| 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 | 31.2 | Very low | 30.6 | Very low | 240 Ų | 240 | 151.7 Ų | 151.7 | 100% | 1.182 | 79% | 0.788 | S | S | * | * | 0 | 162.5 | 0 | -106.5 | 165.1 | 164.6 | 0 | 0 | 108.6 | |||||
| 2 | F | 32.1 | Very low | 30.5 | Very low | 212 Ų | 212 | 156.9 Ų | 156.9 | 93% | 0.93 | 79% | 0.79 | S | S | * | * | trans | -46.5 | 159 | -178.8 | -59.5 | -96.9 | 0 | 0 | 0 | 115.2 | ||||
| 3 | G | 31.3 | Very low | 30.6 | Very low | 67 Ų | 67 | 156 Ų | 156 | 69% | 0.691 | 80% | 0.797 | S | S | * | * | cis | 152.6 | 153.7 | -6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 4 | D | 34.6 | Very low | 30.2 | Very low | 136 Ų | 136 | 149.2 Ų | 149.2 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | 63.4 | 131.8 | 157.3 | -93.4 | 24.8 | 0 | 0 | 0 | 124.7 | ||||
| 5 | R | 31.8 | Very low | 29.8 | Very low | 176 Ų | 176 | 150.5 Ų | 150.5 | 66% | 0.664 | 79% | 0.791 | S | S | * | * | trans | 83.9 | 130.2 | 131.5 | -72.6 | 171.2 | -177.6 | -90.7 | -2.6 | 125 | ||||
| 6 | E | 32.9 | Very low | 30.5 | Very low | 159 Ų | 159 | 147.8 Ų | 147.8 | 74% | 0.743 | 79% | 0.785 | S | S | * | * | 50.5 | 144.9 | 124.9 | -57.4 | 163.3 | 146.3 | 0 | 0 | 120.8 | |||||
| 7 | G | 27.6 | Very low | 30.4 | Very low | 61 Ų | 61 | 148.3 Ų | 148.3 | 63% | 0.629 | 78% | 0.782 | S | S | * | * | cis | 168.4 | 170.3 | -4.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 8 | T | 28 | Very low | 30.4 | Very low | 135 Ų | 135 | 152.3 Ų | 152.3 | 83% | 0.828 | 78% | 0.784 | S | S | * | * | trans | 55.6 | 123.2 | 154.1 | 52.4 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 9 | V | 28.3 | Very low | 30.3 | Very low | 126 Ų | 126 | 148.9 Ų | 148.9 | 76% | 0.764 | 77% | 0.768 | S | S | * | * | 64.6 | 133.3 | 125.2 | -177.7 | 0 | 0 | 0 | 0 | 121 | |||||
| 10 | W | 30.1 | Very low | 30.1 | Very low | 253 Ų | 253 | 147.3 Ų | 147.3 | 96% | 0.958 | 77% | 0.769 | S | S | * | * | trans | -113.4 | 158.6 | 163.4 | -88.3 | 83.5 | 0 | 0 | 0 | 111.8 | ||||
| 11 | D | 28.5 | Very low | 30 | Very low | 104 Ų | 104 | 148.3 Ų | 148.3 | 56% | 0.556 | 77% | 0.772 | S | S | * | * | trans | -150.3 | 160.8 | -161.8 | 173.5 | 36.9 | 0 | 0 | 0 | 112.3 | ||||
| 12 | R | 30 | Very low | 29.7 | Very low | 214 Ų | 214 | 141.4 Ų | 141.4 | 81% | 0.808 | 75% | 0.746 | S | S | * | * | trans | 65.2 | 162 | 178.1 | -84.8 | 162.5 | -88.4 | -176.9 | -5.1 | 115.6 | ||||
| 13 | V | 31.3 | Very low | 29.5 | Very low | 145 Ų | 145 | 141 Ų | 141 | 88% | 0.879 | 74% | 0.74 | S | S | * | * | cis | -133.5 | 168.5 | 28.9 | -178.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 14 | G | 24.9 | Very low | 29.3 | Very low | 61 Ų | 61 | 146 Ų | 146 | 63% | 0.629 | 75% | 0.75 | S | S | * | * | trans | -160.6 | -159.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 15 | L | 24.1 | Very low | 29 | Very low | 168 Ų | 168 | 142.7 Ų | 142.7 | 88% | 0.88 | 75% | 0.748 | S | S | * | * | trans | 73.8 | 162.8 | -179.8 | -97.4 | 70.3 | 0 | 0 | 0 | 117 | ||||
