | G18-V20 PolarHBondContact O-N 3.18Š|
| 19 | M | 41.3 | Very low | 44.7 | Very low | 202 Ų | 202 | 116.3 Ų | 116.3 | 100% | 0.995 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 117.6 | 166.5 | -85.9 | 179.4 | 146.3 | 0 | 0 | 110.5 | ||
| 20 | V | 57.4 | Low | 45.5 | Very low | 89 Ų | 89 | 116.5 Ų | 116.5 | 54% | 0.539 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -69.1 | 142.7 | 165.7 | 179.7 | 0 | 0 | 0 | 0 | 109.4 | G18 D24 | G18-V20 PolarHBondContact O-N 3.18Å; V20-D24 HydrophobicContact CG1-CB 4.24Å |
| 21 | A | 58.6 | Low | 46.3 | Very low | 61 Ų | 61 | 120.5 Ų | 120.5 | 50% | 0.504 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -71.3 | 143.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A23 D24 | A21-A23 PolarHBondContact O-N 3.3Å; A21-D24 PolarHBondContact O-N 3.36Å; A21-D24 VanDerWaalsContact O-N 3.14Å |
| 22 | L | 51 | Low | 47.1 | Very low | 126 Ų | 126 | 123.3 Ų | 123.3 | 66% | 0.66 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -58.9 | -25.8 | -173 | -164.4 | 70.7 | 0 | 0 | 0 | 114 | I26 | L22-I26 HydrophobicContact CG-CD1 4.48Å; L22-I26 WeakPolarHBondContact O-CG1 3.3Å; L22-I26 PolarHBondContact O-N 2.77Å |
| 23 | A | 62.4 | Low | 47.8 | Very low | 67 Ų | 67 | 129.8 Ų | 129.8 | 55% | 0.554 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -64.2 | -39.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A21 I26 L27 | A21-A23 PolarHBondContact O-N 3.3Å; A23-I26 PolarHBondContact O-N 3.14Å; A23-L27 PolarHBondContact O-N 3.33Å |
| 24 | D | 60.6 | Low | 48.3 | Very low | 84 Ų | 84 | 126.8 Ų | 126.8 | 45% | 0.449 | 72% | 0.719 | S | S | . | * | H | α-helix | trans | -75.6 | -30.1 | -177.6 | -64.2 | -45.3 | 0 | 0 | 0 | 111.9 | V20 A21 I26 L27 Q28 | V20-D24 HydrophobicContact CG1-CB 4.24Å; A21-D24 PolarHBondContact O-N 3.36Å; A21-D24 VanDerWaalsContact O-N 3.14Å; D24-I26 VanDerWaalsContact C-N 3.34Å; D24-I26 PolarHBondContact O-N 3.06Å; D24-L27 PolarHBondContact O-N 3.2Å; D24-Q28 WeakPolarHBondContact O-CG 3.43Å; D24-Q28 PolarHBondContact O-N 3.33Å |
| 25 | Q | 60.6 | Low | 48.7 | Very low | 112 Ų | 112 | 125.7 Ų | 125.7 | 52% | 0.523 | 72% | 0.716 | S | S | . | * | H | α-helix | trans | -65.8 | -35.8 | 174.6 | -68.7 | -176.3 | -18.9 | 0 | 0 | 112.3 | L27 Q28 | Q25-L27 VanDerWaalsContact C-N 3.33Å; Q25-Q28 PolarHBondContact O-N 3.33Å |
| 26 | I | 63.2 | Low | 48.6 | Very low | 129 Ų | 129 | 122.6 Ų | 122.6 | 66% | 0.662 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -69.7 | -32.1 | 178.4 | -66.5 | 167.5 | 0 | 0 | 0 | 111.4 | L22 A23 D24 | L22-I26 HydrophobicContact CG-CD1 4.48Å; L22-I26 WeakPolarHBondContact O-CG1 3.3Å; L22-I26 PolarHBondContact O-N 2.77Å; A23-I26 PolarHBondContact O-N 3.14Å; D24-I26 VanDerWaalsContact C-N 3.34Å; D24-I26 PolarHBondContact O-N 3.06Å |
| 27 | L | 59.7 | Low | 48.9 | Very low | 145 Ų | 145 | 130.6 Ų | 130.6 | 76% | 0.759 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -76.3 | -18.3 | 176.7 | -71.1 | 172.2 | 0 | 0 | 0 | 114 | A23 D24 Q25 | A23-L27 PolarHBondContact O-N 3.33Å; D24-L27 PolarHBondContact O-N 3.2Å; Q25-L27 VanDerWaalsContact C-N 3.33Å |
| 28 | Q | 56.3 | Low | 48.8 | Very low | 154 Ų | 154 | 128.6 Ų | 128.6 | 72% | 0.72 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -9.1 | -178.7 | -73.2 | 178.7 | 9.3 | 0 | 0 | 114.4 | D24 Q25 D30 | D24-Q28 WeakPolarHBondContact O-CG 3.43Å; D24-Q28 PolarHBondContact O-N 3.33Å; Q25-Q28 PolarHBondContact O-N 3.33Å; Q28-D30 VanDerWaalsContact C-N 3.28Å; Q28-D30 PolarHBondContact O-N 3.22Å |
| 29 | G | 51.6 | Low | 48.7 | Very low | 59 Ų | 59 | 135.6 Ų | 135.6 | 61% | 0.608 | 72% | 0.719 | S | S | * | * | trans | 66.2 | 12 | 159.2 | 0 | 0 | 0 | 0 | 0 | 117.8 | M31 | G29-M31 PolarHBondContact O-N 3.15Š| ||
| 30 | D | 45.8 | Very low | 48.4 | Very low | 138 Ų | 138 | 131.9 Ų | 131.9 | 74% | 0.738 | 71% | 0.708 | S | S | * | * | trans | -77 | 111.7 | -176.6 | -160.6 | 13.3 | 0 | 0 | 0 | 111.5 | Q28 | Q28-D30 VanDerWaalsContact C-N 3.28Å; Q28-D30 PolarHBondContact O-N 3.22Å | ||
| 31 | M | 43 | Very low | 47.2 | Very low | 162 Ų | 162 | 137 Ų | 137 | 80% | 0.798 | 72% | 0.717 | S | S | * | * | trans | -81 | 133.2 | -173.6 | -66.9 | 178.4 | 66.2 | 0 | 0 | 111.7 | G29 R33 | G29-M31 PolarHBondContact O-N 3.15Å; M31-R33 PolarHBondContact O-N 3.12Å; M31-R33 VanDerWaalsContact O-N 3.1Å | ||
| 32 | V | 42.9 | Very low | 46.1 | Very low | 140 Ų | 140 | 141.7 Ų | 141.7 | 85% | 0.848 | 73% | 0.734 | S | S | * | * | trans | -55.2 | 115.4 | -179.2 | -179.9 | 0 | 0 | 0 | 0 | 111.4 | V34 | V32-V34 PolarHBondContact O-N 3.38Š| ||
| 33 | R | 43 | Very low | 45.5 | Very low | 216 Ų | 216 | 141.7 Ų | 141.7 | 82% | 0.815 | 73% | 0.73 | S | S | * | * | trans | -73.7 | 111.9 | -178.6 | -62.9 | -175.8 | -174.1 | -174.4 | 2.3 | 111.2 | M31 H35 | M31-R33 PolarHBondContact O-N 3.12Å; M31-R33 VanDerWaalsContact O-N 3.1Å; R33-H35 PolarHBondContact O-N 3.01Å | ||
| 34 | V | 40.8 | Very low | 44.2 | Very low | 140 Ų | 140 | 150.7 Ų | 150.7 | 85% | 0.848 | 75% | 0.75 | S | S | * | * | trans | -73.3 | 113.1 | 176.1 | 179.7 | 0 | 0 | 0 | 0 | 110.3 | V32 G36 | V32-V34 PolarHBondContact O-N 3.38Å; V34-G36 PolarHBondContact O-N 2.99Å; V34-G36 VanDerWaalsContact O-N 3.17Å | ||
| 35 | H | 41.5 | Very low | 42.8 | Very low | 189 Ų | 189 | 149.7 Ų | 149.7 | 88% | 0.875 | 76% | 0.76 | S | S | * | * | trans | -86.3 | 85.6 | -179.2 | -142.1 | -51 | 0 | 0 | 0 | 111.5 | R33 R37 | R33-H35 PolarHBondContact O-N 3.01Å; H35-R37 PolarHBondContact O-N 3.28Å | ||
| 36 | G | 33.8 | Very low | 41.9 | Very low | 61 Ų | 61 | 153.5 Ų | 153.5 | 63% | 0.629 | 78% | 0.778 | S | S | * | * | trans | -65.1 | 123.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V34 | V34-G36 PolarHBondContact O-N 2.99Å; V34-G36 VanDerWaalsContact O-N 3.17Å | ||
| 37 | R | 38.2 | Very low | 40.9 | Very low | 245 Ų | 245 | 153.4 Ų | 153.4 | 93% | 0.925 | 78% | 0.779 | S | S | * | * | trans | -98.9 | 105.6 | 173.5 | -173.3 | 175.4 | -177 | 171.3 | 1 | 110 | H35 K39 | H35-R37 PolarHBondContact O-N 3.28Å; R37-K39 PolarHBondContact O-N 3.47Å | ||
| 38 | V | 36.2 | Very low | 40 | Very low | 127 Ų | 127 | 155.7 Ų | 155.7 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | trans | -65.3 | 129 | 174.5 | 179.7 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 39 | K | 34.3 | Very low | 39.5 | Very low | 201 Ų | 201 | 154.5 Ų | 154.5 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -97.1 | 103.5 | 170.1 | -175.3 | 179.3 | 179.2 | -177.7 | 0 | 108.5 | R37 | R37-K39 PolarHBondContact O-N 3.47Š| ||
| 40 | T | 34.8 | Very low | 39.3 | Very low | 124 Ų | 124 | 159.1 Ų | 159.1 | 76% | 0.761 | 79% | 0.79 | S | S | * | * | trans | -63.1 | 134.5 | 173.9 | -44.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 41 | R | 33.3 | Very low | 39.4 | Very low | 196 Ų | 196 | 160.8 Ų | 160.8 | 74% | 0.74 | 80% | 0.799 | S | S | * | * | trans | -89.9 | 115.6 | 171 | 164.1 | 177.4 | 161 | -173 | -6.6 | 108 | Q43 | R41-Q43 VanDerWaalsContact CZ-OE1 3.28Š| ||
| 42 | D | 34.8 | Very low | 39.8 | Very low | 160 Ų | 160 | 160.8 Ų | 160.8 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | trans | -104.1 | 155.4 | 158.8 | -150.4 | -23.4 | 0 | 0 | 0 | 108.7 | ||||
| 43 | Q | 38.1 | Very low | 40.7 | Very low | 126 Ų | 126 | 163.4 Ų | 163.4 | 59% | 0.589 | 79% | 0.793 | S | S | * | * | trans | -156.1 | 85.4 | -165.3 | -167.7 | 175.9 | 10.7 | 0 | 0 | 114.3 | R41 | R41-Q43 VanDerWaalsContact CZ-OE1 3.28Š| ||
| 44 | R | 35.4 | Very low | 42 | Very low | 256 Ų | 256 | 157 Ų | 157 | 97% | 0.966 | 78% | 0.777 | S | S | * | * | trans | -179.7 | 141.4 | 155.3 | -96 | 146 | -177.5 | -134.2 | -1.3 | 106.8 | ||||
| 45 | G | 30.9 | Very low | 43.7 | Very low | 64 Ų | 64 | 154.8 Ų | 154.8 | 66% | 0.66 | 76% | 0.761 | S | S | * | * | cis | 158.6 | 153.1 | -4.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 46 | E | 42.8 | Very low | 45.2 | Very low | 192 Ų | 192 | 151.3 Ų | 151.3 | 90% | 0.897 | 75% | 0.745 | S | S | * | * | trans | 63.8 | 100.8 | -179.4 | -67.3 | 160.9 | -152.8 | 0 | 0 | 114.7 | ||||
| 47 | D | 40.9 | Very low | 47 | Very low | 127 Ų | 127 | 158.3 Ų | 158.3 | 68% | 0.679 | 75% | 0.752 | S | S | * | * | trans | 178.6 | 87.7 | 147.8 | -90.8 | -27.4 | 0 | 0 | 0 | 107.5 | ||||
| 48 | E | 42.3 | Very low | 48.7 | Very low | 193 Ų | 193 | 151.1 Ų | 151.1 | 90% | 0.902 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -81.8 | -2.4 | 177.1 | -68.4 | -171.9 | 140.8 | 0 | 0 | 112.7 | ||
| 49 | D | 44.6 | Very low | 50.7 | Low | 128 Ų | 128 | 146.8 Ų | 146.8 | 68% | 0.684 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -91.7 | -16.9 | -175.2 | -63 | -41.1 | 0 | 0 | 0 | 114.2 | E52 | D49-E52 PolarHBondContact O-N 3.06Š|
| 50 | E | 47.3 | Very low | 52.9 | Low | 156 Ų | 156 | 144.9 Ų | 144.9 | 73% | 0.729 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -72.4 | -26.9 | -178.2 | -76.4 | -152.4 | 138.1 | 0 | 0 | 113.7 | E52 Y53 | E50-E52 PolarHBondContact O-N 3.09Å; E50-Y53 PolarHBondContact O-N 3.36Å |
| 51 | D | 47.7 | Very low | 55 | Low | 174 Ų | 174 | 145.8 Ų | 145.8 | 93% | 0.93 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -72.7 | -10.1 | 178.9 | -92.8 | -27.4 | 0 | 0 | 0 | 113.3 | ||
| 52 | E | 53.1 | Low | 57.2 | Low | 162 Ų | 162 | 140.8 Ų | 140.8 | 76% | 0.757 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -78.9 | -23 | 172.2 | -169.7 | 170.1 | -140.2 | 0 | 0 | 112.5 | D49 E50 | D49-E52 PolarHBondContact O-N 3.06Å; E50-E52 PolarHBondContact O-N 3.09Å |
| 53 | Y | 60.1 | Low | 59.4 | Low | 194 Ų | 194 | 139.1 Ų | 139.1 | 76% | 0.761 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -106.6 | 115.1 | -173 | -89.8 | -95.3 | 0 | 0 | 0 | 114.5 | E50 D55 | E50-Y53 PolarHBondContact O-N 3.36Å; Y53-D55 PolarHBondContact O-N 2.7Å |
| 54 | V | 70.5 | Confident | 61.6 | Low | 81 Ų | 81 | 138.3 Ų | 138.3 | 49% | 0.491 | 66% | 0.662 | S | S | . | * | trans | -71.5 | 113.9 | 177 | -177.8 | 0 | 0 | 0 | 0 | 111.2 | L58 I62 | V54-L58 HydrophobicContact CG1-CB 3.91Å; V54-L58 HydrophobicContact CG1-CD2 3.93Å; V54-L58 HydrophobicContact CG1-CG 3.73Å; V54-I62 HydrophobicContact CG1-CD1 3.99Å | ||
| 55 | D | 77.4 | Confident | 63.6 | Low | 95 Ų | 95 | 130.9 Ų | 130.9 | 51% | 0.508 | 64% | 0.638 | S | S | . | * | trans | -36.2 | 140.5 | 176 | 162 | 51.5 | 0 | 0 | 0 | 113.8 | Y53 R57 L58 S59 | Y53-D55 PolarHBondContact O-N 2.7Å; D55-R57 PolarHBondContact O-N 3.31Å; D55-R57 VanDerWaalsContact O-N 3.11Å; D55-R57 PolarHBondContact OD1-N 3.46Å; D55-R57 WeakPolarHBondContact OD2-CB 3.38Å; D55-R57 PolarHBondContact OD2-N 3.5Å; D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 CarbonylContact O-C 3.58Å; D55-L58 WeakPolarHBondContact O-CA 3.38Å; D55-L58 PolarHBondContact O-N 3.41Å; D55-L58 PolarHBondContact OD2-N 3.5Å; D55-S59 PolarHBondContact O-N 3.34Å; D55-S59 PolarHBondContact O-OG 3.05Å; D55-S59 VanDerWaalsContact O-OG 3.05Å | ||
| 56 | E | 71.8 | Confident | 66.1 | Low | 116 Ų | 116 | 130 Ų | 130 | 54% | 0.542 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -57.3 | -32.1 | -174.9 | -149 | -148.8 | 146.4 | 0 | 0 | 113 | S59 R60 | E56-S59 WeakPolarHBondContact CA-OG 3.46Å; E56-S59 PolarHBondContact O-OG 2.83Å; E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.45Å; E56-R60 VanDerWaalsContact O-CD 3.29Å; E56-R60 WeakPolarHBondContact O-CD 3.46Å; E56-R60 WeakPolarHBondContact O-CG 3.42Å; E56-R60 PolarHBondContact O-N 3.36Å; E56-R60 VanDerWaalsContact O-N 3.11Å; E56-R60 IonicContact OE1-CZ 2.75Å; E56-R60 IonicContact OE1-NE 2.97Å; E56-R60 PolarHBondContact OE1-NE 3.37Å; E56-R60 IonicContact OE1-NH2 3.46Å; E56-R60 PolarHBondContact OE1-NH2 3.02Å |
| 57 | R | 72.9 | Confident | 67.7 | Low | 207 Ų | 207 | 127.6 Ų | 127.6 | 78% | 0.781 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -77.2 | -36.4 | 176.5 | -63.4 | 174.4 | 163.8 | 178.7 | -4.1 | 112 | D55 K61 | D55-R57 PolarHBondContact O-N 3.31Å; D55-R57 VanDerWaalsContact O-N 3.11Å; D55-R57 PolarHBondContact OD1-N 3.46Å; D55-R57 WeakPolarHBondContact OD2-CB 3.38Å; D55-R57 PolarHBondContact OD2-N 3.5Å; R57-K61 WeakPolarHBondContact O-CB 3.5Å; R57-K61 PolarHBondContact O-N 2.97Å |
| 58 | L | 73.5 | Confident | 69.6 | Low | 94 Ų | 94 | 124.6 Ų | 124.6 | 49% | 0.492 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.9 | -43.8 | 176 | -175.8 | 53.6 | 0 | 0 | 0 | 111.4 | V54 D55 K61 I62 | V54-L58 HydrophobicContact CG1-CB 3.91Å; V54-L58 HydrophobicContact CG1-CD2 3.93Å; V54-L58 HydrophobicContact CG1-CG 3.73Å; D55-L58 HydrophobicContact CB-CB 4.31Å; D55-L58 CarbonylContact O-C 3.58Å; D55-L58 WeakPolarHBondContact O-CA 3.38Å; D55-L58 PolarHBondContact O-N 3.41Å; D55-L58 PolarHBondContact OD2-N 3.5Å; L58-K61 PolarHBondContact O-N 2.97Å; L58-K61 VanDerWaalsContact O-N 3.16Å; L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.39Å; L58-I62 HydrophobicContact CG-CD1 3.93Å; L58-I62 VanDerWaalsContact O-CG1 3.31Å; L58-I62 WeakPolarHBondContact O-CG1 3.5Å; L58-I62 PolarHBondContact O-N 2.86Å |
| 59 | S | 77.3 | Confident | 71.2 | Confident | 37 Ų | 37 | 120.9 Ų | 120.9 | 26% | 0.259 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.6 | -41.5 | 176.8 | 56.5 | 0 | 0 | 0 | 0 | 112.6 | D55 E56 K61 I62 L63 | D55-S59 PolarHBondContact O-N 3.34Å; D55-S59 PolarHBondContact O-OG 3.05Å; D55-S59 VanDerWaalsContact O-OG 3.05Å; E56-S59 WeakPolarHBondContact CA-OG 3.46Å; E56-S59 PolarHBondContact O-OG 2.83Å; S59-K61 VanDerWaalsContact C-N 3.29Å; S59-K61 PolarHBondContact O-N 3.01Å; S59-I62 PolarHBondContact O-N 3.11Å; S59-L63 WeakPolarHBondContact O-CB 3.49Å; S59-L63 WeakPolarHBondContact O-CG 3.23Å; S59-L63 PolarHBondContact O-N 2.87Å |
| 60 | R | 80.7 | Confident | 72.2 | Confident | 161 Ų | 161 | 120.4 Ų | 120.4 | 61% | 0.608 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -55.8 | -42.7 | 168.9 | -77.4 | 168.9 | -179.3 | -121.1 | 9.9 | 112 | E56 L63 E64 | E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.45Å; E56-R60 VanDerWaalsContact O-CD 3.29Å; E56-R60 WeakPolarHBondContact O-CD 3.46Å; E56-R60 WeakPolarHBondContact O-CG 3.42Å; E56-R60 PolarHBondContact O-N 3.36Å; E56-R60 VanDerWaalsContact O-N 3.11Å; E56-R60 IonicContact OE1-CZ 2.75Å; E56-R60 IonicContact OE1-NE 2.97Å; E56-R60 PolarHBondContact OE1-NE 3.37Å; E56-R60 IonicContact OE1-NH2 3.46Å; E56-R60 PolarHBondContact OE1-NH2 3.02Å; R60-L63 PolarHBondContact O-N 2.86Å; R60-E64 PolarHBondContact O-N 2.97Å |
| 61 | K | 79.5 | Confident | 73.5 | Confident | 142 Ų | 142 | 118.2 Ų | 118.2 | 62% | 0.617 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.3 | -36.6 | -179.9 | -162.7 | 172.8 | -173.7 | 179.4 | 0 | 112.6 | R57 L58 S59 E64 Q65 | R57-K61 WeakPolarHBondContact O-CB 3.5Å; R57-K61 PolarHBondContact O-N 2.97Å; L58-K61 PolarHBondContact O-N 2.97Å; L58-K61 VanDerWaalsContact O-N 3.16Å; S59-K61 VanDerWaalsContact C-N 3.29Å; S59-K61 PolarHBondContact O-N 3.01Å; K61-E64 PolarHBondContact O-N 3.02Å; K61-Q65 WeakPolarHBondContact O-CG 3.47Å; K61-Q65 PolarHBondContact O-N 3.44Å |
| 62 | I | 80 | Confident | 74.6 | Confident | 92 Ų | 92 | 115.9 Ų | 115.9 | 47% | 0.472 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.7 | -44.8 | 172.1 | -71 | 163.2 | 0 | 0 | 0 | 110.3 | V54 L58 S59 E64 Q65 A66 | V54-I62 HydrophobicContact CG1-CD1 3.99Å; L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.39Å; L58-I62 HydrophobicContact CG-CD1 3.93Å; L58-I62 VanDerWaalsContact O-CG1 3.31Å; L58-I62 WeakPolarHBondContact O-CG1 3.5Å; L58-I62 PolarHBondContact O-N 2.86Å; S59-I62 PolarHBondContact O-N 3.11Å; I62-E64 VanDerWaalsContact C-N 3.33Å; I62-E64 PolarHBondContact O-N 3.22Å; I62-Q65 PolarHBondContact O-N 2.97Å; I62-A66 VanDerWaalsContact O-CB 3.22Å; I62-A66 WeakPolarHBondContact O-CB 3.29Å; I62-A66 PolarHBondContact O-N 3.38Å |
| 63 | L | 81.1 | Confident | 75.3 | Confident | 124 Ų | 124 | 112.7 Ų | 112.7 | 65% | 0.649 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.2 | -39.1 | 175.6 | -77.4 | 165.7 | 0 | 0 | 0 | 112.4 | S59 R60 R67 | S59-L63 WeakPolarHBondContact O-CB 3.49Å; S59-L63 WeakPolarHBondContact O-CG 3.23Å; S59-L63 PolarHBondContact O-N 2.87Å; R60-L63 PolarHBondContact O-N 2.86Å; L63-R67 WeakPolarHBondContact O-CB 3.34Å; L63-R67 PolarHBondContact O-N 2.98Å |
| 64 | E | 84.4 | Confident | 75.5 | Confident | 109 Ų | 109 | 109 Ų | 109 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70 | -41.9 | 176.8 | -173.3 | 152.1 | -126.6 | 0 | 0 | 112.5 | R60 K61 I62 R67 I68 | R60-E64 PolarHBondContact O-N 2.97Å; K61-E64 PolarHBondContact O-N 3.02Å; I62-E64 VanDerWaalsContact C-N 3.33Å; I62-E64 PolarHBondContact O-N 3.22Å; E64-R67 PolarHBondContact O-N 3.43Å; E64-I68 HydrophobicContact CG-CD1 4.34Å; E64-I68 WeakPolarHBondContact O-CG1 3.41Å; E64-I68 PolarHBondContact O-N 3.12Å |
| 65 | Q | 77.8 | Confident | 75.2 | Confident | 101 Ų | 101 | 110.8 Ų | 110.8 | 47% | 0.472 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 172.8 | -69.3 | -64.6 | -83.7 | 0 | 0 | 112.4 | K61 I62 R67 I68 Q69 | K61-Q65 WeakPolarHBondContact O-CG 3.47Å; K61-Q65 PolarHBondContact O-N 3.44Å; I62-Q65 PolarHBondContact O-N 2.97Å; Q65-R67 VanDerWaalsContact C-N 3.33Å; Q65-R67 PolarHBondContact O-N 3.34Å; Q65-I68 PolarHBondContact O-N 3.42Å; Q65-Q69 WeakPolarHBondContact O-CG 3.46Å; Q65-Q69 PolarHBondContact O-N 2.79Å |
| 66 | A | 81.7 | Confident | 74.3 | Confident | 45 Ų | 45 | 112.3 Ų | 112.3 | 37% | 0.372 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -39.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I62 Q69 Q70 | I62-A66 VanDerWaalsContact O-CB 3.22Å; I62-A66 WeakPolarHBondContact O-CB 3.29Å; I62-A66 PolarHBondContact O-N 3.38Å; A66-Q69 PolarHBondContact O-N 2.77Å; A66-Q70 VanDerWaalsContact O-CB 3.23Å; A66-Q70 WeakPolarHBondContact O-CB 3.4Å; A66-Q70 PolarHBondContact O-N 3.47Å |
| 67 | R | 76.7 | Confident | 73.1 | Confident | 142 Ų | 142 | 114.7 Ų | 114.7 | 54% | 0.536 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64 | -40.9 | 175 | -156.9 | -169.7 | 84.4 | -138.3 | -1 | 111.9 | L63 E64 Q65 Q70 E71 | L63-R67 WeakPolarHBondContact O-CB 3.34Å; L63-R67 PolarHBondContact O-N 2.98Å; E64-R67 PolarHBondContact O-N 3.43Å; Q65-R67 VanDerWaalsContact C-N 3.33Å; Q65-R67 PolarHBondContact O-N 3.34Å; R67-Q70 PolarHBondContact O-N 2.91Å; R67-E71 VanDerWaalsContact O-CB 3.32Å; R67-E71 WeakPolarHBondContact O-CB 3.37Å; R67-E71 PolarHBondContact O-N 2.97Å |
| 68 | I | 80.6 | Confident | 72 | Confident | 64 Ų | 64 | 107.8 Ų | 107.8 | 33% | 0.328 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.6 | -50.2 | 176.2 | -69.4 | 161.7 | 0 | 0 | 0 | 110.5 | E64 Q65 Q70 E71 E72 | E64-I68 HydrophobicContact CG-CD1 4.34Å; E64-I68 WeakPolarHBondContact O-CG1 3.41Å; E64-I68 PolarHBondContact O-N 3.12Å; Q65-I68 PolarHBondContact O-N 3.42Å; I68-Q70 VanDerWaalsContact C-N 3.26Å; I68-Q70 PolarHBondContact O-N 3.47Å; I68-E71 PolarHBondContact O-N 2.85Å; I68-E71 VanDerWaalsContact O-N 3.11Å; I68-E72 WeakPolarHBondContact O-CG 3.27Å; I68-E72 PolarHBondContact O-N 3.18Å |
| 69 | Q | 76.4 | Confident | 70.5 | Confident | 114 Ų | 114 | 110.7 Ų | 110.7 | 53% | 0.533 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.4 | -37.1 | 176.2 | -70.8 | 173.5 | 3.7 | 0 | 0 | 112.1 | Q65 A66 L73 | Q65-Q69 WeakPolarHBondContact O-CG 3.46Å; Q65-Q69 PolarHBondContact O-N 2.79Å; A66-Q69 PolarHBondContact O-N 2.77Å; Q69-L73 WeakPolarHBondContact O-CB 3.21Å; Q69-L73 VanDerWaalsContact O-CG 3.25Å; Q69-L73 WeakPolarHBondContact O-CG 3.42Å; Q69-L73 PolarHBondContact O-N 3.34Å |
| 70 | Q | 66.3 | Low | 68.7 | Low | 119 Ų | 119 | 113.3 Ų | 113.3 | 56% | 0.556 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -71.2 | -35 | 177.1 | -159.5 | -179.6 | 28.1 | 0 | 0 | 112.2 | A66 R67 I68 Q74 | A66-Q70 VanDerWaalsContact O-CB 3.23Å; A66-Q70 WeakPolarHBondContact O-CB 3.4Å; A66-Q70 PolarHBondContact O-N 3.47Å; R67-Q70 PolarHBondContact O-N 2.91Å; I68-Q70 VanDerWaalsContact C-N 3.26Å; I68-Q70 PolarHBondContact O-N 3.47Å; Q70-Q74 VanDerWaalsContact O-CB 3.28Å; Q70-Q74 WeakPolarHBondContact O-CB 3.42Å; Q70-Q74 WeakPolarHBondContact O-CG 3.46Å; Q70-Q74 PolarHBondContact O-N 2.93Å |
| 71 | E | 74.1 | Confident | 66.8 | Low | 110 Ų | 110 | 111.2 Ų | 111.2 | 51% | 0.514 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -70.8 | -37.5 | 174.5 | -171.3 | 163.9 | -171.8 | 0 | 0 | 111.7 | R67 I68 T75 | R67-E71 VanDerWaalsContact O-CB 3.32Å; R67-E71 WeakPolarHBondContact O-CB 3.37Å; R67-E71 PolarHBondContact O-N 2.97Å; I68-E71 PolarHBondContact O-N 2.85Å; I68-E71 VanDerWaalsContact O-N 3.11Å; E71-T75 VanDerWaalsContact O-CB 3.32Å; E71-T75 WeakPolarHBondContact O-CB 3.5Å; E71-T75 PolarHBondContact O-N 3.02Å; E71-T75 PolarHBondContact O-OG1 3.02Å |
| 72 | E | 71.7 | Confident | 64.8 | Low | 124 Ų | 124 | 112.4 Ų | 112.4 | 58% | 0.579 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.6 | -51.2 | 170 | -71.7 | 177 | 157.5 | 0 | 0 | 111.7 | I68 Q74 T75 E76 | I68-E72 WeakPolarHBondContact O-CG 3.27Å; I68-E72 PolarHBondContact O-N 3.18Å; E72-Q74 PolarHBondContact O-N 2.94Å; E72-T75 CarbonylContact O-C 3.58Å; E72-T75 WeakPolarHBondContact O-CA 3.48Å; E72-T75 WeakPolarHBondContact O-CB 3.43Å; E72-T75 PolarHBondContact O-N 3.36Å; E72-T75 VanDerWaalsContact O-N 3.08Å; E72-E76 PolarHBondContact O-N 2.97Å |
| 73 | L | 66.1 | Low | 62.6 | Low | 95 Ų | 95 | 114.3 Ų | 114.3 | 50% | 0.497 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.4 | -38.2 | 178.3 | -74.4 | 169.5 | 0 | 0 | 0 | 112.6 | Q69 T75 E76 Y77 | Q69-L73 WeakPolarHBondContact O-CB 3.21Å; Q69-L73 VanDerWaalsContact O-CG 3.25Å; Q69-L73 WeakPolarHBondContact O-CG 3.42Å; Q69-L73 PolarHBondContact O-N 3.34Å; L73-T75 VanDerWaalsContact C-N 3.32Å; L73-E76 PolarHBondContact O-N 3.17Å; L73-Y77 HydrophobicContact CD2-CD2 4Å; L73-Y77 HydrophobicContact CD2-CE2 3.84Å; L73-Y77 WeakPolarHBondContact O-CB 3.19Å; L73-Y77 PolarHBondContact O-N 2.96Å |
| 74 | Q | 64.6 | Low | 60.5 | Low | 118 Ų | 118 | 116.9 Ų | 116.9 | 55% | 0.551 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -63.9 | -38.3 | 172.4 | -76.5 | 171.1 | 20.4 | 0 | 0 | 111.6 | Q70 E72 G78 | Q70-Q74 VanDerWaalsContact O-CB 3.28Å; Q70-Q74 WeakPolarHBondContact O-CB 3.42Å; Q70-Q74 WeakPolarHBondContact O-CG 3.46Å; Q70-Q74 PolarHBondContact O-N 2.93Å; E72-Q74 PolarHBondContact O-N 2.94Å; Q74-G78 WeakPolarHBondContact O-CA 3.19Å; Q74-G78 PolarHBondContact O-N 3.36Å |
| 75 | T | 65.3 | Low | 58.2 | Low | 117 Ų | 117 | 121.3 Ų | 121.3 | 72% | 0.718 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -67.8 | -33.7 | 176.1 | -61 | 0 | 0 | 0 | 0 | 112.7 | E71 E72 L73 | E71-T75 VanDerWaalsContact O-CB 3.32Å; E71-T75 WeakPolarHBondContact O-CB 3.5Å; E71-T75 PolarHBondContact O-N 3.02Å; E71-T75 PolarHBondContact O-OG1 3.02Å; E72-T75 CarbonylContact O-C 3.58Å; E72-T75 WeakPolarHBondContact O-CA 3.48Å; E72-T75 WeakPolarHBondContact O-CB 3.43Å; E72-T75 PolarHBondContact O-N 3.36Å; E72-T75 VanDerWaalsContact O-N 3.08Å; L73-T75 VanDerWaalsContact C-N 3.32Å |
| 76 | E | 58 | Low | 55.9 | Low | 127 Ų | 127 | 126.2 Ų | 126.2 | 59% | 0.593 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -83.3 | -44.8 | -179.2 | -174.1 | 166.5 | -137.9 | 0 | 0 | 113.1 | E72 L73 | E72-E76 PolarHBondContact O-N 2.97Å; L73-E76 PolarHBondContact O-N 3.17Å |
| 77 | Y | 46 | Very low | 53.5 | Low | 167 Ų | 167 | 133.2 Ų | 133.2 | 66% | 0.655 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -97.2 | -15.9 | -172.4 | -71.3 | -91.6 | 0 | 0 | 0 | 114.9 | L73 L79 | L73-Y77 HydrophobicContact CD2-CD2 4Å; L73-Y77 HydrophobicContact CD2-CE2 3.84Å; L73-Y77 WeakPolarHBondContact O-CB 3.19Å; L73-Y77 PolarHBondContact O-N 2.96Å; Y77-L79 PolarHBondContact O-N 3.24Å |
| 78 | G | 51.1 | Low | 51.3 | Low | 61 Ų | 61 | 131.3 Ų | 131.3 | 63% | 0.629 | 68% | 0.683 | S | S | * | * | trans | 66.5 | 38.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | Q74 | Q74-G78 WeakPolarHBondContact O-CA 3.19Å; Q74-G78 PolarHBondContact O-N 3.36Å | ||
| 79 | L | 41.8 | Very low | 48.8 | Very low | 155 Ų | 155 | 134.5 Ų | 134.5 | 81% | 0.812 | 71% | 0.706 | S | S | * | * | trans | -93.8 | 106 | -179.9 | -74.4 | 167.7 | 0 | 0 | 0 | 112.8 | Y77 | Y77-L79 PolarHBondContact O-N 3.24Š| ||
| 80 | A | 38.7 | Very low | 46.7 | Very low | 93 Ų | 93 | 135.9 Ų | 135.9 | 77% | 0.769 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 74.7 | 179.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 81 | P | 40.1 | Very low | 45 | Very low | 117 Ų | 117 | 138.7 Ų | 138.7 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | -115.1 | 167.2 | -105.8 | 23.4 | -2.9 | 0 | 0 | 0 | 115.4 | V83 | P81-V83 PolarHBondContact O-N 2.77Š| |||
| 82 | E | 38.2 | Very low | 42.8 | Very low | 167 Ų | 167 | 137 Ų | 137 | 78% | 0.78 | 75% | 0.752 | S | S | * | * | trans | -56.8 | 125.9 | -177.9 | -73.9 | -163.9 | 170.8 | 0 | 0 | 114.1 | ||||
| 83 | V | 34.6 | Very low | 41.4 | Very low | 131 Ų | 131 | 136.5 Ų | 136.5 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | trans | -122.4 | 110.5 | 160.9 | -178.8 | 0 | 0 | 0 | 0 | 109.5 | P81 K85 | P81-V83 PolarHBondContact O-N 2.77Å; V83-K85 PolarHBondContact O-N 2.82Å | ||
| 84 | K | 36.7 | Very low | 39.5 | Very low | 179 Ų | 179 | 139.4 Ų | 139.4 | 78% | 0.778 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -73 | 120.4 | -177.5 | -65.1 | 172 | -178.5 | 172.2 | 0 | 111.1 | ||
| 85 | K | 35.1 | Very low | 37.9 | Very low | 201 Ų | 201 | 138.7 Ų | 138.7 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -98.8 | 144.3 | 163 | -76.5 | -176.4 | 176.8 | 175.3 | 0 | 110.6 | V83 | V83-K85 PolarHBondContact O-N 2.82Š|
| 86 | K | 30.6 | Very low | 36.1 | Very low | 205 Ų | 205 | 141.7 Ų | 141.7 | 89% | 0.891 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 150.2 | -172.5 | -64.3 | 177.2 | 179.6 | 177.2 | 0 | 111.3 | ||
| 87 | Q | 30.6 | Very low | 34.9 | Very low | 191 Ų | 191 | 143.5 Ų | 143.5 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 147.8 | 169.7 | -66.8 | 171.4 | -46.2 | 0 | 0 | 110.8 | ||
| 88 | A | 31.1 | Very low | 34.2 | Very low | 102 Ų | 102 | 140.1 Ų | 140.1 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | -133.9 | 125 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 89 | T | 28.7 | Very low | 33.2 | Very low | 132 Ų | 132 | 144.1 Ų | 144.1 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -107 | 130.1 | -175.9 | 48.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 90 | V | 31.6 | Very low | 32.5 | Very low | 142 Ų | 142 | 141.9 Ų | 141.9 | 86% | 0.861 | 81% | 0.814 | S | S | * | * | trans | -133.9 | 142.1 | 165.2 | -178.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 91 | L | 29.4 | Very low | 32.2 | Very low | 178 Ų | 178 | 142.9 Ų | 142.9 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | -119.8 | 135.8 | 178.7 | -72.2 | 164.3 | 0 | 0 | 0 | 109.3 | ||||
| 92 | G | 29.6 | Very low | 31.8 | Very low | 75 Ų | 75 | 144.3 Ų | 144.3 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | trans | -162.3 | 149.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 93 | P | 41 | Very low | 31.6 | Very low | 114 Ų | 114 | 143.9 Ų | 143.9 | 74% | 0.74 | 80% | 0.801 | S | S | * | * | trans | -103.2 | 161.1 | -152.1 | 38.5 | -36.4 | 0 | 0 | 0 | 116.5 | ||||
| 94 | D | 27.4 | Very low | 32 | Very low | 155 Ų | 155 | 147.7 Ų | 147.7 | 83% | 0.829 | 80% | 0.801 | S | S | * | * | trans | 36.8 | 123.2 | 153.6 | -57.2 | -32.6 | 0 | 0 | 0 | 119.1 | ||||
| 95 | S | 29.8 | Very low | 31.8 | Very low | 104 Ų | 104 | 144.8 Ų | 144.8 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | 177.9 | 176.3 | 67 | 44.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 96 | Q | 28.5 | Very low | 31.7 | Very low | 180 Ų | 180 | 139 Ų | 139 | 84% | 0.841 | 79% | 0.791 | S | S | * | * | trans | 81.5 | 105.6 | 169.7 | -54.9 | -169.8 | 16 | 0 | 0 | 116.7 | ||||
| 97 | D | 32.7 | Very low | 32.2 | Very low | 164 Ų | 164 | 137.7 Ų | 137.7 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | trans | -61.6 | 130.2 | 171.1 | -51.7 | -97.8 | 0 | 0 | 0 | 111.9 | ||||
| 98 | A | 30.5 | Very low | 32.4 | Very low | 96 Ų | 96 | 131.4 Ų | 131.4 | 79% | 0.793 | 78% | 0.779 | S | S | * | * | trans | -128.6 | 44.1 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110 | S100 | A98-S100 PolarHBondContact O-N 2.88Š| ||
| 99 | D | 30 | Very low | 32.5 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 78% | 0.781 | 78% | 0.782 | S | S | * | * | trans | -74.1 | 70.6 | 174.1 | -156.4 | 18.3 | 0 | 0 | 0 | 109.2 | D101 | D99-D101 PolarHBondContact O-N 2.85Š| ||
| 100 | S | 28.6 | Very low | 32.7 | Very low | 107 Ų | 107 | 133.5 Ų | 133.5 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | -73.8 | 66 | 176.5 | -177.7 | 0 | 0 | 0 | 0 | 109.8 | A98 E102 | A98-S100 PolarHBondContact O-N 2.88Å; S100-E102 VanDerWaalsContact C-N 3.3Å; S100-E102 PolarHBondContact O-N 2.83Å | ||
| 101 | D | 31.4 | Very low | 32.6 | Very low | 114 Ų | 114 | 128.5 Ų | 128.5 | 61% | 0.61 | 75% | 0.754 | S | S | * | * | trans | -63.7 | 90.8 | 172.4 | -152.3 | 13.9 | 0 | 0 | 0 | 107.2 | D99 E103 | D99-D101 PolarHBondContact O-N 2.85Å; D101-E103 VanDerWaalsContact C-N 3.27Å; D101-E103 PolarHBondContact O-N 3.07Å | ||
| 102 | E | 32.6 | Very low | 32.7 | Very low | 148 Ų | 148 | 125 Ų | 125 | 69% | 0.692 | 75% | 0.751 | S | S | * | * | trans | -60.1 | 95.1 | 168.6 | -82.6 | -166.3 | 158.5 | 0 | 0 | 107.4 | S100 W104 | S100-E102 VanDerWaalsContact C-N 3.3Å; S100-E102 PolarHBondContact O-N 2.83Å; E102-W104 VanDerWaalsContact O-CD1 3.32Å; E102-W104 PolarHBondContact O-N 3.04Å | ||
| 103 | E | 34.2 | Very low | 32.7 | Very low | 158 Ų | 158 | 124.1 Ų | 124.1 | 74% | 0.738 | 74% | 0.741 | S | S | * | * | trans | -72.7 | 80 | -174.4 | -170.4 | 165.4 | -143.2 | 0 | 0 | 110.5 | D101 | D101-E103 VanDerWaalsContact C-N 3.27Å; D101-E103 PolarHBondContact O-N 3.07Å | ||
| 104 | W | 42.7 | Very low | 32.4 | Very low | 210 Ų | 210 | 124.7 Ų | 124.7 | 80% | 0.795 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 122.7 | 167.4 | -81.1 | 79 | 0 | 0 | 0 | 108.5 | E102 | E102-W104 VanDerWaalsContact O-CD1 3.32Å; E102-W104 PolarHBondContact O-N 3.04Å |
| 105 | P | 32.2 | Very low | 32.7 | Very low | 118 Ų | 118 | 125 Ų | 125 | 77% | 0.766 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 138.2 | -158.6 | -34.4 | 35.1 | 0 | 0 | 0 | 115.4 | ||
| 106 | A | 33.3 | Very low | 32.7 | Very low | 81 Ų | 81 | 124.2 Ų | 124.2 | 67% | 0.669 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 146.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | G108 | A106-G108 PolarHBondContact O-N 2.89Š|
| 107 | L | 39.8 | Very low | 33 | Very low | 176 Ų | 176 | 122.6 Ų | 122.6 | 92% | 0.921 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | 74.6 | -175.3 | -167.4 | 79.4 | 0 | 0 | 0 | 111.1 | ||
| 108 | G | 35.3 | Very low | 33 | Very low | 60 Ų | 60 | 118.7 Ų | 118.7 | 62% | 0.619 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -154.6 | -59.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | A106 | A106-G108 PolarHBondContact O-N 2.89Š|
| 109 | E | 32.5 | Very low | 33.1 | Very low | 194 Ų | 194 | 120.9 Ų | 120.9 | 91% | 0.907 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | -19.8 | -165.3 | -64.3 | -172.3 | 136.6 | 0 | 0 | 115.3 | G111 | E109-G111 PolarHBondContact O-N 3.1Š|
| 110 | A | 33.7 | Very low | 33.4 | Very low | 83 Ų | 83 | 119 Ų | 119 | 69% | 0.686 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -7.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | A112 | A110-A112 PolarHBondContact O-N 2.98Š|
| 111 | G | 29.9 | Very low | 33.4 | Very low | 38 Ų | 38 | 117.1 Ų | 117.1 | 39% | 0.392 | 71% | 0.706 | S | S | . | * | H | α-helix | trans | -65.6 | -29.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | E109 G113 | E109-G111 PolarHBondContact O-N 3.1Å; G111-G113 VanDerWaalsContact C-N 3.29Å; G111-G113 PolarHBondContact O-N 3.27Å |
| 112 | A | 31.5 | Very low | 33.5 | Very low | 104 Ų | 104 | 115.4 Ų | 115.4 | 86% | 0.86 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -75.8 | -11 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115 | A110 | A110-A112 PolarHBondContact O-N 2.98Å |
| 113 | G | 28.6 | Very low | 33.7 | Very low | 56 Ų | 56 | 116.1 Ų | 116.1 | 58% | 0.577 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -101.1 | -42.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | G111 | G111-G113 VanDerWaalsContact C-N 3.29Å; G111-G113 PolarHBondContact O-N 3.27Å |
| 114 | E | 35.8 | Very low | 34.2 | Very low | 126 Ų | 126 | 109.6 Ų | 109.6 | 59% | 0.589 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -81.6 | -17 | -171.2 | -66.4 | -163.8 | 152.6 | 0 | 0 | 114.2 | A116 E117 | E114-A116 PolarHBondContact O-N 3.48Å; E114-E117 PolarHBondContact O-N 3.05Å; E114-E117 VanDerWaalsContact O-N 3.09Å |
| 115 | E | 32.4 | Very low | 34.2 | Very low | 162 Ų | 162 | 105 Ų | 105 | 76% | 0.757 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -62.5 | -25.8 | -177.2 | -70.3 | -173 | 171.1 | 0 | 0 | 113.4 | A118 | E115-A118 WeakPolarHBondContact O-CB 3.38Š|
| 116 | A | 30 | Very low | 35.2 | Very low | 88 Ų | 88 | 100.8 Ų | 100.8 | 73% | 0.727 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -73.9 | -24.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | E114 A118 | E114-A116 PolarHBondContact O-N 3.48Å; A116-A118 PolarHBondContact O-N 3.07Å |
| 117 | E | 34.5 | Very low | 36.1 | Very low | 146 Ų | 146 | 100.7 Ų | 100.7 | 68% | 0.682 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -83.1 | 5.9 | 177.6 | -72.1 | -152.3 | 169.8 | 0 | 0 | 113.7 | E114 N119 | E114-E117 PolarHBondContact O-N 3.05Å; E114-E117 VanDerWaalsContact O-N 3.09Å; E117-N119 PolarHBondContact O-N 3.37Å |
| 118 | A | 33.5 | Very low | 37 | Very low | 82 Ų | 82 | 96.3 Ų | 96.3 | 68% | 0.678 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -70.1 | -8.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | E115 A116 C120 | E115-A118 WeakPolarHBondContact O-CB 3.38Å; A116-A118 PolarHBondContact O-N 3.07Å; A118-C120 PolarHBondContact O-N 2.85Å |
| 119 | N | 32.1 | Very low | 37.9 | Very low | 141 Ų | 141 | 100.2 Ų | 100.2 | 75% | 0.754 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -74.9 | 119.8 | 169.3 | -165.5 | 31.5 | 0 | 0 | 0 | 110 | E117 G121 | E117-N119 PolarHBondContact O-N 3.37Å; N119-G121 PolarHBondContact O-N 3.29Å |
| 120 | C | 37.2 | Very low | 39.2 | Very low | 106 Ų | 106 | 91.7 Ų | 91.7 | 72% | 0.716 | 58% | 0.575 | S | S | * | * | trans | -76.1 | 64 | -172.2 | -66.9 | 0 | 0 | 0 | 0 | 113.5 | A118 T122 | A118-C120 PolarHBondContact O-N 2.85Å; C120-T122 PolarHBondContact O-N 2.93Å | ||
| 121 | G | 28.3 | Very low | 40.6 | Very low | 68 Ų | 68 | 91.2 Ų | 91.2 | 70% | 0.701 | 56% | 0.558 | S | S | * | * | trans | -67.6 | 42.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | N119 | N119-G121 PolarHBondContact O-N 3.29Š| ||
| 122 | T | 34 | Very low | 42.1 | Very low | 78 Ų | 78 | 94.7 Ų | 94.7 | 48% | 0.479 | 56% | 0.562 | S | S | . | * | trans | -141.6 | 59.2 | 160.6 | -46 | 0 | 0 | 0 | 0 | 107.2 | C120 V124 | C120-T122 PolarHBondContact O-N 2.93Å; T122-V124 PolarHBondContact O-N 3.1Å | ||
| 123 | E | 35.8 | Very low | 43.4 | Very low | 164 Ų | 164 | 90.5 Ų | 90.5 | 77% | 0.766 | 53% | 0.528 | S | S | * | . | trans | -59.4 | 103.5 | 168.9 | -66.7 | -169.3 | 148.2 | 0 | 0 | 108.3 | V125 | E123-V125 HydrophobicContact CB-CG2 3.96Å; E123-V125 PolarHBondContact O-N 3.43Å | ||
| 124 | V | 46.2 | Very low | 45.2 | Very low | 20 Ų | 20 | 87.9 Ų | 87.9 | 12% | 0.121 | 50% | 0.501 | C | S | . | . | trans | -66.6 | 89.8 | 151.8 | -174.1 | 0 | 0 | 0 | 0 | 104.4 | T122 V126 I307 L378 | T122-V124 PolarHBondContact O-N 3.1Å; V124-V126 VanDerWaalsContact C-N 3.33Å; V124-V126 HydrophobicContact CG1-CG2 4.06Å; V124-V126 WeakPolarHBondContact O-CG2 3.46Å; V124-V126 PolarHBondContact O-N 2.72Å; V124-I307 HydrophobicContact CB-CD1 4.35Å; V124-I307 HydrophobicContact CB-CG1 4.36Å; V124-I307 HydrophobicContact CG2-CG1 4.45Å; V124-L378 HydrophobicContact CG1-CD1 4.29Å; V124-L378 HydrophobicContact CG1-CD2 3.57Å | ||
| 125 | V | 42.7 | Very low | 46.3 | Very low | 113 Ų | 113 | 87 Ų | 87 | 69% | 0.685 | 50% | 0.497 | S | S | * | . | trans | -64.9 | 98.5 | 176.9 | -179.4 | 0 | 0 | 0 | 0 | 106.8 | E123 | E123-V125 HydrophobicContact CB-CG2 3.96Å; E123-V125 PolarHBondContact O-N 3.43Å | ||
| 126 | V | 51.6 | Low | 47.8 | Very low | 31 Ų | 31 | 84.9 Ų | 84.9 | 19% | 0.188 | 49% | 0.488 | C | S | . | . | trans | -91.7 | 117.3 | 173.7 | -174 | 0 | 0 | 0 | 0 | 106.8 | V124 D130 E131 M134 I307 L378 | V124-V126 VanDerWaalsContact C-N 3.33Å; V124-V126 HydrophobicContact CG1-CG2 4.06Å; V124-V126 WeakPolarHBondContact O-CG2 3.46Å; V124-V126 PolarHBondContact O-N 2.72Å; V126-D130 HydrophobicContact CG1-CB 3.68Å; V126-E131 HydrophobicContact CB-CG 4.47Å; V126-E131 HydrophobicContact CG1-CB 4.47Å; V126-E131 HydrophobicContact CG1-CG 3.61Å; V126-M134 HydrophobicContact CG1-CE 3.4Å; V126-M134 HydrophobicContact CG2-CE 4.36Å; V126-I307 HydrophobicContact CG2-CD1 4.28Å; V126-L378 HydrophobicContact CG2-CD1 4.22Å | ||
| 127 | D | 53.3 | Low | 49.4 | Very low | 79 Ų | 79 | 81 Ų | 81 | 42% | 0.422 | 46% | 0.455 | S | S | . | . | trans | -66.9 | 145.8 | 173.6 | -167.6 | -76.7 | 0 | 0 | 0 | 110.3 | E129 D130 E131 | D127-E129 PolarHBondContact O-N 3.4Å; D127-E129 WeakPolarHBondContact OD1-CB 3.4Å; D127-E129 PolarHBondContact OD1-N 2.93Å; D127-D130 HydrophobicContact CB-CB 4.3Å; D127-D130 WeakPolarHBondContact O-CA 3.31Å; D127-D130 WeakPolarHBondContact O-CB 3.41Å; D127-D130 PolarHBondContact O-N 3.19Å; D127-E131 PolarHBondContact O-N 2.74Å | ||
| 128 | P | 57.9 | Low | 50.7 | Low | 84 Ų | 84 | 75.9 Ų | 75.9 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -57.2 | -13.5 | 170.9 | 23.4 | -35.8 | 0 | 0 | 0 | 114.9 | K132 | P128-K132 WeakPolarHBondContact O-CD 3.38Å; P128-K132 WeakPolarHBondContact O-CE 3.35Å; P128-K132 WeakPolarHBondContact O-CG 3.21Å; P128-K132 PolarHBondContact O-NZ 2.93Å |
| 129 | E | 54.9 | Low | 51.8 | Low | 141 Ų | 141 | 76 Ų | 76 | 66% | 0.659 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -83.1 | -37.9 | 166.4 | -58.5 | -157.3 | 151.4 | 0 | 0 | 112.7 | D127 K132 A133 | D127-E129 PolarHBondContact O-N 3.4Å; D127-E129 WeakPolarHBondContact OD1-CB 3.4Å; D127-E129 PolarHBondContact OD1-N 2.93Å; E129-K132 WeakPolarHBondContact O-CB 3.36Å; E129-K132 PolarHBondContact O-N 3.12Å; E129-K132 VanDerWaalsContact O-N 3.16Å; E129-A133 PolarHBondContact O-N 3.49Å |
| 130 | D | 59.8 | Low | 52.6 | Low | 15 Ų | 15 | 77.3 Ų | 77.3 | 8% | 0.08 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 171.2 | -89.6 | -50.4 | 0 | 0 | 0 | 112.6 | V126 D127 K132 A133 M134 V377 | V126-D130 HydrophobicContact CG1-CB 3.68Å; D127-D130 HydrophobicContact CB-CB 4.3Å; D127-D130 WeakPolarHBondContact O-CA 3.31Å; D127-D130 WeakPolarHBondContact O-CB 3.41Å; D127-D130 PolarHBondContact O-N 3.19Å; D130-K132 VanDerWaalsContact C-N 3.25Å; D130-K132 PolarHBondContact O-N 3.09Å; D130-A133 PolarHBondContact O-N 3.19Å; D130-M134 HydrophobicContact CB-CE 4.23Å; D130-M134 WeakPolarHBondContact O-CB 3.41Å; D130-M134 WeakPolarHBondContact O-CE 3.29Å; D130-M134 WeakPolarHBondContact O-CG 3.47Å; D130-M134 PolarHBondContact O-N 3.27Å; D130-V377 WeakPolarHBondContact OD1-CB 3.42Å; D130-V377 WeakPolarHBondContact OD1-CG2 3.32Å; D130-V377 PolarHBondContact OD1-N 2.81Å; D130-V377 VanDerWaalsContact OD2-CB 3.3Å; D130-V377 WeakPolarHBondContact OD2-CB 3.48Å; D130-V377 VanDerWaalsContact OD2-CG2 3.32Å; D130-V377 WeakPolarHBondContact OD2-CG2 3.4Å |
| 131 | E | 62.3 | Low | 52.7 | Low | 73 Ų | 73 | 79 Ų | 79 | 34% | 0.341 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -58.5 | -39.8 | 172.8 | -75.4 | -153.2 | 148.9 | 0 | 0 | 111.1 | V126 D127 Q135 L303 | V126-E131 HydrophobicContact CB-CG 4.47Å; V126-E131 HydrophobicContact CG1-CB 4.47Å; V126-E131 HydrophobicContact CG1-CG 3.61Å; D127-E131 PolarHBondContact O-N 2.74Å; E131-Q135 WeakPolarHBondContact O-CB 3.23Å; E131-Q135 WeakPolarHBondContact O-CG 3.48Å; E131-Q135 PolarHBondContact O-N 3.49Å; E131-Q135 PolarHBondContact O-NE2 2.72Å; E131-L303 HydrophobicContact CG-CD1 4.12Å |
| 132 | K | 61.1 | Low | 53.7 | Low | 111 Ų | 111 | 78.1 Ų | 78.1 | 48% | 0.483 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -71 | -44.4 | 177.3 | -63.7 | 163.7 | -163.3 | 150.1 | 0 | 111.5 | P128 E129 D130 M134 Q135 M136 | P128-K132 WeakPolarHBondContact O-CD 3.38Å; P128-K132 WeakPolarHBondContact O-CE 3.35Å; P128-K132 WeakPolarHBondContact O-CG 3.21Å; P128-K132 PolarHBondContact O-NZ 2.93Å; E129-K132 WeakPolarHBondContact O-CB 3.36Å; E129-K132 PolarHBondContact O-N 3.12Å; E129-K132 VanDerWaalsContact O-N 3.16Å; D130-K132 VanDerWaalsContact C-N 3.25Å; D130-K132 PolarHBondContact O-N 3.09Å; K132-M134 VanDerWaalsContact C-N 3.35Å; K132-M134 PolarHBondContact O-N 2.98Å; K132-Q135 WeakPolarHBondContact O-CB 3.47Å; K132-Q135 PolarHBondContact O-N 3.12Å; K132-M136 WeakPolarHBondContact O-CG 3.44Å; K132-M136 PolarHBondContact O-N 3.05Å |
| 133 | A | 59.5 | Low | 54.1 | Low | 16 Ų | 16 | 79.1 Ų | 79.1 | 13% | 0.132 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -58.2 | -47.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | E129 D130 Q135 M136 F137 P376 | E129-A133 PolarHBondContact O-N 3.49Å; D130-A133 PolarHBondContact O-N 3.19Å; A133-Q135 VanDerWaalsContact C-N 3.35Å; A133-Q135 PolarHBondContact O-N 3.2Å; A133-M136 WeakPolarHBondContact O-CB 3.28Å; A133-M136 PolarHBondContact O-N 2.99Å; A133-F137 VanDerWaalsContact O-CD2 3.27Å; A133-F137 WeakPolarHBondContact O-CD2 3.47Å; A133-P376 HydrophobicContact CB-CB 4.28Å; A133-P376 HydrophobicContact CB-CG 4.2Å |
| 134 | M | 65.7 | Low | 54.5 | Low | 1 Ų | 1 | 80 Ų | 80 | 1% | 0.005 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -64.4 | -34.5 | 175.6 | -72.1 | -172.8 | -74.2 | 0 | 0 | 113.1 | V126 D130 K132 M136 F137 M138 L303 P376 L378 | V126-M134 HydrophobicContact CG1-CE 3.4Å; V126-M134 HydrophobicContact CG2-CE 4.36Å; D130-M134 HydrophobicContact CB-CE 4.23Å; D130-M134 WeakPolarHBondContact O-CB 3.41Å; D130-M134 WeakPolarHBondContact O-CE 3.29Å; D130-M134 WeakPolarHBondContact O-CG 3.47Å; D130-M134 PolarHBondContact O-N 3.27Å; K132-M134 VanDerWaalsContact C-N 3.35Å; K132-M134 PolarHBondContact O-N 2.98Å; M134-M136 PolarHBondContact O-N 3.5Å; M134-F137 CarbonylContact O-C 3.49Å; M134-F137 PolarHBondContact O-N 2.96Å; M134-M138 WeakPolarHBondContact O-CG 3.24Å; M134-M138 PolarHBondContact O-N 3.18Å; M134-L303 HydrophobicContact CB-CD1 4.4Å; M134-L303 HydrophobicContact CB-CD2 4.15Å; M134-L303 HydrophobicContact CE-CD1 3.61Å; M134-L303 HydrophobicContact CE-CD2 3.72Å; M134-L303 HydrophobicContact CE-CG 4.33Å; M134-L303 HydrophobicContact CG-CD2 4.4Å; M134-L303 HydrophobicContact SD-CD1 4.36Å; M134-L303 HydrophobicContact SD-CD2 3.4Å; M134-L303 WeakPolarHBondContact SD-CD2 3.42Å; M134-P376 HydrophobicContact CG-CB 3.74Å; M134-P376 HydrophobicContact CG-CG 3.51Å; M134-L378 HydrophobicContact CE-CD1 3.6Å; M134-L378 HydrophobicContact SD-CD1 3.6Å; M134-L378 VanDerWaalsContact SD-CD1 3.6Å |
| 135 | Q | 60.3 | Low | 54.7 | Low | 109 Ų | 109 | 84.8 Ų | 84.8 | 51% | 0.509 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.4 | -16.2 | 170.9 | -75.5 | 167.9 | 44.7 | 0 | 0 | 113.8 | E131 K132 A133 | E131-Q135 WeakPolarHBondContact O-CB 3.23Å; E131-Q135 WeakPolarHBondContact O-CG 3.48Å; E131-Q135 PolarHBondContact O-N 3.49Å; E131-Q135 PolarHBondContact O-NE2 2.72Å; K132-Q135 WeakPolarHBondContact O-CB 3.47Å; K132-Q135 PolarHBondContact O-N 3.12Å; A133-Q135 VanDerWaalsContact C-N 3.35Å; A133-Q135 PolarHBondContact O-N 3.2Å |
| 136 | M | 62.7 | Low | 54.7 | Low | 116 Ų | 116 | 86.6 Ų | 86.6 | 57% | 0.571 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -11.4 | 169.6 | -56.7 | -171.3 | -162.6 | 0 | 0 | 113.6 | K132 A133 M134 R373 | K132-M136 WeakPolarHBondContact O-CG 3.44Å; K132-M136 PolarHBondContact O-N 3.05Å; A133-M136 WeakPolarHBondContact O-CB 3.28Å; A133-M136 PolarHBondContact O-N 2.99Å; M134-M136 PolarHBondContact O-N 3.5Å; M136-R373 PolarHBondContact O-NH1 3.38Å |
| 137 | F | 64 | Low | 54.9 | Low | 8 Ų | 8 | 88.6 Ų | 88.6 | 4% | 0.035 | 44% | 0.44 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.8 | -14.5 | 172.8 | -66.1 | -78 | 0 | 0 | 0 | 113.7 | A133 M134 Y335 E371 R373 V374 L375 P376 | A133-F137 VanDerWaalsContact O-CD2 3.27Å; A133-F137 WeakPolarHBondContact O-CD2 3.47Å; M134-F137 CarbonylContact O-C 3.49Å; M134-F137 PolarHBondContact O-N 2.96Å; F137-Y335 HydrophobicContact CB-CD1 4.07Å; F137-Y335 HydrophobicContact CB-CE1 3.91Å; F137-Y335 AromaticContact CD1-CD1 3.41Å; F137-Y335 HydrophobicContact CD1-CD1 3.41Å; F137-Y335 VanDerWaalsContact CD1-CD1 3.41Å; F137-Y335 AromaticContact CD1-CE1 3.53Å; F137-Y335 HydrophobicContact CD1-CE1 3.53Å; F137-Y335 AromaticContact CD2-CE1 3.98Å; F137-Y335 HydrophobicContact CD2-CE1 3.98Å; F137-Y335 AromaticContact CE1-CD1 3.92Å; F137-Y335 HydrophobicContact CE1-CD1 3.92Å; F137-Y335 AromaticContact CE1-CE1 3.92Å; F137-Y335 HydrophobicContact CE1-CE1 3.92Å; F137-Y335 HydrophobicContact CE2-CE1 4.36Å; F137-Y335 AromaticContact CG-CD1 3.82Å; F137-Y335 HydrophobicContact CG-CD1 3.82Å; F137-Y335 AromaticContact CG-CE1 3.54Å; F137-Y335 HydrophobicContact CG-CE1 3.54Å; F137-Y335 HydrophobicContact CZ-CE1 4.32Å; F137-E371 HydrophobicContact CE1-CG 4.31Å; F137-R373 VanDerWaalsContact CD1-CZ 3.43Å; F137-R373 VanDerWaalsContact CD1-NH1 3.33Å; F137-R373 HydrophobicContact CE1-CB 3.73Å; F137-R373 HydrophobicContact CE1-CG 4.37Å; F137-R373 VanDerWaalsContact CE1-CZ 3.46Å; F137-R373 HydrophobicContact CE2-CB 4.15Å; F137-R373 HydrophobicContact CZ-CB 3.35Å; F137-R373 HydrophobicContact CZ-CG 4.37Å; F137-V374 WeakPolarHBondContact CE2-O 3.48Å; F137-L375 HydrophobicContact CE1-CD2 4.31Å; F137-L375 HydrophobicContact CE2-CD2 4.41Å; F137-L375 HydrophobicContact CZ-CD2 3.77Å; F137-L375 HydrophobicContact CZ-CG 4.48Å; F137-P376 HydrophobicContact CD2-CG 4.09Å; F137-P376 HydrophobicContact CE2-CG 4.23Å |
| 138 | M | 62.1 | Low | 54.7 | Low | 37 Ų | 37 | 89.2 Ų | 89.2 | 18% | 0.182 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -71.3 | 134.7 | 166.5 | -72.8 | -171.5 | 170.6 | 0 | 0 | 110.1 | M134 K140 C301 L303 A338 | M134-M138 WeakPolarHBondContact O-CG 3.24Å; M134-M138 PolarHBondContact O-N 3.18Å; M138-K140 PolarHBondContact O-N 3.28Å; M138-C301 VanDerWaalsContact CE-O 3.23Å; M138-C301 WeakPolarHBondContact CE-O 3.28Å; M138-L303 HydrophobicContact CE-CD2 3.42Å; M138-L303 VanDerWaalsContact CE-CD2 3.42Å; M138-L303 HydrophobicContact CE-CG 3.69Å; M138-A338 HydrophobicContact CE-CB 4.25Å |
| 139 | N | 55.4 | Low | 54.2 | Low | 86 Ų | 86 | 87.6 Ų | 87.6 | 46% | 0.46 | 44% | 0.437 | S | S | . | . | trans | -65.4 | 118.8 | 178.6 | -175 | -6.8 | 0 | 0 | 0 | 109.4 | N141 P142 | N139-N141 VanDerWaalsContact C-N 3.34Å; N139-N141 PolarHBondContact ND2-O 2.91Å; N139-N141 VanDerWaalsContact OD1-C 3.3Å; N139-N141 PolarHBondContact OD1-N 2.71Å; N139-N141 VanDerWaalsContact OD1-N 3.08Å; N139-N141 PolarHBondContact OD1-O 2.81Å; N139-P142 WeakPolarHBondContact O-CD 3.41Å | ||
| 140 | K | 49 | Very low | 54.2 | Low | 167 Ų | 167 | 84 Ų | 84 | 73% | 0.726 | 42% | 0.422 | S | S | * | . | S | Bend | trans | -73.3 | -26.7 | -176 | -64.6 | -178.7 | 179.4 | 178.9 | 0 | 112.9 | M138 | M138-K140 PolarHBondContact O-N 3.28Š|
| 141 | N | 39.1 | Very low | 54.3 | Low | 142 Ų | 142 | 86.3 Ų | 86.3 | 76% | 0.759 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -121.6 | 79 | 170.4 | -81 | -1.3 | 0 | 0 | 0 | 108.7 | N139 | N139-N141 VanDerWaalsContact C-N 3.34Å; N139-N141 PolarHBondContact ND2-O 2.91Å; N139-N141 VanDerWaalsContact OD1-C 3.3Å; N139-N141 PolarHBondContact OD1-N 2.71Å; N139-N141 VanDerWaalsContact OD1-N 3.08Å; N139-N141 PolarHBondContact OD1-O 2.81Å |
| 142 | P | 49.4 | Very low | 54.4 | Low | 49 Ų | 49 | 86.2 Ų | 86.2 | 32% | 0.318 | 44% | 0.435 | S | S | . | . | P | Polyproline II helix | trans | -62.9 | 148.9 | 164.4 | 30.3 | -32.9 | 0 | 0 | 0 | 109.1 | N139 M144 T300 | N139-P142 WeakPolarHBondContact O-CD 3.41Å; P142-M144 PolarHBondContact O-N 3.04Å; P142-T300 HydrophobicContact CB-CG2 3.35Å; P142-T300 HydrophobicContact CG-CG2 3.79Å |
| 143 | P | 44.2 | Very low | 54.3 | Low | 99 Ų | 99 | 86 Ų | 86 | 64% | 0.643 | 44% | 0.437 | S | S | * | . | P | Polyproline II helix | trans | -57.6 | 135.9 | 168.8 | 26.1 | -33.4 | 0 | 0 | 0 | 109 | R145 | P143-R145 PolarHBondContact O-N 3.13Š|
| 144 | M | 43.6 | Very low | 54.6 | Low | 183 Ų | 183 | 88.4 Ų | 88.4 | 90% | 0.901 | 45% | 0.445 | S | S | * | . | P | Polyproline II helix | trans | -53.6 | 128.3 | 178.6 | -79.7 | -178.4 | 164.8 | 0 | 0 | 109.9 | P142 R146 | P142-M144 PolarHBondContact O-N 3.04Å; M144-R146 PolarHBondContact O-N 3.35Å |
| 145 | R | 50.5 | Low | 54.4 | Low | 120 Ų | 120 | 94.1 Ų | 94.1 | 45% | 0.453 | 47% | 0.47 | S | S | . | . | trans | -64.2 | 95.4 | 177.9 | -66 | -177.2 | -175.8 | 168.3 | 4.5 | 109 | P143 T147 T300 E305 | P143-R145 PolarHBondContact O-N 3.13Å; R145-T147 PolarHBondContact O-N 3.02Å; R145-T300 HydrophobicContact CG-CG2 4.32Å; R145-T300 PolarHBondContact NE-OG1 2.84Å; R145-T300 PolarHBondContact NH2-OG1 3.02Å; R145-E305 IonicContact NH2-OE1 2.85Å | ||
| 146 | R | 41.4 | Very low | 54.4 | Low | 152 Ų | 152 | 93 Ų | 93 | 57% | 0.574 | 47% | 0.467 | S | S | * | . | trans | -74.2 | 108.5 | 167.2 | -57.6 | -177 | 174.7 | -160.1 | -11.4 | 107.5 | M144 D150 I151 E154 | M144-R146 PolarHBondContact O-N 3.35Å; R146-D150 HydrophobicContact CB-CB 4.35Å; R146-I151 HydrophobicContact CB-CD1 4.13Å; R146-I151 HydrophobicContact CB-CG1 3.64Å; R146-E154 IonicContact CZ-OE1 2.7Å; R146-E154 IonicContact CZ-OE2 3.03Å; R146-E154 IonicContact NE-OE1 2.65Å; R146-E154 IonicContact NE-OE2 2.72Å; R146-E154 IonicContact NH1-OE1 3.98Å; R146-E154 PolarHBondContact NH1-OE1 3.18Å; R146-E154 IonicContact NH1-OE2 3.95Å; R146-E154 PolarHBondContact NH1-OE2 3.09Å; R146-E154 IonicContact NH2-OE1 2.68Å; R146-E154 PolarHBondContact NH2-OE1 3.33Å; R146-E154 IonicContact NH2-OE2 3.31Å | ||
| 147 | T | 57.1 | Low | 54.2 | Low | 72 Ų | 72 | 91.2 Ų | 91.2 | 44% | 0.442 | 46% | 0.463 | S | S | . | . | trans | -66.1 | 167.4 | 172 | 68.3 | 0 | 0 | 0 | 0 | 110 | R145 A149 D150 I151 | R145-T147 PolarHBondContact O-N 3.02Å; T147-A149 PolarHBondContact O-N 3.19Å; T147-A149 PolarHBondContact OG1-N 2.99Å; T147-D150 VanDerWaalsContact CB-OD2 3.26Å; T147-D150 WeakPolarHBondContact CB-OD2 3.45Å; T147-D150 WeakPolarHBondContact CG2-OD2 3.49Å; T147-D150 PolarHBondContact N-OD2 3.32Å; T147-D150 PolarHBondContact O-N 2.9Å; T147-D150 VanDerWaalsContact O-N 3.09Å; T147-D150 PolarHBondContact OG1-N 3.31Å; T147-D150 PolarHBondContact OG1-OD2 2.84Å; T147-I151 WeakPolarHBondContact O-CG1 3.4Å; T147-I151 PolarHBondContact O-N 2.82Å | ||
| 148 | L | 49.5 | Very low | 53.9 | Low | 92 Ų | 92 | 96 Ų | 96 | 48% | 0.482 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.8 | -33 | 173.3 | -164.5 | 73 | 0 | 0 | 0 | 111.2 | I152 | L148-I152 HydrophobicContact CD2-CD1 4.38Å; L148-I152 HydrophobicContact CG-CD1 3.94Å; L148-I152 VanDerWaalsContact O-CB 3.27Å; L148-I152 WeakPolarHBondContact O-CB 3.48Å; L148-I152 WeakPolarHBondContact O-CD1 3.26Å; L148-I152 WeakPolarHBondContact O-CG1 3.17Å; L148-I152 PolarHBondContact O-N 3.06Å |
| 149 | A | 46.5 | Very low | 53.6 | Low | 51 Ų | 51 | 99.5 Ų | 99.5 | 42% | 0.421 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.8 | -42.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T147 I152 M153 | T147-A149 PolarHBondContact O-N 3.19Å; T147-A149 PolarHBondContact OG1-N 2.99Å; A149-I152 PolarHBondContact O-N 3.4Å; A149-M153 HydrophobicContact CB-CE 4.24Å; A149-M153 WeakPolarHBondContact O-CB 3.14Å; A149-M153 VanDerWaalsContact O-CG 3.32Å; A149-M153 WeakPolarHBondContact O-CG 3.35Å; A149-M153 PolarHBondContact O-N 3.48Å |
| 150 | D | 55.5 | Low | 53.4 | Low | 64 Ų | 64 | 101.6 Ų | 101.6 | 34% | 0.342 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.1 | -45.2 | 176.7 | -55 | -52.4 | 0 | 0 | 0 | 111.6 | R146 T147 I152 M153 E154 | R146-D150 HydrophobicContact CB-CB 4.35Å; T147-D150 VanDerWaalsContact CB-OD2 3.26Å; T147-D150 WeakPolarHBondContact CB-OD2 3.45Å; T147-D150 WeakPolarHBondContact CG2-OD2 3.49Å; T147-D150 PolarHBondContact N-OD2 3.32Å; T147-D150 PolarHBondContact O-N 2.9Å; T147-D150 VanDerWaalsContact O-N 3.09Å; T147-D150 PolarHBondContact OG1-N 3.31Å; T147-D150 PolarHBondContact OG1-OD2 2.84Å; D150-I152 PolarHBondContact O-N 3.26Å; D150-M153 PolarHBondContact O-N 3.45Å; D150-E154 WeakPolarHBondContact O-CB 3.33Å; D150-E154 PolarHBondContact O-N 3.25Å |
| 151 | I | 62.4 | Low | 53.5 | Low | 65 Ų | 65 | 99.1 Ų | 99.1 | 33% | 0.333 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.1 | -35.7 | 177.4 | -62.4 | 170.2 | 0 | 0 | 0 | 110.8 | R146 T147 K155 | R146-I151 HydrophobicContact CB-CD1 4.13Å; R146-I151 HydrophobicContact CB-CG1 3.64Å; T147-I151 WeakPolarHBondContact O-CG1 3.4Å; T147-I151 PolarHBondContact O-N 2.82Å; I151-K155 HydrophobicContact CG2-CD 4.36Å; I151-K155 VanDerWaalsContact O-CB 3.27Å; I151-K155 WeakPolarHBondContact O-CB 3.1Å; I151-K155 WeakPolarHBondContact O-CG 3.39Å; I151-K155 PolarHBondContact O-N 3.29Å; I151-K155 VanDerWaalsContact O-N 3.14Å |
| 152 | I | 62.9 | Low | 53.8 | Low | 70 Ų | 70 | 98.4 Ų | 98.4 | 36% | 0.359 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -74.5 | -43.1 | 176.3 | -73 | 170.4 | 0 | 0 | 0 | 111.1 | L148 A149 D150 K155 I156 | L148-I152 HydrophobicContact CD2-CD1 4.38Å; L148-I152 HydrophobicContact CG-CD1 3.94Å; L148-I152 VanDerWaalsContact O-CB 3.27Å; L148-I152 WeakPolarHBondContact O-CB 3.48Å; L148-I152 WeakPolarHBondContact O-CD1 3.26Å; L148-I152 WeakPolarHBondContact O-CG1 3.17Å; L148-I152 PolarHBondContact O-N 3.06Å; A149-I152 PolarHBondContact O-N 3.4Å; D150-I152 PolarHBondContact O-N 3.26Å; I152-K155 PolarHBondContact O-N 3.28Å; I152-I156 HydrophobicContact CG2-CD1 3.6Å; I152-I156 HydrophobicContact CG2-CG1 4.34Å; I152-I156 VanDerWaalsContact O-CB 3.27Å; I152-I156 WeakPolarHBondContact O-CB 3.37Å; I152-I156 WeakPolarHBondContact O-CG1 3.45Å; I152-I156 PolarHBondContact O-N 3.42Å |
| 153 | M | 59.3 | Low | 53.7 | Low | 107 Ų | 107 | 99.3 Ų | 99.3 | 53% | 0.527 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.9 | -45.7 | 177.7 | -75.4 | -173.9 | -68.1 | 0 | 0 | 111.7 | A149 D150 K155 I156 T157 | A149-M153 HydrophobicContact CB-CE 4.24Å; A149-M153 WeakPolarHBondContact O-CB 3.14Å; A149-M153 VanDerWaalsContact O-CG 3.32Å; A149-M153 WeakPolarHBondContact O-CG 3.35Å; A149-M153 PolarHBondContact O-N 3.48Å; D150-M153 PolarHBondContact O-N 3.45Å; M153-K155 PolarHBondContact O-N 3.05Å; M153-I156 CarbonylContact O-C 3.56Å; M153-I156 PolarHBondContact O-N 2.79Å; M153-I156 VanDerWaalsContact O-N 3.1Å; M153-T157 PolarHBondContact O-N 2.91Å; M153-T157 PolarHBondContact O-OG1 2.92Å; M153-T157 VanDerWaalsContact O-OG1 3.11Å |
| 154 | E | 65 | Low | 53.6 | Low | 66 Ų | 66 | 97.9 Ų | 97.9 | 31% | 0.308 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -55 | -52.4 | 173.7 | -172.4 | 179 | -159.4 | 0 | 0 | 109.9 | R146 D150 I156 T157 E158 | R146-E154 IonicContact CZ-OE1 2.7Å; R146-E154 IonicContact CZ-OE2 3.03Å; R146-E154 IonicContact NE-OE1 2.65Å; R146-E154 IonicContact NE-OE2 2.72Å; R146-E154 IonicContact NH1-OE1 3.98Å; R146-E154 PolarHBondContact NH1-OE1 3.18Å; R146-E154 IonicContact NH1-OE2 3.95Å; R146-E154 PolarHBondContact NH1-OE2 3.09Å; R146-E154 IonicContact NH2-OE1 2.68Å; R146-E154 PolarHBondContact NH2-OE1 3.33Å; R146-E154 IonicContact NH2-OE2 3.31Å; D150-E154 WeakPolarHBondContact O-CB 3.33Å; D150-E154 PolarHBondContact O-N 3.25Å; E154-I156 VanDerWaalsContact C-N 3.31Å; E154-I156 PolarHBondContact O-N 3.05Å; E154-T157 WeakPolarHBondContact CA-OG1 3.26Å; E154-T157 PolarHBondContact O-N 2.89Å; E154-T157 VanDerWaalsContact O-N 3.16Å; E154-T157 PolarHBondContact O-OG1 3.41Å; E154-E158 WeakPolarHBondContact O-CB 3.45Å; E154-E158 PolarHBondContact O-N 3.23Å |
| 155 | K | 62.7 | Low | 53.8 | Low | 122 Ų | 122 | 95.1 Ų | 95.1 | 53% | 0.53 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.9 | -22.8 | 176 | -74.6 | -176.2 | 172.4 | -178 | 0 | 114.8 | I151 I152 M153 K159 | I151-K155 HydrophobicContact CG2-CD 4.36Å; I151-K155 VanDerWaalsContact O-CB 3.27Å; I151-K155 WeakPolarHBondContact O-CB 3.1Å; I151-K155 WeakPolarHBondContact O-CG 3.39Å; I151-K155 PolarHBondContact O-N 3.29Å; I151-K155 VanDerWaalsContact O-N 3.14Å; I152-K155 PolarHBondContact O-N 3.28Å; M153-K155 PolarHBondContact O-N 3.05Å; K155-K159 WeakPolarHBondContact O-CB 3.43Å; K155-K159 WeakPolarHBondContact O-CG 3.38Å; K155-K159 PolarHBondContact O-N 2.89Å; K155-K159 VanDerWaalsContact O-N 3.11Å |
| 156 | I | 60.1 | Low | 53.2 | Low | 84 Ų | 84 | 94.5 Ų | 94.5 | 43% | 0.431 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -76 | -40.4 | 171.2 | -77.4 | 169.5 | 0 | 0 | 0 | 109.9 | I152 M153 E154 Q160 | I152-I156 HydrophobicContact CG2-CD1 3.6Å; I152-I156 HydrophobicContact CG2-CG1 4.34Å; I152-I156 VanDerWaalsContact O-CB 3.27Å; I152-I156 WeakPolarHBondContact O-CB 3.37Å; I152-I156 WeakPolarHBondContact O-CG1 3.45Å; I152-I156 PolarHBondContact O-N 3.42Å; M153-I156 CarbonylContact O-C 3.56Å; M153-I156 PolarHBondContact O-N 2.79Å; M153-I156 VanDerWaalsContact O-N 3.1Å; E154-I156 VanDerWaalsContact C-N 3.31Å; E154-I156 PolarHBondContact O-N 3.05Å; I156-Q160 HydrophobicContact CG2-CG 4.42Å; I156-Q160 VanDerWaalsContact O-CB 3.24Å; I156-Q160 WeakPolarHBondContact O-CB 3.49Å; I156-Q160 WeakPolarHBondContact O-CG 3.29Å; I156-Q160 PolarHBondContact O-N 2.93Å |
| 157 | T | 58 | Low | 53 | Low | 80 Ų | 80 | 93.3 Ų | 93.3 | 49% | 0.491 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -69.7 | -45 | 176.3 | 50.1 | 0 | 0 | 0 | 0 | 112.3 | M153 E154 K159 Q160 T161 | M153-T157 PolarHBondContact O-N 2.91Å; M153-T157 PolarHBondContact O-OG1 2.92Å; M153-T157 VanDerWaalsContact O-OG1 3.11Å; E154-T157 WeakPolarHBondContact CA-OG1 3.26Å; E154-T157 PolarHBondContact O-N 2.89Å; E154-T157 VanDerWaalsContact O-N 3.16Å; E154-T157 PolarHBondContact O-OG1 3.41Å; T157-K159 PolarHBondContact O-N 3.25Å; T157-Q160 PolarHBondContact O-N 3.4Å; T157-Q160 VanDerWaalsContact O-N 3.08Å; T157-T161 PolarHBondContact O-N 3.27Å; T157-T161 PolarHBondContact O-OG1 3.31Å |
| 158 | E | 59.1 | Low | 52 | Low | 108 Ų | 108 | 95.3 Ų | 95.3 | 51% | 0.505 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 175.5 | -173.9 | 176.5 | -119.6 | 0 | 0 | 110.4 | E154 T161 E162 | E154-E158 WeakPolarHBondContact O-CB 3.45Å; E154-E158 PolarHBondContact O-N 3.23Å; E158-T161 WeakPolarHBondContact CA-OG1 3.23Å; E158-T161 PolarHBondContact O-N 3.14Å; E158-T161 PolarHBondContact O-OG1 2.86Å; E158-E162 PolarHBondContact O-N 2.7Å |
| 159 | K | 55.7 | Low | 51.3 | Low | 110 Ų | 110 | 99.4 Ų | 99.4 | 48% | 0.478 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.6 | -40 | 170.3 | -75.5 | -174.4 | 171.3 | -163.3 | 0 | 113 | K155 T157 T161 E162 V163 | K155-K159 WeakPolarHBondContact O-CB 3.43Å; K155-K159 WeakPolarHBondContact O-CG 3.38Å; K155-K159 PolarHBondContact O-N 2.89Å; K155-K159 VanDerWaalsContact O-N 3.11Å; T157-K159 PolarHBondContact O-N 3.25Å; K159-T161 PolarHBondContact O-N 2.97Å; K159-E162 CarbonylContact O-C 3.52Å; K159-E162 PolarHBondContact O-N 3.42Å; K159-V163 HydrophobicContact CB-CG2 4.45Å; K159-V163 VanDerWaalsContact O-CB 3.26Å; K159-V163 WeakPolarHBondContact O-CB 3.49Å; K159-V163 WeakPolarHBondContact O-CG2 3.37Å; K159-V163 PolarHBondContact O-N 3.03Å |
| 160 | Q | 49.8 | Very low | 50.9 | Low | 130 Ų | 130 | 103.2 Ų | 103.2 | 61% | 0.607 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.5 | -31 | 177.4 | -83.1 | 173.3 | 4.7 | 0 | 0 | 111.9 | I156 T157 | I156-Q160 HydrophobicContact CG2-CG 4.42Å; I156-Q160 VanDerWaalsContact O-CB 3.24Å; I156-Q160 WeakPolarHBondContact O-CB 3.49Å; I156-Q160 WeakPolarHBondContact O-CG 3.29Å; I156-Q160 PolarHBondContact O-N 2.93Å; T157-Q160 PolarHBondContact O-N 3.4Å; T157-Q160 VanDerWaalsContact O-N 3.08Å |
| 161 | T | 51.8 | Low | 49.9 | Very low | 116 Ų | 116 | 104.8 Ų | 104.8 | 71% | 0.712 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -72.9 | -26.2 | 171.2 | 42.4 | 0 | 0 | 0 | 0 | 114.5 | T157 E158 K159 | T157-T161 PolarHBondContact O-N 3.27Å; T157-T161 PolarHBondContact O-OG1 3.31Å; E158-T161 WeakPolarHBondContact CA-OG1 3.23Å; E158-T161 PolarHBondContact O-N 3.14Å; E158-T161 PolarHBondContact O-OG1 2.86Å; K159-T161 PolarHBondContact O-N 2.97Å |
| 162 | E | 46.1 | Very low | 48.7 | Very low | 127 Ų | 127 | 105.7 Ų | 105.7 | 59% | 0.593 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -88.3 | -26 | 171.4 | -65.7 | -173 | 129.7 | 0 | 0 | 113.9 | E158 K159 G164 T165 V166 | E158-E162 PolarHBondContact O-N 2.7Å; K159-E162 CarbonylContact O-C 3.52Å; K159-E162 PolarHBondContact O-N 3.42Å; E162-G164 PolarHBondContact O-N 3.4Å; E162-G164 VanDerWaalsContact O-N 3.15Å; E162-T165 PolarHBondContact O-N 3.15Å; E162-T165 VanDerWaalsContact O-N 3.15Å; E162-T165 PolarHBondContact O-OG1 2.92Å; E162-V166 PolarHBondContact O-N 3.02Å |
| 163 | V | 46.5 | Very low | 47.3 | Very low | 68 Ų | 68 | 113.3 Ų | 113.3 | 41% | 0.412 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -61.1 | -25.4 | -175.9 | 157.7 | 0 | 0 | 0 | 0 | 112 | K159 T165 M167 | K159-V163 HydrophobicContact CB-CG2 4.45Å; K159-V163 VanDerWaalsContact O-CB 3.26Å; K159-V163 WeakPolarHBondContact O-CB 3.49Å; K159-V163 WeakPolarHBondContact O-CG2 3.37Å; K159-V163 PolarHBondContact O-N 3.03Å; V163-T165 PolarHBondContact O-N 2.9Å; V163-M167 HydrophobicContact CB-CG 3.9Å; V163-M167 HydrophobicContact CG1-CG 4.07Å; V163-M167 HydrophobicContact CG2-CG 3.53Å; V163-M167 HydrophobicContact CG2-SD 3.97Å |
| 164 | G | 41.6 | Very low | 46.3 | Very low | 69 Ų | 69 | 114 Ų | 114 | 71% | 0.711 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -62.8 | -15.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | E162 | E162-G164 PolarHBondContact O-N 3.4Å; E162-G164 VanDerWaalsContact O-N 3.15Å |
| 165 | T | 47.3 | Very low | 45.4 | Very low | 125 Ų | 125 | 118.3 Ų | 118.3 | 77% | 0.767 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -137.1 | -19.6 | -173.1 | 42.8 | 0 | 0 | 0 | 0 | 117.2 | E162 V163 | E162-T165 PolarHBondContact O-N 3.15Å; E162-T165 VanDerWaalsContact O-N 3.15Å; E162-T165 PolarHBondContact O-OG1 2.92Å; V163-T165 PolarHBondContact O-N 2.9Å |
| 166 | V | 39.4 | Very low | 44.9 | Very low | 106 Ų | 106 | 116.3 Ų | 116.3 | 64% | 0.642 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -134.3 | 15.4 | -169.2 | -147.2 | 0 | 0 | 0 | 0 | 116 | E162 S168 | E162-V166 PolarHBondContact O-N 3.02Å; V166-S168 PolarHBondContact O-N 3.5Å |
| 167 | M | 35.7 | Very low | 45 | Very low | 128 Ų | 128 | 121.4 Ų | 121.4 | 63% | 0.631 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | 72.8 | -178.9 | -78.9 | -80.8 | 99.9 | 0 | 0 | 114.3 | V163 | V163-M167 HydrophobicContact CB-CG 3.9Å; V163-M167 HydrophobicContact CG1-CG 4.07Å; V163-M167 HydrophobicContact CG2-CG 3.53Å; V163-M167 HydrophobicContact CG2-SD 3.97Å |
| 168 | S | 37.8 | Very low | 45.6 | Very low | 113 Ų | 113 | 119.3 Ų | 119.3 | 79% | 0.79 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.8 | -37.7 | 166.3 | -168.3 | 0 | 0 | 0 | 0 | 115.1 | V166 | V166-S168 PolarHBondContact O-N 3.5Š|
| 169 | E | 33.3 | Very low | 46.5 | Very low | 179 Ų | 179 | 118 Ų | 118 | 84% | 0.836 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -121.4 | -21.1 | -160.5 | -61 | -162.7 | 130.7 | 0 | 0 | 118.3 | ||
| 170 | V | 38 | Very low | 47.8 | Very low | 131 Ų | 131 | 117.1 Ų | 117.1 | 79% | 0.794 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -124.7 | 78.3 | -168.8 | -167.6 | 0 | 0 | 0 | 0 | 114.6 | ||
| 171 | S | 36 | Very low | 49.4 | Very low | 96 Ų | 96 | 119.8 Ų | 119.8 | 67% | 0.671 | 68% | 0.675 | S | S | * | * | trans | -176.3 | 70.6 | 149.6 | -84.2 | 0 | 0 | 0 | 0 | 111.5 | R173 | S171-R173 VanDerWaalsContact C-N 3.3Å; S171-R173 PolarHBondContact O-N 2.81Å | ||
| 172 | G | 36.3 | Very low | 51 | Low | 84 Ų | 84 | 117.4 Ų | 117.4 | 87% | 0.866 | 66% | 0.657 | S | S | * | * | trans | -72.3 | 59 | -171.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 173 | R | 33.3 | Very low | 52.9 | Low | 231 Ų | 231 | 113.7 Ų | 113.7 | 87% | 0.872 | 64% | 0.641 | S | S | * | * | trans | -143 | 102.3 | 159 | -71.4 | -165.8 | -178 | -168.3 | 1.1 | 110.5 | S171 | S171-R173 VanDerWaalsContact C-N 3.3Å; S171-R173 PolarHBondContact O-N 2.81Å | ||
| 174 | P | 38.4 | Very low | 54.8 | Low | 120 Ų | 120 | 117.2 Ų | 117.2 | 78% | 0.779 | 65% | 0.653 | S | S | * | * | trans | -63.8 | 148.7 | 169.1 | 28.6 | -34.1 | 0 | 0 | 0 | 109.8 | ||||
| 175 | M | 47.3 | Very low | 57.2 | Low | 157 Ų | 157 | 117.7 Ų | 117.7 | 77% | 0.773 | 64% | 0.642 | S | S | * | * | trans | -59.9 | 134 | 165 | -78 | -147.2 | -67.2 | 0 | 0 | 108.8 | Q177 | M175-Q177 PolarHBondContact O-N 3.46Š| ||