| 16 | P | 41.7 | Very low | 29.2 | Very low | 107 Ų | 107 | 140.5 Ų | 140.5 | 70% | 0.695 | 76% | 0.757 | S | S | * | * | cis | -134.8 | 164.3 | -4.2 | 34.6 | -14.7 | 0 | 0 | 0 | 118.5 | ||||
| 17 | H | 29.2 | Very low | 29.5 | Very low | 157 Ų | 157 | 138.1 Ų | 138.1 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | 19.5 | 133.5 | 149.2 | -85.8 | -84.9 | 0 | 0 | 0 | 122.4 | D19 | H17-D19 IonicContact CE1-OD1 3.86Å; H17-D19 IonicContact CG-OD1 2.65Å; H17-D19 IonicContact ND1-OD1 3.63Å; H17-D19 PolarHBondContact ND1-OD1 2.59Å | ||
| 18 | R | 30.1 | Very low | 29.5 | Very low | 220 Ų | 220 | 140.8 Ų | 140.8 | 83% | 0.83 | 76% | 0.759 | S | S | * | * | -165.8 | 164.6 | 79.3 | -81.8 | -166.8 | 179.3 | -96.6 | 5.3 | 109.4 | |||||
| 19 | D | 27.6 | Very low | 29.4 | Very low | 89 Ų | 89 | 140.1 Ų | 140.1 | 48% | 0.476 | 76% | 0.755 | S | S | . | * | cis | -164.7 | -177.3 | -24 | -90.1 | -12.1 | 0 | 0 | 0 | 106.3 | H17 | H17-D19 IonicContact CE1-OD1 3.86Å; H17-D19 IonicContact CG-OD1 2.65Å; H17-D19 IonicContact ND1-OD1 3.63Å; H17-D19 PolarHBondContact ND1-OD1 2.59Å | ||
| 20 | C | 26 | Very low | 29.2 | Very low | 116 Ų | 116 | 142.1 Ų | 142.1 | 78% | 0.784 | 76% | 0.761 | S | S | * | * | cis | -157 | -163 | 18.3 | -150.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 21 | M | 28.1 | Very low | 29.1 | Very low | 168 Ų | 168 | 137.5 Ų | 137.5 | 83% | 0.828 | 75% | 0.754 | S | S | * | * | trans | -53.9 | 164.5 | 174.4 | -74.4 | -167.9 | 166.1 | 0 | 0 | 118 | ||||
| 22 | C | 26.2 | Very low | 29.9 | Very low | 96 Ų | 96 | 137.5 Ų | 137.5 | 65% | 0.649 | 76% | 0.76 | S | S | * | * | cis | -171.3 | 175.8 | -0.9 | -107.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 23 | Y | 26.6 | Very low | 29.7 | Very low | 204 Ų | 204 | 135.2 Ų | 135.2 | 80% | 0.8 | 76% | 0.762 | S | S | * | * | cis | -173.1 | 179.9 | -36.8 | -141.3 | -110.6 | 0 | 0 | 0 | 109.3 | ||||
| 24 | L | 27.4 | Very low | 29.3 | Very low | 170 Ų | 170 | 131 Ų | 131 | 89% | 0.89 | 75% | 0.748 | S | S | * | * | trans | 65.4 | 143.5 | -178 | -70.2 | 78 | 0 | 0 | 0 | 115.6 | ||||
| 25 | G | 27.9 | Very low | 29.3 | Very low | 68 Ų | 68 | 136.2 Ų | 136.2 | 70% | 0.701 | 76% | 0.758 | S | S | * | * | cis | 174.3 | 146 | -9.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 26 | P | 36.8 | Very low | 29.3 | Very low | 130 Ų | 130 | 139.2 Ų | 139.2 | 84% | 0.844 | 76% | 0.758 | S | S | * | * | trans | -86.6 | 177.4 | 171.9 | 39.4 | -37.4 | 0 | 0 | 0 | 111.4 | ||||
| 27 | P | 40.2 | Very low | 28.7 | Very low | 109 Ų | 109 | 144 Ų | 144 | 71% | 0.708 | 77% | 0.767 | S | S | * | * | cis | -145.3 | -162.4 | 19.8 | 40.4 | -17 | 0 | 0 | 0 | 117.2 | ||||