| 176 | P | 52.2 | Low | 59.2 | Low | 80 Ų | 80 | 112.3 Ų | 112.3 | 52% | 0.519 | 61% | 0.608 | S | S | . | * | trans | -59.7 | 109 | 165.8 | -17.4 | 30.3 | 0 | 0 | 0 | 107.7 | L178 | P176-L178 PolarHBondContact O-N 3.32Š| ||
| 177 | Q | 62 | Low | 61.6 | Low | 192 Ų | 192 | 112.2 Ų | 112.2 | 90% | 0.897 | 60% | 0.599 | S | S | * | * | trans | -66.4 | 108.8 | 175.3 | -68.5 | -178.1 | -5.8 | 0 | 0 | 107.4 | M175 | M175-Q177 PolarHBondContact O-N 3.46Š| ||
| 178 | L | 69.1 | Low | 64.1 | Low | 36 Ų | 36 | 107.9 Ų | 107.9 | 19% | 0.188 | 59% | 0.587 | C | S | . | * | trans | -60.5 | 140.9 | 172.4 | -66.9 | 173.1 | 0 | 0 | 0 | 108.6 | P176 I183 Q216 V217 L220 | P176-L178 PolarHBondContact O-N 3.32Å; L178-I183 HydrophobicContact CB-CD1 4.4Å; L178-I183 HydrophobicContact CB-CG1 4.18Å; L178-Q216 HydrophobicContact CD1-CB 4.05Å; L178-V217 HydrophobicContact CD1-CG2 4.45Å; L178-L220 HydrophobicContact CD1-CD1 3.7Å | ||
| 179 | D | 79.6 | Confident | 66.7 | Low | 81 Ų | 81 | 103 Ų | 103 | 43% | 0.433 | 55% | 0.552 | S | S | . | * | trans | -49.3 | 128.8 | 177.3 | -177.8 | -36.2 | 0 | 0 | 0 | 109.6 | R181 I182 I183 | D179-R181 PolarHBondContact O-N 3.44Å; D179-R181 VanDerWaalsContact OD1-CB 3.26Å; D179-R181 WeakPolarHBondContact OD1-CB 3.42Å; D179-R181 WeakPolarHBondContact OD1-CG 3.42Å; D179-R181 PolarHBondContact OD1-N 3.27Å; D179-I182 HydrophobicContact CB-CB 4.44Å; D179-I182 HydrophobicContact CB-CD1 3.92Å; D179-I182 HydrophobicContact CB-CG1 4.03Å; D179-I182 WeakPolarHBondContact O-CA 3.41Å; D179-I182 VanDerWaalsContact O-CB 3.3Å; D179-I182 WeakPolarHBondContact O-CB 3.35Å; D179-I182 PolarHBondContact O-N 2.66Å; D179-I183 PolarHBondContact O-N 3.2Å | ||
| 180 | P | 82.9 | Confident | 69.4 | Low | 90 Ų | 90 | 95.1 Ų | 95.1 | 58% | 0.584 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -48.5 | -33.5 | 177.9 | -30.7 | 36.6 | 0 | 0 | 0 | 114 | I182 I183 E184 | P180-I182 PolarHBondContact O-N 3.19Å; P180-I183 WeakPolarHBondContact O-CB 3.4Å; P180-I183 PolarHBondContact O-N 2.8Å; P180-E184 WeakPolarHBondContact O-CG 3.38Å; P180-E184 PolarHBondContact O-N 3.39Å |
| 181 | R | 83.1 | Confident | 71.9 | Confident | 187 Ų | 187 | 96.4 Ų | 96.4 | 71% | 0.706 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.8 | -37.4 | 175.8 | -63.4 | 172.7 | 165.6 | -171.3 | -4.4 | 112.6 | D179 I183 V185 | D179-R181 PolarHBondContact O-N 3.44Å; D179-R181 VanDerWaalsContact OD1-CB 3.26Å; D179-R181 WeakPolarHBondContact OD1-CB 3.42Å; D179-R181 WeakPolarHBondContact OD1-CG 3.42Å; D179-R181 PolarHBondContact OD1-N 3.27Å; R181-I183 VanDerWaalsContact C-N 3.34Å; R181-V185 WeakPolarHBondContact O-CB 3.39Å; R181-V185 VanDerWaalsContact O-CG2 3.28Å; R181-V185 WeakPolarHBondContact O-CG2 3.26Å; R181-V185 PolarHBondContact O-N 3.18Å |
| 182 | I | 84.4 | Confident | 74.6 | Confident | 66 Ų | 66 | 95.2 Ų | 95.2 | 34% | 0.338 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 173.8 | -66.9 | 174.7 | 0 | 0 | 0 | 109.2 | D179 P180 E184 V185 Y186 | D179-I182 HydrophobicContact CB-CB 4.44Å; D179-I182 HydrophobicContact CB-CD1 3.92Å; D179-I182 HydrophobicContact CB-CG1 4.03Å; D179-I182 WeakPolarHBondContact O-CA 3.41Å; D179-I182 VanDerWaalsContact O-CB 3.3Å; D179-I182 WeakPolarHBondContact O-CB 3.35Å; D179-I182 PolarHBondContact O-N 2.66Å; P180-I182 PolarHBondContact O-N 3.19Å; I182-E184 PolarHBondContact O-N 3.37Å; I182-V185 PolarHBondContact O-N 3.4Å; I182-Y186 HydrophobicContact CG2-CD2 3.71Å; I182-Y186 HydrophobicContact CG2-CE2 3.83Å; I182-Y186 VanDerWaalsContact O-CD2 3.28Å; I182-Y186 WeakPolarHBondContact O-CD2 3.46Å; I182-Y186 PolarHBondContact O-N 3.27Å |
| 183 | I | 86.2 | Confident | 77.2 | Confident | 49 Ų | 49 | 91.2 Ų | 91.2 | 25% | 0.251 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 178.7 | -60.1 | 175.1 | 0 | 0 | 0 | 111 | L178 D179 P180 R181 K187 L220 | L178-I183 HydrophobicContact CB-CD1 4.4Å; L178-I183 HydrophobicContact CB-CG1 4.18Å; D179-I183 PolarHBondContact O-N 3.2Å; P180-I183 WeakPolarHBondContact O-CB 3.4Å; P180-I183 PolarHBondContact O-N 2.8Å; R181-I183 VanDerWaalsContact C-N 3.34Å; I183-K187 HydrophobicContact CG2-CD 4.04Å; I183-K187 WeakPolarHBondContact O-CB 3.44Å; I183-K187 VanDerWaalsContact O-CG 3.29Å; I183-K187 WeakPolarHBondContact O-CG 3.49Å; I183-K187 PolarHBondContact O-N 2.95Å; I183-L220 HydrophobicContact CG1-CD1 4.02Å; I183-L220 HydrophobicContact CG2-CD2 4.18Å |
| 184 | E | 87.9 | Confident | 80.1 | Confident | 142 Ų | 142 | 82.3 Ų | 82.3 | 66% | 0.664 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -63 | -44.9 | 176.3 | -72.8 | 178.6 | 168.2 | 0 | 0 | 112.6 | P180 I182 K187 G188 | P180-E184 WeakPolarHBondContact O-CG 3.38Å; P180-E184 PolarHBondContact O-N 3.39Å; I182-E184 PolarHBondContact O-N 3.37Å; E184-K187 PolarHBondContact O-N 3.04Å; E184-G188 PolarHBondContact O-N 3.11Å |
| 185 | V | 90.3 | Very high | 82.6 | Confident | 78 Ų | 78 | 86.9 Ų | 86.9 | 47% | 0.473 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.5 | -47.4 | 179.1 | 166.8 | 0 | 0 | 0 | 0 | 111.6 | R181 I182 G188 V189 A204 | R181-V185 WeakPolarHBondContact O-CB 3.39Å; R181-V185 VanDerWaalsContact O-CG2 3.28Å; R181-V185 WeakPolarHBondContact O-CG2 3.26Å; R181-V185 PolarHBondContact O-N 3.18Å; I182-V185 PolarHBondContact O-N 3.4Å; V185-G188 WeakPolarHBondContact O-CA 3.34Å; V185-G188 PolarHBondContact O-N 3.13Å; V185-G188 VanDerWaalsContact O-N 3.12Å; V185-V189 WeakPolarHBondContact O-CG2 3.17Å; V185-V189 PolarHBondContact O-N 3.18Å; V185-A204 HydrophobicContact CG1-CB 4.17Å |
| 186 | Y | 89.7 | Confident | 84.8 | Confident | 13 Ų | 13 | 80.1 Ų | 80.1 | 5% | 0.051 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -73.6 | -31.3 | -178.6 | -74.5 | -71.5 | 0 | 0 | 0 | 113.2 | I182 G188 V189 N190 A204 I208 V217 T221 | I182-Y186 HydrophobicContact CG2-CD2 3.71Å; I182-Y186 HydrophobicContact CG2-CE2 3.83Å; I182-Y186 VanDerWaalsContact O-CD2 3.28Å; I182-Y186 WeakPolarHBondContact O-CD2 3.46Å; I182-Y186 PolarHBondContact O-N 3.27Å; Y186-G188 VanDerWaalsContact C-N 3.26Å; Y186-G188 PolarHBondContact O-N 3.5Å; Y186-V189 HydrophobicContact CD1-CG2 4.48Å; Y186-V189 WeakPolarHBondContact O-CB 3.28Å; Y186-V189 PolarHBondContact O-N 3.39Å; Y186-V189 VanDerWaalsContact O-N 3.12Å; Y186-N190 PolarHBondContact O-N 2.83Å; Y186-A204 HydrophobicContact CE1-CB 4.21Å; Y186-A204 WeakPolarHBondContact CE1-O 3.07Å; Y186-A204 PolarHBondContact OH-O 3.04Å; Y186-A204 VanDerWaalsContact OH-O 3.09Å; Y186-I208 HydrophobicContact CD1-CD1 4.26Å; Y186-I208 HydrophobicContact CE1-CD1 3.79Å; Y186-I208 HydrophobicContact CE1-CG1 3.77Å; Y186-V217 HydrophobicContact CD1-CG1 3.76Å; Y186-V217 HydrophobicContact CD2-CG1 3.7Å; Y186-V217 HydrophobicContact CE1-CG1 3.53Å; Y186-V217 HydrophobicContact CE2-CG1 3.46Å; Y186-V217 VanDerWaalsContact CE2-CG1 3.46Å; Y186-V217 HydrophobicContact CG-CG1 3.85Å; Y186-T221 HydrophobicContact CD1-CG2 3.78Å; Y186-T221 HydrophobicContact CG-CG2 4.3Å |
| 187 | K | 89.2 | Confident | 86.6 | Confident | 104 Ų | 104 | 86.3 Ų | 86.3 | 45% | 0.452 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.5 | -30.1 | 166.1 | -73.9 | 179.9 | 177.2 | -175.9 | 0 | 112.8 | I183 E184 | I183-K187 HydrophobicContact CG2-CD 4.04Å; I183-K187 WeakPolarHBondContact O-CB 3.44Å; I183-K187 VanDerWaalsContact O-CG 3.29Å; I183-K187 WeakPolarHBondContact O-CG 3.49Å; I183-K187 PolarHBondContact O-N 2.95Å; E184-K187 PolarHBondContact O-N 3.04Å |
| 188 | G | 89.4 | Confident | 87.8 | Confident | 37 Ų | 37 | 81.5 Ų | 81.5 | 38% | 0.381 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | E184 V185 Y186 K191 | E184-G188 PolarHBondContact O-N 3.11Å; V185-G188 WeakPolarHBondContact O-CA 3.34Å; V185-G188 PolarHBondContact O-N 3.13Å; V185-G188 VanDerWaalsContact O-N 3.12Å; Y186-G188 VanDerWaalsContact C-N 3.26Å; Y186-G188 PolarHBondContact O-N 3.5Å; G188-K191 PolarHBondContact O-N 3.45Å |
| 189 | V | 91.5 | Very high | 88.9 | Confident | 10 Ų | 10 | 82.3 Ų | 82.3 | 6% | 0.061 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.8 | -41 | 177.6 | 170.4 | 0 | 0 | 0 | 0 | 112.2 | V185 Y186 K191 V192 L193 P202 A204 F205 T221 | V185-V189 WeakPolarHBondContact O-CG2 3.17Å; V185-V189 PolarHBondContact O-N 3.18Å; Y186-V189 HydrophobicContact CD1-CG2 4.48Å; Y186-V189 WeakPolarHBondContact O-CB 3.28Å; Y186-V189 PolarHBondContact O-N 3.39Å; Y186-V189 VanDerWaalsContact O-N 3.12Å; V189-K191 VanDerWaalsContact C-N 3.33Å; V189-K191 PolarHBondContact O-N 2.96Å; V189-V192 WeakPolarHBondContact O-CA 3.3Å; V189-V192 WeakPolarHBondContact O-CB 3.44Å; V189-V192 PolarHBondContact O-N 3.49Å; V189-L193 HydrophobicContact CG1-CD1 3.72Å; V189-L193 HydrophobicContact CG1-CG 4.04Å; V189-L193 WeakPolarHBondContact O-CG 2.97Å; V189-L193 PolarHBondContact O-N 2.75Å; V189-P202 HydrophobicContact CG2-CB 4.38Å; V189-A204 HydrophobicContact CG2-CB 4.25Å; V189-F205 HydrophobicContact CG1-CB 4.14Å; V189-F205 HydrophobicContact CG1-CD2 4.06Å; V189-T221 HydrophobicContact CB-CG2 4.46Å; V189-T221 HydrophobicContact CG1-CG2 4.22Å |
| 190 | N | 91.3 | Very high | 89.3 | Confident | 13 Ų | 13 | 87 Ų | 87 | 7% | 0.07 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -50.2 | -50.5 | 173.7 | 172.5 | 2.1 | 0 | 0 | 0 | 112 | Y186 V192 L193 S194 E222 T225 | Y186-N190 PolarHBondContact O-N 2.83Å; N190-V192 PolarHBondContact O-N 3.44Å; N190-L193 PolarHBondContact O-N 3.2Å; N190-S194 PolarHBondContact O-N 3.45Å; N190-S194 PolarHBondContact O-OG 3.21Å; N190-E222 PolarHBondContact ND2-OE1 3.05Å; N190-E222 PolarHBondContact ND2-OE2 3.36Å; N190-T225 PolarHBondContact OD1-OG1 2.97Å |
| 191 | K | 90.6 | Very high | 89.7 | Confident | 158 Ų | 158 | 83.1 Ų | 83.1 | 69% | 0.687 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -60.1 | -18.3 | 179.6 | -65.3 | 176.1 | -178.8 | 177.1 | 0 | 114.1 | G188 V189 | G188-K191 PolarHBondContact O-N 3.45Å; V189-K191 VanDerWaalsContact C-N 3.33Å; V189-K191 PolarHBondContact O-N 2.96Å |
| 192 | V | 92 | Very high | 90.1 | Very high | 71 Ų | 71 | 76 Ų | 76 | 43% | 0.43 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -86.2 | -48.5 | 170.9 | -176.8 | 0 | 0 | 0 | 0 | 110.3 | V189 N190 S194 R195 Y196 P202 | V189-V192 WeakPolarHBondContact O-CA 3.3Å; V189-V192 WeakPolarHBondContact O-CB 3.44Å; V189-V192 PolarHBondContact O-N 3.49Å; N190-V192 PolarHBondContact O-N 3.44Å; V192-S194 PolarHBondContact O-N 3.29Å; V192-R195 CarbonylContact O-C 3.52Å; V192-R195 PolarHBondContact O-N 3.19Å; V192-R195 VanDerWaalsContact O-N 3.12Å; V192-Y196 WeakPolarHBondContact O-CB 3.38Å; V192-Y196 PolarHBondContact O-N 3.05Å; V192-P202 HydrophobicContact CG1-CG 4.41Å |
| 193 | L | 91.7 | Very high | 90.4 | Very high | 1 Ų | 1 | 81.8 Ų | 81.8 | 1% | 0.005 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -64.5 | -34.5 | -176.1 | -64.6 | 174.6 | 0 | 0 | 0 | 114.1 | V189 N190 R195 Y196 L201 F205 W226 T227 A230 | V189-L193 HydrophobicContact CG1-CD1 3.72Å; V189-L193 HydrophobicContact CG1-CG 4.04Å; V189-L193 WeakPolarHBondContact O-CG 2.97Å; V189-L193 PolarHBondContact O-N 2.75Å; N190-L193 PolarHBondContact O-N 3.2Å; L193-R195 PolarHBondContact O-N 2.8Å; L193-Y196 PolarHBondContact O-N 3.04Å; L193-L201 HydrophobicContact CD2-CD2 3.69Å; L193-F205 HydrophobicContact CD1-CD2 3.68Å; L193-F205 HydrophobicContact CD1-CE2 3.6Å; L193-F205 HydrophobicContact CD1-CZ 4.41Å; L193-F205 HydrophobicContact CD2-CD2 4.47Å; L193-W226 HydrophobicContact CB-CG 4.16Å; L193-W226 HydrophobicContact CD1-CD2 4.31Å; L193-W226 HydrophobicContact CD1-CZ2 3.81Å; L193-T227 PolarHBondContact O-N 2.91Å; L193-T227 PolarHBondContact O-OG1 3.46Å; L193-A230 HydrophobicContact CB-CB 4.4Å; L193-A230 HydrophobicContact CD2-CB 4.15Å |
| 194 | S | 92.4 | Very high | 90.6 | Very high | 44 Ų | 44 | 80.7 Ų | 80.7 | 31% | 0.308 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -13.5 | 175 | 46.5 | 0 | 0 | 0 | 0 | 114 | N190 V192 T225 T227 | N190-S194 PolarHBondContact O-N 3.45Å; N190-S194 PolarHBondContact O-OG 3.21Å; V192-S194 PolarHBondContact O-N 3.29Å; S194-T225 WeakPolarHBondContact CA-O 3.47Å; S194-T225 WeakPolarHBondContact CB-O 3.46Å; S194-T227 PolarHBondContact O-OG1 3.05Å |
| 195 | R | 92.8 | Very high | 90.8 | Very high | 216 Ų | 216 | 73.9 Ų | 73.9 | 82% | 0.815 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.8 | 5.9 | 176.4 | -63.1 | -177.6 | 177.1 | -171.5 | -1.6 | 113.2 | V192 L193 | V192-R195 CarbonylContact O-C 3.52Å; V192-R195 PolarHBondContact O-N 3.19Å; V192-R195 VanDerWaalsContact O-N 3.12Å; L193-R195 PolarHBondContact O-N 2.8Å |
| 196 | Y | 93.3 | Very high | 90.8 | Very high | 14 Ų | 14 | 75.1 Ų | 75.1 | 6% | 0.055 | 37% | 0.374 | C | S | . | . | trans | -78.9 | 132 | -167 | -179.6 | -91.2 | 0 | 0 | 0 | 112.6 | V192 L193 S198 G199 L201 T227 A229 A230 Q233 | V192-Y196 WeakPolarHBondContact O-CB 3.38Å; V192-Y196 PolarHBondContact O-N 3.05Å; L193-Y196 PolarHBondContact O-N 3.04Å; Y196-S198 VanDerWaalsContact CE2-O 3.23Å; Y196-S198 WeakPolarHBondContact CE2-O 3.31Å; Y196-S198 WeakPolarHBondContact OH-CA 3.44Å; Y196-G199 PolarHBondContact OH-N 3.11Å; Y196-G199 PolarHBondContact OH-O 2.77Å; Y196-L201 HydrophobicContact CD2-CD2 4.06Å; Y196-L201 HydrophobicContact CE1-CD2 4.42Å; Y196-L201 HydrophobicContact CE2-CD2 3.9Å; Y196-L201 HydrophobicContact CE2-CG 4.49Å; Y196-L201 HydrophobicContact CG-CD2 4.39Å; Y196-T227 PolarHBondContact N-OG1 3.45Å; Y196-T227 WeakPolarHBondContact O-CB 3.32Å; Y196-T227 VanDerWaalsContact O-CG2 3.3Å; Y196-T227 WeakPolarHBondContact O-CG2 3.43Å; Y196-T227 PolarHBondContact O-OG1 3.47Å; Y196-A229 HydrophobicContact CD1-CB 4.3Å; Y196-A230 HydrophobicContact CD1-CB 4Å; Y196-A230 HydrophobicContact CG-CB 4.38Å; Y196-Q233 VanDerWaalsContact OH-CD 3.25Å; Y196-Q233 PolarHBondContact OH-NE2 2.79Å; Y196-Q233 PolarHBondContact OH-OE1 3.1Å; Y196-Q233 VanDerWaalsContact OH-OE1 3.05Å | ||
| 197 | R | 89.2 | Confident | 90.9 | Very high | 211 Ų | 211 | 78.9 Ų | 78.9 | 80% | 0.796 | 39% | 0.394 | S | S | * | . | trans | -121.4 | -47.8 | 171 | -69.5 | -168.3 | 175.3 | -142.2 | 0.7 | 113.1 | ||||
| 198 | S | 88.3 | Confident | 91 | Very high | 90 Ų | 90 | 74 Ų | 74 | 63% | 0.629 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -153.8 | 172 | -175.1 | 57.3 | 0 | 0 | 0 | 0 | 111.9 | Y196 | Y196-S198 VanDerWaalsContact CE2-O 3.23Å; Y196-S198 WeakPolarHBondContact CE2-O 3.31Å; Y196-S198 WeakPolarHBondContact OH-CA 3.44Å |
| 199 | G | 90.3 | Very high | 91 | Very high | 54 Ų | 54 | 72.9 Ų | 72.9 | 56% | 0.557 | 36% | 0.358 | S | S | * | . | S | Bend | trans | 105.1 | -175.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114 | Y196 | Y196-G199 PolarHBondContact OH-N 3.11Å; Y196-G199 PolarHBondContact OH-O 2.77Å |
| 200 | K | 89.6 | Confident | 90.9 | Very high | 179 Ų | 179 | 76.7 Ų | 76.7 | 78% | 0.778 | 39% | 0.391 | S | S | * | . | P | Polyproline II helix | trans | -83.4 | 125 | 177.4 | -64.1 | -168.5 | 178.8 | -167.7 | 0 | 110.1 | ||
| 201 | L | 90.1 | Very high | 90.7 | Very high | 9 Ų | 9 | 78.8 Ų | 78.8 | 5% | 0.047 | 40% | 0.402 | C | S | . | . | P | Polyproline II helix | trans | -62.4 | 149 | 176.4 | -78.8 | 174.2 | 0 | 0 | 0 | 112.5 | L193 Y196 F205 Q233 I237 | L193-L201 HydrophobicContact CD2-CD2 3.69Å; Y196-L201 HydrophobicContact CD2-CD2 4.06Å; Y196-L201 HydrophobicContact CE1-CD2 4.42Å; Y196-L201 HydrophobicContact CE2-CD2 3.9Å; Y196-L201 HydrophobicContact CE2-CG 4.49Å; Y196-L201 HydrophobicContact CG-CD2 4.39Å; L201-F205 HydrophobicContact CD1-CD1 3.96Å; L201-F205 HydrophobicContact CD1-CE1 4.08Å; L201-Q233 HydrophobicContact CD1-CB 3.61Å; L201-Q233 HydrophobicContact CG-CB 4.47Å; L201-I237 HydrophobicContact CD1-CD1 3.67Å |
| 202 | P | 92.3 | Very high | 90.4 | Very high | 38 Ų | 38 | 76.6 Ų | 76.6 | 25% | 0.247 | 41% | 0.407 | C | S | . | . | P | Polyproline II helix | trans | -54.3 | 140.1 | -179.6 | -26.6 | 34.8 | 0 | 0 | 0 | 113.5 | V189 V192 A204 F205 K206 | V189-P202 HydrophobicContact CG2-CB 4.38Å; V192-P202 HydrophobicContact CG1-CG 4.41Å; P202-A204 VanDerWaalsContact C-N 3.25Å; P202-A204 PolarHBondContact O-N 2.68Å; P202-F205 HydrophobicContact CB-CB 4.45Å; P202-F205 WeakPolarHBondContact O-CB 3.32Å; P202-F205 PolarHBondContact O-N 3.08Å; P202-K206 PolarHBondContact O-N 2.77Å |
| 203 | K | 89.9 | Confident | 90.2 | Very high | 186 Ų | 186 | 76 Ų | 76 | 81% | 0.809 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -55.9 | -39.6 | 178.5 | -69.8 | -167.7 | 178.2 | -171.4 | 0 | 112.2 | F205 K206 I207 | K203-F205 VanDerWaalsContact C-N 3.28Å; K203-F205 PolarHBondContact O-N 3.1Å; K203-K206 PolarHBondContact O-N 3.16Å; K203-I207 PolarHBondContact O-N 3.31Å |
| 204 | A | 90.7 | Very high | 90.1 | Very high | 26 Ų | 26 | 76.4 Ų | 76.4 | 22% | 0.215 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -57.7 | -37.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | V185 Y186 V189 P202 I207 | V185-A204 HydrophobicContact CG1-CB 4.17Å; Y186-A204 HydrophobicContact CE1-CB 4.21Å; Y186-A204 WeakPolarHBondContact CE1-O 3.07Å; Y186-A204 PolarHBondContact OH-O 3.04Å; Y186-A204 VanDerWaalsContact OH-O 3.09Å; V189-A204 HydrophobicContact CG2-CB 4.25Å; P202-A204 VanDerWaalsContact C-N 3.25Å; P202-A204 PolarHBondContact O-N 2.68Å; A204-I207 WeakPolarHBondContact O-CG1 3.49Å |
| 205 | F | 92.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 77.9 Ų | 77.9 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -72.1 | -40.1 | 176.5 | -171.9 | -95.9 | 0 | 0 | 0 | 112.1 | V189 L193 L201 P202 K203 I207 I208 W226 A234 I237 F238 | V189-F205 HydrophobicContact CG1-CB 4.14Å; V189-F205 HydrophobicContact CG1-CD2 4.06Å; L193-F205 HydrophobicContact CD1-CD2 3.68Å; L193-F205 HydrophobicContact CD1-CE2 3.6Å; L193-F205 HydrophobicContact CD1-CZ 4.41Å; L193-F205 HydrophobicContact CD2-CD2 4.47Å; L201-F205 HydrophobicContact CD1-CD1 3.96Å; L201-F205 HydrophobicContact CD1-CE1 4.08Å; P202-F205 HydrophobicContact CB-CB 4.45Å; P202-F205 WeakPolarHBondContact O-CB 3.32Å; P202-F205 PolarHBondContact O-N 3.08Å; K203-F205 VanDerWaalsContact C-N 3.28Å; K203-F205 PolarHBondContact O-N 3.1Å; F205-I207 PolarHBondContact O-N 3.41Å; F205-I208 HydrophobicContact CD2-CD1 3.56Å; F205-I208 HydrophobicContact CE2-CD1 3.92Å; F205-I208 HydrophobicContact CG-CD1 4.25Å; F205-I208 WeakPolarHBondContact O-CG1 3.27Å; F205-I208 PolarHBondContact O-N 3.36Å; F205-W226 AromaticContact CE2-CH2 3.63Å; F205-W226 HydrophobicContact CE2-CH2 3.63Å; F205-W226 AromaticContact CE2-CZ2 3.68Å; F205-W226 HydrophobicContact CE2-CZ2 3.68Å; F205-W226 AromaticContact CZ-CH2 3.61Å; F205-W226 HydrophobicContact CZ-CH2 3.61Å; F205-W226 HydrophobicContact CZ-CZ2 4.11Å; F205-W226 HydrophobicContact CZ-CZ3 4.17Å; F205-A234 HydrophobicContact CE1-CB 3.92Å; F205-A234 HydrophobicContact CZ-CB 3.64Å; F205-I237 HydrophobicContact CD1-CD1 4.27Å; F205-I237 HydrophobicContact CE1-CD1 4.32Å; F205-F238 AromaticContact CZ-CE2 3.98Å; F205-F238 HydrophobicContact CZ-CE2 3.98Å; F205-F238 HydrophobicContact CZ-CZ 4.37Å |
| 206 | K | 91 | Very high | 89.5 | Confident | 104 Ų | 104 | 70.7 Ų | 70.7 | 45% | 0.452 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.3 | -27.4 | 179.3 | -67.3 | -169.9 | 176 | -167 | 0 | 113.8 | P202 K203 I237 | P202-K206 PolarHBondContact O-N 2.77Å; K203-K206 PolarHBondContact O-N 3.16Å; K206-I237 HydrophobicContact CG-CD1 4.21Å |
| 207 | I | 91.4 | Very high | 89.3 | Confident | 92 Ų | 92 | 70.2 Ų | 70.2 | 47% | 0.472 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | -10.4 | -179.1 | 62.5 | 168.7 | 0 | 0 | 0 | 114.4 | K203 A204 F205 P209 A210 | K203-I207 PolarHBondContact O-N 3.31Å; A204-I207 WeakPolarHBondContact O-CG1 3.49Å; F205-I207 PolarHBondContact O-N 3.41Å; I207-P209 VanDerWaalsContact C-CD 3.47Å; I207-P209 VanDerWaalsContact C-N 3.29Å; I207-A210 PolarHBondContact O-N 3.14Å |
| 208 | I | 90.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 34% | 0.343 | C | S | . | . | G | 310 helix | trans | -49.5 | -44.3 | 179.1 | -61.4 | 175.5 | 0 | 0 | 0 | 112.2 | Y186 F205 A210 L211 W214 V217 F238 | Y186-I208 HydrophobicContact CD1-CD1 4.26Å; Y186-I208 HydrophobicContact CE1-CD1 3.79Å; Y186-I208 HydrophobicContact CE1-CG1 3.77Å; F205-I208 HydrophobicContact CD2-CD1 3.56Å; F205-I208 HydrophobicContact CE2-CD1 3.92Å; F205-I208 HydrophobicContact CG-CD1 4.25Å; F205-I208 WeakPolarHBondContact O-CG1 3.27Å; F205-I208 PolarHBondContact O-N 3.36Å; I208-A210 PolarHBondContact O-N 2.91Å; I208-A210 VanDerWaalsContact O-N 3.11Å; I208-L211 PolarHBondContact O-N 3.1Å; I208-L211 VanDerWaalsContact O-N 3.1Å; I208-W214 HydrophobicContact CG2-CB 3.95Å; I208-W214 VanDerWaalsContact O-CB 3.27Å; I208-W214 WeakPolarHBondContact O-CB 3.35Å; I208-V217 HydrophobicContact CD1-CG1 4.1Å; I208-V217 HydrophobicContact CG1-CG1 3.87Å; I208-V217 HydrophobicContact CG2-CG1 4.37Å; I208-F238 HydrophobicContact CB-CE1 4.42Å; I208-F238 HydrophobicContact CB-CZ 4.44Å; I208-F238 HydrophobicContact CG2-CE1 4.02Å; I208-F238 HydrophobicContact CG2-CZ 4.1Å |
| 209 | P | 90 | Very high | 89.4 | Confident | 14 Ų | 14 | 63.5 Ų | 63.5 | 9% | 0.091 | 34% | 0.341 | C | S | . | . | G | 310 helix | trans | -51.8 | -27.1 | 173 | -33.7 | 38.5 | 0 | 0 | 0 | 118.1 | I207 I237 F238 N241 L242 | I207-P209 VanDerWaalsContact C-CD 3.47Å; I207-P209 VanDerWaalsContact C-N 3.29Å; P209-I237 HydrophobicContact CG-CG2 3.7Å; P209-F238 HydrophobicContact CG-CD1 3.94Å; P209-F238 HydrophobicContact CG-CE1 3.97Å; P209-N241 HydrophobicContact CB-CB 3.45Å; P209-N241 VanDerWaalsContact CB-CB 3.45Å; P209-N241 HydrophobicContact CG-CB 3.87Å; P209-L242 VanDerWaalsContact CA-CD1 3.49Å; P209-L242 HydrophobicContact CB-CD1 3.41Å; P209-L242 VanDerWaalsContact CB-CD1 3.41Å; P209-L242 HydrophobicContact CG-CD1 3.86Å |
| 210 | A | 89.4 | Confident | 89.3 | Confident | 90 Ų | 90 | 62.4 Ų | 62.4 | 74% | 0.744 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -92.2 | -5.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113 | I207 I208 | I207-A210 PolarHBondContact O-N 3.14Å; I208-A210 PolarHBondContact O-N 2.91Å; I208-A210 VanDerWaalsContact O-N 3.11Å |
| 211 | L | 87.6 | Confident | 89.2 | Confident | 57 Ų | 57 | 53.9 Ų | 53.9 | 30% | 0.298 | 29% | 0.285 | S | S | . | . | trans | -84.6 | 137.2 | -178.5 | -54.9 | -179.9 | 0 | 0 | 0 | 111 | I208 N213 W214 V217 | I208-L211 PolarHBondContact O-N 3.1Å; I208-L211 VanDerWaalsContact O-N 3.1Å; L211-N213 PolarHBondContact O-N 3.27Å; L211-W214 HydrophobicContact CB-CB 4.47Å; L211-W214 WeakPolarHBondContact O-CB 3.4Å; L211-W214 PolarHBondContact O-N 3.48Å; L211-V217 HydrophobicContact CD1-CB 4.3Å; L211-V217 HydrophobicContact CD1-CG1 4.04Å; L211-V217 HydrophobicContact CD1-CG2 3.97Å | ||
| 212 | S | 84.5 | Confident | 89.2 | Confident | 113 Ų | 113 | 57 Ų | 57 | 79% | 0.79 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -39.8 | 171.9 | 55.4 | 0 | 0 | 0 | 0 | 112 | W214 | S212-W214 PolarHBondContact O-N 3.19Š|
| 213 | N | 86.9 | Confident | 89.2 | Confident | 58 Ų | 58 | 55.7 Ų | 55.7 | 31% | 0.31 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.4 | 32.8 | -175.6 | -61.9 | 22.4 | 0 | 0 | 0 | 112.1 | L211 E215 Q216 V217 | L211-N213 PolarHBondContact O-N 3.27Å; N213-E215 PolarHBondContact O-N 3.18Å; N213-E215 VanDerWaalsContact O-N 3.14Å; N213-Q216 PolarHBondContact ND2-OE1 2.9Å; N213-Q216 PolarHBondContact O-N 3.3Å; N213-Q216 VanDerWaalsContact O-N 3.08Å; N213-V217 PolarHBondContact O-N 3.37Å |
| 214 | W | 88.9 | Confident | 89.1 | Confident | 10 Ų | 10 | 53.1 Ų | 53.1 | 4% | 0.038 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -53.7 | -35.1 | -174.6 | 71.6 | -85.7 | 0 | 0 | 0 | 113.7 | I208 L211 S212 Q216 V217 L218 L242 M246 R249 F250 | I208-W214 HydrophobicContact CG2-CB 3.95Å; I208-W214 VanDerWaalsContact O-CB 3.27Å; I208-W214 WeakPolarHBondContact O-CB 3.35Å; L211-W214 HydrophobicContact CB-CB 4.47Å; L211-W214 WeakPolarHBondContact O-CB 3.4Å; L211-W214 PolarHBondContact O-N 3.48Å; S212-W214 PolarHBondContact O-N 3.19Å; W214-Q216 PolarHBondContact O-N 3.33Å; W214-V217 PolarHBondContact O-N 3.16Å; W214-L218 HydrophobicContact CE3-CD2 4.06Å; W214-L218 HydrophobicContact CZ3-CD2 3.73Å; W214-L218 WeakPolarHBondContact O-CB 2.77Å; W214-L218 PolarHBondContact O-N 2.86Å; W214-L242 HydrophobicContact CE3-CD2 4.5Å; W214-L242 HydrophobicContact CH2-CD2 4.25Å; W214-L242 HydrophobicContact CZ2-CD2 4.44Å; W214-L242 HydrophobicContact CZ3-CD2 4.27Å; W214-M246 HydrophobicContact CZ2-CB 3.79Å; W214-M246 HydrophobicContact CZ2-CG 4.32Å; W214-R249 HydrophobicContact CH2-CB 4.15Å; W214-R249 HydrophobicContact CZ2-CB 4.29Å; W214-F250 HydrophobicContact CH2-CB 4.02Å; W214-F250 HydrophobicContact CZ3-CB 4.07Å |
| 215 | E | 87.7 | Confident | 89.1 | Confident | 74 Ų | 74 | 54.5 Ų | 54.5 | 35% | 0.346 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 178.5 | -63 | 178 | -175.7 | 0 | 0 | 112.2 | N213 Y219 R249 | N213-E215 PolarHBondContact O-N 3.18Å; N213-E215 VanDerWaalsContact O-N 3.14Å; E215-Y219 PolarHBondContact O-N 2.92Å; E215-R249 VanDerWaalsContact CD-NH1 3.34Å; E215-R249 WeakPolarHBondContact OE1-CD 3.34Å; E215-R249 IonicContact OE1-CZ 3.99Å; E215-R249 IonicContact OE1-NE 3.36Å; E215-R249 IonicContact OE1-NH1 3.14Å; E215-R249 PolarHBondContact OE1-NH1 3.11Å; E215-R249 IonicContact OE2-NH1 3.93Å; E215-R249 PolarHBondContact OE2-NH1 2.79Å; E215-R249 VanDerWaalsContact OE2-NH1 3.15Å |
| 216 | Q | 86.1 | Confident | 89.2 | Confident | 65 Ų | 65 | 54.6 Ų | 54.6 | 30% | 0.304 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -69.1 | -41.6 | 177.6 | -63.1 | 176.8 | -24.2 | 0 | 0 | 111.3 | L178 N213 W214 Y219 L220 | L178-Q216 HydrophobicContact CD1-CB 4.05Å; N213-Q216 PolarHBondContact ND2-OE1 2.9Å; N213-Q216 PolarHBondContact O-N 3.3Å; N213-Q216 VanDerWaalsContact O-N 3.08Å; W214-Q216 PolarHBondContact O-N 3.33Å; Q216-Y219 PolarHBondContact O-N 3.28Å; Q216-L220 WeakPolarHBondContact O-CG 3.43Å; Q216-L220 PolarHBondContact O-N 3.4Å |
| 217 | V | 88.9 | Confident | 89.3 | Confident | 5 Ų | 5 | 51.7 Ų | 51.7 | 3% | 0.03 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.1 | -37.7 | 178.5 | 171.8 | 0 | 0 | 0 | 0 | 111.4 | L178 Y186 I208 L211 N213 W214 L220 | L178-V217 HydrophobicContact CD1-CG2 4.45Å; Y186-V217 HydrophobicContact CD1-CG1 3.76Å; Y186-V217 HydrophobicContact CD2-CG1 3.7Å; Y186-V217 HydrophobicContact CE1-CG1 3.53Å; Y186-V217 HydrophobicContact CE2-CG1 3.46Å; Y186-V217 VanDerWaalsContact CE2-CG1 3.46Å; Y186-V217 HydrophobicContact CG-CG1 3.85Å; I208-V217 HydrophobicContact CD1-CG1 4.1Å; I208-V217 HydrophobicContact CG1-CG1 3.87Å; I208-V217 HydrophobicContact CG2-CG1 4.37Å; L211-V217 HydrophobicContact CD1-CB 4.3Å; L211-V217 HydrophobicContact CD1-CG1 4.04Å; L211-V217 HydrophobicContact CD1-CG2 3.97Å; N213-V217 PolarHBondContact O-N 3.37Å; W214-V217 PolarHBondContact O-N 3.16Å; V217-L220 PolarHBondContact O-N 3.41Å |
| 218 | L | 89.7 | Confident | 89.4 | Confident | 9 Ų | 9 | 47.7 Ų | 47.7 | 5% | 0.047 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.4 | -40.7 | 174.7 | -179.6 | 62.3 | 0 | 0 | 0 | 111.7 | W214 L220 T221 P223 W226 F238 F250 V254 | W214-L218 HydrophobicContact CE3-CD2 4.06Å; W214-L218 HydrophobicContact CZ3-CD2 3.73Å; W214-L218 WeakPolarHBondContact O-CB 2.77Å; W214-L218 PolarHBondContact O-N 2.86Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 2.98Å; L218-T221 PolarHBondContact O-N 3.28Å; L218-T221 PolarHBondContact O-OG1 3.41Å; L218-P223 HydrophobicContact CD1-CG 4Å; L218-P223 HydrophobicContact CG-CG 4.06Å; L218-W226 HydrophobicContact CD1-CH2 3.48Å; L218-W226 VanDerWaalsContact CD1-CH2 3.48Å; L218-W226 HydrophobicContact CD1-CZ2 3.75Å; L218-F238 HydrophobicContact CD1-CE2 4.3Å; L218-F238 HydrophobicContact CD1-CZ 4.1Å; L218-F250 HydrophobicContact CD2-CD2 3.85Å; L218-F250 HydrophobicContact CD2-CE2 4.3Å; L218-V254 HydrophobicContact CD2-CG2 4.19Å |
| 219 | Y | 89.1 | Confident | 89.6 | Confident | 150 Ų | 150 | 47.9 Ų | 47.9 | 59% | 0.588 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -59.8 | -39.5 | 174.7 | -168.3 | -92.7 | 0 | 0 | 0 | 112.3 | E215 Q216 T221 E222 | E215-Y219 PolarHBondContact O-N 2.92Å; Q216-Y219 PolarHBondContact O-N 3.28Å; Y219-T221 PolarHBondContact O-N 2.61Å; Y219-T221 VanDerWaalsContact O-N 3.09Å; Y219-E222 PolarHBondContact O-N 2.8Å; Y219-E222 VanDerWaalsContact O-N 3.12Å |
| 220 | L | 88.6 | Confident | 89.8 | Confident | 31 Ų | 31 | 47.3 Ų | 47.3 | 16% | 0.162 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -9.9 | 173.5 | -68.3 | 173.2 | 0 | 0 | 0 | 114.7 | L178 I183 Q216 V217 L218 | L178-L220 HydrophobicContact CD1-CD1 3.7Å; I183-L220 HydrophobicContact CG1-CD1 4.02Å; I183-L220 HydrophobicContact CG2-CD2 4.18Å; Q216-L220 WeakPolarHBondContact O-CG 3.43Å; Q216-L220 PolarHBondContact O-N 3.4Å; V217-L220 PolarHBondContact O-N 3.41Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-L220 PolarHBondContact O-N 2.98Å |
| 221 | T | 88.6 | Confident | 90 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -100.4 | 5.1 | 175.6 | 56.3 | 0 | 0 | 0 | 0 | 114.3 | Y186 V189 L218 Y219 W226 | Y186-T221 HydrophobicContact CD1-CG2 3.78Å; Y186-T221 HydrophobicContact CG-CG2 4.3Å; V189-T221 HydrophobicContact CB-CG2 4.46Å; V189-T221 HydrophobicContact CG1-CG2 4.22Å; L218-T221 PolarHBondContact O-N 3.28Å; L218-T221 PolarHBondContact O-OG1 3.41Å; Y219-T221 PolarHBondContact O-N 2.61Å; Y219-T221 VanDerWaalsContact O-N 3.09Å; T221-W226 PolarHBondContact O-NE1 3.05Å; T221-W226 WeakPolarHBondContact OG1-CZ2 3.41Å |
| 222 | E | 90.3 | Very high | 90.4 | Very high | 74 Ų | 74 | 42.9 Ų | 42.9 | 35% | 0.346 | 22% | 0.219 | S | C | . | . | trans | 47.5 | 65.6 | 173.5 | -66.3 | 165 | -148 | 0 | 0 | 113.5 | N190 Y219 E224 T225 | N190-E222 PolarHBondContact ND2-OE1 3.05Å; N190-E222 PolarHBondContact ND2-OE2 3.36Å; Y219-E222 PolarHBondContact O-N 2.8Å; Y219-E222 VanDerWaalsContact O-N 3.12Å; E222-E224 VanDerWaalsContact C-OE2 3.27Å; E222-E224 WeakPolarHBondContact CA-OE1 3.4Å; E222-E224 VanDerWaalsContact CB-OE1 3.31Å; E222-E224 WeakPolarHBondContact CB-OE1 3.37Å; E222-E224 PolarHBondContact O-N 3.09Å; E222-E224 VanDerWaalsContact O-N 3.1Å; E222-T225 HydrophobicContact CB-CG2 4.01Å; E222-T225 WeakPolarHBondContact O-CB 3.45Å; E222-T225 PolarHBondContact O-N 3.26Å; E222-T225 PolarHBondContact O-OG1 2.81Å | ||
| 223 | P | 90.4 | Very high | 90.8 | Very high | 12 Ų | 12 | 38.8 Ų | 38.8 | 8% | 0.078 | 19% | 0.187 | C | C | . | . | G | 310 helix | trans | -57.2 | -26.8 | -171 | -24.4 | 35.9 | 0 | 0 | 0 | 115.9 | L218 T225 W226 V254 | L218-P223 HydrophobicContact CD1-CG 4Å; L218-P223 HydrophobicContact CG-CG 4.06Å; P223-T225 PolarHBondContact O-N 2.74Å; P223-W226 HydrophobicContact CB-CD2 4.29Å; P223-W226 HydrophobicContact CB-CE3 4.5Å; P223-W226 HydrophobicContact CB-CH2 4.39Å; P223-W226 HydrophobicContact CB-CZ2 4.17Å; P223-W226 HydrophobicContact CG-CZ2 4.13Å; P223-W226 WeakPolarHBondContact O-CB 3.16Å; P223-W226 PolarHBondContact O-N 2.91Å; P223-V254 HydrophobicContact CB-CG1 3.58Å; P223-V254 HydrophobicContact CB-CG2 4.18Å; P223-V254 HydrophobicContact CG-CG1 4.41Å; P223-V254 HydrophobicContact CG-CG2 4.24Å |
| 224 | E | 88.8 | Confident | 91.1 | Very high | 131 Ų | 131 | 36 Ų | 36 | 61% | 0.612 | 17% | 0.172 | S | C | * | . | G | 310 helix | trans | -57.2 | -35.2 | 172.2 | 61.5 | -75.1 | 175.6 | 0 | 0 | 112.7 | E222 W226 R258 | E222-E224 VanDerWaalsContact C-OE2 3.27Å; E222-E224 WeakPolarHBondContact CA-OE1 3.4Å; E222-E224 VanDerWaalsContact CB-OE1 3.31Å; E222-E224 WeakPolarHBondContact CB-OE1 3.37Å; E222-E224 PolarHBondContact O-N 3.09Å; E222-E224 VanDerWaalsContact O-N 3.1Å; E224-W226 VanDerWaalsContact C-N 3.32Å; E224-W226 PolarHBondContact O-N 2.78Å; E224-R258 PolarHBondContact O-NH1 3.36Å |
| 225 | T | 91.1 | Very high | 91.4 | Very high | 56 Ų | 56 | 35.6 Ų | 35.6 | 34% | 0.344 | 17% | 0.17 | S | C | . | . | G | 310 helix | trans | -80.2 | -9 | -178.4 | 69.7 | 0 | 0 | 0 | 0 | 114.2 | N190 S194 E222 P223 | N190-T225 PolarHBondContact OD1-OG1 2.97Å; S194-T225 WeakPolarHBondContact CA-O 3.47Å; S194-T225 WeakPolarHBondContact CB-O 3.46Å; E222-T225 HydrophobicContact CB-CG2 4.01Å; E222-T225 WeakPolarHBondContact O-CB 3.45Å; E222-T225 PolarHBondContact O-N 3.26Å; E222-T225 PolarHBondContact O-OG1 2.81Å; P223-T225 PolarHBondContact O-N 2.74Å |
| 226 | W | 93.3 | Very high | 91.7 | Very high | 2 Ų | 2 | 37.5 Ų | 37.5 | 1% | 0.008 | 18% | 0.175 | C | C | . | . | trans | -67.7 | 143.3 | -171.3 | -69 | 5.7 | 0 | 0 | 0 | 112.7 | L193 F205 L218 T221 P223 E224 A230 M231 A234 F238 R258 | L193-W226 HydrophobicContact CB-CG 4.16Å; L193-W226 HydrophobicContact CD1-CD2 4.31Å; L193-W226 HydrophobicContact CD1-CZ2 3.81Å; F205-W226 AromaticContact CE2-CH2 3.63Å; F205-W226 HydrophobicContact CE2-CH2 3.63Å; F205-W226 AromaticContact CE2-CZ2 3.68Å; F205-W226 HydrophobicContact CE2-CZ2 3.68Å; F205-W226 AromaticContact CZ-CH2 3.61Å; F205-W226 HydrophobicContact CZ-CH2 3.61Å; F205-W226 HydrophobicContact CZ-CZ2 4.11Å; F205-W226 HydrophobicContact CZ-CZ3 4.17Å; L218-W226 HydrophobicContact CD1-CH2 3.48Å; L218-W226 VanDerWaalsContact CD1-CH2 3.48Å; L218-W226 HydrophobicContact CD1-CZ2 3.75Å; T221-W226 PolarHBondContact O-NE1 3.05Å; T221-W226 WeakPolarHBondContact OG1-CZ2 3.41Å; P223-W226 HydrophobicContact CB-CD2 4.29Å; P223-W226 HydrophobicContact CB-CE3 4.5Å; P223-W226 HydrophobicContact CB-CH2 4.39Å; P223-W226 HydrophobicContact CB-CZ2 4.17Å; P223-W226 HydrophobicContact CG-CZ2 4.13Å; P223-W226 WeakPolarHBondContact O-CB 3.16Å; P223-W226 PolarHBondContact O-N 2.91Å; E224-W226 VanDerWaalsContact C-N 3.32Å; E224-W226 PolarHBondContact O-N 2.78Å; W226-A230 HydrophobicContact CB-CB 4.22Å; W226-M231 HydrophobicContact CB-CG 4.18Å; W226-M231 HydrophobicContact CB-SD 4.43Å; W226-M231 HydrophobicContact CD2-SD 4.46Å; W226-M231 HydrophobicContact CE3-CG 4.28Å; W226-M231 HydrophobicContact CE3-SD 3.57Å; W226-M231 VanDerWaalsContact CE3-SD 3.57Å; W226-M231 HydrophobicContact CZ3-SD 4.18Å; W226-A234 HydrophobicContact CE3-CB 4.07Å; W226-A234 HydrophobicContact CH2-CB 4.05Å; W226-A234 HydrophobicContact CZ3-CB 3.35Å; W226-F238 HydrophobicContact CH2-CE2 4.42Å; W226-R258 PolarHBondContact O-NH1 2.99Å; W226-R258 PolarHBondContact O-NH2 3.34Å | ||
| 227 | T | 93.8 | Very high | 92 | Very high | 43 Ų | 43 | 35.4 Ų | 35.4 | 26% | 0.264 | 17% | 0.165 | S | C | . | . | trans | -65.3 | 147.6 | 168 | -41.4 | 0 | 0 | 0 | 0 | 110.2 | L193 S194 Y196 A229 A230 M231 | L193-T227 PolarHBondContact O-N 2.91Å; L193-T227 PolarHBondContact O-OG1 3.46Å; S194-T227 PolarHBondContact O-OG1 3.05Å; Y196-T227 PolarHBondContact N-OG1 3.45Å; Y196-T227 WeakPolarHBondContact O-CB 3.32Å; Y196-T227 VanDerWaalsContact O-CG2 3.3Å; Y196-T227 WeakPolarHBondContact O-CG2 3.43Å; Y196-T227 PolarHBondContact O-OG1 3.47Å; T227-A229 PolarHBondContact O-N 3.04Å; T227-A229 VanDerWaalsContact O-N 3.11Å; T227-A230 WeakPolarHBondContact O-CA 3.35Å; T227-A230 WeakPolarHBondContact O-CB 3.42Å; T227-A230 PolarHBondContact O-N 2.97Å; T227-M231 PolarHBondContact O-N 2.75Å | ||
| 228 | A | 93.4 | Very high | 92.1 | Very high | 8 Ų | 8 | 35.2 Ų | 35.2 | 7% | 0.066 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -55.1 | -32.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | M231 Y232 N270 H272 L273 | A228-M231 WeakPolarHBondContact O-CB 3.4Å; A228-M231 PolarHBondContact O-N 3.48Å; A228-Y232 PolarHBondContact O-N 3.47Å; A228-N270 HydrophobicContact CB-CB 4.32Å; A228-N270 WeakPolarHBondContact CB-OD1 3.17Å; A228-H272 HydrophobicContact CB-CB 4.02Å; A228-H272 VanDerWaalsContact O-CB 3.27Å; A228-H272 WeakPolarHBondContact O-CB 3.32Å; A228-L273 HydrophobicContact CB-CG 4.27Å |
| 229 | A | 93.8 | Very high | 92.1 | Very high | 4 Ų | 4 | 35.1 Ų | 35.1 | 3% | 0.033 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.5 | -33.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y196 T227 Q233 | Y196-A229 HydrophobicContact CD1-CB 4.3Å; T227-A229 PolarHBondContact O-N 3.04Å; T227-A229 VanDerWaalsContact O-N 3.11Å; A229-Q233 PolarHBondContact O-N 2.92Å |
| 230 | A | 94.6 | Very high | 92.1 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.008 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -70.7 | -44.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | L193 Y196 W226 T227 Y232 Q233 A234 | L193-A230 HydrophobicContact CB-CB 4.4Å; L193-A230 HydrophobicContact CD2-CB 4.15Å; Y196-A230 HydrophobicContact CD1-CB 4Å; Y196-A230 HydrophobicContact CG-CB 4.38Å; W226-A230 HydrophobicContact CB-CB 4.22Å; T227-A230 WeakPolarHBondContact O-CA 3.35Å; T227-A230 WeakPolarHBondContact O-CB 3.42Å; T227-A230 PolarHBondContact O-N 2.97Å; A230-Y232 VanDerWaalsContact C-N 3.27Å; A230-Y232 PolarHBondContact O-N 2.98Å; A230-Q233 PolarHBondContact O-N 3.28Å; A230-Q233 VanDerWaalsContact O-N 3.13Å; A230-A234 VanDerWaalsContact O-CB 3.23Å; A230-A234 WeakPolarHBondContact O-CB 3.26Å; A230-A234 PolarHBondContact O-N 3.4Å |
| 231 | M | 94.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -53.5 | -41.6 | 173.9 | -74.9 | -69.5 | -65.8 | 0 | 0 | 112.4 | W226 T227 A228 T235 V254 L255 R258 L273 | W226-M231 HydrophobicContact CB-CG 4.18Å; W226-M231 HydrophobicContact CB-SD 4.43Å; W226-M231 HydrophobicContact CD2-SD 4.46Å; W226-M231 HydrophobicContact CE3-CG 4.28Å; W226-M231 HydrophobicContact CE3-SD 3.57Å; W226-M231 VanDerWaalsContact CE3-SD 3.57Å; W226-M231 HydrophobicContact CZ3-SD 4.18Å; T227-M231 PolarHBondContact O-N 2.75Å; A228-M231 WeakPolarHBondContact O-CB 3.4Å; A228-M231 PolarHBondContact O-N 3.48Å; M231-T235 VanDerWaalsContact O-CB 3.24Å; M231-T235 WeakPolarHBondContact O-CB 3.23Å; M231-T235 PolarHBondContact O-N 2.87Å; M231-T235 PolarHBondContact O-OG1 3.42Å; M231-V254 HydrophobicContact CE-CG1 4.13Å; M231-V254 HydrophobicContact SD-CG1 4.2Å; M231-L255 HydrophobicContact CE-CD1 3.79Å; M231-R258 HydrophobicContact CE-CB 3.97Å; M231-R258 HydrophobicContact CE-CG 3.94Å; M231-L273 HydrophobicContact CB-CD2 3.6Å; M231-L273 HydrophobicContact CE-CD2 4.35Å; M231-L273 HydrophobicContact CG-CD2 4.07Å |
| 232 | Y | 95 | Very high | 92.1 | Very high | 55 Ų | 55 | 34.4 Ų | 34.4 | 22% | 0.216 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.2 | -52.2 | 174.1 | 173 | -121.7 | 0 | 0 | 0 | 112.8 | A228 A230 T235 R236 M275 A276 K279 | A228-Y232 PolarHBondContact O-N 3.47Å; A230-Y232 VanDerWaalsContact C-N 3.27Å; A230-Y232 PolarHBondContact O-N 2.98Å; Y232-T235 PolarHBondContact O-N 3.32Å; Y232-R236 PolarHBondContact O-N 3.07Å; Y232-M275 HydrophobicContact CD2-CB 3.85Å; Y232-M275 HydrophobicContact CE2-CB 3.71Å; Y232-A276 HydrophobicContact CD2-CB 4.44Å; Y232-K279 HydrophobicContact CE2-CG 3.76Å |
| 233 | Q | 93.6 | Very high | 92.1 | Very high | 27 Ų | 27 | 38.5 Ų | 38.5 | 13% | 0.126 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -76.1 | -31.3 | -174.1 | -64.2 | -168 | 30.4 | 0 | 0 | 113.1 | Y196 L201 A229 A230 R236 I237 | Y196-Q233 VanDerWaalsContact OH-CD 3.25Å; Y196-Q233 PolarHBondContact OH-NE2 2.79Å; Y196-Q233 PolarHBondContact OH-OE1 3.1Å; Y196-Q233 VanDerWaalsContact OH-OE1 3.05Å; L201-Q233 HydrophobicContact CD1-CB 3.61Å; L201-Q233 HydrophobicContact CG-CB 4.47Å; A229-Q233 PolarHBondContact O-N 2.92Å; A230-Q233 PolarHBondContact O-N 3.28Å; A230-Q233 VanDerWaalsContact O-N 3.13Å; Q233-R236 PolarHBondContact O-N 3.02Å; Q233-I237 WeakPolarHBondContact O-CG1 3.35Å; Q233-I237 PolarHBondContact O-N 3.37Å |
| 234 | A | 93.4 | Very high | 92 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.8 | -53.6 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | F205 W226 A230 R236 I237 F238 | F205-A234 HydrophobicContact CE1-CB 3.92Å; F205-A234 HydrophobicContact CZ-CB 3.64Å; W226-A234 HydrophobicContact CE3-CB 4.07Å; W226-A234 HydrophobicContact CH2-CB 4.05Å; W226-A234 HydrophobicContact CZ3-CB 3.35Å; A230-A234 VanDerWaalsContact O-CB 3.23Å; A230-A234 WeakPolarHBondContact O-CB 3.26Å; A230-A234 PolarHBondContact O-N 3.4Å; A234-R236 VanDerWaalsContact C-N 3.26Å; A234-R236 PolarHBondContact O-N 3.33Å; A234-I237 PolarHBondContact O-N 3.22Å; A234-F238 HydrophobicContact CB-CD2 4.15Å; A234-F238 HydrophobicContact CB-CE2 4.09Å; A234-F238 WeakPolarHBondContact O-CD2 3.32Å; A234-F238 PolarHBondContact O-N 3.5Å |
| 235 | T | 94.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -57.5 | -39.6 | 178.1 | -58 | 0 | 0 | 0 | 0 | 111.5 | M231 Y232 S239 Y251 L255 A276 A280 | M231-T235 VanDerWaalsContact O-CB 3.24Å; M231-T235 WeakPolarHBondContact O-CB 3.23Å; M231-T235 PolarHBondContact O-N 2.87Å; M231-T235 PolarHBondContact O-OG1 3.42Å; Y232-T235 PolarHBondContact O-N 3.32Å; T235-S239 WeakPolarHBondContact O-CA 3.41Å; T235-S239 WeakPolarHBondContact O-CB 3.3Å; T235-S239 PolarHBondContact O-N 3.08Å; T235-S239 PolarHBondContact O-OG 3.14Å; T235-S239 VanDerWaalsContact O-OG 3.05Å; T235-Y251 HydrophobicContact CG2-CE1 4.31Å; T235-L255 HydrophobicContact CG2-CD2 3.75Å; T235-A276 HydrophobicContact CG2-CB 4.18Å; T235-A276 VanDerWaalsContact CG2-O 3.32Å; T235-A276 WeakPolarHBondContact CG2-O 3.17Å; T235-A280 HydrophobicContact CG2-CB 3.94Å |
| 236 | R | 93.8 | Very high | 92 | Very high | 115 Ų | 115 | 44.8 Ų | 44.8 | 43% | 0.434 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -56.9 | -53.7 | 172.3 | -174.9 | 173.5 | 64.9 | 160.8 | -3.5 | 111.8 | Y232 Q233 A234 S239 S240 | Y232-R236 PolarHBondContact O-N 3.07Å; Q233-R236 PolarHBondContact O-N 3.02Å; A234-R236 VanDerWaalsContact C-N 3.26Å; A234-R236 PolarHBondContact O-N 3.33Å; R236-S239 PolarHBondContact O-N 2.93Å; R236-S239 PolarHBondContact O-OG 3Å; R236-S240 PolarHBondContact O-N 3.17Å; R236-S240 VanDerWaalsContact O-N 3.16Å; R236-S240 PolarHBondContact O-OG 3.36Å |
| 237 | I | 92.2 | Very high | 92 | Very high | 21 Ų | 21 | 44.7 Ų | 44.7 | 11% | 0.108 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.9 | -43.9 | -178.9 | -71.1 | 165.6 | 0 | 0 | 0 | 112 | L201 F205 K206 P209 Q233 A234 S240 N241 | L201-I237 HydrophobicContact CD1-CD1 3.67Å; F205-I237 HydrophobicContact CD1-CD1 4.27Å; F205-I237 HydrophobicContact CE1-CD1 4.32Å; K206-I237 HydrophobicContact CG-CD1 4.21Å; P209-I237 HydrophobicContact CG-CG2 3.7Å; Q233-I237 WeakPolarHBondContact O-CG1 3.35Å; Q233-I237 PolarHBondContact O-N 3.37Å; A234-I237 PolarHBondContact O-N 3.22Å; I237-S240 PolarHBondContact O-OG 3.48Å; I237-S240 VanDerWaalsContact O-OG 3.1Å; I237-N241 WeakPolarHBondContact O-CB 3.41Å; I237-N241 PolarHBondContact O-N 3.34Å |
| 238 | F | 91.6 | Very high | 92 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68.1 | -38.8 | 177 | -70 | -60.1 | 0 | 0 | 0 | 111.3 | F205 I208 P209 L218 W226 A234 S240 L242 F250 | F205-F238 AromaticContact CZ-CE2 3.98Å; F205-F238 HydrophobicContact CZ-CE2 3.98Å; F205-F238 HydrophobicContact CZ-CZ 4.37Å; I208-F238 HydrophobicContact CB-CE1 4.42Å; I208-F238 HydrophobicContact CB-CZ 4.44Å; I208-F238 HydrophobicContact CG2-CE1 4.02Å; I208-F238 HydrophobicContact CG2-CZ 4.1Å; P209-F238 HydrophobicContact CG-CD1 3.94Å; P209-F238 HydrophobicContact CG-CE1 3.97Å; L218-F238 HydrophobicContact CD1-CE2 4.3Å; L218-F238 HydrophobicContact CD1-CZ 4.1Å; W226-F238 HydrophobicContact CH2-CE2 4.42Å; A234-F238 HydrophobicContact CB-CD2 4.15Å; A234-F238 HydrophobicContact CB-CE2 4.09Å; A234-F238 WeakPolarHBondContact O-CD2 3.32Å; A234-F238 PolarHBondContact O-N 3.5Å; F238-S240 VanDerWaalsContact C-N 3.31Å; F238-S240 PolarHBondContact O-N 3.38Å; F238-L242 HydrophobicContact CB-CD2 4.19Å; F238-L242 HydrophobicContact CD1-CD1 3.7Å; F238-L242 HydrophobicContact CD1-CD2 3.71Å; F238-L242 HydrophobicContact CD1-CG 4.37Å; F238-L242 HydrophobicContact CE1-CD1 4.38Å; F238-L242 HydrophobicContact CG-CD2 4.33Å; F238-L242 WeakPolarHBondContact O-CB 3.4Å; F238-L242 PolarHBondContact O-N 3.16Å; F238-L242 VanDerWaalsContact O-N 3.14Å; F238-F250 HydrophobicContact CB-CD1 3.78Å; F238-F250 HydrophobicContact CB-CE1 3.98Å; F238-F250 HydrophobicContact CB-CG 4.18Å; F238-F250 HydrophobicContact CD2-CD1 4.14Å; F238-F250 AromaticContact CD2-CD2 3.81Å; F238-F250 HydrophobicContact CD2-CD2 3.81Å; F238-F250 AromaticContact CD2-CE1 3.83Å; F238-F250 HydrophobicContact CD2-CE1 3.83Å; F238-F250 AromaticContact CD2-CE2 3.45Å; F238-F250 HydrophobicContact CD2-CE2 3.45Å; F238-F250 VanDerWaalsContact CD2-CE2 3.45Å; F238-F250 HydrophobicContact CD2-CG 4.16Å; F238-F250 AromaticContact CD2-CZ 3.48Å; F238-F250 HydrophobicContact CD2-CZ 3.48Å; F238-F250 VanDerWaalsContact CD2-CZ 3.48Å; F238-F250 HydrophobicContact CE2-CD2 4.11Å; F238-F250 AromaticContact CE2-CE2 3.68Å; F238-F250 HydrophobicContact CE2-CE2 3.68Å; F238-F250 HydrophobicContact CE2-CZ 4.09Å; F238-F250 HydrophobicContact CG-CD1 4.13Å; F238-F250 HydrophobicContact CG-CD2 4.17Å; F238-F250 HydrophobicContact CG-CE1 4.22Å; F238-F250 HydrophobicContact CG-CE2 4.24Å; F238-F250 HydrophobicContact CG-CG 4.13Å; F238-F250 HydrophobicContact CG-CZ 4.28Å |
| 239 | S | 90.8 | Very high | 91.9 | Very high | 8 Ų | 8 | 51.7 Ų | 51.7 | 6% | 0.056 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -67.3 | -23.9 | 178.7 | 73 | 0 | 0 | 0 | 0 | 114.4 | T235 R236 Y251 K283 | T235-S239 WeakPolarHBondContact O-CA 3.41Å; T235-S239 WeakPolarHBondContact O-CB 3.3Å; T235-S239 PolarHBondContact O-N 3.08Å; T235-S239 PolarHBondContact O-OG 3.14Å; T235-S239 VanDerWaalsContact O-OG 3.05Å; R236-S239 PolarHBondContact O-N 2.93Å; R236-S239 PolarHBondContact O-OG 3Å; S239-Y251 WeakPolarHBondContact CB-OH 3.5Å; S239-K283 WeakPolarHBondContact O-CD 3.48Å; S239-K283 WeakPolarHBondContact O-CE 3.37Å |
| 240 | S | 88.8 | Confident | 91.9 | Very high | 66 Ų | 66 | 51.5 Ų | 51.5 | 46% | 0.462 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -86.7 | -53.4 | 171 | 55.5 | 0 | 0 | 0 | 0 | 111.1 | R236 I237 F238 K283 | R236-S240 PolarHBondContact O-N 3.17Å; R236-S240 VanDerWaalsContact O-N 3.16Å; R236-S240 PolarHBondContact O-OG 3.36Å; I237-S240 PolarHBondContact O-OG 3.48Å; I237-S240 VanDerWaalsContact O-OG 3.1Å; F238-S240 VanDerWaalsContact C-N 3.31Å; F238-S240 PolarHBondContact O-N 3.38Å; S240-K283 WeakPolarHBondContact O-CE 3.4Å; S240-K283 PolarHBondContact O-NZ 3.41Å; S240-K283 VanDerWaalsContact O-NZ 3.15Å |
| 241 | N | 88.8 | Confident | 91.9 | Very high | 97 Ų | 97 | 51.5 Ų | 51.5 | 52% | 0.519 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -89.4 | -18.1 | -159.4 | -62.5 | 8.5 | 0 | 0 | 0 | 114.8 | P209 I237 | P209-N241 HydrophobicContact CB-CB 3.45Å; P209-N241 VanDerWaalsContact CB-CB 3.45Å; P209-N241 HydrophobicContact CG-CB 3.87Å; I237-N241 WeakPolarHBondContact O-CB 3.41Å; I237-N241 PolarHBondContact O-N 3.34Å |
| 242 | L | 87.7 | Confident | 91.8 | Very high | 3 Ų | 3 | 54.5 Ų | 54.5 | 2% | 0.016 | 25% | 0.246 | C | C | . | . | S | Bend | trans | -82.9 | 147.7 | 179.1 | -95.1 | 46.6 | 0 | 0 | 0 | 113 | P209 W214 F238 M246 A247 F250 K283 | P209-L242 VanDerWaalsContact CA-CD1 3.49Å; P209-L242 HydrophobicContact CB-CD1 3.41Å; P209-L242 VanDerWaalsContact CB-CD1 3.41Å; P209-L242 HydrophobicContact CG-CD1 3.86Å; W214-L242 HydrophobicContact CE3-CD2 4.5Å; W214-L242 HydrophobicContact CH2-CD2 4.25Å; W214-L242 HydrophobicContact CZ2-CD2 4.44Å; W214-L242 HydrophobicContact CZ3-CD2 4.27Å; F238-L242 HydrophobicContact CB-CD2 4.19Å; F238-L242 HydrophobicContact CD1-CD1 3.7Å; F238-L242 HydrophobicContact CD1-CD2 3.71Å; F238-L242 HydrophobicContact CD1-CG 4.37Å; F238-L242 HydrophobicContact CE1-CD1 4.38Å; F238-L242 HydrophobicContact CG-CD2 4.33Å; F238-L242 WeakPolarHBondContact O-CB 3.4Å; F238-L242 PolarHBondContact O-N 3.16Å; F238-L242 VanDerWaalsContact O-N 3.14Å; L242-M246 HydrophobicContact CB-CB 3.99Å; L242-M246 HydrophobicContact CD2-CB 3.82Å; L242-M246 HydrophobicContact CG-CB 3.63Å; L242-M246 HydrophobicContact CG-SD 4.34Å; L242-A247 HydrophobicContact CB-CB 4.02Å; L242-F250 HydrophobicContact CD2-CB 4.29Å; L242-K283 WeakPolarHBondContact O-CE 3.28Å; L242-K283 PolarHBondContact O-NZ 2.93Å |
| 243 | K | 90.4 | Very high | 91.5 | Very high | 159 Ų | 159 | 55.9 Ų | 55.9 | 69% | 0.691 | 26% | 0.257 | S | S | * | . | trans | -64.6 | 149.4 | 161.7 | -59.2 | -170.1 | 179.1 | -169.9 | 0 | 109.4 | R245 M246 A247 | K243-R245 VanDerWaalsContact C-N 3.33Å; K243-R245 PolarHBondContact O-N 3.03Å; K243-M246 HydrophobicContact CB-SD 4.26Å; K243-M246 HydrophobicContact CD-CE 4.48Å; K243-M246 WeakPolarHBondContact O-CA 3.14Å; K243-M246 WeakPolarHBondContact O-CB 3.43Å; K243-M246 PolarHBondContact O-N 3.36Å; K243-A247 PolarHBondContact O-N 3.15Å | ||
| 244 | E | 88.9 | Confident | 91.5 | Very high | 71 Ų | 71 | 55.6 Ų | 55.6 | 33% | 0.332 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -51.3 | -47.4 | -171.7 | -168.9 | -166.6 | 140.9 | 0 | 0 | 113.2 | M246 A247 Q248 G285 A286 K289 | E244-M246 VanDerWaalsContact C-N 3.25Å; E244-M246 PolarHBondContact O-N 3.28Å; E244-A247 PolarHBondContact O-N 2.77Å; E244-Q248 WeakPolarHBondContact O-CB 3.2Å; E244-Q248 PolarHBondContact O-N 3.15Å; E244-G285 WeakPolarHBondContact OE1-CA 3.41Å; E244-A286 HydrophobicContact CG-CB 3.71Å; E244-A286 PolarHBondContact OE1-N 3.33Å; E244-K289 IonicContact OE1-NZ 3.89Å; E244-K289 PolarHBondContact OE1-NZ 3.01Å |
| 245 | R | 90.1 | Very high | 91.4 | Very high | 195 Ų | 195 | 55.6 Ų | 55.6 | 74% | 0.736 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -61 | -29.8 | 178.9 | -60.2 | -173 | -171.3 | -179.8 | 5.9 | 113.4 | K243 | K243-R245 VanDerWaalsContact C-N 3.33Å; K243-R245 PolarHBondContact O-N 3.03Å |
| 246 | M | 90.2 | Very high | 91.3 | Very high | 65 Ų | 65 | 56.2 Ų | 56.2 | 32% | 0.32 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -79.2 | -43.3 | 175.2 | -60.4 | 171.6 | -179 | 0 | 0 | 110.8 | W214 L242 K243 E244 Q248 R249 F250 | W214-M246 HydrophobicContact CZ2-CB 3.79Å; W214-M246 HydrophobicContact CZ2-CG 4.32Å; L242-M246 HydrophobicContact CB-CB 3.99Å; L242-M246 HydrophobicContact CD2-CB 3.82Å; L242-M246 HydrophobicContact CG-CB 3.63Å; L242-M246 HydrophobicContact CG-SD 4.34Å; K243-M246 HydrophobicContact CB-SD 4.26Å; K243-M246 HydrophobicContact CD-CE 4.48Å; K243-M246 WeakPolarHBondContact O-CA 3.14Å; K243-M246 WeakPolarHBondContact O-CB 3.43Å; K243-M246 PolarHBondContact O-N 3.36Å; E244-M246 VanDerWaalsContact C-N 3.25Å; E244-M246 PolarHBondContact O-N 3.28Å; M246-Q248 VanDerWaalsContact C-N 3.27Å; M246-Q248 PolarHBondContact O-N 3.34Å; M246-R249 WeakPolarHBondContact O-CB 3.46Å; M246-R249 PolarHBondContact O-N 3.32Å; M246-R249 VanDerWaalsContact O-N 3.08Å; M246-F250 PolarHBondContact O-N 3.23Å |
| 247 | A | 92.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.3 | -39.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L242 K243 E244 R249 F250 Y251 K283 A286 | L242-A247 HydrophobicContact CB-CB 4.02Å; K243-A247 PolarHBondContact O-N 3.15Å; E244-A247 PolarHBondContact O-N 2.77Å; A247-R249 VanDerWaalsContact C-N 3.35Å; A247-R249 PolarHBondContact O-N 3.17Å; A247-F250 PolarHBondContact O-N 2.98Å; A247-Y251 HydrophobicContact CB-CE2 4.4Å; A247-Y251 WeakPolarHBondContact O-CB 3.2Å; A247-Y251 WeakPolarHBondContact O-CD1 3.43Å; A247-Y251 WeakPolarHBondContact O-CD2 3.36Å; A247-Y251 PolarHBondContact O-N 3.18Å; A247-K283 HydrophobicContact CB-CD 4.48Å; A247-A286 HydrophobicContact CB-CB 3.84Å |
| 248 | Q | 93.1 | Very high | 91.2 | Very high | 63 Ų | 63 | 54.6 Ų | 54.6 | 29% | 0.294 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -56.5 | -45.3 | 172.2 | -172.5 | -167.3 | -14.2 | 0 | 0 | 112 | E244 M246 Y251 N252 A286 K289 | E244-Q248 WeakPolarHBondContact O-CB 3.2Å; E244-Q248 PolarHBondContact O-N 3.15Å; M246-Q248 VanDerWaalsContact C-N 3.27Å; M246-Q248 PolarHBondContact O-N 3.34Å; Q248-Y251 PolarHBondContact O-N 3.08Å; Q248-N252 VanDerWaalsContact O-CB 3.3Å; Q248-N252 WeakPolarHBondContact O-CB 3.1Å; Q248-N252 PolarHBondContact O-N 2.87Å; Q248-A286 HydrophobicContact CB-CB 4.33Å; Q248-K289 HydrophobicContact CG-CB 3.93Å; Q248-K289 PolarHBondContact NE2-O 3.39Å; Q248-K289 VanDerWaalsContact NE2-O 3.07Å |
| 249 | R | 91.5 | Very high | 91.2 | Very high | 135 Ų | 135 | 54.7 Ų | 54.7 | 51% | 0.509 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.9 | -45.6 | 176.9 | -72.9 | -176.2 | 175.4 | -163.8 | -5.2 | 112.2 | W214 E215 M246 A247 Y251 N252 L253 | W214-R249 HydrophobicContact CH2-CB 4.15Å; W214-R249 HydrophobicContact CZ2-CB 4.29Å; E215-R249 VanDerWaalsContact CD-NH1 3.34Å; E215-R249 WeakPolarHBondContact OE1-CD 3.34Å; E215-R249 IonicContact OE1-CZ 3.99Å; E215-R249 IonicContact OE1-NE 3.36Å; E215-R249 IonicContact OE1-NH1 3.14Å; E215-R249 PolarHBondContact OE1-NH1 3.11Å; E215-R249 IonicContact OE2-NH1 3.93Å; E215-R249 PolarHBondContact OE2-NH1 2.79Å; E215-R249 VanDerWaalsContact OE2-NH1 3.15Å; M246-R249 WeakPolarHBondContact O-CB 3.46Å; M246-R249 PolarHBondContact O-N 3.32Å; M246-R249 VanDerWaalsContact O-N 3.08Å; A247-R249 VanDerWaalsContact C-N 3.35Å; A247-R249 PolarHBondContact O-N 3.17Å; R249-Y251 VanDerWaalsContact C-N 3.3Å; R249-Y251 PolarHBondContact O-N 3.37Å; R249-N252 PolarHBondContact O-N 2.77Å; R249-L253 WeakPolarHBondContact O-CB 3.45Å; R249-L253 WeakPolarHBondContact O-CG 3.43Å; R249-L253 PolarHBondContact O-N 3.27Å |
| 250 | F | 93.6 | Very high | 91.2 | Very high | 1 Ų | 1 | 55 Ų | 55 | 0% | 0.004 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.1 | -44.3 | 175.1 | 172.7 | -103.6 | 0 | 0 | 0 | 111.3 | W214 L218 F238 L242 M246 A247 V254 L255 | W214-F250 HydrophobicContact CH2-CB 4.02Å; W214-F250 HydrophobicContact CZ3-CB 4.07Å; L218-F250 HydrophobicContact CD2-CD2 3.85Å; L218-F250 HydrophobicContact CD2-CE2 4.3Å; F238-F250 HydrophobicContact CB-CD1 3.78Å; F238-F250 HydrophobicContact CB-CE1 3.98Å; F238-F250 HydrophobicContact CB-CG 4.18Å; F238-F250 HydrophobicContact CD2-CD1 4.14Å; F238-F250 AromaticContact CD2-CD2 3.81Å; F238-F250 HydrophobicContact CD2-CD2 3.81Å; F238-F250 AromaticContact CD2-CE1 3.83Å; F238-F250 HydrophobicContact CD2-CE1 3.83Å; F238-F250 AromaticContact CD2-CE2 3.45Å; F238-F250 HydrophobicContact CD2-CE2 3.45Å; F238-F250 VanDerWaalsContact CD2-CE2 3.45Å; F238-F250 HydrophobicContact CD2-CG 4.16Å; F238-F250 AromaticContact CD2-CZ 3.48Å; F238-F250 HydrophobicContact CD2-CZ 3.48Å; F238-F250 VanDerWaalsContact CD2-CZ 3.48Å; F238-F250 HydrophobicContact CE2-CD2 4.11Å; F238-F250 AromaticContact CE2-CE2 3.68Å; F238-F250 HydrophobicContact CE2-CE2 3.68Å; F238-F250 HydrophobicContact CE2-CZ 4.09Å; F238-F250 HydrophobicContact CG-CD1 4.13Å; F238-F250 HydrophobicContact CG-CD2 4.17Å; F238-F250 HydrophobicContact CG-CE1 4.22Å; F238-F250 HydrophobicContact CG-CE2 4.24Å; F238-F250 HydrophobicContact CG-CG 4.13Å; F238-F250 HydrophobicContact CG-CZ 4.28Å; L242-F250 HydrophobicContact CD2-CB 4.29Å; M246-F250 PolarHBondContact O-N 3.23Å; A247-F250 PolarHBondContact O-N 2.98Å; F250-V254 HydrophobicContact CD2-CB 4.09Å; F250-V254 HydrophobicContact CD2-CG1 4.47Å; F250-V254 HydrophobicContact CD2-CG2 4.31Å; F250-V254 HydrophobicContact CE2-CB 3.89Å; F250-V254 HydrophobicContact CE2-CG1 3.78Å; F250-V254 HydrophobicContact CE2-CG2 4.38Å; F250-V254 HydrophobicContact CZ-CG1 4.27Å; F250-V254 WeakPolarHBondContact O-CB 3.43Å; F250-V254 PolarHBondContact O-N 3.33Å; F250-L255 PolarHBondContact O-N 2.8Å |
| 251 | Y | 94.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -65 | -42.6 | 177.7 | -61.8 | -19.9 | 0 | 0 | 0 | 112.5 | T235 S239 A247 Q248 R249 L255 L256 A280 A286 W287 I291 | T235-Y251 HydrophobicContact CG2-CE1 4.31Å; S239-Y251 WeakPolarHBondContact CB-OH 3.5Å; A247-Y251 HydrophobicContact CB-CE2 4.4Å; A247-Y251 WeakPolarHBondContact O-CB 3.2Å; A247-Y251 WeakPolarHBondContact O-CD1 3.43Å; A247-Y251 WeakPolarHBondContact O-CD2 3.36Å; A247-Y251 PolarHBondContact O-N 3.18Å; Q248-Y251 PolarHBondContact O-N 3.08Å; R249-Y251 VanDerWaalsContact C-N 3.3Å; R249-Y251 PolarHBondContact O-N 3.37Å; Y251-L255 HydrophobicContact CD1-CD2 3.83Å; Y251-L255 HydrophobicContact CE1-CD2 4.31Å; Y251-L255 PolarHBondContact O-N 3.16Å; Y251-L256 WeakPolarHBondContact O-CB 3.5Å; Y251-L256 PolarHBondContact O-N 2.77Å; Y251-A280 HydrophobicContact CD1-CB 4.34Å; Y251-A280 HydrophobicContact CE1-CB 3.75Å; Y251-A280 HydrophobicContact CE2-CB 4.11Å; Y251-A280 VanDerWaalsContact OH-CA 3.31Å; Y251-A280 WeakPolarHBondContact OH-CA 3.46Å; Y251-A280 PolarHBondContact OH-O 3.31Å; Y251-A286 HydrophobicContact CD2-CB 4.11Å; Y251-A286 HydrophobicContact CE2-CB 3.77Å; Y251-W287 HydrophobicContact CE2-CB 4.42Å; Y251-I291 HydrophobicContact CD2-CD1 4.11Å; Y251-I291 HydrophobicContact CG-CD1 4.04Å; Y251-I291 HydrophobicContact CG-CG1 4.49Å |
| 252 | N | 92.2 | Very high | 91.3 | Very high | 63 Ų | 63 | 52 Ų | 52 | 34% | 0.337 | 24% | 0.238 | S | C | . | . | I | π-helix | trans | -72.1 | -39.4 | -177.5 | -174.6 | -104 | 0 | 0 | 0 | 113.5 | Q248 R249 P257 G290 | Q248-N252 VanDerWaalsContact O-CB 3.3Å; Q248-N252 WeakPolarHBondContact O-CB 3.1Å; Q248-N252 PolarHBondContact O-N 2.87Å; R249-N252 PolarHBondContact O-N 2.77Å; N252-P257 WeakPolarHBondContact O-CD 3.5Å; N252-G290 WeakPolarHBondContact CA-O 3.47Å |
| 253 | L | 90.3 | Very high | 91.4 | Very high | 85 Ų | 85 | 52.3 Ų | 52.3 | 45% | 0.445 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -91.5 | -26.4 | -173.5 | -63.5 | 174.7 | 0 | 0 | 0 | 114.3 | R249 | R249-L253 WeakPolarHBondContact O-CB 3.45Å; R249-L253 WeakPolarHBondContact O-CG 3.43Å; R249-L253 PolarHBondContact O-N 3.27Å |
| 254 | V | 92.4 | Very high | 91.3 | Very high | 21 Ų | 21 | 48.2 Ų | 48.2 | 13% | 0.127 | 24% | 0.235 | C | C | . | . | I | π-helix | trans | -121.6 | -52.2 | -172.8 | 176.8 | 0 | 0 | 0 | 0 | 112.4 | L218 P223 M231 F250 R258 | L218-V254 HydrophobicContact CD2-CG2 4.19Å; P223-V254 HydrophobicContact CB-CG1 3.58Å; P223-V254 HydrophobicContact CB-CG2 4.18Å; P223-V254 HydrophobicContact CG-CG1 4.41Å; P223-V254 HydrophobicContact CG-CG2 4.24Å; M231-V254 HydrophobicContact CE-CG1 4.13Å; M231-V254 HydrophobicContact SD-CG1 4.2Å; F250-V254 HydrophobicContact CD2-CB 4.09Å; F250-V254 HydrophobicContact CD2-CG1 4.47Å; F250-V254 HydrophobicContact CD2-CG2 4.31Å; F250-V254 HydrophobicContact CE2-CB 3.89Å; F250-V254 HydrophobicContact CE2-CG1 3.78Å; F250-V254 HydrophobicContact CE2-CG2 4.38Å; F250-V254 HydrophobicContact CZ-CG1 4.27Å; F250-V254 WeakPolarHBondContact O-CB 3.43Å; F250-V254 PolarHBondContact O-N 3.33Å; V254-R258 WeakPolarHBondContact O-CB 3.31Å |
| 255 | L | 92.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -73.6 | -47.2 | -174.4 | -173.7 | 57 | 0 | 0 | 0 | 112.2 | M231 T235 F250 Y251 I259 A276 A280 I291 | M231-L255 HydrophobicContact CE-CD1 3.79Å; T235-L255 HydrophobicContact CG2-CD2 3.75Å; F250-L255 PolarHBondContact O-N 2.8Å; Y251-L255 HydrophobicContact CD1-CD2 3.83Å; Y251-L255 HydrophobicContact CE1-CD2 4.31Å; Y251-L255 PolarHBondContact O-N 3.16Å; L255-I259 HydrophobicContact CD1-CD1 3.75Å; L255-I259 HydrophobicContact CD1-CG1 4.32Å; L255-I259 HydrophobicContact CG-CD1 3.68Å; L255-I259 VanDerWaalsContact O-CD1 3.26Å; L255-I259 WeakPolarHBondContact O-CD1 3.32Å; L255-I259 VanDerWaalsContact O-CG1 3.28Å; L255-I259 WeakPolarHBondContact O-CG1 3.39Å; L255-I259 PolarHBondContact O-N 3.48Å; L255-A276 HydrophobicContact CD1-CB 4.09Å; L255-A280 HydrophobicContact CD2-CB 3.96Å; L255-I291 HydrophobicContact CD2-CD1 4.27Å |
| 256 | L | 92.2 | Very high | 91.3 | Very high | 13 Ų | 13 | 48.7 Ų | 48.7 | 7% | 0.068 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.3 | -52 | -176.6 | 174.8 | 64.1 | 0 | 0 | 0 | 112.4 | Y251 R258 I259 R260 I291 P294 L295 | Y251-L256 WeakPolarHBondContact O-CB 3.5Å; Y251-L256 PolarHBondContact O-N 2.77Å; L256-R258 PolarHBondContact O-N 2.8Å; L256-I259 PolarHBondContact O-N 2.83Å; L256-R260 HydrophobicContact CD1-CG 4.29Å; L256-R260 WeakPolarHBondContact O-CG 3.38Å; L256-R260 PolarHBondContact O-N 2.96Å; L256-I291 HydrophobicContact CD1-CG2 4.34Å; L256-P294 HydrophobicContact CD2-CB 4.12Å; L256-L295 HydrophobicContact CD1-CB 4.49Å; L256-L295 HydrophobicContact CD1-CD1 4.2Å |
| 257 | P | 92.1 | Very high | 91.1 | Very high | 51 Ų | 51 | 52.1 Ų | 52.1 | 33% | 0.331 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -57 | -51.1 | 179.9 | -24.5 | 35.7 | 0 | 0 | 0 | 111.4 | N252 I259 R260 D261 | N252-P257 WeakPolarHBondContact O-CD 3.5Å; P257-I259 VanDerWaalsContact C-N 3.27Å; P257-I259 PolarHBondContact O-N 3.1Å; P257-I259 VanDerWaalsContact O-N 3.15Å; P257-R260 WeakPolarHBondContact O-CA 3.46Å; P257-R260 WeakPolarHBondContact O-CB 3.24Å; P257-R260 PolarHBondContact O-N 2.76Å; P257-D261 VanDerWaalsContact O-CG 3.23Å; P257-D261 PolarHBondContact O-N 3.41Å; P257-D261 VanDerWaalsContact O-OD2 3.1Å |
| 258 | R | 91.7 | Very high | 90.7 | Very high | 50 Ų | 50 | 59.9 Ų | 59.9 | 19% | 0.189 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.4 | -37.1 | -178.1 | -178.6 | 54.5 | -179.3 | -84.6 | 1.5 | 113.8 | E224 W226 M231 V254 L256 D262 L273 | E224-R258 PolarHBondContact O-NH1 3.36Å; W226-R258 PolarHBondContact O-NH1 2.99Å; W226-R258 PolarHBondContact O-NH2 3.34Å; M231-R258 HydrophobicContact CE-CB 3.97Å; M231-R258 HydrophobicContact CE-CG 3.94Å; V254-R258 WeakPolarHBondContact O-CB 3.31Å; L256-R258 PolarHBondContact O-N 2.8Å; R258-D262 IonicContact CZ-OD1 2.72Å; R258-D262 IonicContact NE-OD1 3.15Å; R258-D262 PolarHBondContact NE-OD1 3Å; R258-D262 IonicContact NH2-OD1 3.73Å; R258-D262 WeakPolarHBondContact O-CB 3.46Å; R258-D262 PolarHBondContact O-N 3Å; R258-L273 HydrophobicContact CG-CD1 4.31Å; R258-L273 HydrophobicContact CG-CD2 4.49Å |
| 259 | I | 91.1 | Very high | 90.6 | Very high | 2 Ų | 2 | 58.2 Ų | 58.2 | 1% | 0.01 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -66 | -38.8 | 175.3 | -71.9 | 159.6 | 0 | 0 | 0 | 111.6 | L255 L256 P257 I263 L269 L277 | L255-I259 HydrophobicContact CD1-CD1 3.75Å; L255-I259 HydrophobicContact CD1-CG1 4.32Å; L255-I259 HydrophobicContact CG-CD1 3.68Å; L255-I259 VanDerWaalsContact O-CD1 3.26Å; L255-I259 WeakPolarHBondContact O-CD1 3.32Å; L255-I259 VanDerWaalsContact O-CG1 3.28Å; L255-I259 WeakPolarHBondContact O-CG1 3.39Å; L255-I259 PolarHBondContact O-N 3.48Å; L256-I259 PolarHBondContact O-N 2.83Å; P257-I259 VanDerWaalsContact C-N 3.27Å; P257-I259 PolarHBondContact O-N 3.1Å; P257-I259 VanDerWaalsContact O-N 3.15Å; I259-I263 HydrophobicContact CG2-CD1 3.77Å; I259-I263 WeakPolarHBondContact O-CB 3.18Å; I259-I263 WeakPolarHBondContact O-CD1 3.49Å; I259-I263 WeakPolarHBondContact O-CG1 3.27Å; I259-I263 PolarHBondContact O-N 3.06Å; I259-I263 VanDerWaalsContact O-N 3.07Å; I259-L269 HydrophobicContact CG1-CD1 4.46Å; I259-L269 HydrophobicContact CG2-CD1 4.06Å; I259-L269 HydrophobicContact CG2-CD2 4.38Å; I259-L277 HydrophobicContact CD1-CD1 3.83Å; I259-L277 HydrophobicContact CD1-CD2 3.56Å; I259-L277 HydrophobicContact CD1-CG 3.54Å; I259-L277 HydrophobicContact CG2-CD1 4.41Å |
| 260 | R | 89.9 | Confident | 90.6 | Very high | 16 Ų | 16 | 54.8 Ų | 54.8 | 6% | 0.06 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -71.3 | -35.8 | 179.6 | -57.7 | -172.1 | 80.4 | 163.4 | 11.9 | 111.4 | L256 P257 I263 A264 L295 S298 T300 E305 | L256-R260 HydrophobicContact CD1-CG 4.29Å; L256-R260 WeakPolarHBondContact O-CG 3.38Å; L256-R260 PolarHBondContact O-N 2.96Å; P257-R260 WeakPolarHBondContact O-CA 3.46Å; P257-R260 WeakPolarHBondContact O-CB 3.24Å; P257-R260 PolarHBondContact O-N 2.76Å; R260-I263 PolarHBondContact O-N 3.23Å; R260-A264 VanDerWaalsContact O-CB 3.29Å; R260-A264 WeakPolarHBondContact O-CB 3.33Å; R260-A264 PolarHBondContact O-N 2.99Å; R260-L295 VanDerWaalsContact CZ-CD1 3.41Å; R260-S298 PolarHBondContact NH1-OG 3.13Å; R260-T300 PolarHBondContact NH1-OG1 3.08Å; R260-T300 VanDerWaalsContact NH2-C 3.29Å; R260-T300 PolarHBondContact NH2-O 3.07Å; R260-T300 PolarHBondContact NH2-OG1 3.44Å; R260-E305 WeakPolarHBondContact CB-OE1 3.47Å; R260-E305 WeakPolarHBondContact CG-OE1 3.33Å; R260-E305 IonicContact CZ-OE1 2.7Å; R260-E305 IonicContact CZ-OE2 2.65Å; R260-E305 IonicContact NE-OE1 3.16Å; R260-E305 PolarHBondContact NE-OE1 2.99Å; R260-E305 IonicContact NE-OE2 3.64Å; R260-E305 IonicContact NH2-OE1 3.62Å; R260-E305 PolarHBondContact NH2-OE1 3.06Å; R260-E305 VanDerWaalsContact NH2-OE1 3.14Å; R260-E305 IonicContact NH2-OE2 3.78Å; R260-E305 PolarHBondContact NH2-OE2 3.13Å |
| 261 | D | 90.8 | Very high | 90.6 | Very high | 84 Ų | 84 | 60.8 Ų | 60.8 | 45% | 0.449 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -68 | -51.6 | 177.2 | -54.5 | -33.4 | 0 | 0 | 0 | 110.9 | P257 I263 A264 E265 | P257-D261 VanDerWaalsContact O-CG 3.23Å; P257-D261 PolarHBondContact O-N 3.41Å; P257-D261 VanDerWaalsContact O-OD2 3.1Å; D261-I263 VanDerWaalsContact C-N 3.27Å; D261-I263 PolarHBondContact O-N 2.93Å; D261-A264 PolarHBondContact O-N 3.48Å; D261-A264 VanDerWaalsContact O-N 3.1Å; D261-E265 PolarHBondContact O-N 3.49Å |