| 28 | T | 26 | Very low | 28.5 | Very low | 116 Ų | 116 | 141.9 Ų | 141.9 | 71% | 0.712 | 77% | 0.77 | S | S | * | * | trans | 80.8 | 124.1 | 149.2 | 37.2 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 29 | T | 26.3 | Very low | 28.7 | Very low | 121 Ų | 121 | 136.5 Ų | 136.5 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | 76.6 | 136.9 | 137.7 | 49.3 | 0 | 0 | 0 | 0 | 125 | ||||
| 30 | L | 24.9 | Very low | 29 | Very low | 168 Ų | 168 | 140 Ų | 140 | 88% | 0.88 | 78% | 0.782 | S | S | * | * | trans | 84.5 | 129.6 | 143.9 | -74.3 | 162.8 | 0 | 0 | 0 | 122.8 | ||||
| 31 | L | 27.1 | Very low | 29.2 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 82% | 0.817 | 78% | 0.783 | S | S | * | * | trans | -83.8 | 175.4 | 157.4 | -88.2 | 158.7 | 0 | 0 | 0 | 110 | ||||
| 32 | P | 46.1 | Very low | 29.4 | Very low | 104 Ų | 104 | 137.3 Ų | 137.3 | 68% | 0.675 | 78% | 0.776 | S | S | * | * | cis | -131.4 | -145.1 | -5.8 | 34.9 | -12.1 | 0 | 0 | 0 | 112.5 | ||||
| 33 | I | 24.8 | Very low | 30 | Very low | 167 Ų | 167 | 138.8 Ų | 138.8 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | trans | 82.9 | 139 | 173.9 | -50.7 | 168.4 | 0 | 0 | 0 | 113.4 | ||||
| 34 | G | 24.1 | Very low | 30.4 | Very low | 57 Ų | 57 | 140.2 Ų | 140.2 | 59% | 0.588 | 79% | 0.788 | S | S | * | * | cis | 155.4 | 169.4 | -6.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 35 | M | 24.2 | Very low | 30.8 | Very low | 170 Ų | 170 | 142.5 Ų | 142.5 | 84% | 0.837 | 79% | 0.785 | S | S | * | * | trans | 71 | 160.1 | -173.5 | -53.4 | -163.2 | -69.3 | 0 | 0 | 114.9 | ||||
| 36 | R | 24.7 | Very low | 31.2 | Very low | 231 Ų | 231 | 147.1 Ų | 147.1 | 87% | 0.872 | 79% | 0.793 | S | S | * | * | cis | -145.6 | 158.3 | 12.3 | -147.1 | 172.5 | -150.8 | -173.2 | 5.9 | 111 | ||||
| 37 | K | 28.6 | Very low | 31.7 | Very low | 207 Ų | 207 | 144.2 Ų | 144.2 | 90% | 0.9 | 78% | 0.775 | S | S | * | * | trans | -140.5 | 120.7 | -179.3 | -175.3 | -170 | -177 | -171.9 | 0 | 111.7 | ||||
| 38 | S | 25.8 | Very low | 31.9 | Very low | 112 Ų | 112 | 144.6 Ų | 144.6 | 78% | 0.783 | 77% | 0.771 | S | S | * | * | trans | 175.8 | 164.9 | 159.7 | -127 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 39 | P | 33.9 | Very low | 32.8 | Very low | 107 Ų | 107 | 144.7 Ų | 144.7 | 70% | 0.695 | 77% | 0.766 | S | S | * | * | cis | -120.9 | -177.2 | -12.4 | 33.6 | -15.4 | 0 | 0 | 0 | 112.5 | ||||
| 40 | D | 33.1 | Very low | 33.8 | Very low | 163 Ų | 163 | 142.9 Ų | 142.9 | 87% | 0.872 | 76% | 0.759 | S | S | * | * | trans | -63.6 | 139.2 | 175.4 | -59.6 | -87.8 | 0 | 0 | 0 | 113.5 | ||||