| 262 | D | 90.3 | Very high | 90.6 | Very high | 16 Ų | 16 | 64 Ų | 64 | 9% | 0.086 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -54.4 | -40.7 | 173.1 | -96.3 | 67.1 | 0 | 0 | 0 | 111.5 | R258 Y266 L269 L273 | R258-D262 IonicContact CZ-OD1 2.72Å; R258-D262 IonicContact NE-OD1 3.15Å; R258-D262 PolarHBondContact NE-OD1 3Å; R258-D262 IonicContact NH2-OD1 3.73Å; R258-D262 WeakPolarHBondContact O-CB 3.46Å; R258-D262 PolarHBondContact O-N 3Å; D262-Y266 WeakPolarHBondContact O-CB 3.27Å; D262-Y266 WeakPolarHBondContact O-CD2 3.49Å; D262-Y266 PolarHBondContact O-N 2.91Å; D262-L269 HydrophobicContact CB-CD1 4.26Å; D262-L273 HydrophobicContact CB-CD1 3.82Å; D262-L273 VanDerWaalsContact OD2-CD1 3.29Å; D262-L273 WeakPolarHBondContact OD2-CD1 3.12Å |
| 263 | I | 89.3 | Confident | 90.7 | Very high | 8 Ų | 8 | 61 Ų | 61 | 4% | 0.041 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -71.9 | -36.1 | 177.6 | -70.5 | 168.9 | 0 | 0 | 0 | 112.4 | I259 R260 D261 K267 L269 E305 I308 | I259-I263 HydrophobicContact CG2-CD1 3.77Å; I259-I263 WeakPolarHBondContact O-CB 3.18Å; I259-I263 WeakPolarHBondContact O-CD1 3.49Å; I259-I263 WeakPolarHBondContact O-CG1 3.27Å; I259-I263 PolarHBondContact O-N 3.06Å; I259-I263 VanDerWaalsContact O-N 3.07Å; R260-I263 PolarHBondContact O-N 3.23Å; D261-I263 VanDerWaalsContact C-N 3.27Å; D261-I263 PolarHBondContact O-N 2.93Å; I263-K267 WeakPolarHBondContact O-CA 3.36Å; I263-K267 PolarHBondContact O-N 3.13Å; I263-L269 HydrophobicContact CD1-CB 4.44Å; I263-L269 HydrophobicContact CD1-CD1 4.31Å; I263-L269 HydrophobicContact CG1-CB 4.15Å; I263-L269 HydrophobicContact CG1-CD1 4.07Å; I263-E305 HydrophobicContact CD1-CG 4.24Å; I263-E305 HydrophobicContact CG2-CG 3.91Å; I263-I308 HydrophobicContact CD1-CD1 3.91Å; I263-I308 HydrophobicContact CD1-CG2 4.37Å; I263-I308 HydrophobicContact CG1-CD1 4.06Å |
| 264 | A | 88.7 | Confident | 90.8 | Very high | 73 Ų | 73 | 59.3 Ų | 59.3 | 60% | 0.603 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -68.8 | -41.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R260 D261 | R260-A264 VanDerWaalsContact O-CB 3.29Å; R260-A264 WeakPolarHBondContact O-CB 3.33Å; R260-A264 PolarHBondContact O-N 2.99Å; D261-A264 PolarHBondContact O-N 3.48Å; D261-A264 VanDerWaalsContact O-N 3.1Å |
| 265 | E | 90.6 | Very high | 90.9 | Very high | 132 Ų | 132 | 59.8 Ų | 59.8 | 62% | 0.617 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -73.7 | -58 | 179.9 | -170.9 | -177.6 | 164.2 | 0 | 0 | 111.6 | D261 | D261-E265 PolarHBondContact O-N 3.49Å |
| 266 | Y | 87.6 | Confident | 91 | Very high | 145 Ų | 145 | 59.8 Ų | 59.8 | 57% | 0.569 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -92 | -11.6 | -169.9 | -63.8 | -83.4 | 0 | 0 | 0 | 114.4 | D262 K268 | D262-Y266 WeakPolarHBondContact O-CB 3.27Å; D262-Y266 WeakPolarHBondContact O-CD2 3.49Å; D262-Y266 PolarHBondContact O-N 2.91Å; Y266-K268 PolarHBondContact O-N 2.79Å |
| 267 | K | 85.4 | Confident | 91 | Very high | 136 Ų | 136 | 59.2 Ų | 59.2 | 59% | 0.591 | 28% | 0.284 | S | S | * | . | S | Bend | trans | 58.4 | 7.3 | -174.3 | -57 | 167.9 | -173.2 | 167.5 | 0 | 114.4 | I263 | I263-K267 WeakPolarHBondContact O-CA 3.36Å; I263-K267 PolarHBondContact O-N 3.13Å |
| 268 | K | 85.7 | Confident | 91.1 | Very high | 164 Ų | 164 | 60.9 Ų | 60.9 | 71% | 0.713 | 29% | 0.286 | S | S | * | . | S | Bend | trans | -143.1 | 139.6 | 177.9 | -64.7 | -175.2 | 178.2 | -174.2 | 0 | 107.5 | Y266 | Y266-K268 PolarHBondContact O-N 2.79Š|
| 269 | L | 89.8 | Confident | 91.2 | Very high | 28 Ų | 28 | 61.6 Ų | 61.6 | 15% | 0.147 | 29% | 0.29 | C | S | . | . | trans | -82.5 | 138.3 | 178.7 | -174.5 | 61.6 | 0 | 0 | 0 | 111.3 | I259 D262 I263 L273 Y274 L277 I308 | I259-L269 HydrophobicContact CG1-CD1 4.46Å; I259-L269 HydrophobicContact CG2-CD1 4.06Å; I259-L269 HydrophobicContact CG2-CD2 4.38Å; D262-L269 HydrophobicContact CB-CD1 4.26Å; I263-L269 HydrophobicContact CD1-CB 4.44Å; I263-L269 HydrophobicContact CD1-CD1 4.31Å; I263-L269 HydrophobicContact CG1-CB 4.15Å; I263-L269 HydrophobicContact CG1-CD1 4.07Å; L269-L273 HydrophobicContact CD1-CB 3.66Å; L269-L273 HydrophobicContact CD1-CD1 3.87Å; L269-L273 HydrophobicContact CD1-CG 4.43Å; L269-L273 HydrophobicContact CD2-CB 4.42Å; L269-L273 HydrophobicContact CG-CB 4.04Å; L269-Y274 HydrophobicContact CD2-CD2 4.38Å; L269-L277 HydrophobicContact CD2-CD1 4Å; L269-I308 HydrophobicContact CB-CD1 4.33Å; L269-I308 HydrophobicContact CB-CG2 3.96Å; L269-I308 HydrophobicContact CD2-CG2 3.67Å; L269-I308 HydrophobicContact CG-CG2 4.47Å | ||
| 270 | N | 92.9 | Very high | 91.3 | Very high | 63 Ų | 63 | 61.5 Ų | 61.5 | 34% | 0.337 | 29% | 0.29 | S | S | . | . | trans | -60.9 | 137.7 | 174.2 | -171.1 | -71.6 | 0 | 0 | 0 | 111.8 | A228 H272 L273 Y274 | A228-N270 HydrophobicContact CB-CB 4.32Å; A228-N270 WeakPolarHBondContact CB-OD1 3.17Å; N270-H272 VanDerWaalsContact C-N 3.26Å; N270-H272 PolarHBondContact O-N 3.38Å; N270-H272 PolarHBondContact OD1-N 2.99Å; N270-L273 HydrophobicContact CB-CB 4.43Å; N270-L273 HydrophobicContact CB-CD1 4.39Å; N270-L273 HydrophobicContact CB-CG 4.28Å; N270-L273 PolarHBondContact O-N 3.16Å; N270-Y274 PolarHBondContact O-N 3.18Å | ||
| 271 | F | 92.9 | Very high | 91.4 | Very high | 126 Ų | 126 | 61.4 Ų | 61.4 | 55% | 0.553 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -50 | -43.1 | 178.9 | 174.1 | -97.1 | 0 | 0 | 0 | 113.4 | L273 Y274 M275 | F271-L273 PolarHBondContact O-N 3.16Å; F271-Y274 PolarHBondContact O-N 3.26Å; F271-M275 HydrophobicContact CD2-CE 4.32Å; F271-M275 HydrophobicContact CE1-CG 4.12Å; F271-M275 HydrophobicContact CE2-CE 3.46Å; F271-M275 VanDerWaalsContact CE2-CE 3.46Å; F271-M275 HydrophobicContact CE2-CG 4.18Å; F271-M275 HydrophobicContact CZ-CE 3.71Å; F271-M275 HydrophobicContact CZ-CG 3.95Å; F271-M275 WeakPolarHBondContact O-CG 3.27Å; F271-M275 PolarHBondContact O-N 3.43Å |
| 272 | H | 93.8 | Very high | 91.4 | Very high | 68 Ų | 68 | 64.3 Ų | 64.3 | 32% | 0.315 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -69.1 | -32.9 | 180 | -61.8 | -60.4 | 0 | 0 | 0 | 112.6 | A228 N270 A276 | A228-H272 HydrophobicContact CB-CB 4.02Å; A228-H272 VanDerWaalsContact O-CB 3.27Å; A228-H272 WeakPolarHBondContact O-CB 3.32Å; N270-H272 VanDerWaalsContact C-N 3.26Å; N270-H272 PolarHBondContact O-N 3.38Å; N270-H272 PolarHBondContact OD1-N 2.99Å; H272-A276 WeakPolarHBondContact O-CB 3.27Å; H272-A276 PolarHBondContact O-N 2.92Å |
| 273 | L | 93.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -74.3 | -35.6 | 173.9 | -66 | -176.9 | 0 | 0 | 0 | 112.1 | A228 M231 R258 D262 L269 N270 F271 M275 A276 L277 | A228-L273 HydrophobicContact CB-CG 4.27Å; M231-L273 HydrophobicContact CB-CD2 3.6Å; M231-L273 HydrophobicContact CE-CD2 4.35Å; M231-L273 HydrophobicContact CG-CD2 4.07Å; R258-L273 HydrophobicContact CG-CD1 4.31Å; R258-L273 HydrophobicContact CG-CD2 4.49Å; D262-L273 HydrophobicContact CB-CD1 3.82Å; D262-L273 VanDerWaalsContact OD2-CD1 3.29Å; D262-L273 WeakPolarHBondContact OD2-CD1 3.12Å; L269-L273 HydrophobicContact CD1-CB 3.66Å; L269-L273 HydrophobicContact CD1-CD1 3.87Å; L269-L273 HydrophobicContact CD1-CG 4.43Å; L269-L273 HydrophobicContact CD2-CB 4.42Å; L269-L273 HydrophobicContact CG-CB 4.04Å; N270-L273 HydrophobicContact CB-CB 4.43Å; N270-L273 HydrophobicContact CB-CD1 4.39Å; N270-L273 HydrophobicContact CB-CG 4.28Å; N270-L273 PolarHBondContact O-N 3.16Å; F271-L273 PolarHBondContact O-N 3.16Å; L273-M275 VanDerWaalsContact C-N 3.33Å; L273-A276 WeakPolarHBondContact O-CB 3.44Å; L273-A276 PolarHBondContact O-N 3.21Å; L273-L277 PolarHBondContact O-N 3.14Å |
| 274 | Y | 93.7 | Very high | 91.6 | Very high | 50 Ų | 50 | 66.9 Ų | 66.9 | 20% | 0.196 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.9 | -45.3 | 170.8 | -171 | -81.9 | 0 | 0 | 0 | 110.9 | L269 N270 F271 A276 L277 K278 I308 S311 I312 | L269-Y274 HydrophobicContact CD2-CD2 4.38Å; N270-Y274 PolarHBondContact O-N 3.18Å; F271-Y274 PolarHBondContact O-N 3.26Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; Y274-A276 PolarHBondContact O-N 2.73Å; Y274-L277 PolarHBondContact O-N 3Å; Y274-K278 PolarHBondContact O-N 3.15Å; Y274-I308 HydrophobicContact CD2-CG2 4.46Å; Y274-S311 PolarHBondContact OH-OG 2.74Å; Y274-I312 HydrophobicContact CD2-CD1 3.74Å; Y274-I312 HydrophobicContact CD2-CG1 4.01Å; Y274-I312 HydrophobicContact CE1-CG1 3.98Å; Y274-I312 HydrophobicContact CE2-CD1 3.67Å; Y274-I312 HydrophobicContact CE2-CG1 3.41Å; Y274-I312 VanDerWaalsContact CE2-CG1 3.41Å; Y274-I312 HydrophobicContact CG-CD1 4.21Å |
| 275 | M | 93.6 | Very high | 91.8 | Very high | 31 Ų | 31 | 63.5 Ų | 63.5 | 15% | 0.153 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.4 | -27.3 | 174.5 | -66.3 | -58.9 | 179.2 | 0 | 0 | 113.1 | Y232 F271 L273 K278 K279 | Y232-M275 HydrophobicContact CD2-CB 3.85Å; Y232-M275 HydrophobicContact CE2-CB 3.71Å; F271-M275 HydrophobicContact CD2-CE 4.32Å; F271-M275 HydrophobicContact CE1-CG 4.12Å; F271-M275 HydrophobicContact CE2-CE 3.46Å; F271-M275 VanDerWaalsContact CE2-CE 3.46Å; F271-M275 HydrophobicContact CE2-CG 4.18Å; F271-M275 HydrophobicContact CZ-CE 3.71Å; F271-M275 HydrophobicContact CZ-CG 3.95Å; F271-M275 WeakPolarHBondContact O-CG 3.27Å; F271-M275 PolarHBondContact O-N 3.43Å; L273-M275 VanDerWaalsContact C-N 3.33Å; M275-K278 PolarHBondContact O-N 3.13Å; M275-K278 HydrophobicContact SD-CB 4.42Å; M275-K278 HydrophobicContact SD-CD 3.68Å; M275-K279 PolarHBondContact O-N 2.82Å |
| 276 | A | 94.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.4 | -48.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | Y232 T235 L255 H272 L273 Y274 K278 K279 A280 | Y232-A276 HydrophobicContact CD2-CB 4.44Å; T235-A276 HydrophobicContact CG2-CB 4.18Å; T235-A276 VanDerWaalsContact CG2-O 3.32Å; T235-A276 WeakPolarHBondContact CG2-O 3.17Å; L255-A276 HydrophobicContact CD1-CB 4.09Å; H272-A276 WeakPolarHBondContact O-CB 3.27Å; H272-A276 PolarHBondContact O-N 2.92Å; L273-A276 WeakPolarHBondContact O-CB 3.44Å; L273-A276 PolarHBondContact O-N 3.21Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; Y274-A276 PolarHBondContact O-N 2.73Å; A276-K278 PolarHBondContact O-N 3.45Å; A276-K279 PolarHBondContact O-N 3.4Å; A276-A280 WeakPolarHBondContact O-CB 3.38Å; A276-A280 PolarHBondContact O-N 3.48Å |
| 277 | L | 93.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.2 | -43.8 | 172.3 | -79.6 | 174.4 | 0 | 0 | 0 | 112.4 | I259 L269 L273 Y274 K279 A280 L281 I291 I309 I312 | I259-L277 HydrophobicContact CD1-CD1 3.83Å; I259-L277 HydrophobicContact CD1-CD2 3.56Å; I259-L277 HydrophobicContact CD1-CG 3.54Å; I259-L277 HydrophobicContact CG2-CD1 4.41Å; L269-L277 HydrophobicContact CD2-CD1 4Å; L273-L277 PolarHBondContact O-N 3.14Å; Y274-L277 PolarHBondContact O-N 3Å; L277-K279 PolarHBondContact O-N 2.89Å; L277-A280 PolarHBondContact O-N 3.12Å; L277-L281 PolarHBondContact O-N 3.02Å; L277-I291 HydrophobicContact CD2-CD1 3.86Å; L277-I291 HydrophobicContact CD2-CG2 4.31Å; L277-I309 HydrophobicContact CD1-CG1 4.2Å; L277-I312 HydrophobicContact CB-CD1 3.64Å; L277-I312 HydrophobicContact CB-CG2 4.43Å; L277-I312 HydrophobicContact CD1-CD1 3.45Å; L277-I312 VanDerWaalsContact CD1-CD1 3.45Å; L277-I312 HydrophobicContact CG-CD1 4.21Å |
| 278 | K | 93.4 | Very high | 92.6 | Very high | 86 Ų | 86 | 44.2 Ų | 44.2 | 37% | 0.374 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -58.9 | -34.6 | 176 | -165.5 | -177.4 | -178.7 | -177.1 | 0 | 112.1 | Y274 M275 A276 | Y274-K278 PolarHBondContact O-N 3.15Å; M275-K278 PolarHBondContact O-N 3.13Å; M275-K278 HydrophobicContact SD-CB 4.42Å; M275-K278 HydrophobicContact SD-CD 3.68Å; A276-K278 PolarHBondContact O-N 3.45Å |
| 279 | K | 92.8 | Very high | 92.9 | Very high | 66 Ų | 66 | 40.9 Ų | 40.9 | 29% | 0.287 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -82.1 | -33.3 | 173.7 | -71 | -65.5 | -179.3 | -179.6 | 0 | 113.6 | Y232 M275 A276 L277 L281 F282 | Y232-K279 HydrophobicContact CE2-CG 3.76Å; M275-K279 PolarHBondContact O-N 2.82Å; A276-K279 PolarHBondContact O-N 3.4Å; L277-K279 PolarHBondContact O-N 2.89Å; K279-L281 PolarHBondContact O-N 3.39Å; K279-F282 HydrophobicContact CD-CD2 4.24Å; K279-F282 HydrophobicContact CD-CE2 3.87Å; K279-F282 HydrophobicContact CD-CZ 4.47Å; K279-F282 WeakPolarHBondContact O-CB 3.32Å; K279-F282 WeakPolarHBondContact O-CD2 3.33Å; K279-F282 PolarHBondContact O-N 3.26Å; K279-F282 VanDerWaalsContact O-N 3.08Å |
| 280 | A | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59 | -31.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | T235 Y251 L255 A276 L277 F282 K283 I291 | T235-A280 HydrophobicContact CG2-CB 3.94Å; Y251-A280 HydrophobicContact CD1-CB 4.34Å; Y251-A280 HydrophobicContact CE1-CB 3.75Å; Y251-A280 HydrophobicContact CE2-CB 4.11Å; Y251-A280 VanDerWaalsContact OH-CA 3.31Å; Y251-A280 WeakPolarHBondContact OH-CA 3.46Å; Y251-A280 PolarHBondContact OH-O 3.31Å; L255-A280 HydrophobicContact CD2-CB 3.96Å; A276-A280 WeakPolarHBondContact O-CB 3.38Å; A276-A280 PolarHBondContact O-N 3.48Å; L277-A280 PolarHBondContact O-N 3.12Å; A280-F282 PolarHBondContact O-N 3.12Å; A280-F282 VanDerWaalsContact O-N 3.16Å; A280-K283 PolarHBondContact O-N 2.99Å; A280-I291 HydrophobicContact CB-CD1 4.37Å |
| 281 | L | 92.1 | Very high | 92.9 | Very high | 14 Ų | 14 | 36.6 Ų | 36.6 | 7% | 0.073 | 16% | 0.163 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -13.3 | 175.4 | -91.7 | 169.9 | 0 | 0 | 0 | 115.4 | L277 K279 K283 P284 W287 I312 C316 I318 | L277-L281 PolarHBondContact O-N 3.02Å; K279-L281 PolarHBondContact O-N 3.39Å; L281-K283 PolarHBondContact O-N 2.93Å; L281-K283 VanDerWaalsContact O-N 3.15Å; L281-P284 WeakPolarHBondContact O-CD 3.47Å; L281-W287 HydrophobicContact CD2-CB 4.15Å; L281-W287 HydrophobicContact CD2-CD2 3.4Å; L281-W287 VanDerWaalsContact CD2-CD2 3.4Å; L281-W287 HydrophobicContact CD2-CE3 3.68Å; L281-W287 HydrophobicContact CD2-CG 3.59Å; L281-W287 HydrophobicContact CD2-CZ2 4.45Å; L281-W287 HydrophobicContact CD2-CZ3 4.33Å; L281-W287 HydrophobicContact CG-CD2 3.86Å; L281-W287 HydrophobicContact CG-CG 3.83Å; L281-W287 HydrophobicContact CG-CZ2 4.5Å; L281-I312 HydrophobicContact CD1-CG2 3.74Å; L281-C316 HydrophobicContact CD1-CB 3.62Å; L281-I318 HydrophobicContact CD2-CD1 4.22Å; L281-I318 HydrophobicContact CD2-CG1 4.48Å |
| 282 | F | 90.6 | Very high | 92.9 | Very high | 144 Ų | 144 | 30.6 Ų | 30.6 | 63% | 0.632 | 14% | 0.137 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -19.4 | 174.4 | -83.8 | -113 | 0 | 0 | 0 | 112.9 | K279 A280 | K279-F282 HydrophobicContact CD-CD2 4.24Å; K279-F282 HydrophobicContact CD-CE2 3.87Å; K279-F282 HydrophobicContact CD-CZ 4.47Å; K279-F282 WeakPolarHBondContact O-CB 3.32Å; K279-F282 WeakPolarHBondContact O-CD2 3.33Å; K279-F282 PolarHBondContact O-N 3.26Å; K279-F282 VanDerWaalsContact O-N 3.08Å; A280-F282 PolarHBondContact O-N 3.12Å; A280-F282 VanDerWaalsContact O-N 3.16Å |
| 283 | K | 92.3 | Very high | 92.7 | Very high | 58 Ų | 58 | 28.5 Ų | 28.5 | 25% | 0.252 | 13% | 0.128 | S | C | . | . | S | Bend | trans | -116.7 | 84.1 | 165.8 | -66.3 | -171 | -167.7 | -124.2 | 0 | 109.3 | S239 S240 L242 A247 A280 L281 G285 A286 W287 | S239-K283 WeakPolarHBondContact O-CD 3.48Å; S239-K283 WeakPolarHBondContact O-CE 3.37Å; S240-K283 WeakPolarHBondContact O-CE 3.4Å; S240-K283 PolarHBondContact O-NZ 3.41Å; S240-K283 VanDerWaalsContact O-NZ 3.15Å; L242-K283 WeakPolarHBondContact O-CE 3.28Å; L242-K283 PolarHBondContact O-NZ 2.93Å; A247-K283 HydrophobicContact CB-CD 4.48Å; A280-K283 PolarHBondContact O-N 2.99Å; L281-K283 PolarHBondContact O-N 2.93Å; L281-K283 VanDerWaalsContact O-N 3.15Å; K283-G285 PolarHBondContact O-N 3.39Å; K283-A286 HydrophobicContact CB-CB 4.13Å; K283-A286 PolarHBondContact O-N 3.43Å; K283-W287 PolarHBondContact O-N 3.1Å |
| 284 | P | 92.5 | Very high | 92.6 | Very high | 20 Ų | 20 | 29.7 Ų | 29.7 | 13% | 0.13 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.7 | -37.8 | -169 | 22.8 | -33.4 | 0 | 0 | 0 | 113.2 | L281 A286 W287 F288 I318 P319 H322 | L281-P284 WeakPolarHBondContact O-CD 3.47Å; P284-A286 PolarHBondContact O-N 3.15Å; P284-W287 PolarHBondContact O-N 3.14Å; P284-W287 VanDerWaalsContact O-N 3.17Å; P284-F288 HydrophobicContact CB-CD2 4.41Å; P284-F288 HydrophobicContact CB-CE2 4.35Å; P284-F288 WeakPolarHBondContact O-CD2 3.48Å; P284-F288 PolarHBondContact O-N 2.85Å; P284-I318 HydrophobicContact CB-CG2 4.25Å; P284-P319 HydrophobicContact CG-CG 4.08Å; P284-H322 HydrophobicContact CB-CB 4.14Å; P284-H322 HydrophobicContact CG-CB 4.47Å |
| 285 | G | 91.2 | Very high | 92.3 | Very high | 2 Ų | 2 | 27.4 Ų | 27.4 | 2% | 0.021 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58.5 | -46.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | E244 K283 K289 H322 | E244-G285 WeakPolarHBondContact OE1-CA 3.41Å; K283-G285 PolarHBondContact O-N 3.39Å; G285-K289 WeakPolarHBondContact O-CB 3.42Å; G285-K289 WeakPolarHBondContact O-CD 3.47Å; G285-K289 WeakPolarHBondContact O-CG 3.46Å; G285-K289 PolarHBondContact O-N 3.26Å; G285-K289 VanDerWaalsContact O-N 3.13Å; G285-H322 PolarHBondContact N-CD2 3.25Å; G285-H322 VanDerWaalsContact N-CD2 3.3Å |
| 286 | A | 93.3 | Very high | 92 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -64.3 | -39.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | E244 A247 Q248 Y251 K283 P284 G290 | E244-A286 HydrophobicContact CG-CB 3.71Å; E244-A286 PolarHBondContact OE1-N 3.33Å; A247-A286 HydrophobicContact CB-CB 3.84Å; Q248-A286 HydrophobicContact CB-CB 4.33Å; Y251-A286 HydrophobicContact CD2-CB 4.11Å; Y251-A286 HydrophobicContact CE2-CB 3.77Å; K283-A286 HydrophobicContact CB-CB 4.13Å; K283-A286 PolarHBondContact O-N 3.43Å; P284-A286 PolarHBondContact O-N 3.15Å; A286-G290 WeakPolarHBondContact O-CA 3.42Å; A286-G290 PolarHBondContact O-N 2.96Å |
| 287 | W | 95.1 | Very high | 91.6 | Very high | 1 Ų | 1 | 31.4 Ų | 31.4 | 0% | 0.004 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65 | -49.6 | 179.4 | -174.3 | 94.2 | 0 | 0 | 0 | 111.9 | Y251 L281 K283 P284 G290 I291 L292 I309 L313 | Y251-W287 HydrophobicContact CE2-CB 4.42Å; L281-W287 HydrophobicContact CD2-CB 4.15Å; L281-W287 HydrophobicContact CD2-CD2 3.4Å; L281-W287 VanDerWaalsContact CD2-CD2 3.4Å; L281-W287 HydrophobicContact CD2-CE3 3.68Å; L281-W287 HydrophobicContact CD2-CG 3.59Å; L281-W287 HydrophobicContact CD2-CZ2 4.45Å; L281-W287 HydrophobicContact CD2-CZ3 4.33Å; L281-W287 HydrophobicContact CG-CD2 3.86Å; L281-W287 HydrophobicContact CG-CG 3.83Å; L281-W287 HydrophobicContact CG-CZ2 4.5Å; K283-W287 PolarHBondContact O-N 3.1Å; P284-W287 PolarHBondContact O-N 3.14Å; P284-W287 VanDerWaalsContact O-N 3.17Å; W287-G290 PolarHBondContact O-N 3.11Å; W287-I291 VanDerWaalsContact CD1-CD1 3.41Å; W287-I291 HydrophobicContact CG-CD1 4.11Å; W287-I291 HydrophobicContact CZ2-CG2 4.45Å; W287-I291 WeakPolarHBondContact O-CA 3.48Å; W287-I291 WeakPolarHBondContact O-CB 3.39Å; W287-I291 PolarHBondContact O-N 2.91Å; W287-L292 HydrophobicContact CE3-CB 4.36Å; W287-L292 HydrophobicContact CH2-CB 4.02Å; W287-L292 HydrophobicContact CH2-CD1 4.29Å; W287-L292 HydrophobicContact CH2-CD2 4.38Å; W287-L292 HydrophobicContact CH2-CG 4.46Å; W287-L292 HydrophobicContact CZ3-CB 3.7Å; W287-L292 HydrophobicContact CZ3-CD2 3.99Å; W287-L292 HydrophobicContact CZ3-CG 4.31Å; W287-L292 PolarHBondContact O-N 2.99Å; W287-I309 HydrophobicContact CH2-CG2 4.09Å; W287-I309 HydrophobicContact CZ2-CG2 3.89Å; W287-L313 HydrophobicContact CH2-CD1 4.15Å; W287-L313 HydrophobicContact CH2-CD2 3.44Å; W287-L313 VanDerWaalsContact CH2-CD2 3.44Å; W287-L313 HydrophobicContact CH2-CG 3.69Å; W287-L313 HydrophobicContact CZ2-CD2 4.38Å; W287-L313 HydrophobicContact CZ3-CD2 3.52Å; W287-L313 HydrophobicContact CZ3-CG 4.27Å |
| 288 | F | 93.8 | Very high | 91 | Very high | 7 Ų | 7 | 33.1 Ų | 33.1 | 3% | 0.031 | 16% | 0.158 | C | C | . | . | I | π-helix | trans | -62.5 | -47 | 178.4 | -77.2 | -64.9 | 0 | 0 | 0 | 111.9 | P284 G290 L292 I293 L313 I318 H322 A326 | P284-F288 HydrophobicContact CB-CD2 4.41Å; P284-F288 HydrophobicContact CB-CE2 4.35Å; P284-F288 WeakPolarHBondContact O-CD2 3.48Å; P284-F288 PolarHBondContact O-N 2.85Å; F288-G290 PolarHBondContact O-N 3.32Å; F288-L292 HydrophobicContact CD1-CB 4.2Å; F288-L292 HydrophobicContact CD1-CD2 3.7Å; F288-L292 HydrophobicContact CE1-CD2 3.78Å; F288-L292 PolarHBondContact O-N 3.03Å; F288-I293 WeakPolarHBondContact O-CB 3.44Å; F288-I293 WeakPolarHBondContact O-CG1 3.4Å; F288-I293 PolarHBondContact O-N 3.32Å; F288-L313 HydrophobicContact CE1-CD2 4.25Å; F288-L313 HydrophobicContact CZ-CD2 4.43Å; F288-I318 HydrophobicContact CE2-CG2 3.73Å; F288-I318 HydrophobicContact CZ-CD1 4.36Å; F288-I318 HydrophobicContact CZ-CG2 3.96Å; F288-H322 HydrophobicContact CD2-CB 4.08Å; F288-H322 HydrophobicContact CE2-CB 3.84Å; F288-A326 HydrophobicContact CD1-CB 3.32Å; F288-A326 HydrophobicContact CD2-CB 4.33Å; F288-A326 HydrophobicContact CE1-CB 3.35Å; F288-A326 HydrophobicContact CE2-CB 4.36Å; F288-A326 HydrophobicContact CG-CB 3.85Å; F288-A326 HydrophobicContact CZ-CB 3.9Å |
| 289 | K | 91.8 | Very high | 90.1 | Very high | 95 Ų | 95 | 30 Ų | 30 | 41% | 0.413 | 15% | 0.15 | S | C | . | . | I | π-helix | trans | -77.5 | -16.4 | -177.7 | -58.1 | 165.9 | -169.7 | 162.4 | 0 | 114 | E244 Q248 G285 P294 | E244-K289 IonicContact OE1-NZ 3.89Å; E244-K289 PolarHBondContact OE1-NZ 3.01Å; Q248-K289 HydrophobicContact CG-CB 3.93Å; Q248-K289 PolarHBondContact NE2-O 3.39Å; Q248-K289 VanDerWaalsContact NE2-O 3.07Å; G285-K289 WeakPolarHBondContact O-CB 3.42Å; G285-K289 WeakPolarHBondContact O-CD 3.47Å; G285-K289 WeakPolarHBondContact O-CG 3.46Å; G285-K289 PolarHBondContact O-N 3.26Å; G285-K289 VanDerWaalsContact O-N 3.13Å; K289-P294 WeakPolarHBondContact O-CG 3.42Å |
| 290 | G | 90 | Very high | 89.5 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.143 | C | C | . | . | I | π-helix | trans | -105.9 | -30.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | N252 A286 W287 F288 | N252-G290 WeakPolarHBondContact CA-O 3.47Å; A286-G290 WeakPolarHBondContact O-CA 3.42Å; A286-G290 PolarHBondContact O-N 2.96Å; W287-G290 PolarHBondContact O-N 3.11Å; F288-G290 PolarHBondContact O-N 3.32Å |
| 291 | I | 92.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.144 | C | C | . | . | I | π-helix | trans | -116.5 | -66.6 | -175.9 | -64.2 | 157.4 | 0 | 0 | 0 | 110.2 | Y251 L255 L256 L277 A280 W287 L295 | Y251-I291 HydrophobicContact CD2-CD1 4.11Å; Y251-I291 HydrophobicContact CG-CD1 4.04Å; Y251-I291 HydrophobicContact CG-CG1 4.49Å; L255-I291 HydrophobicContact CD2-CD1 4.27Å; L256-I291 HydrophobicContact CD1-CG2 4.34Å; L277-I291 HydrophobicContact CD2-CD1 3.86Å; L277-I291 HydrophobicContact CD2-CG2 4.31Å; A280-I291 HydrophobicContact CB-CD1 4.37Å; W287-I291 VanDerWaalsContact CD1-CD1 3.41Å; W287-I291 HydrophobicContact CG-CD1 4.11Å; W287-I291 HydrophobicContact CZ2-CG2 4.45Å; W287-I291 WeakPolarHBondContact O-CA 3.48Å; W287-I291 WeakPolarHBondContact O-CB 3.39Å; W287-I291 PolarHBondContact O-N 2.91Å; I291-L295 WeakPolarHBondContact O-CB 3.47Å; I291-L295 PolarHBondContact O-N 3.39Å |
| 292 | L | 91.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | I | π-helix | trans | -67.5 | -50.9 | -166.7 | -170.7 | 66.9 | 0 | 0 | 0 | 113.2 | W287 F288 L295 C296 I309 L313 L330 F342 | W287-L292 HydrophobicContact CE3-CB 4.36Å; W287-L292 HydrophobicContact CH2-CB 4.02Å; W287-L292 HydrophobicContact CH2-CD1 4.29Å; W287-L292 HydrophobicContact CH2-CD2 4.38Å; W287-L292 HydrophobicContact CH2-CG 4.46Å; W287-L292 HydrophobicContact CZ3-CB 3.7Å; W287-L292 HydrophobicContact CZ3-CD2 3.99Å; W287-L292 HydrophobicContact CZ3-CG 4.31Å; W287-L292 PolarHBondContact O-N 2.99Å; F288-L292 HydrophobicContact CD1-CB 4.2Å; F288-L292 HydrophobicContact CD1-CD2 3.7Å; F288-L292 HydrophobicContact CE1-CD2 3.78Å; F288-L292 PolarHBondContact O-N 3.03Å; L292-L295 PolarHBondContact O-N 2.88Å; L292-C296 PolarHBondContact O-N 3.02Å; L292-C296 VanDerWaalsContact O-N 3.14Å; L292-C296 PolarHBondContact O-SG 3.03Å; L292-I309 HydrophobicContact CD1-CG2 4.43Å; L292-L313 HydrophobicContact CD2-CD1 4.36Å; L292-L330 HydrophobicContact CD2-CD1 4.17Å; L292-F342 HydrophobicContact CD1-CD1 3.67Å; L292-F342 HydrophobicContact CD1-CD2 3.73Å; L292-F342 HydrophobicContact CD1-CE1 3.61Å; L292-F342 HydrophobicContact CD1-CE2 3.66Å; L292-F342 HydrophobicContact CD1-CG 3.73Å; L292-F342 HydrophobicContact CD1-CZ 3.59Å |
| 293 | I | 90.9 | Very high | 88.3 | Confident | 24 Ų | 24 | 24.1 Ų | 24.1 | 12% | 0.123 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.9 | -51 | -177.7 | -65.7 | 163.4 | 0 | 0 | 0 | 110.3 | F288 L295 C296 E297 K329 | F288-I293 WeakPolarHBondContact O-CB 3.44Å; F288-I293 WeakPolarHBondContact O-CG1 3.4Å; F288-I293 PolarHBondContact O-N 3.32Å; I293-L295 VanDerWaalsContact C-N 3.29Å; I293-L295 PolarHBondContact O-N 3.25Å; I293-C296 PolarHBondContact O-N 3.02Å; I293-C296 VanDerWaalsContact O-N 3.1Å; I293-E297 HydrophobicContact CG2-CG 4Å; I293-E297 WeakPolarHBondContact O-CB 3.3Å; I293-E297 WeakPolarHBondContact O-CG 3.41Å; I293-E297 PolarHBondContact O-N 3.48Å; I293-K329 HydrophobicContact CD1-CB 4.45Å; I293-K329 HydrophobicContact CD1-CG 4.02Å; I293-K329 HydrophobicContact CG1-CG 4.13Å; I293-K329 HydrophobicContact CG2-CG 4.17Å |
| 294 | P | 90.9 | Very high | 88 | Confident | 26 Ų | 26 | 27.7 Ų | 27.7 | 17% | 0.169 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.3 | -33.1 | 176.2 | -26.5 | 36.7 | 0 | 0 | 0 | 114.5 | L256 K289 S298 | L256-P294 HydrophobicContact CD2-CB 4.12Å; K289-P294 WeakPolarHBondContact O-CG 3.42Å; P294-S298 VanDerWaalsContact O-CB 3.28Å; P294-S298 WeakPolarHBondContact O-CB 3.32Å; P294-S298 PolarHBondContact O-N 3.4Å |
| 295 | L | 88.4 | Confident | 87.9 | Confident | 1 Ų | 1 | 27 Ų | 27 | 1% | 0.005 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.9 | -46.5 | 174.4 | -178.5 | 76.6 | 0 | 0 | 0 | 111 | L256 R260 I291 L292 I293 S298 C301 I309 F342 | L256-L295 HydrophobicContact CD1-CB 4.49Å; L256-L295 HydrophobicContact CD1-CD1 4.2Å; R260-L295 VanDerWaalsContact CZ-CD1 3.41Å; I291-L295 WeakPolarHBondContact O-CB 3.47Å; I291-L295 PolarHBondContact O-N 3.39Å; L292-L295 PolarHBondContact O-N 2.88Å; I293-L295 VanDerWaalsContact C-N 3.29Å; I293-L295 PolarHBondContact O-N 3.25Å; L295-S298 PolarHBondContact O-OG 3.47Å; L295-C301 HydrophobicContact CG-CB 4.18Å; L295-I309 HydrophobicContact CD2-CD1 3.6Å; L295-F342 HydrophobicContact CD2-CE2 4.02Å; L295-F342 HydrophobicContact CD2-CZ 3.76Å |
| 296 | C | 86.1 | Confident | 87.8 | Confident | 7 Ų | 7 | 26.9 Ų | 26.9 | 5% | 0.047 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -69.9 | -48.6 | 179.2 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | L292 I293 S298 G299 L330 M333 N339 | L292-C296 PolarHBondContact O-N 3.02Å; L292-C296 VanDerWaalsContact O-N 3.14Å; L292-C296 PolarHBondContact O-SG 3.03Å; I293-C296 PolarHBondContact O-N 3.02Å; I293-C296 VanDerWaalsContact O-N 3.1Å; C296-S298 PolarHBondContact O-N 3.3Å; C296-G299 PolarHBondContact O-N 3.41Å; C296-G299 VanDerWaalsContact O-N 3.16Å; C296-L330 HydrophobicContact CB-CD2 4.43Å; C296-M333 HydrophobicContact CB-CE 3.77Å; C296-M333 HydrophobicContact CB-SD 4.29Å; C296-N339 WeakPolarHBondContact CB-OD1 3.49Å |
| 297 | E | 86.4 | Confident | 87.6 | Confident | 108 Ų | 108 | 29.3 Ų | 29.3 | 51% | 0.505 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -59.8 | -27.9 | 177.3 | -70.2 | -177 | 148.7 | 0 | 0 | 112.6 | I293 G299 K329 M333 | I293-E297 HydrophobicContact CG2-CG 4Å; I293-E297 WeakPolarHBondContact O-CB 3.3Å; I293-E297 WeakPolarHBondContact O-CG 3.41Å; I293-E297 PolarHBondContact O-N 3.48Å; E297-G299 PolarHBondContact O-N 2.88Å; E297-G299 VanDerWaalsContact O-N 3.16Å; E297-K329 WeakPolarHBondContact OE1-CE 3.45Å; E297-K329 IonicContact OE1-NZ 3.96Å; E297-K329 PolarHBondContact OE1-NZ 2.91Å; E297-M333 HydrophobicContact CB-SD 4.5Å; E297-M333 HydrophobicContact CG-SD 3.33Å; E297-M333 WeakPolarHBondContact CG-SD 3.32Å |
| 298 | S | 80.9 | Confident | 87.4 | Confident | 37 Ų | 37 | 30.6 Ų | 30.6 | 26% | 0.259 | 16% | 0.157 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -13 | 178.1 | 77.2 | 0 | 0 | 0 | 0 | 115 | R260 P294 L295 C296 T300 | R260-S298 PolarHBondContact NH1-OG 3.13Å; P294-S298 VanDerWaalsContact O-CB 3.28Å; P294-S298 WeakPolarHBondContact O-CB 3.32Å; P294-S298 PolarHBondContact O-N 3.4Å; L295-S298 PolarHBondContact O-OG 3.47Å; C296-S298 PolarHBondContact O-N 3.3Å; S298-T300 PolarHBondContact O-N 2.87Å; S298-T300 PolarHBondContact OG-OG1 3.15Å |
| 299 | G | 73.8 | Confident | 87.3 | Confident | 20 Ų | 20 | 30.4 Ų | 30.4 | 21% | 0.206 | 16% | 0.156 | C | C | . | . | S | Bend | trans | 67.4 | -29.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | C296 E297 C301 N336 | C296-G299 PolarHBondContact O-N 3.41Å; C296-G299 VanDerWaalsContact O-N 3.16Å; E297-G299 PolarHBondContact O-N 2.88Å; E297-G299 VanDerWaalsContact O-N 3.16Å; G299-C301 PolarHBondContact O-N 3.5Å; G299-C301 VanDerWaalsContact O-N 3.13Å; G299-N336 PolarHBondContact O-ND2 3.44Å |
| 300 | T | 80.7 | Confident | 87.3 | Confident | 23 Ų | 23 | 25.9 Ų | 25.9 | 14% | 0.141 | 14% | 0.136 | C | C | . | . | trans | -73.4 | 6.4 | -178.5 | 61.5 | 0 | 0 | 0 | 0 | 114.8 | P142 R145 R260 S298 T302 | P142-T300 HydrophobicContact CB-CG2 3.35Å; P142-T300 HydrophobicContact CG-CG2 3.79Å; R145-T300 HydrophobicContact CG-CG2 4.32Å; R145-T300 PolarHBondContact NE-OG1 2.84Å; R145-T300 PolarHBondContact NH2-OG1 3.02Å; R260-T300 PolarHBondContact NH1-OG1 3.08Å; R260-T300 VanDerWaalsContact NH2-C 3.29Å; R260-T300 PolarHBondContact NH2-O 3.07Å; R260-T300 PolarHBondContact NH2-OG1 3.44Å; S298-T300 PolarHBondContact O-N 2.87Å; S298-T300 PolarHBondContact OG-OG1 3.15Å; T300-T302 PolarHBondContact O-N 3.13Å | ||
| 301 | C | 82.5 | Confident | 87.3 | Confident | 1 Ų | 1 | 27.4 Ų | 27.4 | 1% | 0.007 | 15% | 0.147 | C | C | . | . | trans | -67.4 | 118.6 | -176.3 | -170.3 | 0 | 0 | 0 | 0 | 111.1 | M138 L295 G299 A338 | M138-C301 VanDerWaalsContact CE-O 3.23Å; M138-C301 WeakPolarHBondContact CE-O 3.28Å; L295-C301 HydrophobicContact CG-CB 4.18Å; G299-C301 PolarHBondContact O-N 3.5Å; G299-C301 VanDerWaalsContact O-N 3.13Å; C301-A338 HydrophobicContact CB-CB 3.94Å | ||
| 302 | T | 85.6 | Confident | 87.3 | Confident | 58 Ų | 58 | 27.4 Ų | 27.4 | 36% | 0.356 | 15% | 0.147 | S | C | . | . | trans | -90.9 | 160.2 | 179.8 | 64.1 | 0 | 0 | 0 | 0 | 111.9 | T300 R304 E305 A306 | T300-T302 PolarHBondContact O-N 3.13Å; T302-R304 VanDerWaalsContact C-N 3.27Å; T302-R304 PolarHBondContact O-N 3.23Å; T302-E305 PolarHBondContact N-OE2 2.72Å; T302-E305 PolarHBondContact O-N 3.29Å; T302-E305 VanDerWaalsContact OG1-CD 3.28Å; T302-E305 VanDerWaalsContact OG1-CG 3.23Å; T302-E305 WeakPolarHBondContact OG1-CG 3Å; T302-E305 PolarHBondContact OG1-N 2.81Å; T302-E305 PolarHBondContact OG1-OE2 2.81Å; T302-A306 WeakPolarHBondContact O-CB 3.44Å; T302-A306 PolarHBondContact O-N 3.48Å | ||
| 303 | L | 84.1 | Confident | 87.3 | Confident | 18 Ų | 18 | 27.4 Ų | 27.4 | 9% | 0.094 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.4 | -36.5 | 179.8 | -59.2 | 178.9 | 0 | 0 | 0 | 112.7 | E131 M134 M138 A306 I307 I341 | E131-L303 HydrophobicContact CG-CD1 4.12Å; M134-L303 HydrophobicContact CB-CD1 4.4Å; M134-L303 HydrophobicContact CB-CD2 4.15Å; M134-L303 HydrophobicContact CE-CD1 3.61Å; M134-L303 HydrophobicContact CE-CD2 3.72Å; M134-L303 HydrophobicContact CE-CG 4.33Å; M134-L303 HydrophobicContact CG-CD2 4.4Å; M134-L303 HydrophobicContact SD-CD1 4.36Å; M134-L303 HydrophobicContact SD-CD2 3.4Å; M134-L303 WeakPolarHBondContact SD-CD2 3.42Å; M138-L303 HydrophobicContact CE-CD2 3.42Å; M138-L303 VanDerWaalsContact CE-CD2 3.42Å; M138-L303 HydrophobicContact CE-CG 3.69Å; L303-A306 PolarHBondContact O-N 3.5Å; L303-I307 WeakPolarHBondContact O-CB 3.28Å; L303-I307 VanDerWaalsContact O-CG1 3.26Å; L303-I307 WeakPolarHBondContact O-CG1 3.46Å; L303-I307 PolarHBondContact O-N 3.44Å; L303-I341 HydrophobicContact CD2-CD1 4.19Å |
| 304 | R | 85.9 | Confident | 87.3 | Confident | 134 Ų | 134 | 29 Ų | 29 | 51% | 0.506 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -71 | -42 | 178.6 | -64.8 | -173.3 | -175.9 | 119.6 | 12 | 112.2 | T302 A306 I307 I308 | T302-R304 VanDerWaalsContact C-N 3.27Å; T302-R304 PolarHBondContact O-N 3.23Å; R304-A306 VanDerWaalsContact C-N 3.3Å; R304-A306 PolarHBondContact O-N 3.31Å; R304-I307 PolarHBondContact O-N 2.86Å; R304-I308 WeakPolarHBondContact O-CB 3.34Å; R304-I308 WeakPolarHBondContact O-CD1 3.45Å; R304-I308 WeakPolarHBondContact O-CG1 3.28Å; R304-I308 PolarHBondContact O-N 3.47Å |
| 305 | E | 89.6 | Confident | 87.3 | Confident | 5 Ų | 5 | 33.3 Ų | 33.3 | 2% | 0.023 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -58.5 | -44.8 | 171.5 | -69.4 | 166.7 | 139.3 | 0 | 0 | 110.8 | R145 R260 I263 T302 I309 | R145-E305 IonicContact NH2-OE1 2.85Å; R260-E305 WeakPolarHBondContact CB-OE1 3.47Å; R260-E305 WeakPolarHBondContact CG-OE1 3.33Å; R260-E305 IonicContact CZ-OE1 2.7Å; R260-E305 IonicContact CZ-OE2 2.65Å; R260-E305 IonicContact NE-OE1 3.16Å; R260-E305 PolarHBondContact NE-OE1 2.99Å; R260-E305 IonicContact NE-OE2 3.64Å; R260-E305 IonicContact NH2-OE1 3.62Å; R260-E305 PolarHBondContact NH2-OE1 3.06Å; R260-E305 VanDerWaalsContact NH2-OE1 3.14Å; R260-E305 IonicContact NH2-OE2 3.78Å; R260-E305 PolarHBondContact NH2-OE2 3.13Å; I263-E305 HydrophobicContact CD1-CG 4.24Å; I263-E305 HydrophobicContact CG2-CG 3.91Å; T302-E305 PolarHBondContact N-OE2 2.72Å; T302-E305 PolarHBondContact O-N 3.29Å; T302-E305 VanDerWaalsContact OG1-CD 3.28Å; T302-E305 VanDerWaalsContact OG1-CG 3.23Å; T302-E305 WeakPolarHBondContact OG1-CG 3Å; T302-E305 PolarHBondContact OG1-N 2.81Å; T302-E305 PolarHBondContact OG1-OE2 2.81Å; E305-I309 WeakPolarHBondContact O-CB 3.43Å; E305-I309 WeakPolarHBondContact O-CG1 3.35Å; E305-I309 PolarHBondContact O-N 3.2Å |
| 306 | A | 90.2 | Very high | 87.3 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.2 | -45.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | T302 L303 R304 G310 A338 I341 F342 | T302-A306 WeakPolarHBondContact O-CB 3.44Å; T302-A306 PolarHBondContact O-N 3.48Å; L303-A306 PolarHBondContact O-N 3.5Å; R304-A306 VanDerWaalsContact C-N 3.3Å; R304-A306 PolarHBondContact O-N 3.31Å; A306-G310 WeakPolarHBondContact O-CA 3.36Å; A306-G310 PolarHBondContact O-N 3.41Å; A306-A338 HydrophobicContact CB-CB 3.91Å; A306-I341 HydrophobicContact CB-CB 4.47Å; A306-I341 HydrophobicContact CB-CD1 4.01Å; A306-F342 HydrophobicContact CB-CE2 4.25Å; A306-F342 HydrophobicContact CB-CZ 4.04Å; A306-F342 WeakPolarHBondContact O-CE1 3.32Å |
| 307 | I | 89.4 | Confident | 87.5 | Confident | 50 Ų | 50 | 39.3 Ų | 39.3 | 26% | 0.256 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67 | -43.5 | 178.3 | -68.5 | 165.3 | 0 | 0 | 0 | 111 | V124 V126 L303 R304 G310 S311 I341 | V124-I307 HydrophobicContact CB-CD1 4.35Å; V124-I307 HydrophobicContact CB-CG1 4.36Å; V124-I307 HydrophobicContact CG2-CG1 4.45Å; V126-I307 HydrophobicContact CG2-CD1 4.28Å; L303-I307 WeakPolarHBondContact O-CB 3.28Å; L303-I307 VanDerWaalsContact O-CG1 3.26Å; L303-I307 WeakPolarHBondContact O-CG1 3.46Å; L303-I307 PolarHBondContact O-N 3.44Å; R304-I307 PolarHBondContact O-N 2.86Å; I307-G310 PolarHBondContact O-N 3.17Å; I307-S311 PolarHBondContact O-N 2.98Å; I307-I341 HydrophobicContact CG1-CD1 4.25Å |
| 308 | I | 90.8 | Very high | 87.7 | Confident | 29 Ų | 29 | 34.4 Ų | 34.4 | 15% | 0.149 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.9 | -50 | -179.7 | -68.9 | 166.2 | 0 | 0 | 0 | 110.6 | I263 L269 Y274 R304 G310 S311 | I263-I308 HydrophobicContact CD1-CD1 3.91Å; I263-I308 HydrophobicContact CD1-CG2 4.37Å; I263-I308 HydrophobicContact CG1-CD1 4.06Å; L269-I308 HydrophobicContact CB-CD1 4.33Å; L269-I308 HydrophobicContact CB-CG2 3.96Å; L269-I308 HydrophobicContact CD2-CG2 3.67Å; L269-I308 HydrophobicContact CG-CG2 4.47Å; Y274-I308 HydrophobicContact CD2-CG2 4.46Å; R304-I308 WeakPolarHBondContact O-CB 3.34Å; R304-I308 WeakPolarHBondContact O-CD1 3.45Å; R304-I308 WeakPolarHBondContact O-CG1 3.28Å; R304-I308 PolarHBondContact O-N 3.47Å; I308-G310 VanDerWaalsContact C-N 3.33Å; I308-G310 PolarHBondContact O-N 2.88Å; I308-S311 PolarHBondContact O-N 2.7Å; I308-S311 PolarHBondContact O-OG 2.97Å |
| 309 | I | 91.6 | Very high | 88.3 | Confident | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -70 | -33.5 | 179.5 | -65.7 | 170.5 | 0 | 0 | 0 | 110.8 | L277 W287 L292 L295 E305 I312 L313 F342 | L277-I309 HydrophobicContact CD1-CG1 4.2Å; W287-I309 HydrophobicContact CH2-CG2 4.09Å; W287-I309 HydrophobicContact CZ2-CG2 3.89Å; L292-I309 HydrophobicContact CD1-CG2 4.43Å; L295-I309 HydrophobicContact CD2-CD1 3.6Å; E305-I309 WeakPolarHBondContact O-CB 3.43Å; E305-I309 WeakPolarHBondContact O-CG1 3.35Å; E305-I309 PolarHBondContact O-N 3.2Å; I309-I312 PolarHBondContact O-N 3.09Å; I309-L313 PolarHBondContact O-N 3.41Å; I309-F342 HydrophobicContact CB-CE1 4.04Å; I309-F342 HydrophobicContact CB-CZ 4.26Å; I309-F342 HydrophobicContact CG2-CE1 3.89Å; I309-F342 HydrophobicContact CG2-CZ 4.2Å |
| 310 | G | 90.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.2 | -43.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | A306 I307 I308 I312 L313 T314 L345 | A306-G310 WeakPolarHBondContact O-CA 3.36Å; A306-G310 PolarHBondContact O-N 3.41Å; I307-G310 PolarHBondContact O-N 3.17Å; I308-G310 VanDerWaalsContact C-N 3.33Å; I308-G310 PolarHBondContact O-N 2.88Å; G310-I312 PolarHBondContact O-N 3.22Å; G310-L313 WeakPolarHBondContact O-CB 3.17Å; G310-L313 PolarHBondContact O-N 3.25Å; G310-L313 VanDerWaalsContact O-N 3.11Å; G310-T314 PolarHBondContact O-N 2.9Å; G310-T314 PolarHBondContact O-OG1 3.18Å; G310-T314 VanDerWaalsContact O-OG1 3.13Å; G310-L345 VanDerWaalsContact CA-CD1 3.5Å |
| 311 | S | 91.4 | Very high | 89.7 | Confident | 32 Ų | 32 | 43.2 Ų | 43.2 | 22% | 0.224 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.7 | -30.3 | 177.2 | 74.1 | 0 | 0 | 0 | 0 | 113 | Y274 I307 I308 T314 K315 | Y274-S311 PolarHBondContact OH-OG 2.74Å; I307-S311 PolarHBondContact O-N 2.98Å; I308-S311 PolarHBondContact O-N 2.7Å; I308-S311 PolarHBondContact O-OG 2.97Å; S311-T314 PolarHBondContact O-N 3.37Å; S311-K315 WeakPolarHBondContact O-CB 3.38Å; S311-K315 WeakPolarHBondContact O-CG 3.48Å; S311-K315 PolarHBondContact O-N 3.3Å |
| 312 | I | 92 | Very high | 90.2 | Very high | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -76.6 | -39.2 | 178.1 | -60.5 | 165.8 | 0 | 0 | 0 | 110.5 | Y274 L277 L281 I309 G310 T314 K315 C316 | Y274-I312 HydrophobicContact CD2-CD1 3.74Å; Y274-I312 HydrophobicContact CD2-CG1 4.01Å; Y274-I312 HydrophobicContact CE1-CG1 3.98Å; Y274-I312 HydrophobicContact CE2-CD1 3.67Å; Y274-I312 HydrophobicContact CE2-CG1 3.41Å; Y274-I312 VanDerWaalsContact CE2-CG1 3.41Å; Y274-I312 HydrophobicContact CG-CD1 4.21Å; L277-I312 HydrophobicContact CB-CD1 3.64Å; L277-I312 HydrophobicContact CB-CG2 4.43Å; L277-I312 HydrophobicContact CD1-CD1 3.45Å; L277-I312 VanDerWaalsContact CD1-CD1 3.45Å; L277-I312 HydrophobicContact CG-CD1 4.21Å; L281-I312 HydrophobicContact CD1-CG2 3.74Å; I309-I312 PolarHBondContact O-N 3.09Å; G310-I312 PolarHBondContact O-N 3.22Å; I312-T314 VanDerWaalsContact C-N 3.33Å; I312-T314 PolarHBondContact O-N 2.71Å; I312-K315 PolarHBondContact O-N 3.36Å; I312-C316 WeakPolarHBondContact O-CB 3.35Å; I312-C316 PolarHBondContact O-N 3.29Å; I312-C316 PolarHBondContact O-SG 3.39Å |
| 313 | L | 91 | Very high | 90.5 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -55.8 | -48.3 | 167.3 | -75.8 | 171.5 | 0 | 0 | 0 | 110.7 | W287 F288 L292 I309 G310 I318 F342 L346 K349 | W287-L313 HydrophobicContact CH2-CD1 4.15Å; W287-L313 HydrophobicContact CH2-CD2 3.44Å; W287-L313 VanDerWaalsContact CH2-CD2 3.44Å; W287-L313 HydrophobicContact CH2-CG 3.69Å; W287-L313 HydrophobicContact CZ2-CD2 4.38Å; W287-L313 HydrophobicContact CZ3-CD2 3.52Å; W287-L313 HydrophobicContact CZ3-CG 4.27Å; F288-L313 HydrophobicContact CE1-CD2 4.25Å; F288-L313 HydrophobicContact CZ-CD2 4.43Å; L292-L313 HydrophobicContact CD2-CD1 4.36Å; I309-L313 PolarHBondContact O-N 3.41Å; G310-L313 WeakPolarHBondContact O-CB 3.17Å; G310-L313 PolarHBondContact O-N 3.25Å; G310-L313 VanDerWaalsContact O-N 3.11Å; L313-I318 HydrophobicContact CD2-CD1 3.4Å; L313-I318 VanDerWaalsContact CD2-CD1 3.4Å; L313-F342 HydrophobicContact CD1-CD1 3.89Å; L313-L346 HydrophobicContact CD1-CD2 4.42Å; L313-L346 HydrophobicContact CD1-CG 4.47Å; L313-L346 HydrophobicContact CD2-CD2 4.2Å; L313-K349 WeakPolarHBondContact O-CE 3.19Å; L313-K349 PolarHBondContact O-NZ 3.3Å |
| 314 | T | 91 | Very high | 90.9 | Very high | 57 Ų | 57 | 43 Ų | 43 | 35% | 0.35 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.2 | -45.3 | -179.8 | -50.6 | 0 | 0 | 0 | 0 | 112.4 | G310 S311 I312 K349 | G310-T314 PolarHBondContact O-N 2.9Å; G310-T314 PolarHBondContact O-OG1 3.18Å; G310-T314 VanDerWaalsContact O-OG1 3.13Å; S311-T314 PolarHBondContact O-N 3.37Å; I312-T314 VanDerWaalsContact C-N 3.33Å; I312-T314 PolarHBondContact O-N 2.71Å; T314-K349 PolarHBondContact O-NZ 3.16Å |
| 315 | K | 90.1 | Very high | 91.2 | Very high | 117 Ų | 117 | 39.7 Ų | 39.7 | 51% | 0.509 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -75.4 | -24 | -177.7 | -71.8 | -165.8 | 177.7 | -160 | 0 | 114.9 | S311 I312 | S311-K315 WeakPolarHBondContact O-CB 3.38Å; S311-K315 WeakPolarHBondContact O-CG 3.48Å; S311-K315 PolarHBondContact O-N 3.3Å; I312-K315 PolarHBondContact O-N 3.36Å |
| 316 | C | 90 | Very high | 91.3 | Very high | 17 Ų | 17 | 39.5 Ų | 39.5 | 12% | 0.115 | 23% | 0.232 | C | C | . | . | S | Bend | trans | -93.3 | 146.6 | 179.7 | -68.8 | 0 | 0 | 0 | 0 | 113.1 | L281 I312 K349 | L281-C316 HydrophobicContact CD1-CB 3.62Å; I312-C316 WeakPolarHBondContact O-CB 3.35Å; I312-C316 PolarHBondContact O-N 3.29Å; I312-C316 PolarHBondContact O-SG 3.39Å; C316-K349 PolarHBondContact O-NZ 3.48Å |
| 317 | S | 89.1 | Confident | 91.4 | Very high | 116 Ų | 116 | 39.5 Ų | 39.5 | 81% | 0.811 | 23% | 0.232 | S | C | * | . | trans | -80.6 | 138.9 | 165 | -167.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 318 | I | 91.6 | Very high | 91.5 | Very high | 6 Ų | 6 | 39.4 Ų | 39.4 | 3% | 0.031 | 23% | 0.231 | C | C | . | . | trans | -135.8 | 137.1 | -174.1 | -50.1 | 179.4 | 0 | 0 | 0 | 108.7 | L281 P284 F288 L313 S323 Y351 | L281-I318 HydrophobicContact CD2-CD1 4.22Å; L281-I318 HydrophobicContact CD2-CG1 4.48Å; P284-I318 HydrophobicContact CB-CG2 4.25Å; F288-I318 HydrophobicContact CE2-CG2 3.73Å; F288-I318 HydrophobicContact CZ-CD1 4.36Å; F288-I318 HydrophobicContact CZ-CG2 3.96Å; L313-I318 HydrophobicContact CD2-CD1 3.4Å; L313-I318 VanDerWaalsContact CD2-CD1 3.4Å; I318-S323 VanDerWaalsContact CG2-OG 3.31Å; I318-S323 WeakPolarHBondContact CG2-OG 3.42Å; I318-Y351 PolarHBondContact N-OH 3.03Å; I318-Y351 VanDerWaalsContact O-CZ 3.28Å; I318-Y351 PolarHBondContact O-OH 3.06Å | ||
| 319 | P | 93.1 | Very high | 91.5 | Very high | 69 Ų | 69 | 41 Ų | 41 | 45% | 0.448 | 24% | 0.238 | S | C | . | . | trans | -60.6 | 141.9 | 176.3 | -24.5 | 34.7 | 0 | 0 | 0 | 112.9 | P284 L321 H322 S323 | P284-P319 HydrophobicContact CG-CG 4.08Å; P319-L321 PolarHBondContact O-N 3.08Å; P319-H322 PolarHBondContact O-N 2.95Å; P319-S323 PolarHBondContact O-N 3.15Å; P319-S323 VanDerWaalsContact O-N 3.09Å; P319-S323 PolarHBondContact O-OG 3.18Å | ||
| 320 | V | 91.8 | Very high | 91.4 | Very high | 57 Ų | 57 | 41.1 Ų | 41.1 | 35% | 0.345 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -57.4 | -47.1 | -176.3 | 178.5 | 0 | 0 | 0 | 0 | 112.2 | H322 S323 S324 Y351 A352 | V320-H322 VanDerWaalsContact C-N 3.34Å; V320-H322 PolarHBondContact O-N 2.72Å; V320-S323 PolarHBondContact O-N 3.18Å; V320-S324 VanDerWaalsContact O-CB 3.28Å; V320-S324 WeakPolarHBondContact O-CB 3.49Å; V320-S324 PolarHBondContact O-N 3.36Å; V320-S324 PolarHBondContact O-OG 2.79Å; V320-Y351 HydrophobicContact CG2-CD1 3.86Å; V320-Y351 HydrophobicContact CG2-CG 3.97Å; V320-A352 VanDerWaalsContact CG1-O 3.24Å; V320-A352 WeakPolarHBondContact CG1-O 3.41Å |
| 321 | L | 92.6 | Very high | 91.4 | Very high | 138 Ų | 138 | 41.5 Ų | 41.5 | 72% | 0.723 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -59.5 | -42.5 | -178.3 | -61.8 | 177.2 | 0 | 0 | 0 | 112.6 | P319 S324 A325 | P319-L321 PolarHBondContact O-N 3.08Å; L321-S324 PolarHBondContact O-N 2.65Å; L321-A325 PolarHBondContact O-N 3.14Å |
| 322 | H | 91.9 | Very high | 91.2 | Very high | 68 Ų | 68 | 46.4 Ų | 46.4 | 32% | 0.315 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -67.3 | -42.9 | 177.8 | -72.1 | 95 | 0 | 0 | 0 | 111.7 | P284 G285 F288 P319 V320 S324 A326 | P284-H322 HydrophobicContact CB-CB 4.14Å; P284-H322 HydrophobicContact CG-CB 4.47Å; G285-H322 PolarHBondContact N-CD2 3.25Å; G285-H322 VanDerWaalsContact N-CD2 3.3Å; F288-H322 HydrophobicContact CD2-CB 4.08Å; F288-H322 HydrophobicContact CE2-CB 3.84Å; P319-H322 PolarHBondContact O-N 2.95Å; V320-H322 VanDerWaalsContact C-N 3.34Å; V320-H322 PolarHBondContact O-N 2.72Å; H322-S324 VanDerWaalsContact C-N 3.34Å; H322-A326 WeakPolarHBondContact O-CB 3.36Å; H322-A326 PolarHBondContact O-N 3.5Å |
| 323 | S | 92.5 | Very high | 90.8 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 176.5 | -51.7 | 0 | 0 | 0 | 0 | 111.7 | I318 P319 V320 A326 M327 Y351 | I318-S323 VanDerWaalsContact CG2-OG 3.31Å; I318-S323 WeakPolarHBondContact CG2-OG 3.42Å; P319-S323 PolarHBondContact O-N 3.15Å; P319-S323 VanDerWaalsContact O-N 3.09Å; P319-S323 PolarHBondContact O-OG 3.18Å; V320-S323 PolarHBondContact O-N 3.18Å; S323-A326 PolarHBondContact O-N 3.25Å; S323-M327 VanDerWaalsContact O-CE 3.28Å; S323-M327 WeakPolarHBondContact O-CE 3.19Å; S323-M327 WeakPolarHBondContact O-CG 3.34Å; S323-M327 PolarHBondContact O-N 3.11Å; S323-Y351 WeakPolarHBondContact OG-CE2 3.2Å |
| 324 | S | 92 | Very high | 90.1 | Very high | 5 Ų | 5 | 55.9 Ų | 55.9 | 4% | 0.035 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.5 | -46.6 | 177.8 | -63.8 | 0 | 0 | 0 | 0 | 112.1 | V320 L321 H322 A326 M327 L328 P354 | V320-S324 VanDerWaalsContact O-CB 3.28Å; V320-S324 WeakPolarHBondContact O-CB 3.49Å; V320-S324 PolarHBondContact O-N 3.36Å; V320-S324 PolarHBondContact O-OG 2.79Å; L321-S324 PolarHBondContact O-N 2.65Å; H322-S324 VanDerWaalsContact C-N 3.34Å; S324-A326 VanDerWaalsContact C-N 3.32Å; S324-A326 PolarHBondContact O-N 2.8Å; S324-M327 PolarHBondContact O-N 3.28Å; S324-L328 PolarHBondContact O-N 3.14Å; S324-P354 WeakPolarHBondContact OG-CD 3.48Å |
| 325 | A | 92.2 | Very high | 89.4 | Confident | 64 Ų | 64 | 54.6 Ų | 54.6 | 53% | 0.529 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.5 | -37.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L321 K329 | L321-A325 PolarHBondContact O-N 3.14Å; A325-K329 PolarHBondContact O-N 3.03Å; A325-K329 VanDerWaalsContact O-N 3.14Å |
| 326 | A | 91.9 | Very high | 88.7 | Confident | 2 Ų | 2 | 49.5 Ų | 49.5 | 2% | 0.017 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -67.9 | -43 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | F288 H322 S323 S324 K329 L330 | F288-A326 HydrophobicContact CD1-CB 3.32Å; F288-A326 HydrophobicContact CD2-CB 4.33Å; F288-A326 HydrophobicContact CE1-CB 3.35Å; F288-A326 HydrophobicContact CE2-CB 4.36Å; F288-A326 HydrophobicContact CG-CB 3.85Å; F288-A326 HydrophobicContact CZ-CB 3.9Å; H322-A326 WeakPolarHBondContact O-CB 3.36Å; H322-A326 PolarHBondContact O-N 3.5Å; S323-A326 PolarHBondContact O-N 3.25Å; S324-A326 VanDerWaalsContact C-N 3.32Å; S324-A326 PolarHBondContact O-N 2.8Å; A326-K329 PolarHBondContact O-N 2.81Å; A326-L330 WeakPolarHBondContact O-CB 3.2Å; A326-L330 WeakPolarHBondContact O-CD1 2.96Å; A326-L330 VanDerWaalsContact O-CG 3.27Å; A326-L330 WeakPolarHBondContact O-CG 3.18Å; A326-L330 PolarHBondContact O-N 2.93Å |
| 327 | M | 91.6 | Very high | 88 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62 | -42.5 | 175.5 | -81.6 | -180 | -89.4 | 0 | 0 | 112.3 | S323 S324 L330 A331 L343 L346 L347 L353 V357 | S323-M327 VanDerWaalsContact O-CE 3.28Å; S323-M327 WeakPolarHBondContact O-CE 3.19Å; S323-M327 WeakPolarHBondContact O-CG 3.34Å; S323-M327 PolarHBondContact O-N 3.11Å; S324-M327 PolarHBondContact O-N 3.28Å; M327-L330 PolarHBondContact O-N 3.33Å; M327-A331 WeakPolarHBondContact O-CB 3.49Å; M327-A331 PolarHBondContact O-N 3.2Å; M327-L343 HydrophobicContact CG-CD1 4.46Å; M327-L346 HydrophobicContact CE-CB 4.11Å; M327-L346 HydrophobicContact CG-CB 3.7Å; M327-L346 HydrophobicContact CG-CD1 3.84Å; M327-L346 HydrophobicContact CG-CG 4.37Å; M327-L346 HydrophobicContact SD-CB 3.72Å; M327-L347 HydrophobicContact SD-CD2 4.09Å; M327-L347 HydrophobicContact SD-CG 4.46Å; M327-L353 HydrophobicContact CE-CD2 3.57Å; M327-L353 HydrophobicContact SD-CD1 4.24Å; M327-L353 HydrophobicContact SD-CD2 4.3Å; M327-V357 HydrophobicContact CB-CG1 3.94Å |
| 328 | L | 92.6 | Very high | 87.6 | Confident | 47 Ų | 47 | 43.1 Ų | 43.1 | 25% | 0.246 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.4 | -51 | 175.5 | -174.6 | 155.1 | 0 | 0 | 0 | 110.9 | S324 L330 A331 E332 V357 A360 | S324-L328 PolarHBondContact O-N 3.14Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 2.98Å; L328-A331 WeakPolarHBondContact O-CB 3.26Å; L328-A331 PolarHBondContact O-N 2.72Å; L328-A331 VanDerWaalsContact O-N 3.1Å; L328-E332 VanDerWaalsContact CD2-CD 3.47Å; L328-E332 HydrophobicContact CD2-CG 4.23Å; L328-E332 WeakPolarHBondContact CD2-OE1 3.37Å; L328-E332 WeakPolarHBondContact O-CG 3.39Å; L328-E332 PolarHBondContact O-N 3.03Å; L328-V357 HydrophobicContact CB-CG2 4.45Å; L328-V357 HydrophobicContact CD1-CG2 4.38Å; L328-A360 HydrophobicContact CG-CB 4.43Å |
| 329 | K | 91.3 | Very high | 87.3 | Confident | 64 Ų | 64 | 43.2 Ų | 43.2 | 28% | 0.278 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.2 | -34 | 177.8 | 179 | 56.6 | 178.3 | 172.6 | 0 | 112.7 | I293 E297 A325 A326 M333 | I293-K329 HydrophobicContact CD1-CB 4.45Å; I293-K329 HydrophobicContact CD1-CG 4.02Å; I293-K329 HydrophobicContact CG1-CG 4.13Å; I293-K329 HydrophobicContact CG2-CG 4.17Å; E297-K329 WeakPolarHBondContact OE1-CE 3.45Å; E297-K329 IonicContact OE1-NZ 3.96Å; E297-K329 PolarHBondContact OE1-NZ 2.91Å; A325-K329 PolarHBondContact O-N 3.03Å; A325-K329 VanDerWaalsContact O-N 3.14Å; A326-K329 PolarHBondContact O-N 2.81Å; K329-M333 HydrophobicContact CD-CG 4.29Å; K329-M333 HydrophobicContact CD-SD 4.46Å; K329-M333 HydrophobicContact CG-CE 4.28Å; K329-M333 WeakPolarHBondContact O-CE 3.4Å; K329-M333 VanDerWaalsContact O-CG 3.26Å; K329-M333 WeakPolarHBondContact O-CG 3.04Å; K329-M333 PolarHBondContact O-N 2.99Å |
| 330 | L | 89.8 | Confident | 86.9 | Confident | 3 Ų | 3 | 40.1 Ų | 40.1 | 2% | 0.016 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67 | -33.7 | 173 | -76.6 | 162.5 | 0 | 0 | 0 | 112.7 | L292 C296 A326 M327 L328 M333 F342 L343 L346 | L292-L330 HydrophobicContact CD2-CD1 4.17Å; C296-L330 HydrophobicContact CB-CD2 4.43Å; A326-L330 WeakPolarHBondContact O-CB 3.2Å; A326-L330 WeakPolarHBondContact O-CD1 2.96Å; A326-L330 VanDerWaalsContact O-CG 3.27Å; A326-L330 WeakPolarHBondContact O-CG 3.18Å; A326-L330 PolarHBondContact O-N 2.93Å; M327-L330 PolarHBondContact O-N 3.33Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 2.98Å; L330-M333 HydrophobicContact CB-CE 4.5Å; L330-M333 HydrophobicContact CD2-CE 3.74Å; L330-M333 HydrophobicContact CG-CE 4.19Å; L330-F342 HydrophobicContact CD1-CB 4.21Å; L330-F342 HydrophobicContact CD2-CB 4.49Å; L330-L343 HydrophobicContact CB-CD1 3.9Å; L330-L346 HydrophobicContact CD1-CD1 3.59Å |
| 331 | A | 89.1 | Confident | 86.8 | Confident | 9 Ų | 9 | 37.4 Ų | 37.4 | 7% | 0.074 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -74.5 | -33.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | M327 L328 A360 L361 H364 | M327-A331 WeakPolarHBondContact O-CB 3.49Å; M327-A331 PolarHBondContact O-N 3.2Å; L328-A331 WeakPolarHBondContact O-CB 3.26Å; L328-A331 PolarHBondContact O-N 2.72Å; L328-A331 VanDerWaalsContact O-N 3.1Å; A331-A360 HydrophobicContact CB-CB 4.48Å; A331-L361 HydrophobicContact CB-CD2 4.47Å; A331-H364 HydrophobicContact CB-CB 3.91Å; A331-H364 PolarHBondContact O-ND1 2.81Å |
| 332 | E | 88.3 | Confident | 86.7 | Confident | 135 Ų | 135 | 30.9 Ų | 30.9 | 63% | 0.631 | 16% | 0.158 | S | C | * | . | H | α-helix | trans | -75.4 | -18.4 | 175.8 | -70.7 | 178.2 | 158.3 | 0 | 0 | 114.3 | L328 | L328-E332 VanDerWaalsContact CD2-CD 3.47Å; L328-E332 HydrophobicContact CD2-CG 4.23Å; L328-E332 WeakPolarHBondContact CD2-OE1 3.37Å; L328-E332 WeakPolarHBondContact O-CG 3.39Å; L328-E332 PolarHBondContact O-N 3.03Å |
| 333 | M | 83.4 | Confident | 86.6 | Confident | 24 Ų | 24 | 27.8 Ų | 27.8 | 12% | 0.118 | 14% | 0.144 | C | C | . | . | S | Bend | trans | -82.8 | 158 | -178 | -79.5 | -174.9 | -59.1 | 0 | 0 | 113.3 | C296 E297 K329 L330 | C296-M333 HydrophobicContact CB-CE 3.77Å; C296-M333 HydrophobicContact CB-SD 4.29Å; E297-M333 HydrophobicContact CB-SD 4.5Å; E297-M333 HydrophobicContact CG-SD 3.33Å; E297-M333 WeakPolarHBondContact CG-SD 3.32Å; K329-M333 HydrophobicContact CD-CG 4.29Å; K329-M333 HydrophobicContact CD-SD 4.46Å; K329-M333 HydrophobicContact CG-CE 4.28Å; K329-M333 WeakPolarHBondContact O-CE 3.4Å; K329-M333 VanDerWaalsContact O-CG 3.26Å; K329-M333 WeakPolarHBondContact O-CG 3.04Å; K329-M333 PolarHBondContact O-N 2.99Å; L330-M333 HydrophobicContact CB-CE 4.5Å; L330-M333 HydrophobicContact CD2-CE 3.74Å; L330-M333 HydrophobicContact CG-CE 4.19Å |
| 334 | E | 76.7 | Confident | 86.5 | Confident | 175 Ų | 175 | 29.2 Ų | 29.2 | 82% | 0.818 | 15% | 0.149 | S | C | * | . | P | Polyproline II helix | trans | -54.2 | 146.5 | 173.3 | -67.6 | -170.8 | 172.3 | 0 | 0 | 112.4 | N336 N339 | E334-N336 PolarHBondContact O-N 3.43Å; E334-N339 PolarHBondContact O-ND2 3.37Å |
| 335 | Y | 75.1 | Confident | 86.5 | Confident | 30 Ų | 30 | 29.4 Ų | 29.4 | 12% | 0.118 | 15% | 0.15 | C | C | . | . | P | Polyproline II helix | trans | -76.5 | 117.8 | -176.1 | -175.9 | -105.6 | 0 | 0 | 0 | 112.8 | F137 S340 F368 L375 W379 | F137-Y335 HydrophobicContact CB-CD1 4.07Å; F137-Y335 HydrophobicContact CB-CE1 3.91Å; F137-Y335 AromaticContact CD1-CD1 3.41Å; F137-Y335 HydrophobicContact CD1-CD1 3.41Å; F137-Y335 VanDerWaalsContact CD1-CD1 3.41Å; F137-Y335 AromaticContact CD1-CE1 3.53Å; F137-Y335 HydrophobicContact CD1-CE1 3.53Å; F137-Y335 AromaticContact CD2-CE1 3.98Å; F137-Y335 HydrophobicContact CD2-CE1 3.98Å; F137-Y335 AromaticContact CE1-CD1 3.92Å; F137-Y335 HydrophobicContact CE1-CD1 3.92Å; F137-Y335 AromaticContact CE1-CE1 3.92Å; F137-Y335 HydrophobicContact CE1-CE1 3.92Å; F137-Y335 HydrophobicContact CE2-CE1 4.36Å; F137-Y335 AromaticContact CG-CD1 3.82Å; F137-Y335 HydrophobicContact CG-CD1 3.82Å; F137-Y335 AromaticContact CG-CE1 3.54Å; F137-Y335 HydrophobicContact CG-CE1 3.54Å; F137-Y335 HydrophobicContact CZ-CE1 4.32Å; Y335-S340 WeakPolarHBondContact CE2-OG 3.33Å; Y335-S340 VanDerWaalsContact CZ-OG 3.26Å; Y335-S340 PolarHBondContact OH-OG 3Å; Y335-F368 AromaticContact CD1-CE1 3.79Å; Y335-F368 HydrophobicContact CD1-CE1 3.79Å; Y335-F368 HydrophobicContact CD1-CZ 4.26Å; Y335-F368 AromaticContact CD2-CE1 3.71Å; Y335-F368 HydrophobicContact CD2-CE1 3.71Å; Y335-F368 HydrophobicContact CD2-CE2 4.3Å; Y335-F368 AromaticContact CD2-CZ 3.29Å; Y335-F368 HydrophobicContact CD2-CZ 3.29Å; Y335-F368 HydrophobicContact CE1-CE1 4.4Å; Y335-F368 HydrophobicContact CE2-CE1 4.32Å; Y335-F368 AromaticContact CE2-CZ 3.96Å; Y335-F368 HydrophobicContact CE2-CZ 3.96Å; Y335-F368 AromaticContact CG-CE1 3.41Å; Y335-F368 HydrophobicContact CG-CE1 3.41Å; Y335-F368 VanDerWaalsContact CG-CE1 3.41Å; Y335-F368 AromaticContact CG-CZ 3.46Å; Y335-F368 HydrophobicContact CG-CZ 3.46Å; Y335-F368 VanDerWaalsContact CG-CZ 3.46Å; Y335-L375 HydrophobicContact CE1-CD2 4.47Å; Y335-W379 AromaticContact CE2-CD1 3.72Å; Y335-W379 AromaticContact CZ-CD1 3.87Å |
| 336 | N | 76.1 | Confident | 86.4 | Confident | 10 Ų | 10 | 26.4 Ų | 26.4 | 5% | 0.053 | 13% | 0.125 | C | C | . | . | trans | -122.7 | 143.5 | 167.4 | -179.1 | -17.6 | 0 | 0 | 0 | 108.1 | G299 E334 A338 N339 S340 | G299-N336 PolarHBondContact O-ND2 3.44Å; E334-N336 PolarHBondContact O-N 3.43Å; N336-A338 PolarHBondContact O-N 3.37Å; N336-A338 PolarHBondContact OD1-N 3.41Å; N336-N339 WeakPolarHBondContact O-CB 3.26Å; N336-N339 PolarHBondContact O-N 2.93Å; N336-S340 PolarHBondContact O-N 3.1Å | ||
| 337 | G | 74.6 | Confident | 86.4 | Confident | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -53.1 | -35.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | N339 S340 | G337-N339 VanDerWaalsContact C-N 3.35Å; G337-N339 PolarHBondContact O-N 3.3Å; G337-S340 WeakPolarHBondContact O-CB 2.97Å; G337-S340 PolarHBondContact O-N 2.89Å |
| 338 | A | 81.8 | Confident | 86.4 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.5 | -37.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | M138 C301 A306 N336 S340 I341 F342 | M138-A338 HydrophobicContact CE-CB 4.25Å; C301-A338 HydrophobicContact CB-CB 3.94Å; A306-A338 HydrophobicContact CB-CB 3.91Å; N336-A338 PolarHBondContact O-N 3.37Å; N336-A338 PolarHBondContact OD1-N 3.41Å; A338-S340 VanDerWaalsContact C-N 3.28Å; A338-S340 PolarHBondContact O-N 3.45Å; A338-I341 PolarHBondContact O-N 3.34Å; A338-F342 WeakPolarHBondContact O-CD2 3.41Å; A338-F342 PolarHBondContact O-N 3.45Å |
| 339 | N | 85.3 | Confident | 86.2 | Confident | 7 Ų | 7 | 28.9 Ų | 28.9 | 4% | 0.037 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -66.9 | -33.1 | 179.3 | -61.9 | 0.2 | 0 | 0 | 0 | 110.8 | C296 E334 N336 G337 I341 F342 L343 | C296-N339 WeakPolarHBondContact CB-OD1 3.49Å; E334-N339 PolarHBondContact O-ND2 3.37Å; N336-N339 WeakPolarHBondContact O-CB 3.26Å; N336-N339 PolarHBondContact O-N 2.93Å; G337-N339 VanDerWaalsContact C-N 3.35Å; G337-N339 PolarHBondContact O-N 3.3Å; N339-I341 VanDerWaalsContact C-N 3.3Å; N339-I341 PolarHBondContact O-N 3Å; N339-F342 PolarHBondContact O-N 2.94Å; N339-L343 WeakPolarHBondContact O-CB 3.33Å; N339-L343 PolarHBondContact O-N 2.94Å |
| 340 | S | 84.6 | Confident | 86.2 | Confident | 5 Ų | 5 | 32 Ų | 32 | 4% | 0.035 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.7 | -40 | 175.3 | -55.8 | 0 | 0 | 0 | 0 | 112.5 | Y335 N336 G337 A338 L343 R344 | Y335-S340 WeakPolarHBondContact CE2-OG 3.33Å; Y335-S340 VanDerWaalsContact CZ-OG 3.26Å; Y335-S340 PolarHBondContact OH-OG 3Å; N336-S340 PolarHBondContact O-N 3.1Å; G337-S340 WeakPolarHBondContact O-CB 2.97Å; G337-S340 PolarHBondContact O-N 2.89Å; A338-S340 VanDerWaalsContact C-N 3.28Å; A338-S340 PolarHBondContact O-N 3.45Å; S340-L343 PolarHBondContact O-N 3.34Å; S340-R344 WeakPolarHBondContact O-CB 3.11Å; S340-R344 PolarHBondContact O-N 2.9Å |
| 341 | I | 88.8 | Confident | 86.2 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64.2 | -48.5 | 179.9 | -62.4 | 169 | 0 | 0 | 0 | 109.4 | L303 A306 I307 A338 N339 L343 R344 L345 L378 | L303-I341 HydrophobicContact CD2-CD1 4.19Å; A306-I341 HydrophobicContact CB-CB 4.47Å; A306-I341 HydrophobicContact CB-CD1 4.01Å; I307-I341 HydrophobicContact CG1-CD1 4.25Å; A338-I341 PolarHBondContact O-N 3.34Å; N339-I341 VanDerWaalsContact C-N 3.3Å; N339-I341 PolarHBondContact O-N 3Å; I341-L343 PolarHBondContact O-N 3.36Å; I341-R344 PolarHBondContact O-N 2.89Å; I341-L345 HydrophobicContact CG2-CD1 3.79Å; I341-L345 HydrophobicContact CG2-CG 4.47Å; I341-L345 WeakPolarHBondContact O-CB 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.37Å; I341-L345 PolarHBondContact O-N 2.79Å; I341-L378 HydrophobicContact CD1-CD1 4.26Å; I341-L378 HydrophobicContact CG1-CD1 4.06Å |
| 342 | F | 90.9 | Very high | 86.3 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.2 | -40.2 | 176.6 | -62.8 | -51.4 | 0 | 0 | 0 | 112.7 | L292 L295 A306 I309 L313 L330 A338 N339 L345 L346 | L292-F342 HydrophobicContact CD1-CD1 3.67Å; L292-F342 HydrophobicContact CD1-CD2 3.73Å; L292-F342 HydrophobicContact CD1-CE1 3.61Å; L292-F342 HydrophobicContact CD1-CE2 3.66Å; L292-F342 HydrophobicContact CD1-CG 3.73Å; L292-F342 HydrophobicContact CD1-CZ 3.59Å; L295-F342 HydrophobicContact CD2-CE2 4.02Å; L295-F342 HydrophobicContact CD2-CZ 3.76Å; A306-F342 HydrophobicContact CB-CE2 4.25Å; A306-F342 HydrophobicContact CB-CZ 4.04Å; A306-F342 WeakPolarHBondContact O-CE1 3.32Å; I309-F342 HydrophobicContact CB-CE1 4.04Å; I309-F342 HydrophobicContact CB-CZ 4.26Å; I309-F342 HydrophobicContact CG2-CE1 3.89Å; I309-F342 HydrophobicContact CG2-CZ 4.2Å; L313-F342 HydrophobicContact CD1-CD1 3.89Å; L330-F342 HydrophobicContact CD1-CB 4.21Å; L330-F342 HydrophobicContact CD2-CB 4.49Å; A338-F342 WeakPolarHBondContact O-CD2 3.41Å; A338-F342 PolarHBondContact O-N 3.45Å; N339-F342 PolarHBondContact O-N 2.94Å; F342-L345 PolarHBondContact O-N 2.81Å; F342-L346 WeakPolarHBondContact O-CB 3.27Å; F342-L346 VanDerWaalsContact O-CG 3.28Å; F342-L346 WeakPolarHBondContact O-CG 3.38Å; F342-L346 PolarHBondContact O-N 3.02Å |
| 343 | L | 90.3 | Very high | 86.4 | Confident | 4 Ų | 4 | 31.7 Ų | 31.7 | 2% | 0.021 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.5 | -48.6 | 178.6 | -154.8 | 70.5 | 0 | 0 | 0 | 111.4 | M327 L330 N339 S340 I341 L345 L346 L347 L361 F365 | M327-L343 HydrophobicContact CG-CD1 4.46Å; L330-L343 HydrophobicContact CB-CD1 3.9Å; N339-L343 WeakPolarHBondContact O-CB 3.33Å; N339-L343 PolarHBondContact O-N 2.94Å; S340-L343 PolarHBondContact O-N 3.34Å; I341-L343 PolarHBondContact O-N 3.36Å; L343-L345 PolarHBondContact O-N 3.44Å; L343-L346 PolarHBondContact O-N 3.46Å; L343-L347 WeakPolarHBondContact O-CG 3.27Å; L343-L347 PolarHBondContact O-N 3.37Å; L343-L361 HydrophobicContact CD1-CD2 3.69Å; L343-L361 HydrophobicContact CD2-CD2 3.91Å; L343-L361 HydrophobicContact CG-CD2 3.94Å; L343-F365 HydrophobicContact CD2-CE2 4.47Å; L343-F365 HydrophobicContact CD2-CZ 4.2Å |
| 344 | R | 90.4 | Very high | 86.8 | Confident | 30 Ų | 30 | 33.5 Ų | 33.5 | 11% | 0.113 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.9 | -49.2 | 176.5 | -167.3 | -167.6 | 83.1 | -168.5 | -2.4 | 111.2 | S340 I341 L346 L347 D348 S382 | S340-R344 WeakPolarHBondContact O-CB 3.11Å; S340-R344 PolarHBondContact O-N 2.9Å; I341-R344 PolarHBondContact O-N 2.89Å; R344-L346 VanDerWaalsContact C-N 3.28Å; R344-L346 PolarHBondContact O-N 3.06Å; R344-L347 PolarHBondContact O-N 2.7Å; R344-L347 VanDerWaalsContact O-N 3.13Å; R344-D348 IonicContact NE-OD2 3.83Å; R344-D348 PolarHBondContact NE-OD2 3.27Å; R344-D348 WeakPolarHBondContact O-CB 3.4Å; R344-D348 PolarHBondContact O-N 3.45Å; R344-S382 PolarHBondContact N-OG 3.36Å |
| 345 | L | 91.8 | Very high | 87.5 | Confident | 9 Ų | 9 | 30 Ų | 30 | 5% | 0.047 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68.3 | -23.7 | -176.7 | -65.1 | 174.6 | 0 | 0 | 0 | 113.8 | G310 I341 F342 L343 | G310-L345 VanDerWaalsContact CA-CD1 3.5Å; I341-L345 HydrophobicContact CG2-CD1 3.79Å; I341-L345 HydrophobicContact CG2-CG 4.47Å; I341-L345 WeakPolarHBondContact O-CB 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.37Å; I341-L345 PolarHBondContact O-N 2.79Å; F342-L345 PolarHBondContact O-N 2.81Å; L343-L345 PolarHBondContact O-N 3.44Å |
| 346 | L | 91.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -80 | -35.2 | 171 | -71.6 | 168.6 | 0 | 0 | 0 | 112 | L313 M327 L330 F342 L343 R344 K349 | L313-L346 HydrophobicContact CD1-CD2 4.42Å; L313-L346 HydrophobicContact CD1-CG 4.47Å; L313-L346 HydrophobicContact CD2-CD2 4.2Å; M327-L346 HydrophobicContact CE-CB 4.11Å; M327-L346 HydrophobicContact CG-CB 3.7Å; M327-L346 HydrophobicContact CG-CD1 3.84Å; M327-L346 HydrophobicContact CG-CG 4.37Å; M327-L346 HydrophobicContact SD-CB 3.72Å; L330-L346 HydrophobicContact CD1-CD1 3.59Å; F342-L346 WeakPolarHBondContact O-CB 3.27Å; F342-L346 VanDerWaalsContact O-CG 3.28Å; F342-L346 WeakPolarHBondContact O-CG 3.38Å; F342-L346 PolarHBondContact O-N 3.02Å; L343-L346 PolarHBondContact O-N 3.46Å; R344-L346 VanDerWaalsContact C-N 3.28Å; R344-L346 PolarHBondContact O-N 3.06Å; L346-K349 WeakPolarHBondContact O-CB 3.28Å; L346-K349 PolarHBondContact O-N 3.37Å |
| 347 | L | 91 | Very high | 89.1 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -69.4 | -35.8 | 171.7 | -65.2 | 168.7 | 0 | 0 | 0 | 111.9 | M327 L343 R344 K349 K350 L353 L361 T385 L386 Y390 | M327-L347 HydrophobicContact SD-CD2 4.09Å; M327-L347 HydrophobicContact SD-CG 4.46Å; L343-L347 WeakPolarHBondContact O-CG 3.27Å; L343-L347 PolarHBondContact O-N 3.37Å; R344-L347 PolarHBondContact O-N 2.7Å; R344-L347 VanDerWaalsContact O-N 3.13Å; L347-K349 PolarHBondContact O-N 3.46Å; L347-K350 PolarHBondContact O-N 3.41Å; L347-L353 HydrophobicContact CD2-CD1 4.07Å; L347-L361 HydrophobicContact CD2-CD1 3.89Å; L347-T385 HydrophobicContact CB-CG2 3.57Å; L347-L386 HydrophobicContact CD1-CB 4.26Å; L347-L386 HydrophobicContact CD1-CD1 4.38Å; L347-L386 HydrophobicContact CD2-CD1 4.01Å; L347-Y390 HydrophobicContact CB-CE2 4.49Å; L347-Y390 HydrophobicContact CD2-CD2 4.24Å; L347-Y390 HydrophobicContact CD2-CE2 3.69Å |
| 348 | D | 91.3 | Very high | 89.9 | Confident | 59 Ų | 59 | 38 Ų | 38 | 32% | 0.316 | 19% | 0.187 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -14.4 | 176.2 | -73.2 | -33.6 | 0 | 0 | 0 | 112.8 | R344 K350 T385 | R344-D348 IonicContact NE-OD2 3.83Å; R344-D348 PolarHBondContact NE-OD2 3.27Å; R344-D348 WeakPolarHBondContact O-CB 3.4Å; R344-D348 PolarHBondContact O-N 3.45Å; D348-K350 VanDerWaalsContact C-N 3.32Å; D348-T385 WeakPolarHBondContact OD1-CG2 3.31Å; D348-T385 PolarHBondContact OD1-OG1 3.15Å |
| 349 | K | 89.4 | Confident | 90.4 | Very high | 42 Ų | 42 | 41 Ų | 41 | 18% | 0.183 | 20% | 0.203 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -20 | 171.4 | -67.4 | -64.5 | -166.9 | 174.4 | 0 | 114.5 | L313 T314 C316 L346 L347 Y351 | L313-K349 WeakPolarHBondContact O-CE 3.19Å; L313-K349 PolarHBondContact O-NZ 3.3Å; T314-K349 PolarHBondContact O-NZ 3.16Å; C316-K349 PolarHBondContact O-NZ 3.48Å; L346-K349 WeakPolarHBondContact O-CB 3.28Å; L346-K349 PolarHBondContact O-N 3.37Å; L347-K349 PolarHBondContact O-N 3.46Å; K349-Y351 HydrophobicContact CB-CD1 4.4Å; K349-Y351 HydrophobicContact CB-CD2 3.62Å; K349-Y351 HydrophobicContact CB-CE1 4.23Å; K349-Y351 HydrophobicContact CB-CE2 3.41Å; K349-Y351 VanDerWaalsContact CB-CE2 3.41Å; K349-Y351 HydrophobicContact CB-CG 4.11Å; K349-Y351 HydrophobicContact CD-CE2 4.33Å; K349-Y351 HydrophobicContact CG-CD2 4.32Å; K349-Y351 HydrophobicContact CG-CE2 3.68Å; K349-Y351 PolarHBondContact O-N 2.98Å |
| 350 | K | 89.6 | Confident | 90.7 | Very high | 131 Ų | 131 | 42 Ų | 42 | 57% | 0.57 | 21% | 0.211 | S | C | * | . | trans | 58.1 | 34 | 176.9 | -46.4 | 166.7 | -164.4 | 167.1 | 0 | 113.3 | L347 D348 R389 | L347-K350 PolarHBondContact O-N 3.41Å; D348-K350 VanDerWaalsContact C-N 3.32Å; K350-R389 HydrophobicContact CG-CG 4.29Å | ||
| 351 | Y | 90.9 | Very high | 91.1 | Very high | 36 Ų | 36 | 41.7 Ų | 41.7 | 14% | 0.141 | 21% | 0.21 | C | C | . | . | P | Polyproline II helix | trans | -70.7 | 144.7 | 172 | -61.9 | -44.7 | 0 | 0 | 0 | 110.2 | I318 V320 S323 K349 L353 Y390 | I318-Y351 PolarHBondContact N-OH 3.03Å; I318-Y351 VanDerWaalsContact O-CZ 3.28Å; I318-Y351 PolarHBondContact O-OH 3.06Å; V320-Y351 HydrophobicContact CG2-CD1 3.86Å; V320-Y351 HydrophobicContact CG2-CG 3.97Å; S323-Y351 WeakPolarHBondContact OG-CE2 3.2Å; K349-Y351 HydrophobicContact CB-CD1 4.4Å; K349-Y351 HydrophobicContact CB-CD2 3.62Å; K349-Y351 HydrophobicContact CB-CE1 4.23Å; K349-Y351 HydrophobicContact CB-CE2 3.41Å; K349-Y351 VanDerWaalsContact CB-CE2 3.41Å; K349-Y351 HydrophobicContact CB-CG 4.11Å; K349-Y351 HydrophobicContact CD-CE2 4.33Å; K349-Y351 HydrophobicContact CG-CD2 4.32Å; K349-Y351 HydrophobicContact CG-CE2 3.68Å; K349-Y351 PolarHBondContact O-N 2.98Å; Y351-L353 PolarHBondContact O-N 2.95Å; Y351-Y390 VanDerWaalsContact O-CE1 3.25Å; Y351-Y390 WeakPolarHBondContact O-CE1 3.47Å; Y351-Y390 PolarHBondContact O-OH 3.26Å |
| 352 | A | 90.6 | Very high | 91.3 | Very high | 88 Ų | 88 | 41.9 Ų | 41.9 | 73% | 0.727 | 21% | 0.211 | S | C | * | . | P | Polyproline II helix | trans | -63.7 | 120.3 | 166.6 | 0 | 0 | 0 | 0 | 0 | 109 | V320 | V320-A352 VanDerWaalsContact CG1-O 3.24Å; V320-A352 WeakPolarHBondContact CG1-O 3.41Å |
| 353 | L | 89.8 | Confident | 91.2 | Very high | 15 Ų | 15 | 43.7 Ų | 43.7 | 8% | 0.079 | 23% | 0.23 | C | C | . | . | P | Polyproline II helix | trans | -100.2 | 139 | -175.1 | -62.7 | -176.3 | 0 | 0 | 0 | 111 | M327 L347 Y351 L358 L361 Y390 | M327-L353 HydrophobicContact CE-CD2 3.57Å; M327-L353 HydrophobicContact SD-CD1 4.24Å; M327-L353 HydrophobicContact SD-CD2 4.3Å; L347-L353 HydrophobicContact CD2-CD1 4.07Å; Y351-L353 PolarHBondContact O-N 2.95Å; L353-L358 HydrophobicContact CB-CD1 4.45Å; L353-L358 HydrophobicContact CB-CD2 4.34Å; L353-L358 HydrophobicContact CB-CG 4.08Å; L353-L358 HydrophobicContact CD1-CD2 3.93Å; L353-L358 HydrophobicContact CD1-CG 4.48Å; L353-L361 HydrophobicContact CD1-CD1 3.97Å; L353-Y390 HydrophobicContact CB-CE1 4.26Å; L353-Y390 HydrophobicContact CD1-CD1 4.42Å; L353-Y390 HydrophobicContact CD1-CE1 3.82Å; L353-Y390 HydrophobicContact CD1-CE2 4.11Å; L353-Y390 HydrophobicContact CG-CE1 3.69Å |
| 354 | P | 92.9 | Very high | 91.2 | Very high | 62 Ų | 62 | 44.5 Ų | 44.5 | 40% | 0.403 | 23% | 0.233 | S | C | . | . | P | Polyproline II helix | trans | -60.4 | 138 | 168.5 | -19 | 31.1 | 0 | 0 | 0 | 110.3 | S324 R356 V357 L358 | S324-P354 WeakPolarHBondContact OG-CD 3.48Å; P354-R356 PolarHBondContact O-N 2.68Å; P354-R356 VanDerWaalsContact O-N 3.11Å; P354-V357 HydrophobicContact CB-CG2 4.32Å; P354-V357 HydrophobicContact CG-CG2 4.33Å; P354-V357 WeakPolarHBondContact O-CB 3.18Å; P354-V357 PolarHBondContact O-N 3.23Å; P354-L358 PolarHBondContact O-N 3.45Å |
| 355 | F | 91 | Very high | 91.2 | Very high | 103 Ų | 103 | 43.1 Ų | 43.1 | 45% | 0.452 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -52.4 | -39.9 | -175.2 | -60.5 | -51.3 | 0 | 0 | 0 | 113.4 | V357 L358 D359 D393 | F355-V357 PolarHBondContact O-N 2.87Å; F355-L358 HydrophobicContact CD1-CD1 4.25Å; F355-L358 CarbonylContact O-C 3.55Å; F355-L358 WeakPolarHBondContact O-CA 3.5Å; F355-L358 WeakPolarHBondContact O-CB 3.25Å; F355-L358 PolarHBondContact O-N 3.31Å; F355-D359 VanDerWaalsContact C-OD2 3.3Å; F355-D359 PolarHBondContact O-N 3.41Å; F355-D359 VanDerWaalsContact O-OD2 3.06Å; F355-D393 HydrophobicContact CE1-CB 4.24Å |
| 356 | R | 92 | Very high | 91.2 | Very high | 201 Ų | 201 | 45.1 Ų | 45.1 | 76% | 0.758 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -54.8 | -27 | 175.1 | -67 | -169.7 | 66.8 | -176.8 | -0.6 | 114.7 | P354 D359 A360 | P354-R356 PolarHBondContact O-N 2.68Å; P354-R356 VanDerWaalsContact O-N 3.11Å; R356-D359 WeakPolarHBondContact CA-OD2 3.44Å; R356-D359 PolarHBondContact N-OD2 2.82Å; R356-A360 WeakPolarHBondContact O-CB 3.28Å; R356-A360 PolarHBondContact O-N 3.2Å |
| 357 | V | 93 | Very high | 91 | Very high | 6 Ų | 6 | 48.2 Ų | 48.2 | 4% | 0.036 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -80.2 | -39.1 | 175.2 | -174.2 | 0 | 0 | 0 | 0 | 110.5 | M327 L328 P354 F355 A360 L361 | M327-V357 HydrophobicContact CB-CG1 3.94Å; L328-V357 HydrophobicContact CB-CG2 4.45Å; L328-V357 HydrophobicContact CD1-CG2 4.38Å; P354-V357 HydrophobicContact CB-CG2 4.32Å; P354-V357 HydrophobicContact CG-CG2 4.33Å; P354-V357 WeakPolarHBondContact O-CB 3.18Å; P354-V357 PolarHBondContact O-N 3.23Å; F355-V357 PolarHBondContact O-N 2.87Å; V357-A360 PolarHBondContact O-N 3.07Å; V357-L361 HydrophobicContact CG1-CD1 4.09Å; V357-L361 HydrophobicContact CG1-CG 4.5Å; V357-L361 WeakPolarHBondContact O-CB 3.24Å; V357-L361 WeakPolarHBondContact O-CD1 3.38Å; V357-L361 WeakPolarHBondContact O-CG 3.49Å; V357-L361 PolarHBondContact O-N 3.36Å |
| 358 | L | 91.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 172.4 | -68.3 | 169.9 | 0 | 0 | 0 | 111.3 | L353 P354 F355 A360 L361 V362 L386 Y390 D393 | L353-L358 HydrophobicContact CB-CD1 4.45Å; L353-L358 HydrophobicContact CB-CD2 4.34Å; L353-L358 HydrophobicContact CB-CG 4.08Å; L353-L358 HydrophobicContact CD1-CD2 3.93Å; L353-L358 HydrophobicContact CD1-CG 4.48Å; P354-L358 PolarHBondContact O-N 3.45Å; F355-L358 HydrophobicContact CD1-CD1 4.25Å; F355-L358 CarbonylContact O-C 3.55Å; F355-L358 WeakPolarHBondContact O-CA 3.5Å; F355-L358 WeakPolarHBondContact O-CB 3.25Å; F355-L358 PolarHBondContact O-N 3.31Å; L358-A360 VanDerWaalsContact C-N 3.33Å; L358-A360 PolarHBondContact O-N 3.18Å; L358-L361 HydrophobicContact CD2-CD1 4.32Å; L358-L361 PolarHBondContact O-N 3.01Å; L358-V362 VanDerWaalsContact O-CG2 3.32Å; L358-V362 WeakPolarHBondContact O-CG2 3.18Å; L358-V362 PolarHBondContact O-N 3.38Å; L358-L386 HydrophobicContact CD2-CD1 4.13Å; L358-Y390 HydrophobicContact CD1-CD1 4.48Å; L358-Y390 HydrophobicContact CD2-CD1 3.89Å; L358-Y390 HydrophobicContact CD2-CD2 4.34Å; L358-Y390 HydrophobicContact CD2-CG 3.72Å; L358-D393 HydrophobicContact CD1-CB 3.47Å; L358-D393 VanDerWaalsContact CD1-CB 3.47Å |
| 359 | D | 92 | Very high | 90.5 | Very high | 63 Ų | 63 | 51.8 Ų | 51.8 | 34% | 0.337 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 175.7 | -54.6 | -37.3 | 0 | 0 | 0 | 111 | F355 R356 V362 G363 Q398 | F355-D359 VanDerWaalsContact C-OD2 3.3Å; F355-D359 PolarHBondContact O-N 3.41Å; F355-D359 VanDerWaalsContact O-OD2 3.06Å; R356-D359 WeakPolarHBondContact CA-OD2 3.44Å; R356-D359 PolarHBondContact N-OD2 2.82Å; D359-V362 PolarHBondContact O-N 2.84Å; D359-G363 PolarHBondContact O-N 3.21Å; D359-Q398 PolarHBondContact OD1-NE2 2.82Å |
| 360 | A | 92.6 | Very high | 90.1 | Very high | 27 Ų | 27 | 54.6 Ų | 54.6 | 22% | 0.223 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.7 | -40.1 | 175 | 0 | 0 | 0 | 0 | 0 | 113 | L328 A331 R356 V357 L358 G363 H364 | L328-A360 HydrophobicContact CG-CB 4.43Å; A331-A360 HydrophobicContact CB-CB 4.48Å; R356-A360 WeakPolarHBondContact O-CB 3.28Å; R356-A360 PolarHBondContact O-N 3.2Å; V357-A360 PolarHBondContact O-N 3.07Å; L358-A360 VanDerWaalsContact C-N 3.33Å; L358-A360 PolarHBondContact O-N 3.18Å; A360-G363 PolarHBondContact O-N 3Å; A360-H364 WeakPolarHBondContact O-CB 3.45Å; A360-H364 PolarHBondContact O-N 2.97Å |
| 361 | L | 92 | Very high | 89.7 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63 | -45.3 | 174.5 | -74.7 | 162.4 | 0 | 0 | 0 | 111.4 | A331 L343 L347 L353 V357 L358 H364 F365 L386 | A331-L361 HydrophobicContact CB-CD2 4.47Å; L343-L361 HydrophobicContact CD1-CD2 3.69Å; L343-L361 HydrophobicContact CD2-CD2 3.91Å; L343-L361 HydrophobicContact CG-CD2 3.94Å; L347-L361 HydrophobicContact CD2-CD1 3.89Å; L353-L361 HydrophobicContact CD1-CD1 3.97Å; V357-L361 HydrophobicContact CG1-CD1 4.09Å; V357-L361 HydrophobicContact CG1-CG 4.5Å; V357-L361 WeakPolarHBondContact O-CB 3.24Å; V357-L361 WeakPolarHBondContact O-CD1 3.38Å; V357-L361 WeakPolarHBondContact O-CG 3.49Å; V357-L361 PolarHBondContact O-N 3.36Å; L358-L361 HydrophobicContact CD2-CD1 4.32Å; L358-L361 PolarHBondContact O-N 3.01Å; L361-H364 WeakPolarHBondContact O-CB 3.08Å; L361-H364 PolarHBondContact O-N 3.39Å; L361-F365 WeakPolarHBondContact O-CD2 3.2Å; L361-F365 PolarHBondContact O-N 3.29Å; L361-L386 HydrophobicContact CB-CD1 4.44Å; L361-L386 HydrophobicContact CD1-CD1 4.17Å |
| 362 | V | 92 | Very high | 88.9 | Confident | 3 Ų | 3 | 58.4 Ų | 58.4 | 2% | 0.018 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 175.3 | 173.6 | 0 | 0 | 0 | 0 | 110.3 | L358 D359 H364 F365 L366 L394 Q398 L402 | L358-V362 VanDerWaalsContact O-CG2 3.32Å; L358-V362 WeakPolarHBondContact O-CG2 3.18Å; L358-V362 PolarHBondContact O-N 3.38Å; D359-V362 PolarHBondContact O-N 2.84Å; V362-H364 VanDerWaalsContact C-N 3.33Å; V362-H364 PolarHBondContact O-N 3.44Å; V362-F365 PolarHBondContact O-N 3.27Å; V362-L366 HydrophobicContact CG1-CD1 3.69Å; V362-L366 HydrophobicContact CG1-CG 4.08Å; V362-L366 WeakPolarHBondContact O-CB 3.39Å; V362-L366 VanDerWaalsContact O-CG 3.27Å; V362-L366 WeakPolarHBondContact O-CG 3.32Å; V362-L366 PolarHBondContact O-N 3.4Å; V362-L394 HydrophobicContact CG2-CD2 3.49Å; V362-L394 VanDerWaalsContact CG2-CD2 3.49Å; V362-Q398 HydrophobicContact CG1-CB 4.11Å; V362-Q398 HydrophobicContact CG1-CG 4.04Å; V362-L402 HydrophobicContact CG1-CD2 4.47Å; V362-L402 HydrophobicContact CG1-CG 4.48Å; V362-L402 HydrophobicContact CG2-CD1 4.43Å |
| 363 | G | 90.6 | Very high | 88.4 | Confident | 39 Ų | 39 | 59.1 Ų | 59.1 | 40% | 0.402 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -56.3 | -44.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | D359 A360 L366 S367 | D359-G363 PolarHBondContact O-N 3.21Å; A360-G363 PolarHBondContact O-N 3Å; G363-L366 PolarHBondContact O-N 2.84Å; G363-S367 PolarHBondContact O-N 3.32Å |
| 364 | H | 90.4 | Very high | 87.9 | Confident | 20 Ų | 20 | 64.1 Ų | 64.1 | 9% | 0.093 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -58.9 | -51.9 | 173.5 | -178.7 | 88.2 | 0 | 0 | 0 | 111.4 | A331 A360 L361 V362 L366 S367 F368 | A331-H364 HydrophobicContact CB-CB 3.91Å; A331-H364 PolarHBondContact O-ND1 2.81Å; A360-H364 WeakPolarHBondContact O-CB 3.45Å; A360-H364 PolarHBondContact O-N 2.97Å; L361-H364 WeakPolarHBondContact O-CB 3.08Å; L361-H364 PolarHBondContact O-N 3.39Å; V362-H364 VanDerWaalsContact C-N 3.33Å; V362-H364 PolarHBondContact O-N 3.44Å; H364-L366 VanDerWaalsContact C-N 3.34Å; H364-L366 PolarHBondContact O-N 3.49Å; H364-S367 WeakPolarHBondContact O-CB 3.45Å; H364-S367 PolarHBondContact O-N 3.2Å; H364-S367 PolarHBondContact O-OG 2.66Å; H364-F368 AromaticContact CD2-CE2 3.76Å; H364-F368 AromaticContact NE2-CE2 3.68Å; H364-F368 AromaticContact NE2-CZ 3.82Å; H364-F368 WeakPolarHBondContact O-CD2 3.45Å; H364-F368 WeakPolarHBondContact O-CE2 3.29Å |
| 365 | F | 90.2 | Very high | 87.4 | Confident | 2 Ų | 2 | 61.6 Ų | 61.6 | 1% | 0.009 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.8 | -37.1 | 178.4 | -74.4 | -65.6 | 0 | 0 | 0 | 113 | L343 L361 V362 S367 F368 W379 L383 L386 L402 L405 | L343-F365 HydrophobicContact CD2-CE2 4.47Å; L343-F365 HydrophobicContact CD2-CZ 4.2Å; L361-F365 WeakPolarHBondContact O-CD2 3.2Å; L361-F365 PolarHBondContact O-N 3.29Å; V362-F365 PolarHBondContact O-N 3.27Å; F365-S367 VanDerWaalsContact C-N 3.31Å; F365-S367 PolarHBondContact O-N 2.91Å; F365-F368 WeakPolarHBondContact O-CD2 3.45Å; F365-F368 PolarHBondContact O-N 2.88Å; F365-W379 AromaticContact CD1-CE2 3.74Å; F365-W379 AromaticContact CD1-CZ2 3.77Å; F365-W379 HydrophobicContact CD1-CZ2 3.77Å; F365-W379 AromaticContact CD1-NE1 3.8Å; F365-L383 HydrophobicContact CB-CD1 4.33Å; F365-L383 HydrophobicContact CD1-CB 4.15Å; F365-L383 HydrophobicContact CD1-CD1 4.1Å; F365-L383 HydrophobicContact CD2-CD1 4.04Å; F365-L383 HydrophobicContact CE1-CB 3.88Å; F365-L383 HydrophobicContact CE1-CD1 4.45Å; F365-L383 HydrophobicContact CE2-CD1 4.41Å; F365-L383 HydrophobicContact CG-CD1 3.9Å; F365-L383 HydrophobicContact CZ-CB 4.28Å; F365-L386 HydrophobicContact CD2-CD2 3.81Å; F365-L386 HydrophobicContact CE2-CB 4.46Å; F365-L386 HydrophobicContact CE2-CD2 3.84Å; F365-L402 HydrophobicContact CB-CD2 4.22Å; F365-L405 HydrophobicContact CB-CD2 4.17Å; F365-L405 WeakPolarHBondContact O-CD2 3.37Å |
| 366 | L | 90.2 | Very high | 87.1 | Confident | 51 Ų | 51 | 56.7 Ų | 56.7 | 27% | 0.267 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -69.6 | -24.7 | 177.1 | -68.9 | 176.4 | 0 | 0 | 0 | 113.5 | V362 G363 H364 F368 R369 A401 L402 L405 | V362-L366 HydrophobicContact CG1-CD1 3.69Å; V362-L366 HydrophobicContact CG1-CG 4.08Å; V362-L366 WeakPolarHBondContact O-CB 3.39Å; V362-L366 VanDerWaalsContact O-CG 3.27Å; V362-L366 WeakPolarHBondContact O-CG 3.32Å; V362-L366 PolarHBondContact O-N 3.4Å; G363-L366 PolarHBondContact O-N 2.84Å; H364-L366 VanDerWaalsContact C-N 3.34Å; H364-L366 PolarHBondContact O-N 3.49Å; L366-F368 PolarHBondContact O-N 2.87Å; L366-R369 VanDerWaalsContact O-CB 3.27Å; L366-R369 WeakPolarHBondContact O-CB 3.47Å; L366-R369 PolarHBondContact O-N 3.39Å; L366-A401 HydrophobicContact CD1-CB 3.81Å; L366-A401 HydrophobicContact CD2-CB 3.68Å; L366-A401 WeakPolarHBondContact CD2-O 3.41Å; L366-A401 HydrophobicContact CG-CB 4.41Å; L366-L402 HydrophobicContact CD2-CD2 4.24Å; L366-L405 HydrophobicContact CD2-CB 4.35Å; L366-L405 HydrophobicContact CD2-CD2 4.47Å |
| 367 | S | 87.3 | Confident | 86.9 | Confident | 65 Ų | 65 | 48.7 Ų | 48.7 | 46% | 0.455 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -57.8 | -29.7 | 175.6 | 77.1 | 0 | 0 | 0 | 0 | 112.9 | G363 H364 F365 R369 S370 | G363-S367 PolarHBondContact O-N 3.32Å; H364-S367 WeakPolarHBondContact O-CB 3.45Å; H364-S367 PolarHBondContact O-N 3.2Å; H364-S367 PolarHBondContact O-OG 2.66Å; F365-S367 VanDerWaalsContact C-N 3.31Å; F365-S367 PolarHBondContact O-N 2.91Å; S367-R369 PolarHBondContact O-N 3.01Å; S367-S370 PolarHBondContact O-OG 3.14Å |
| 368 | F | 86.9 | Confident | 86.4 | Confident | 8 Ų | 8 | 48.5 Ų | 48.5 | 4% | 0.035 | 26% | 0.261 | C | S | . | . | G | 310 helix | trans | -76.7 | 0.3 | 178.2 | -54.8 | -77.7 | 0 | 0 | 0 | 114.5 | Y335 H364 F365 L366 S370 E371 L375 W379 Q409 | Y335-F368 AromaticContact CD1-CE1 3.79Å; Y335-F368 HydrophobicContact CD1-CE1 3.79Å; Y335-F368 HydrophobicContact CD1-CZ 4.26Å; Y335-F368 AromaticContact CD2-CE1 3.71Å; Y335-F368 HydrophobicContact CD2-CE1 3.71Å; Y335-F368 HydrophobicContact CD2-CE2 4.3Å; Y335-F368 AromaticContact CD2-CZ 3.29Å; Y335-F368 HydrophobicContact CD2-CZ 3.29Å; Y335-F368 HydrophobicContact CE1-CE1 4.4Å; Y335-F368 HydrophobicContact CE2-CE1 4.32Å; Y335-F368 AromaticContact CE2-CZ 3.96Å; Y335-F368 HydrophobicContact CE2-CZ 3.96Å; Y335-F368 AromaticContact CG-CE1 3.41Å; Y335-F368 HydrophobicContact CG-CE1 3.41Å; Y335-F368 VanDerWaalsContact CG-CE1 3.41Å; Y335-F368 AromaticContact CG-CZ 3.46Å; Y335-F368 HydrophobicContact CG-CZ 3.46Å; Y335-F368 VanDerWaalsContact CG-CZ 3.46Å; H364-F368 AromaticContact CD2-CE2 3.76Å; H364-F368 AromaticContact NE2-CE2 3.68Å; H364-F368 AromaticContact NE2-CZ 3.82Å; H364-F368 WeakPolarHBondContact O-CD2 3.45Å; H364-F368 WeakPolarHBondContact O-CE2 3.29Å; F365-F368 WeakPolarHBondContact O-CD2 3.45Å; F365-F368 PolarHBondContact O-N 2.88Å; L366-F368 PolarHBondContact O-N 2.87Å; F368-S370 PolarHBondContact O-N 3.24Å; F368-E371 HydrophobicContact CB-CB 4.27Å; F368-E371 HydrophobicContact CD1-CB 4.28Å; F368-E371 HydrophobicContact CD1-CG 4.38Å; F368-E371 WeakPolarHBondContact O-CB 3.33Å; F368-E371 PolarHBondContact O-N 2.73Å; F368-L375 HydrophobicContact CB-CD1 4.12Å; F368-L375 HydrophobicContact CD1-CD2 3.88Å; F368-L375 HydrophobicContact CE1-CD2 4.46Å; F368-L375 HydrophobicContact CG-CD2 4.32Å; F368-W379 HydrophobicContact CB-CZ2 3.9Å; F368-W379 AromaticContact CD2-CE2 3.74Å; F368-W379 AromaticContact CD2-CZ2 3.72Å; F368-W379 HydrophobicContact CD2-CZ2 3.72Å; F368-W379 AromaticContact CD2-NE1 3.21Å; F368-W379 AromaticContact CE2-NE1 3.34Å; F368-W379 VanDerWaalsContact CE2-NE1 3.34Å; F368-W379 HydrophobicContact CG-CZ2 4.01Å; F368-W379 AromaticContact CG-NE1 3.72Å; F368-W379 AromaticContact CZ-NE1 3.95Å; F368-Q409 PolarHBondContact O-NE2 3.06Å |
| 369 | R | 85.4 | Confident | 86.3 | Confident | 126 Ų | 126 | 48.6 Ų | 48.6 | 48% | 0.475 | 26% | 0.261 | S | S | . | . | G | 310 helix | trans | -64.2 | -25.1 | 174.7 | -166 | 179.4 | -173.4 | -167.3 | 4.4 | 112.8 | L366 S367 E404 L405 V408 | L366-R369 VanDerWaalsContact O-CB 3.27Å; L366-R369 WeakPolarHBondContact O-CB 3.47Å; L366-R369 PolarHBondContact O-N 3.39Å; S367-R369 PolarHBondContact O-N 3.01Å; R369-E404 IonicContact CZ-OE2 3.12Å; R369-E404 IonicContact NH2-OE2 2.64Å; R369-E404 PolarHBondContact NH2-OE2 3.45Å; R369-L405 HydrophobicContact CB-CD1 4.05Å; R369-V408 HydrophobicContact CG-CG2 4.36Å |
| 370 | S | 81.3 | Confident | 86.2 | Confident | 101 Ų | 101 | 45.9 Ų | 45.9 | 71% | 0.706 | 25% | 0.246 | S | C | * | . | G | 310 helix | trans | -100.4 | -6.5 | 176 | 57 | 0 | 0 | 0 | 0 | 113.9 | S367 F368 | S367-S370 PolarHBondContact O-OG 3.14Å; F368-S370 PolarHBondContact O-N 3.24Å |
| 371 | E | 80.5 | Confident | 86 | Confident | 44 Ų | 44 | 47.3 Ų | 47.3 | 21% | 0.206 | 25% | 0.249 | C | C | . | . | trans | -71.2 | 136.6 | -179.7 | 179.9 | 55.5 | -101.9 | 0 | 0 | 110.7 | F137 F368 R373 Q409 | F137-E371 HydrophobicContact CE1-CG 4.31Å; F368-E371 HydrophobicContact CB-CB 4.27Å; F368-E371 HydrophobicContact CD1-CB 4.28Å; F368-E371 HydrophobicContact CD1-CG 4.38Å; F368-E371 WeakPolarHBondContact O-CB 3.33Å; F368-E371 PolarHBondContact O-N 2.73Å; E371-R373 VanDerWaalsContact CD-NE 3.28Å; E371-R373 HydrophobicContact CG-CB 4.23Å; E371-R373 WeakPolarHBondContact OE1-CB 3.27Å; E371-R373 WeakPolarHBondContact OE1-CG 3.47Å; E371-R373 IonicContact OE1-CZ 3.84Å; E371-R373 PolarHBondContact OE1-N 3.47Å; E371-R373 IonicContact OE1-NE 3.86Å; E371-R373 PolarHBondContact OE1-NE 3.39Å; E371-R373 IonicContact OE1-NH2 2.78Å; E371-R373 IonicContact OE2-CZ 2.91Å; E371-R373 VanDerWaalsContact OE2-CZ 3.31Å; E371-R373 IonicContact OE2-NE 2.7Å; E371-R373 PolarHBondContact OE2-NE 3.03Å; E371-R373 VanDerWaalsContact OE2-NE 3.14Å; E371-R373 IonicContact OE2-NH2 2.82Å; E371-R373 PolarHBondContact OE2-NH2 2.89Å; E371-Q409 PolarHBondContact O-NE2 3.44Å | ||
| 372 | K | 75 | Confident | 85.9 | Confident | 202 Ų | 202 | 47.4 Ų | 47.4 | 88% | 0.878 | 25% | 0.249 | S | C | * | . | trans | -106.1 | -10.9 | -176.9 | -65.2 | -177.6 | -179.5 | 178.1 | 0 | 113.2 | ||||
| 373 | R | 79.9 | Confident | 85.8 | Confident | 104 Ų | 104 | 47.3 Ų | 47.3 | 39% | 0.392 | 25% | 0.248 | S | C | . | . | S | Bend | trans | -73.3 | 143.3 | 173.2 | -69.1 | 175.3 | -77.3 | 177.5 | -0.3 | 110.5 | M136 F137 E371 L375 | M136-R373 PolarHBondContact O-NH1 3.38Å; F137-R373 VanDerWaalsContact CD1-CZ 3.43Å; F137-R373 VanDerWaalsContact CD1-NH1 3.33Å; F137-R373 HydrophobicContact CE1-CB 3.73Å; F137-R373 HydrophobicContact CE1-CG 4.37Å; F137-R373 VanDerWaalsContact CE1-CZ 3.46Å; F137-R373 HydrophobicContact CE2-CB 4.15Å; F137-R373 HydrophobicContact CZ-CB 3.35Å; F137-R373 HydrophobicContact CZ-CG 4.37Å; E371-R373 VanDerWaalsContact CD-NE 3.28Å; E371-R373 HydrophobicContact CG-CB 4.23Å; E371-R373 WeakPolarHBondContact OE1-CB 3.27Å; E371-R373 WeakPolarHBondContact OE1-CG 3.47Å; E371-R373 IonicContact OE1-CZ 3.84Å; E371-R373 PolarHBondContact OE1-N 3.47Å; E371-R373 IonicContact OE1-NE 3.86Å; E371-R373 PolarHBondContact OE1-NE 3.39Å; E371-R373 IonicContact OE1-NH2 2.78Å; E371-R373 IonicContact OE2-CZ 2.91Å; E371-R373 VanDerWaalsContact OE2-CZ 3.31Å; E371-R373 IonicContact OE2-NE 2.7Å; E371-R373 PolarHBondContact OE2-NE 3.03Å; E371-R373 VanDerWaalsContact OE2-NE 3.14Å; E371-R373 IonicContact OE2-NH2 2.82Å; E371-R373 PolarHBondContact OE2-NH2 2.89Å; R373-L375 PolarHBondContact O-N 2.84Å |
| 374 | V | 78.1 | Confident | 85.9 | Confident | 119 Ų | 119 | 46.3 Ų | 46.3 | 72% | 0.721 | 23% | 0.234 | S | C | * | . | trans | -68.1 | 115.8 | 173.3 | 179.7 | 0 | 0 | 0 | 0 | 108.8 | F137 | F137-V374 WeakPolarHBondContact CE2-O 3.48Š| ||
| 375 | L | 82.4 | Confident | 85.9 | Confident | 9 Ų | 9 | 46 Ų | 46 | 5% | 0.047 | 23% | 0.233 | C | C | . | . | trans | -71.5 | 144.6 | -177.7 | -68.3 | 161.9 | 0 | 0 | 0 | 111.3 | F137 Y335 F368 R373 W379 Q409 | F137-L375 HydrophobicContact CE1-CD2 4.31Å; F137-L375 HydrophobicContact CE2-CD2 4.41Å; F137-L375 HydrophobicContact CZ-CD2 3.77Å; F137-L375 HydrophobicContact CZ-CG 4.48Å; Y335-L375 HydrophobicContact CE1-CD2 4.47Å; F368-L375 HydrophobicContact CB-CD1 4.12Å; F368-L375 HydrophobicContact CD1-CD2 3.88Å; F368-L375 HydrophobicContact CE1-CD2 4.46Å; F368-L375 HydrophobicContact CG-CD2 4.32Å; R373-L375 PolarHBondContact O-N 2.84Å; L375-W379 HydrophobicContact CB-CB 4.39Å; L375-W379 HydrophobicContact CB-CD2 4.3Å; L375-W379 HydrophobicContact CB-CE3 4.23Å; L375-W379 HydrophobicContact CB-CG 4.39Å; L375-W379 HydrophobicContact CD1-CD2 3.81Å; L375-W379 HydrophobicContact CD1-CE3 3.75Å; L375-W379 HydrophobicContact CD1-CH2 3.87Å; L375-W379 HydrophobicContact CD1-CZ2 3.9Å; L375-W379 HydrophobicContact CD1-CZ3 3.79Å; L375-W379 HydrophobicContact CD2-CD2 4.32Å; L375-W379 HydrophobicContact CD2-CG 4.21Å; L375-W379 HydrophobicContact CG-CD2 4.37Å; L375-Q409 HydrophobicContact CD1-CB 4.04Å; L375-Q409 VanDerWaalsContact CD1-CD 3.47Å; L375-Q409 HydrophobicContact CD1-CG 3.63Å | ||
| 376 | P | 85.9 | Confident | 86 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.006 | 23% | 0.233 | C | C | . | . | trans | -69.6 | 154.9 | 178.1 | -14.2 | 29.8 | 0 | 0 | 0 | 111.7 | A133 M134 F137 L378 W379 H380 | A133-P376 HydrophobicContact CB-CB 4.28Å; A133-P376 HydrophobicContact CB-CG 4.2Å; M134-P376 HydrophobicContact CG-CB 3.74Å; M134-P376 HydrophobicContact CG-CG 3.51Å; F137-P376 HydrophobicContact CD2-CG 4.09Å; F137-P376 HydrophobicContact CE2-CG 4.23Å; P376-L378 PolarHBondContact O-N 3.03Å; P376-L378 VanDerWaalsContact O-N 3.13Å; P376-W379 WeakPolarHBondContact O-CB 3.46Å; P376-W379 PolarHBondContact O-N 2.72Å; P376-H380 PolarHBondContact O-N 2.84Å | ||
| 377 | V | 86.5 | Confident | 86 | Confident | 32 Ų | 32 | 43.5 Ų | 43.5 | 19% | 0.194 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.5 | -33.8 | 175 | -178.2 | 0 | 0 | 0 | 0 | 110.9 | D130 W379 H380 Q381 I414 | D130-V377 WeakPolarHBondContact OD1-CB 3.42Å; D130-V377 WeakPolarHBondContact OD1-CG2 3.32Å; D130-V377 PolarHBondContact OD1-N 2.81Å; D130-V377 VanDerWaalsContact OD2-CB 3.3Å; D130-V377 WeakPolarHBondContact OD2-CB 3.48Å; D130-V377 VanDerWaalsContact OD2-CG2 3.32Å; D130-V377 WeakPolarHBondContact OD2-CG2 3.4Å; V377-W379 VanDerWaalsContact C-N 3.28Å; V377-W379 PolarHBondContact O-N 2.97Å; V377-H380 CarbonylContact O-C 3.59Å; V377-H380 PolarHBondContact O-N 3.46Å; V377-H380 VanDerWaalsContact O-N 3.12Å; V377-Q381 HydrophobicContact CG1-CG 4.22Å; V377-Q381 WeakPolarHBondContact O-CG 3.49Å; V377-Q381 PolarHBondContact O-N 3.42Å; V377-I414 HydrophobicContact CG1-CD1 3.68Å |
| 378 | L | 84.2 | Confident | 86.2 | Confident | 3 Ų | 3 | 43.5 Ų | 43.5 | 2% | 0.016 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61 | -29.7 | 175.2 | -75.6 | 165.4 | 0 | 0 | 0 | 114.3 | V124 V126 M134 I341 P376 S382 | V124-L378 HydrophobicContact CG1-CD1 4.29Å; V124-L378 HydrophobicContact CG1-CD2 3.57Å; V126-L378 HydrophobicContact CG2-CD1 4.22Å; M134-L378 HydrophobicContact CE-CD1 3.6Å; M134-L378 HydrophobicContact SD-CD1 3.6Å; M134-L378 VanDerWaalsContact SD-CD1 3.6Å; I341-L378 HydrophobicContact CD1-CD1 4.26Å; I341-L378 HydrophobicContact CG1-CD1 4.06Å; P376-L378 PolarHBondContact O-N 3.03Å; P376-L378 VanDerWaalsContact O-N 3.13Å; L378-S382 WeakPolarHBondContact O-CB 3.42Å; L378-S382 PolarHBondContact O-N 2.93Å |
| 379 | W | 89.3 | Confident | 86.3 | Confident | 1 Ų | 1 | 48.4 Ų | 48.4 | 0% | 0.004 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -69.6 | -46.6 | 171.9 | -178.4 | 96.6 | 0 | 0 | 0 | 110.6 | Y335 F365 F368 L375 P376 V377 Q381 S382 L383 L405 Q409 | Y335-W379 AromaticContact CE2-CD1 3.72Å; Y335-W379 AromaticContact CZ-CD1 3.87Å; F365-W379 AromaticContact CD1-CE2 3.74Å; F365-W379 AromaticContact CD1-CZ2 3.77Å; F365-W379 HydrophobicContact CD1-CZ2 3.77Å; F365-W379 AromaticContact CD1-NE1 3.8Å; F368-W379 HydrophobicContact CB-CZ2 3.9Å; F368-W379 AromaticContact CD2-CE2 3.74Å; F368-W379 AromaticContact CD2-CZ2 3.72Å; F368-W379 HydrophobicContact CD2-CZ2 3.72Å; F368-W379 AromaticContact CD2-NE1 3.21Å; F368-W379 AromaticContact CE2-NE1 3.34Å; F368-W379 VanDerWaalsContact CE2-NE1 3.34Å; F368-W379 HydrophobicContact CG-CZ2 4.01Å; F368-W379 AromaticContact CG-NE1 3.72Å; F368-W379 AromaticContact CZ-NE1 3.95Å; L375-W379 HydrophobicContact CB-CB 4.39Å; L375-W379 HydrophobicContact CB-CD2 4.3Å; L375-W379 HydrophobicContact CB-CE3 4.23Å; L375-W379 HydrophobicContact CB-CG 4.39Å; L375-W379 HydrophobicContact CD1-CD2 3.81Å; L375-W379 HydrophobicContact CD1-CE3 3.75Å; L375-W379 HydrophobicContact CD1-CH2 3.87Å; L375-W379 HydrophobicContact CD1-CZ2 3.9Å; L375-W379 HydrophobicContact CD1-CZ3 3.79Å; L375-W379 HydrophobicContact CD2-CD2 4.32Å; L375-W379 HydrophobicContact CD2-CG 4.21Å; L375-W379 HydrophobicContact CG-CD2 4.37Å; P376-W379 WeakPolarHBondContact O-CB 3.46Å; P376-W379 PolarHBondContact O-N 2.72Å; V377-W379 VanDerWaalsContact C-N 3.28Å; V377-W379 PolarHBondContact O-N 2.97Å; W379-Q381 VanDerWaalsContact C-N 3.31Å; W379-Q381 PolarHBondContact O-N 3.11Å; W379-S382 WeakPolarHBondContact O-CB 3.4Å; W379-S382 PolarHBondContact O-N 3.07Å; W379-S382 VanDerWaalsContact O-N 3.12Å; W379-L383 HydrophobicContact CH2-CD2 3.91Å; W379-L383 HydrophobicContact CZ3-CD2 3.97Å; W379-L383 PolarHBondContact O-N 3.3Å; W379-L405 HydrophobicContact CH2-CD1 4.36Å; W379-L405 HydrophobicContact CH2-CD2 3.84Å; W379-L405 HydrophobicContact CH2-CG 4.14Å; W379-L405 HydrophobicContact CZ2-CD2 4.17Å; W379-Q409 HydrophobicContact CH2-CB 4.42Å; W379-Q409 HydrophobicContact CZ3-CB 4.36Å |
| 380 | H | 88.7 | Confident | 86.5 | Confident | 6 Ų | 6 | 42.7 Ų | 42.7 | 3% | 0.028 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.7 | -36.9 | 176.3 | -68.1 | -80.4 | 0 | 0 | 0 | 112.1 | P376 V377 L383 L384 H411 I414 | P376-H380 PolarHBondContact O-N 2.84Å; V377-H380 CarbonylContact O-C 3.59Å; V377-H380 PolarHBondContact O-N 3.46Å; V377-H380 VanDerWaalsContact O-N 3.12Å; H380-L383 PolarHBondContact O-N 3Å; H380-L384 WeakPolarHBondContact O-CB 3.38Å; H380-L384 PolarHBondContact O-N 3.13Å; H380-H411 HydrophobicContact CB-CB 4.37Å; H380-I414 HydrophobicContact CB-CB 4.32Å; H380-I414 HydrophobicContact CB-CD1 4.17Å; H380-I414 HydrophobicContact CB-CG2 3.97Å |
| 381 | Q | 88.9 | Confident | 86.9 | Confident | 58 Ų | 58 | 40.4 Ų | 40.4 | 27% | 0.271 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -66.5 | -38.5 | 172.6 | -70.8 | 176.1 | 4.3 | 0 | 0 | 112.3 | V377 W379 L384 T385 I414 | V377-Q381 HydrophobicContact CG1-CG 4.22Å; V377-Q381 WeakPolarHBondContact O-CG 3.49Å; V377-Q381 PolarHBondContact O-N 3.42Å; W379-Q381 VanDerWaalsContact C-N 3.31Å; W379-Q381 PolarHBondContact O-N 3.11Å; Q381-L384 PolarHBondContact O-N 3.08Å; Q381-T385 PolarHBondContact O-N 2.9Å; Q381-T385 PolarHBondContact O-OG1 3.4Å; Q381-I414 HydrophobicContact CG-CD1 3.83Å |
| 382 | S | 89.6 | Confident | 87.3 | Confident | 1 Ų | 1 | 41.3 Ų | 41.3 | 1% | 0.007 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.4 | -44.2 | 174.4 | -163.4 | 0 | 0 | 0 | 0 | 111.9 | R344 L378 W379 L384 T385 L386 | R344-S382 PolarHBondContact N-OG 3.36Å; L378-S382 WeakPolarHBondContact O-CB 3.42Å; L378-S382 PolarHBondContact O-N 2.93Å; W379-S382 WeakPolarHBondContact O-CB 3.4Å; W379-S382 PolarHBondContact O-N 3.07Å; W379-S382 VanDerWaalsContact O-N 3.12Å; S382-L384 VanDerWaalsContact C-N 3.34Å; S382-L384 PolarHBondContact O-N 3.02Å; S382-T385 PolarHBondContact O-N 3.43Å; S382-L386 PolarHBondContact O-N 2.89Å |
| 383 | L | 91.1 | Very high | 87.9 | Confident | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -66 | -34 | 173.9 | -176.7 | 58.3 | 0 | 0 | 0 | 112.4 | F365 W379 H380 L386 A387 L402 L405 L406 I418 | F365-L383 HydrophobicContact CB-CD1 4.33Å; F365-L383 HydrophobicContact CD1-CB 4.15Å; F365-L383 HydrophobicContact CD1-CD1 4.1Å; F365-L383 HydrophobicContact CD2-CD1 4.04Å; F365-L383 HydrophobicContact CE1-CB 3.88Å; F365-L383 HydrophobicContact CE1-CD1 4.45Å; F365-L383 HydrophobicContact CE2-CD1 4.41Å; F365-L383 HydrophobicContact CG-CD1 3.9Å; F365-L383 HydrophobicContact CZ-CB 4.28Å; W379-L383 HydrophobicContact CH2-CD2 3.91Å; W379-L383 HydrophobicContact CZ3-CD2 3.97Å; W379-L383 PolarHBondContact O-N 3.3Å; H380-L383 PolarHBondContact O-N 3Å; L383-L386 HydrophobicContact CD1-CD2 4.25Å; L383-L386 PolarHBondContact O-N 2.9Å; L383-A387 PolarHBondContact O-N 3.01Å; L383-L402 HydrophobicContact CD1-CD2 4.09Å; L383-L405 HydrophobicContact CD2-CD2 4.35Å; L383-L406 HydrophobicContact CD2-CD2 4.17Å; L383-I418 HydrophobicContact CB-CD1 4.2Å; L383-I418 HydrophobicContact CD2-CD1 4.06Å; L383-I418 HydrophobicContact CG-CD1 3.99Å; L383-I418 HydrophobicContact CG-CG2 4.23Å |
| 384 | L | 91.5 | Very high | 88.3 | Confident | 19 Ų | 19 | 29.5 Ų | 29.5 | 10% | 0.099 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.6 | -43.6 | 172.3 | -177.5 | 66.4 | 0 | 0 | 0 | 112.1 | H380 Q381 S382 L386 A387 Q388 I414 E417 I418 | H380-L384 WeakPolarHBondContact O-CB 3.38Å; H380-L384 PolarHBondContact O-N 3.13Å; Q381-L384 PolarHBondContact O-N 3.08Å; S382-L384 VanDerWaalsContact C-N 3.34Å; S382-L384 PolarHBondContact O-N 3.02Å; L384-L386 VanDerWaalsContact C-N 3.3Å; L384-L386 PolarHBondContact O-N 2.73Å; L384-A387 PolarHBondContact O-N 3.42Å; L384-Q388 HydrophobicContact CD1-CG 4.09Å; L384-Q388 HydrophobicContact CG-CG 4.2Å; L384-Q388 WeakPolarHBondContact O-CB 3.32Å; L384-Q388 WeakPolarHBondContact O-CG 3.37Å; L384-Q388 PolarHBondContact O-N 2.91Å; L384-I414 HydrophobicContact CB-CG2 4.08Å; L384-I414 HydrophobicContact CD2-CG2 4.17Å; L384-E417 HydrophobicContact CD1-CB 3.88Å; L384-I418 HydrophobicContact CB-CD1 4.38Å; L384-I418 HydrophobicContact CB-CG1 3.91Å; L384-I418 HydrophobicContact CD1-CG1 3.75Å; L384-I418 HydrophobicContact CG-CG1 4.43Å |
| 385 | T | 91.4 | Very high | 88.8 | Confident | 12 Ų | 12 | 24.3 Ų | 24.3 | 7% | 0.074 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -60.5 | -41.6 | 173.8 | -63.9 | 0 | 0 | 0 | 0 | 110.6 | L347 D348 Q381 S382 Q388 R389 | L347-T385 HydrophobicContact CB-CG2 3.57Å; D348-T385 WeakPolarHBondContact OD1-CG2 3.31Å; D348-T385 PolarHBondContact OD1-OG1 3.15Å; Q381-T385 PolarHBondContact O-N 2.9Å; Q381-T385 PolarHBondContact O-OG1 3.4Å; S382-T385 PolarHBondContact O-N 3.43Å; T385-Q388 PolarHBondContact O-N 3.3Å; T385-R389 HydrophobicContact CG2-CG 4.35Å; T385-R389 VanDerWaalsContact O-CG 3.32Å; T385-R389 WeakPolarHBondContact O-CG 3.03Å; T385-R389 PolarHBondContact O-N 2.86Å |
| 386 | L | 91.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -57 | -53.4 | 174.4 | -173 | 75.6 | 0 | 0 | 0 | 111.1 | L347 L358 L361 F365 S382 L383 L384 Q388 R389 Y390 | L347-L386 HydrophobicContact CD1-CB 4.26Å; L347-L386 HydrophobicContact CD1-CD1 4.38Å; L347-L386 HydrophobicContact CD2-CD1 4.01Å; L358-L386 HydrophobicContact CD2-CD1 4.13Å; L361-L386 HydrophobicContact CB-CD1 4.44Å; L361-L386 HydrophobicContact CD1-CD1 4.17Å; F365-L386 HydrophobicContact CD2-CD2 3.81Å; F365-L386 HydrophobicContact CE2-CB 4.46Å; F365-L386 HydrophobicContact CE2-CD2 3.84Å; S382-L386 PolarHBondContact O-N 2.89Å; L383-L386 HydrophobicContact CD1-CD2 4.25Å; L383-L386 PolarHBondContact O-N 2.9Å; L384-L386 VanDerWaalsContact C-N 3.3Å; L384-L386 PolarHBondContact O-N 2.73Å; L386-Q388 PolarHBondContact O-N 3.06Å; L386-R389 PolarHBondContact O-N 2.9Å; L386-Y390 HydrophobicContact CD1-CD2 3.94Å; L386-Y390 HydrophobicContact CD1-CG 4.47Å; L386-Y390 PolarHBondContact O-N 3.11Å |
| 387 | A | 91.3 | Very high | 89.3 | Confident | 2 Ų | 2 | 34.4 Ų | 34.4 | 2% | 0.017 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65.5 | -38.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L383 L384 R389 K391 I418 E421 L422 | L383-A387 PolarHBondContact O-N 3.01Å; L384-A387 PolarHBondContact O-N 3.42Å; A387-R389 VanDerWaalsContact C-N 3.27Å; A387-R389 PolarHBondContact O-N 3.46Å; A387-K391 WeakPolarHBondContact O-CB 3.47Å; A387-K391 WeakPolarHBondContact O-CD 3.39Å; A387-K391 VanDerWaalsContact O-CG 3.31Å; A387-K391 WeakPolarHBondContact O-CG 3.46Å; A387-I418 HydrophobicContact CB-CG2 3.82Å; A387-E421 HydrophobicContact CB-CB 4.3Å; A387-L422 HydrophobicContact CB-CD2 4.09Å; A387-L422 HydrophobicContact CB-CG 4.19Å |
| 388 | Q | 90.7 | Very high | 89.5 | Confident | 64 Ų | 64 | 34.2 Ų | 34.2 | 30% | 0.299 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -66.4 | -26.8 | 178.3 | -78.2 | -175.6 | 8.7 | 0 | 0 | 113.6 | L384 T385 L386 E421 | L384-Q388 HydrophobicContact CD1-CG 4.09Å; L384-Q388 HydrophobicContact CG-CG 4.2Å; L384-Q388 WeakPolarHBondContact O-CB 3.32Å; L384-Q388 WeakPolarHBondContact O-CG 3.37Å; L384-Q388 PolarHBondContact O-N 2.91Å; T385-Q388 PolarHBondContact O-N 3.3Å; L386-Q388 PolarHBondContact O-N 3.06Å; Q388-E421 HydrophobicContact CG-CG 4.18Å |
| 389 | R | 89.3 | Confident | 89.7 | Confident | 111 Ų | 111 | 34.6 Ų | 34.6 | 42% | 0.419 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -108.6 | -40.7 | -171.3 | -55.8 | -55.5 | 166.6 | -158.8 | -15.3 | 113.9 | K350 T385 L386 A387 | K350-R389 HydrophobicContact CG-CG 4.29Å; T385-R389 HydrophobicContact CG2-CG 4.35Å; T385-R389 VanDerWaalsContact O-CG 3.32Å; T385-R389 WeakPolarHBondContact O-CG 3.03Å; T385-R389 PolarHBondContact O-N 2.86Å; L386-R389 PolarHBondContact O-N 2.9Å; A387-R389 VanDerWaalsContact C-N 3.27Å; A387-R389 PolarHBondContact O-N 3.46Å |
| 390 | Y | 90.5 | Very high | 89.8 | Confident | 6 Ų | 6 | 37.1 Ų | 37.1 | 2% | 0.024 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -110 | 12.2 | -169.2 | -58.2 | -76.4 | 0 | 0 | 0 | 113.7 | L347 Y351 L353 L358 L386 A392 D393 L394 | L347-Y390 HydrophobicContact CB-CE2 4.49Å; L347-Y390 HydrophobicContact CD2-CD2 4.24Å; L347-Y390 HydrophobicContact CD2-CE2 3.69Å; Y351-Y390 VanDerWaalsContact O-CE1 3.25Å; Y351-Y390 WeakPolarHBondContact O-CE1 3.47Å; Y351-Y390 PolarHBondContact O-OH 3.26Å; L353-Y390 HydrophobicContact CB-CE1 4.26Å; L353-Y390 HydrophobicContact CD1-CD1 4.42Å; L353-Y390 HydrophobicContact CD1-CE1 3.82Å; L353-Y390 HydrophobicContact CD1-CE2 4.11Å; L353-Y390 HydrophobicContact CG-CE1 3.69Å; L358-Y390 HydrophobicContact CD1-CD1 4.48Å; L358-Y390 HydrophobicContact CD2-CD1 3.89Å; L358-Y390 HydrophobicContact CD2-CD2 4.34Å; L358-Y390 HydrophobicContact CD2-CG 3.72Å; L386-Y390 HydrophobicContact CD1-CD2 3.94Å; L386-Y390 HydrophobicContact CD1-CG 4.47Å; L386-Y390 PolarHBondContact O-N 3.11Å; Y390-A392 PolarHBondContact O-N 3.38Å; Y390-A392 VanDerWaalsContact O-N 3.13Å; Y390-D393 PolarHBondContact O-N 3.35Å; Y390-L394 WeakPolarHBondContact O-CG 3.41Å; Y390-L394 PolarHBondContact O-N 3.35Å |
| 391 | K | 88.1 | Confident | 89.9 | Confident | 53 Ų | 53 | 38.1 Ų | 38.1 | 23% | 0.23 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -25.3 | -179.4 | 53.1 | -177.3 | -177.7 | 171.4 | 0 | 115.5 | A387 K399 E421 | A387-K391 WeakPolarHBondContact O-CB 3.47Å; A387-K391 WeakPolarHBondContact O-CD 3.39Å; A387-K391 VanDerWaalsContact O-CG 3.31Å; A387-K391 WeakPolarHBondContact O-CG 3.46Å; K391-K399 WeakPolarHBondContact O-CE 3.27Å; K391-K399 PolarHBondContact O-NZ 2.88Å; K391-E421 HydrophobicContact CD-CB 4.36Å; K391-E421 VanDerWaalsContact CD-O 3.28Å; K391-E421 WeakPolarHBondContact CD-O 3.29Å; K391-E421 IonicContact NZ-OE2 3.14Å; K391-E421 PolarHBondContact NZ-OE2 3.11Å |
| 392 | A | 88.5 | Confident | 90 | Very high | 64 Ų | 64 | 35.5 Ų | 35.5 | 53% | 0.529 | 20% | 0.197 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -35.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y390 L394 R428 | Y390-A392 PolarHBondContact O-N 3.38Å; Y390-A392 VanDerWaalsContact O-N 3.13Å; A392-L394 VanDerWaalsContact C-N 3.32Å; A392-L394 PolarHBondContact O-N 3.44Å; A392-R428 PolarHBondContact O-N 3.47Å |
| 393 | D | 88.1 | Confident | 90 | Very high | 57 Ų | 57 | 37.5 Ų | 37.5 | 31% | 0.305 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -13.4 | -175.9 | -52.3 | -68.9 | 0 | 0 | 0 | 113.7 | F355 L358 Y390 R428 | F355-D393 HydrophobicContact CE1-CB 4.24Å; L358-D393 HydrophobicContact CD1-CB 3.47Å; L358-D393 VanDerWaalsContact CD1-CB 3.47Å; Y390-D393 PolarHBondContact O-N 3.35Å; D393-R428 PolarHBondContact O-NH1 2.99Å |
| 394 | L | 88.4 | Confident | 89.9 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 22% | 0.221 | C | C | . | . | S | Bend | trans | -77.6 | 138.7 | -179.1 | -72.9 | 175.3 | 0 | 0 | 0 | 112.6 | V362 Y390 A392 Q398 K399 L402 L422 R428 | V362-L394 HydrophobicContact CG2-CD2 3.49Å; V362-L394 VanDerWaalsContact CG2-CD2 3.49Å; Y390-L394 WeakPolarHBondContact O-CG 3.41Å; Y390-L394 PolarHBondContact O-N 3.35Å; A392-L394 VanDerWaalsContact C-N 3.32Å; A392-L394 PolarHBondContact O-N 3.44Å; L394-Q398 HydrophobicContact CD2-CB 4.44Å; L394-K399 HydrophobicContact CB-CG 3.95Å; L394-K399 HydrophobicContact CD1-CG 4.41Å; L394-K399 WeakPolarHBondContact O-CE 3.37Å; L394-L402 HydrophobicContact CD1-CD1 4.11Å; L394-L422 HydrophobicContact CD1-CD2 3.92Å; L394-R428 PolarHBondContact O-N 3.04Å |
| 395 | A | 89.9 | Confident | 89.8 | Confident | 10 Ų | 10 | 39.6 Ų | 39.6 | 8% | 0.083 | 22% | 0.216 | C | C | . | . | trans | -67.6 | 153.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | E397 Q398 K399 D429 | A395-E397 PolarHBondContact O-N 3.25Å; A395-Q398 HydrophobicContact CB-CB 4.08Å; A395-Q398 HydrophobicContact CB-CG 3.83Å; A395-Q398 WeakPolarHBondContact O-CB 3.33Å; A395-Q398 PolarHBondContact O-N 2.95Å; A395-Q398 VanDerWaalsContact O-N 3.16Å; A395-K399 WeakPolarHBondContact O-CG 3.35Å; A395-K399 PolarHBondContact O-N 2.96Å; A395-D429 WeakPolarHBondContact CA-OD1 3.25Å; A395-D429 WeakPolarHBondContact CA-OD2 3.33Å; A395-D429 WeakPolarHBondContact CB-OD1 3.37Å; A395-D429 WeakPolarHBondContact CB-OD2 3.32Å | ||
| 396 | S | 88.3 | Confident | 89.7 | Confident | 61 Ų | 61 | 39 Ų | 39 | 43% | 0.427 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -55.3 | -47.3 | 174.7 | 51.5 | 0 | 0 | 0 | 0 | 112.7 | K399 A400 D429 | S396-K399 PolarHBondContact O-N 2.65Å; S396-A400 PolarHBondContact O-N 3.35Å; S396-D429 PolarHBondContact N-OD2 3.32Å; S396-D429 PolarHBondContact OG-OD2 3.3Å |
| 397 | E | 89.8 | Confident | 89.4 | Confident | 161 Ų | 161 | 45.4 Ų | 45.4 | 75% | 0.752 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -62.2 | -43 | 174 | -175.4 | 179.7 | -170 | 0 | 0 | 112 | A395 K399 A400 A401 | A395-E397 PolarHBondContact O-N 3.25Å; E397-K399 PolarHBondContact O-N 3.37Å; E397-A400 PolarHBondContact O-N 2.93Å; E397-A401 WeakPolarHBondContact O-CB 3.42Å; E397-A401 PolarHBondContact O-N 2.88Å |
| 398 | Q | 89.8 | Confident | 89.2 | Confident | 29 Ų | 29 | 48.9 Ų | 48.9 | 14% | 0.136 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.5 | -43.2 | 177.9 | -70 | 172.4 | -17 | 0 | 0 | 111.3 | D359 V362 L394 A395 A401 L402 | D359-Q398 PolarHBondContact OD1-NE2 2.82Å; V362-Q398 HydrophobicContact CG1-CB 4.11Å; V362-Q398 HydrophobicContact CG1-CG 4.04Å; L394-Q398 HydrophobicContact CD2-CB 4.44Å; A395-Q398 HydrophobicContact CB-CB 4.08Å; A395-Q398 HydrophobicContact CB-CG 3.83Å; A395-Q398 WeakPolarHBondContact O-CB 3.33Å; A395-Q398 PolarHBondContact O-N 2.95Å; A395-Q398 VanDerWaalsContact O-N 3.16Å; Q398-A401 PolarHBondContact O-N 3.05Å; Q398-L402 WeakPolarHBondContact O-CG 3.42Å; Q398-L402 PolarHBondContact O-N 3.21Å |
| 399 | K | 89.4 | Confident | 88.9 | Confident | 11 Ų | 11 | 46.9 Ų | 46.9 | 5% | 0.048 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 174.6 | -67.1 | -179.3 | -169.1 | -176.5 | 0 | 111.9 | K391 L394 A395 S396 E397 L402 L403 L422 S425 E426 S427 | K391-K399 WeakPolarHBondContact O-CE 3.27Å; K391-K399 PolarHBondContact O-NZ 2.88Å; L394-K399 HydrophobicContact CB-CG 3.95Å; L394-K399 HydrophobicContact CD1-CG 4.41Å; L394-K399 WeakPolarHBondContact O-CE 3.37Å; A395-K399 WeakPolarHBondContact O-CG 3.35Å; A395-K399 PolarHBondContact O-N 2.96Å; S396-K399 PolarHBondContact O-N 2.65Å; E397-K399 PolarHBondContact O-N 3.37Å; K399-L402 PolarHBondContact O-N 3.04Å; K399-L403 WeakPolarHBondContact O-CB 3.44Å; K399-L403 VanDerWaalsContact O-CG 3.29Å; K399-L403 WeakPolarHBondContact O-CG 3.4Å; K399-L403 PolarHBondContact O-N 3.39Å; K399-L422 HydrophobicContact CG-CD2 4.37Å; K399-S425 WeakPolarHBondContact CE-OG 3.35Å; K399-S425 PolarHBondContact NZ-O 3.31Å; K399-S425 PolarHBondContact NZ-OG 3.43Å; K399-E426 PolarHBondContact NZ-O 2.92Å; K399-S427 WeakPolarHBondContact CD-OG 3.39Å; K399-S427 WeakPolarHBondContact CE-OG 3.5Å; K399-S427 VanDerWaalsContact NZ-CA 3.33Å; K399-S427 PolarHBondContact NZ-OG 3.35Å; K399-S427 VanDerWaalsContact NZ-OG 3.07Å |
| 400 | A | 90.6 | Very high | 88.6 | Confident | 54 Ų | 54 | 46.1 Ų | 46.1 | 45% | 0.446 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.6 | -43.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S396 E397 L403 E404 | S396-A400 PolarHBondContact O-N 3.35Å; E397-A400 PolarHBondContact O-N 2.93Å; A400-L403 PolarHBondContact O-N 3.45Å; A400-E404 PolarHBondContact O-N 2.93Å |
| 401 | A | 91.3 | Very high | 88.4 | Confident | 27 Ų | 27 | 47.9 Ų | 47.9 | 22% | 0.223 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.9 | -38.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L366 E397 Q398 E404 L405 | L366-A401 HydrophobicContact CD1-CB 3.81Å; L366-A401 HydrophobicContact CD2-CB 3.68Å; L366-A401 WeakPolarHBondContact CD2-O 3.41Å; L366-A401 HydrophobicContact CG-CB 4.41Å; E397-A401 WeakPolarHBondContact O-CB 3.42Å; E397-A401 PolarHBondContact O-N 2.88Å; Q398-A401 PolarHBondContact O-N 3.05Å; A401-E404 WeakPolarHBondContact O-CB 3.44Å; A401-E404 PolarHBondContact O-N 3.16Å; A401-L405 PolarHBondContact O-N 2.78Å |
| 402 | L | 90.6 | Very high | 88.2 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.01 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.2 | -35.8 | 173.4 | -69.6 | 177.2 | 0 | 0 | 0 | 112.4 | V362 F365 L366 L383 L394 Q398 K399 E404 L405 L406 L422 | V362-L402 HydrophobicContact CG1-CD2 4.47Å; V362-L402 HydrophobicContact CG1-CG 4.48Å; V362-L402 HydrophobicContact CG2-CD1 4.43Å; F365-L402 HydrophobicContact CB-CD2 4.22Å; L366-L402 HydrophobicContact CD2-CD2 4.24Å; L383-L402 HydrophobicContact CD1-CD2 4.09Å; L394-L402 HydrophobicContact CD1-CD1 4.11Å; Q398-L402 WeakPolarHBondContact O-CG 3.42Å; Q398-L402 PolarHBondContact O-N 3.21Å; K399-L402 PolarHBondContact O-N 3.04Å; L402-E404 VanDerWaalsContact C-N 3.32Å; L402-L405 HydrophobicContact CD2-CD2 4.05Å; L402-L405 WeakPolarHBondContact O-CB 3.36Å; L402-L405 PolarHBondContact O-N 3.23Å; L402-L406 WeakPolarHBondContact O-CG 3.17Å; L402-L406 PolarHBondContact O-N 2.81Å; L402-L422 HydrophobicContact CB-CD1 3.89Å; L402-L422 HydrophobicContact CD1-CD2 4.45Å |
| 403 | L | 89.8 | Confident | 88.1 | Confident | 43 Ų | 43 | 55.6 Ų | 55.6 | 23% | 0.225 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.7 | -33.2 | 172.9 | -72.7 | 170.5 | 0 | 0 | 0 | 112.3 | K399 A400 L406 R419 L422 | K399-L403 WeakPolarHBondContact O-CB 3.44Å; K399-L403 VanDerWaalsContact O-CG 3.29Å; K399-L403 WeakPolarHBondContact O-CG 3.4Å; K399-L403 PolarHBondContact O-N 3.39Å; A400-L403 PolarHBondContact O-N 3.45Å; L403-L406 HydrophobicContact CD2-CD1 4.47Å; L403-R419 HydrophobicContact CD2-CB 4.38Å; L403-R419 HydrophobicContact CD2-CG 3.91Å; L403-L422 HydrophobicContact CD2-CB 4.34Å; L403-L422 HydrophobicContact CD2-CD1 4.27Å; L403-L422 HydrophobicContact CG-CD1 4.37Å |
| 404 | E | 90.3 | Very high | 88.1 | Confident | 64 Ų | 64 | 53.6 Ų | 53.6 | 30% | 0.299 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -66.4 | -44.5 | 169 | -81.7 | -64.9 | 122.5 | 0 | 0 | 112.5 | R369 A400 A401 L402 L406 K407 | R369-E404 IonicContact CZ-OE2 3.12Å; R369-E404 IonicContact NH2-OE2 2.64Å; R369-E404 PolarHBondContact NH2-OE2 3.45Å; A400-E404 PolarHBondContact O-N 2.93Å; A401-E404 WeakPolarHBondContact O-CB 3.44Å; A401-E404 PolarHBondContact O-N 3.16Å; L402-E404 VanDerWaalsContact C-N 3.32Å; E404-L406 VanDerWaalsContact C-N 3.28Å; E404-L406 PolarHBondContact O-N 2.75Å; E404-K407 WeakPolarHBondContact O-CB 3.49Å; E404-K407 PolarHBondContact O-N 3.25Å; E404-K407 WeakPolarHBondContact OE1-CD 3.46Å; E404-K407 WeakPolarHBondContact OE1-CE 3.47Å; E404-K407 IonicContact OE1-NZ 3.31Å; E404-K407 PolarHBondContact OE1-NZ 3.47Å |
| 405 | L | 89.3 | Confident | 88.1 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.7 | -42.2 | 174.9 | 178.4 | 66 | 0 | 0 | 0 | 111.5 | F365 L366 R369 W379 L383 A401 L402 K407 V408 Q409 | F365-L405 HydrophobicContact CB-CD2 4.17Å; F365-L405 WeakPolarHBondContact O-CD2 3.37Å; L366-L405 HydrophobicContact CD2-CB 4.35Å; L366-L405 HydrophobicContact CD2-CD2 4.47Å; R369-L405 HydrophobicContact CB-CD1 4.05Å; W379-L405 HydrophobicContact CH2-CD1 4.36Å; W379-L405 HydrophobicContact CH2-CD2 3.84Å; W379-L405 HydrophobicContact CH2-CG 4.14Å; W379-L405 HydrophobicContact CZ2-CD2 4.17Å; L383-L405 HydrophobicContact CD2-CD2 4.35Å; A401-L405 PolarHBondContact O-N 2.78Å; L402-L405 HydrophobicContact CD2-CD2 4.05Å; L402-L405 WeakPolarHBondContact O-CB 3.36Å; L402-L405 PolarHBondContact O-N 3.23Å; L405-K407 PolarHBondContact O-N 3.5Å; L405-V408 PolarHBondContact O-N 3.22Å; L405-V408 VanDerWaalsContact O-N 3.07Å; L405-Q409 HydrophobicContact CD1-CG 4.28Å; L405-Q409 PolarHBondContact O-N 2.91Å |
| 406 | L | 87.8 | Confident | 88.1 | Confident | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -69.6 | -4.6 | 175.8 | -68.1 | 170.9 | 0 | 0 | 0 | 115.1 | L383 L402 L403 E404 T410 I418 L422 | L383-L406 HydrophobicContact CD2-CD2 4.17Å; L402-L406 WeakPolarHBondContact O-CG 3.17Å; L402-L406 PolarHBondContact O-N 2.81Å; L403-L406 HydrophobicContact CD2-CD1 4.47Å; E404-L406 VanDerWaalsContact C-N 3.28Å; E404-L406 PolarHBondContact O-N 2.75Å; L406-T410 WeakPolarHBondContact O-CG2 3.36Å; L406-I418 HydrophobicContact CD1-CB 3.88Å; L406-I418 HydrophobicContact CD1-CG2 3.66Å; L406-I418 HydrophobicContact CD2-CB 4.2Å; L406-I418 HydrophobicContact CD2-CD1 3.84Å; L406-I418 HydrophobicContact CD2-CG2 4.29Å; L406-L422 HydrophobicContact CD1-CD1 4.18Å |
| 407 | K | 86.9 | Confident | 88.1 | Confident | 134 Ų | 134 | 56.8 Ų | 56.8 | 58% | 0.583 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -88.2 | -30.9 | 167.3 | -64 | 173.3 | -174.7 | 176.1 | 0 | 111.8 | E404 L405 | E404-K407 WeakPolarHBondContact O-CB 3.49Å; E404-K407 PolarHBondContact O-N 3.25Å; E404-K407 WeakPolarHBondContact OE1-CD 3.46Å; E404-K407 WeakPolarHBondContact OE1-CE 3.47Å; E404-K407 IonicContact OE1-NZ 3.31Å; E404-K407 PolarHBondContact OE1-NZ 3.47Å; L405-K407 PolarHBondContact O-N 3.5Å |
| 408 | V | 86.4 | Confident | 88.1 | Confident | 75 Ų | 75 | 49.1 Ų | 49.1 | 46% | 0.455 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -85.5 | -49.2 | 179.8 | -175.8 | 0 | 0 | 0 | 0 | 110.7 | R369 L405 | R369-V408 HydrophobicContact CG-CG2 4.36Å; L405-V408 PolarHBondContact O-N 3.22Å; L405-V408 VanDerWaalsContact O-N 3.07Å |
| 409 | Q | 83.8 | Confident | 88.1 | Confident | 21 Ų | 21 | 52.7 Ų | 52.7 | 10% | 0.098 | 29% | 0.288 | C | S | . | . | S | Bend | trans | -105.1 | 91.7 | -177.3 | -62.9 | -66.5 | -4.6 | 0 | 0 | 109.9 | F368 E371 L375 W379 L405 | F368-Q409 PolarHBondContact O-NE2 3.06Å; E371-Q409 PolarHBondContact O-NE2 3.44Å; L375-Q409 HydrophobicContact CD1-CB 4.04Å; L375-Q409 VanDerWaalsContact CD1-CD 3.47Å; L375-Q409 HydrophobicContact CD1-CG 3.63Å; W379-Q409 HydrophobicContact CH2-CB 4.42Å; W379-Q409 HydrophobicContact CZ3-CB 4.36Å; L405-Q409 HydrophobicContact CD1-CG 4.28Å; L405-Q409 PolarHBondContact O-N 2.91Å |
| 410 | T | 83.8 | Confident | 88.1 | Confident | 95 Ų | 95 | 57 Ų | 57 | 58% | 0.583 | 30% | 0.304 | S | S | * | . | trans | -103.8 | 125.4 | -174.2 | 48.2 | 0 | 0 | 0 | 0 | 112.3 | L406 | L406-T410 WeakPolarHBondContact O-CG2 3.36Š| ||
| 411 | H | 86.1 | Confident | 88.1 | Confident | 44 Ų | 44 | 55.8 Ų | 55.8 | 20% | 0.204 | 29% | 0.29 | C | S | . | . | trans | -113 | 128.6 | 168.6 | -174.4 | -111.1 | 0 | 0 | 0 | 110 | H380 Q413 I414 S415 | H380-H411 HydrophobicContact CB-CB 4.37Å; H411-Q413 VanDerWaalsContact C-N 3.33Å; H411-Q413 PolarHBondContact O-N 2.93Å; H411-Q413 VanDerWaalsContact O-N 3.14Å; H411-I414 HydrophobicContact CB-CB 4.41Å; H411-I414 WeakPolarHBondContact ND1-CB 3.15Å; H411-I414 WeakPolarHBondContact ND1-CG1 3.28Å; H411-I414 PolarHBondContact ND1-N 2.87Å; H411-I414 PolarHBondContact O-N 3.34Å; H411-S415 PolarHBondContact N-OG 3.42Å; H411-S415 WeakPolarHBondContact O-CB 3.42Å; H411-S415 PolarHBondContact O-N 2.91Å; H411-S415 VanDerWaalsContact O-N 3.13Å | ||
| 412 | P | 83.8 | Confident | 87.9 | Confident | 122 Ų | 122 | 54.8 Ų | 54.8 | 79% | 0.792 | 28% | 0.28 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | -38.3 | -165.6 | -30.5 | 36.6 | 0 | 0 | 0 | 116 | ||
| 413 | Q | 86 | Confident | 87.7 | Confident | 157 Ų | 157 | 60.6 Ų | 60.6 | 73% | 0.734 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | -46.5 | 179.9 | -66.8 | 175.4 | -14.1 | 0 | 0 | 112 | H411 | H411-Q413 VanDerWaalsContact C-N 3.33Å; H411-Q413 PolarHBondContact O-N 2.93Å; H411-Q413 VanDerWaalsContact O-N 3.14Å |
| 414 | I | 89.3 | Confident | 87.5 | Confident | 15 Ų | 15 | 63.9 Ų | 63.9 | 8% | 0.077 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -79.9 | -38.9 | -165.4 | -62.5 | 173.4 | 0 | 0 | 0 | 112.4 | V377 H380 Q381 L384 H411 A416 E417 I418 | V377-I414 HydrophobicContact CG1-CD1 3.68Å; H380-I414 HydrophobicContact CB-CB 4.32Å; H380-I414 HydrophobicContact CB-CD1 4.17Å; H380-I414 HydrophobicContact CB-CG2 3.97Å; Q381-I414 HydrophobicContact CG-CD1 3.83Å; L384-I414 HydrophobicContact CB-CG2 4.08Å; L384-I414 HydrophobicContact CD2-CG2 4.17Å; H411-I414 HydrophobicContact CB-CB 4.41Å; H411-I414 WeakPolarHBondContact ND1-CB 3.15Å; H411-I414 WeakPolarHBondContact ND1-CG1 3.28Å; H411-I414 PolarHBondContact ND1-N 2.87Å; H411-I414 PolarHBondContact O-N 3.34Å; I414-A416 PolarHBondContact O-N 3.43Å; I414-A416 VanDerWaalsContact O-N 3.15Å; I414-E417 PolarHBondContact O-N 2.86Å; I414-I418 HydrophobicContact CG2-CD1 3.72Å; I414-I418 HydrophobicContact CG2-CG1 3.92Å; I414-I418 WeakPolarHBondContact O-CG1 3.23Å; I414-I418 PolarHBondContact O-N 3.18Å |
| 415 | S | 88.1 | Confident | 87 | Confident | 7 Ų | 7 | 62.1 Ų | 62.1 | 5% | 0.049 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65 | -22.7 | -176.3 | -65.7 | 0 | 0 | 0 | 0 | 113.2 | H411 R419 | H411-S415 PolarHBondContact N-OG 3.42Å; H411-S415 WeakPolarHBondContact O-CB 3.42Å; H411-S415 PolarHBondContact O-N 2.91Å; H411-S415 VanDerWaalsContact O-N 3.13Å; S415-R419 WeakPolarHBondContact O-CB 3.22Å; S415-R419 PolarHBondContact O-N 2.79Å |
| 416 | A | 88.4 | Confident | 86.5 | Confident | 62 Ų | 62 | 70.2 Ų | 70.2 | 51% | 0.512 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -69.5 | -41.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112 | I414 R420 | I414-A416 PolarHBondContact O-N 3.43Å; I414-A416 VanDerWaalsContact O-N 3.15Å; A416-R420 PolarHBondContact O-N 3.05Å |
| 417 | E | 89.3 | Confident | 86.1 | Confident | 68 Ų | 68 | 71.1 Ų | 71.1 | 32% | 0.318 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68.9 | -45.4 | 176.7 | -61.6 | -140.7 | 107.5 | 0 | 0 | 112.3 | L384 I414 R419 R420 E421 | L384-E417 HydrophobicContact CD1-CB 3.88Å; I414-E417 PolarHBondContact O-N 2.86Å; E417-R419 VanDerWaalsContact C-N 3.25Å; E417-R419 PolarHBondContact O-N 3.45Å; E417-R420 WeakPolarHBondContact O-CB 3.44Å; E417-R420 PolarHBondContact O-N 3.31Å; E417-R420 VanDerWaalsContact O-N 3.11Å; E417-R420 IonicContact OE1-CZ 3.01Å; E417-R420 VanDerWaalsContact OE1-CZ 3.31Å; E417-R420 IonicContact OE1-NH1 2.79Å; E417-R420 PolarHBondContact OE1-NH1 3.38Å; E417-R420 IonicContact OE1-NH2 2.8Å; E417-R420 PolarHBondContact OE1-NH2 3.16Å; E417-E421 WeakPolarHBondContact O-CG 3.31Å; E417-E421 PolarHBondContact O-N 2.83Å |
| 418 | I | 90.4 | Very high | 85.7 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.005 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.3 | -43 | 177.2 | -53.3 | 168.1 | 0 | 0 | 0 | 109.8 | L383 L384 A387 L406 I414 E421 L422 | L383-I418 HydrophobicContact CB-CD1 4.2Å; L383-I418 HydrophobicContact CD2-CD1 4.06Å; L383-I418 HydrophobicContact CG-CD1 3.99Å; L383-I418 HydrophobicContact CG-CG2 4.23Å; L384-I418 HydrophobicContact CB-CD1 4.38Å; L384-I418 HydrophobicContact CB-CG1 3.91Å; L384-I418 HydrophobicContact CD1-CG1 3.75Å; L384-I418 HydrophobicContact CG-CG1 4.43Å; A387-I418 HydrophobicContact CB-CG2 3.82Å; L406-I418 HydrophobicContact CD1-CB 3.88Å; L406-I418 HydrophobicContact CD1-CG2 3.66Å; L406-I418 HydrophobicContact CD2-CB 4.2Å; L406-I418 HydrophobicContact CD2-CD1 3.84Å; L406-I418 HydrophobicContact CD2-CG2 4.29Å; I414-I418 HydrophobicContact CG2-CD1 3.72Å; I414-I418 HydrophobicContact CG2-CG1 3.92Å; I414-I418 WeakPolarHBondContact O-CG1 3.23Å; I414-I418 PolarHBondContact O-N 3.18Å; I418-E421 PolarHBondContact O-N 3.01Å; I418-L422 HydrophobicContact CG2-CD1 3.97Å; I418-L422 HydrophobicContact CG2-CG 4.34Å; I418-L422 WeakPolarHBondContact O-CB 3.38Å; I418-L422 WeakPolarHBondContact O-CG 3.43Å; I418-L422 PolarHBondContact O-N 2.8Å |
| 419 | R | 88.9 | Confident | 85.3 | Confident | 103 Ų | 103 | 68.7 Ų | 68.7 | 39% | 0.389 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 175.6 | -177.1 | 179.4 | -60.5 | 164.2 | 4.9 | 112 | L403 S415 E417 L422 Q423 | L403-R419 HydrophobicContact CD2-CB 4.38Å; L403-R419 HydrophobicContact CD2-CG 3.91Å; S415-R419 WeakPolarHBondContact O-CB 3.22Å; S415-R419 PolarHBondContact O-N 2.79Å; E417-R419 VanDerWaalsContact C-N 3.25Å; E417-R419 PolarHBondContact O-N 3.45Å; R419-L422 PolarHBondContact O-N 2.97Å; R419-Q423 HydrophobicContact CG-CG 4.41Å; R419-Q423 WeakPolarHBondContact O-CB 3.5Å; R419-Q423 VanDerWaalsContact O-CG 3.31Å; R419-Q423 WeakPolarHBondContact O-CG 3.29Å; R419-Q423 PolarHBondContact O-N 3.33Å |
| 420 | R | 89.9 | Confident | 84.4 | Confident | 102 Ų | 102 | 73.5 Ų | 73.5 | 39% | 0.385 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.3 | -48.2 | 176.1 | -176.7 | -169.5 | 70.5 | -137.3 | -4.2 | 111.7 | A416 E417 Q423 N424 | A416-R420 PolarHBondContact O-N 3.05Å; E417-R420 WeakPolarHBondContact O-CB 3.44Å; E417-R420 PolarHBondContact O-N 3.31Å; E417-R420 VanDerWaalsContact O-N 3.11Å; E417-R420 IonicContact OE1-CZ 3.01Å; E417-R420 VanDerWaalsContact OE1-CZ 3.31Å; E417-R420 IonicContact OE1-NH1 2.79Å; E417-R420 PolarHBondContact OE1-NH1 3.38Å; E417-R420 IonicContact OE1-NH2 2.8Å; E417-R420 PolarHBondContact OE1-NH2 3.16Å; R420-Q423 PolarHBondContact O-N 3.11Å; R420-N424 VanDerWaalsContact O-CB 3.27Å; R420-N424 WeakPolarHBondContact O-CB 3.11Å; R420-N424 VanDerWaalsContact O-CG 3.24Å; R420-N424 PolarHBondContact O-N 2.78Å |
| 421 | E | 89.4 | Confident | 82.9 | Confident | 29 Ų | 29 | 77.6 Ų | 77.6 | 14% | 0.136 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.3 | -37.5 | -178.5 | -63.6 | -48.5 | 131.5 | 0 | 0 | 112.8 | A387 Q388 K391 E417 I418 | A387-E421 HydrophobicContact CB-CB 4.3Å; Q388-E421 HydrophobicContact CG-CG 4.18Å; K391-E421 HydrophobicContact CD-CB 4.36Å; K391-E421 VanDerWaalsContact CD-O 3.28Å; K391-E421 WeakPolarHBondContact CD-O 3.29Å; K391-E421 IonicContact NZ-OE2 3.14Å; K391-E421 PolarHBondContact NZ-OE2 3.11Å; E417-E421 WeakPolarHBondContact O-CG 3.31Å; E417-E421 PolarHBondContact O-N 2.83Å; I418-E421 PolarHBondContact O-N 3.01Å |
| 422 | L | 87.8 | Confident | 81.2 | Confident | 5 Ų | 5 | 81.9 Ų | 81.9 | 3% | 0.026 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -70.1 | -40.7 | 175.5 | -68.8 | 175.1 | 0 | 0 | 0 | 112.3 | A387 L394 K399 L402 L403 L406 I418 R419 S425 | A387-L422 HydrophobicContact CB-CD2 4.09Å; A387-L422 HydrophobicContact CB-CG 4.19Å; L394-L422 HydrophobicContact CD1-CD2 3.92Å; K399-L422 HydrophobicContact CG-CD2 4.37Å; L402-L422 HydrophobicContact CB-CD1 3.89Å; L402-L422 HydrophobicContact CD1-CD2 4.45Å; L403-L422 HydrophobicContact CD2-CB 4.34Å; L403-L422 HydrophobicContact CD2-CD1 4.27Å; L403-L422 HydrophobicContact CG-CD1 4.37Å; L406-L422 HydrophobicContact CD1-CD1 4.18Å; I418-L422 HydrophobicContact CG2-CD1 3.97Å; I418-L422 HydrophobicContact CG2-CG 4.34Å; I418-L422 WeakPolarHBondContact O-CB 3.38Å; I418-L422 WeakPolarHBondContact O-CG 3.43Å; I418-L422 PolarHBondContact O-N 2.8Å; R419-L422 PolarHBondContact O-N 2.97Å; L422-S425 PolarHBondContact O-OG 3.23Å |
| 423 | Q | 87.1 | Confident | 79 | Confident | 125 Ų | 125 | 80.6 Ų | 80.6 | 58% | 0.584 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -70.6 | -36.8 | 178.6 | -72.7 | -179.1 | -47.1 | 0 | 0 | 112.6 | R419 R420 S425 | R419-Q423 HydrophobicContact CG-CG 4.41Å; R419-Q423 WeakPolarHBondContact O-CB 3.5Å; R419-Q423 VanDerWaalsContact O-CG 3.31Å; R419-Q423 WeakPolarHBondContact O-CG 3.29Å; R419-Q423 PolarHBondContact O-N 3.33Å; R420-Q423 PolarHBondContact O-N 3.11Å; Q423-S425 PolarHBondContact O-N 2.64Å |
| 424 | N | 85.1 | Confident | 76.9 | Confident | 112 Ų | 112 | 81.1 Ų | 81.1 | 60% | 0.599 | 42% | 0.42 | S | S | * | . | S | Bend | trans | -84 | 45.7 | 178.2 | -63.1 | -4.1 | 0 | 0 | 0 | 111.7 | R420 | R420-N424 VanDerWaalsContact O-CB 3.27Å; R420-N424 WeakPolarHBondContact O-CB 3.11Å; R420-N424 VanDerWaalsContact O-CG 3.24Å; R420-N424 PolarHBondContact O-N 2.78Å |
| 425 | S | 80.4 | Confident | 74.7 | Confident | 26 Ų | 26 | 86.3 Ų | 86.3 | 18% | 0.182 | 46% | 0.455 | C | S | . | . | S | Bend | trans | -150.4 | 127.4 | -178.1 | 69.9 | 0 | 0 | 0 | 0 | 114.5 | K399 L422 Q423 | K399-S425 WeakPolarHBondContact CE-OG 3.35Å; K399-S425 PolarHBondContact NZ-O 3.31Å; K399-S425 PolarHBondContact NZ-OG 3.43Å; L422-S425 PolarHBondContact O-OG 3.23Å; Q423-S425 PolarHBondContact O-N 2.64Å |
| 426 | E | 77.6 | Confident | 72.5 | Confident | 171 Ų | 171 | 92.2 Ų | 92.2 | 80% | 0.799 | 49% | 0.491 | S | S | * | . | trans | -65.1 | 145.8 | 167.2 | -66.4 | 172.8 | 172.5 | 0 | 0 | 110 | K399 | K399-E426 PolarHBondContact NZ-O 2.92Š| ||
| 427 | S | 80.5 | Confident | 70.4 | Confident | 20 Ų | 20 | 95.5 Ų | 95.5 | 14% | 0.14 | 50% | 0.504 | C | S | . | . | trans | -103.1 | 138.8 | -172.5 | -52 | 0 | 0 | 0 | 0 | 110.2 | K399 D429 L430 | K399-S427 WeakPolarHBondContact CD-OG 3.39Å; K399-S427 WeakPolarHBondContact CE-OG 3.5Å; K399-S427 VanDerWaalsContact NZ-CA 3.33Å; K399-S427 PolarHBondContact NZ-OG 3.35Å; K399-S427 VanDerWaalsContact NZ-OG 3.07Å; S427-D429 PolarHBondContact O-N 3.24Å; S427-L430 WeakPolarHBondContact O-CB 3.33Å; S427-L430 PolarHBondContact O-N 2.94Å | ||
| 428 | R | 78.4 | Confident | 68.2 | Low | 88 Ų | 88 | 100.9 Ų | 100.9 | 33% | 0.332 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.9 | -36.6 | -174.4 | -174.7 | -162.7 | 61.7 | -152.8 | -9.1 | 114.1 | A392 D393 L394 L430 | A392-R428 PolarHBondContact O-N 3.47Å; D393-R428 PolarHBondContact O-NH1 2.99Å; L394-R428 PolarHBondContact O-N 3.04Å; R428-L430 VanDerWaalsContact C-N 3.26Å; R428-L430 PolarHBondContact O-N 2.95Å |
| 429 | D | 77.2 | Confident | 66.2 | Low | 69 Ų | 69 | 105 Ų | 105 | 37% | 0.369 | 57% | 0.565 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.1 | -0.2 | -177.2 | -7 | -72.4 | 0 | 0 | 0 | 113.6 | A395 S396 S427 E431 | A395-D429 WeakPolarHBondContact CA-OD1 3.25Å; A395-D429 WeakPolarHBondContact CA-OD2 3.33Å; A395-D429 WeakPolarHBondContact CB-OD1 3.37Å; A395-D429 WeakPolarHBondContact CB-OD2 3.32Å; S396-D429 PolarHBondContact N-OD2 3.32Å; S396-D429 PolarHBondContact OG-OD2 3.3Å; S427-D429 PolarHBondContact O-N 3.24Å; D429-E431 VanDerWaalsContact C-N 3.32Å; D429-E431 PolarHBondContact O-N 3.21Å |
| 430 | L | 64.4 | Low | 63.9 | Low | 123 Ų | 123 | 109 Ų | 109 | 64% | 0.644 | 59% | 0.591 | S | S | * | * | trans | -85.2 | 76.9 | 164.4 | -64.1 | 174.6 | 0 | 0 | 0 | 108.8 | S427 R428 T432 | S427-L430 WeakPolarHBondContact O-CB 3.33Å; S427-L430 PolarHBondContact O-N 2.94Å; R428-L430 VanDerWaalsContact C-N 3.26Å; R428-L430 PolarHBondContact O-N 2.95Å; L430-T432 PolarHBondContact O-N 3.09Å | ||
| 431 | E | 54 | Low | 61.7 | Low | 180 Ų | 180 | 115.2 Ų | 115.2 | 84% | 0.841 | 63% | 0.632 | S | S | * | * | trans | -55 | 125.7 | 166.7 | -67.9 | -170.5 | 151.6 | 0 | 0 | 109 | D429 A433 | D429-E431 VanDerWaalsContact C-N 3.32Å; D429-E431 PolarHBondContact O-N 3.21Å; E431-A433 PolarHBondContact O-N 3.26Å | ||
| 432 | T | 49.2 | Very low | 60.3 | Low | 135 Ų | 135 | 119.6 Ų | 119.6 | 83% | 0.828 | 66% | 0.657 | S | S | * | * | trans | -57.4 | 109.5 | 169 | 37.2 | 0 | 0 | 0 | 0 | 108.2 | L430 M434 | L430-T432 PolarHBondContact O-N 3.09Å; T432-M434 PolarHBondContact O-N 2.89Å; T432-M434 VanDerWaalsContact O-N 3.09Å | ||
| 433 | A | 37.1 | Very low | 58.9 | Low | 95 Ų | 95 | 125.6 Ų | 125.6 | 79% | 0.785 | 69% | 0.69 | S | S | * | * | trans | -48.8 | 120.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | E431 | E431-A433 PolarHBondContact O-N 3.26Š| ||
| 434 | M | 42.3 | Very low | 57.3 | Low | 167 Ų | 167 | 125.6 Ų | 125.6 | 82% | 0.823 | 70% | 0.696 | S | S | * | * | trans | -52 | 135.6 | -178.7 | -66.1 | 175.5 | 66.4 | 0 | 0 | 109.1 | T432 V436 | T432-M434 PolarHBondContact O-N 2.89Å; T432-M434 VanDerWaalsContact O-N 3.09Å; M434-V436 PolarHBondContact O-N 3.02Å | ||
| 435 | P | 43.4 | Very low | 55.7 | Low | 125 Ų | 125 | 126.4 Ų | 126.4 | 81% | 0.812 | 70% | 0.702 | S | S | * | * | trans | -57.3 | 115.8 | 177.8 | 24.2 | -32.9 | 0 | 0 | 0 | 108 | T437 | P435-T437 PolarHBondContact O-N 3.3Š| ||
| 436 | V | 42.7 | Very low | 54.2 | Low | 131 Ų | 131 | 132.7 Ų | 132.7 | 79% | 0.794 | 73% | 0.734 | S | S | * | * | trans | -52.1 | 127.4 | -172.6 | 175.4 | 0 | 0 | 0 | 0 | 108.5 | M434 M438 | M434-V436 PolarHBondContact O-N 3.02Å; V436-M438 PolarHBondContact O-N 3.26Å | ||
| 437 | T | 44 | Very low | 52.6 | Low | 130 Ų | 130 | 130.1 Ų | 130.1 | 80% | 0.798 | 73% | 0.73 | S | S | * | * | trans | -53.4 | 106.3 | 175.5 | 47.6 | 0 | 0 | 0 | 0 | 108.8 | P435 A439 | P435-T437 PolarHBondContact O-N 3.3Å; T437-A439 PolarHBondContact O-N 3.49Å | ||
| 438 | M | 42.8 | Very low | 50.6 | Low | 181 Ų | 181 | 138 Ų | 138 | 89% | 0.892 | 77% | 0.772 | S | S | * | * | trans | -62.6 | 111.5 | 171.9 | -77.6 | -173.2 | 166.1 | 0 | 0 | 107.5 | V436 M440 | V436-M438 PolarHBondContact O-N 3.26Å; M438-M440 PolarHBondContact O-N 3.29Å | ||
| 439 | A | 47.3 | Very low | 48.5 | Very low | 87 Ų | 87 | 141.8 Ų | 141.8 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | trans | -58.3 | 126.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | T437 | T437-A439 PolarHBondContact O-N 3.49Š| ||
| 440 | M | 42.3 | Very low | 46.1 | Very low | 188 Ų | 188 | 147.9 Ų | 147.9 | 93% | 0.926 | 84% | 0.842 | S | S | * | * | trans | -88.2 | 114.7 | 162.6 | -73.4 | -179.8 | 158.5 | 0 | 0 | 106.5 | M438 | M438-M440 PolarHBondContact O-N 3.29Š| ||
| 441 | D | 43.6 | Very low | 44.4 | Very low | 233 Ų | 233 | 150.2 Ų | 150.2 | 100% | 1.246 | 86% | 0.86 | S | S | * | * | trans | -69.5 | 0 | 165.6 | -65.5 | -49.1 | 0 | 0 | 0 | 111.1 |
Retrieved 441 of 441 residues in 271 ms
(Link to these results)