| 41 | V | 30.4 | Very low | 34.6 | Very low | 131 Ų | 131 | 138.9 Ų | 138.9 | 79% | 0.794 | 74% | 0.743 | S | S | * | * | trans | -130.2 | 119.2 | 165.6 | 179.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 42 | S | 32.6 | Very low | 35.1 | Very low | 97 Ų | 97 | 139.1 Ų | 139.1 | 68% | 0.678 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 144.8 | 177.1 | 48.5 | 0 | 0 | 0 | 0 | 111.4 | R44 | S42-R44 PolarHBondContact O-N 3.35Š|
| 43 | P | 37.6 | Very low | 34.8 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 83% | 0.825 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -68 | 118.7 | -177.4 | 26.5 | -33.7 | 0 | 0 | 0 | 111.1 | ||
| 44 | R | 35.7 | Very low | 35.6 | Very low | 233 Ų | 233 | 142 Ų | 142 | 88% | 0.879 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 144 | 171.5 | -66.6 | -176.6 | 178.1 | -180 | -1.5 | 110.1 | S42 | S42-R44 PolarHBondContact O-N 3.35Š|
| 45 | R | 36.5 | Very low | 36.2 | Very low | 218 Ų | 218 | 147.4 Ų | 147.4 | 82% | 0.823 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 152.7 | -179 | -74.8 | -169.9 | 172 | -148.6 | -0.6 | 111.8 | S47 | R45-S47 PolarHBondContact O-N 2.92Å; R45-S47 VanDerWaalsContact O-N 3.09Å |
| 46 | L | 36.6 | Very low | 36.8 | Very low | 165 Ų | 165 | 146.9 Ų | 146.9 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 11.6 | -175.1 | -148.2 | 77.6 | 0 | 0 | 0 | 114.6 | ||
| 47 | S | 46.1 | Very low | 37.4 | Very low | 69 Ų | 69 | 144.7 Ų | 144.7 | 48% | 0.483 | 74% | 0.742 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.2 | -35.1 | -176.6 | 34.7 | 0 | 0 | 0 | 0 | 113.4 | R45 I49 S50 | R45-S47 PolarHBondContact O-N 2.92Å; R45-S47 VanDerWaalsContact O-N 3.09Å; S47-I49 VanDerWaalsContact C-N 3.34Å; S47-I49 PolarHBondContact O-N 3.1Å; S47-S50 WeakPolarHBondContact O-CB 3.06Å; S47-S50 PolarHBondContact O-N 2.92Å; S47-S50 PolarHBondContact O-OG 3.36Å |
| 48 | D | 45 | Very low | 37.7 | Very low | 117 Ų | 117 | 144.7 Ų | 144.7 | 63% | 0.626 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -8.4 | -153.4 | -52.9 | -6.8 | 0 | 0 | 0 | 113.4 | ||
| 49 | I | 45.8 | Very low | 38.1 | Very low | 118 Ų | 118 | 146.8 Ų | 146.8 | 61% | 0.605 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | -13.1 | -179.8 | -55.9 | 176.1 | 0 | 0 | 0 | 111.6 | S47 | S47-I49 VanDerWaalsContact C-N 3.34Å; S47-I49 PolarHBondContact O-N 3.1Å |
| 50 | S | 45.7 | Very low | 38.1 | Very low | 84 Ų | 84 | 148.1 Ų | 148.1 | 59% | 0.587 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.8 | -25.9 | -176 | 62.7 | 0 | 0 | 0 | 0 | 118.1 | S47 | S47-S50 WeakPolarHBondContact O-CB 3.06Å; S47-S50 PolarHBondContact O-N 2.92Å; S47-S50 PolarHBondContact O-OG 3.36Å |
| 51 | P | 41.3 | Very low | 38.1 | Very low | 83 Ų | 83 | 146.4 Ų | 146.4 | 54% | 0.539 | 74% | 0.741 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80 | -33 | -178.6 | 27.4 | -30.4 | 0 | 0 | 0 | 114.2 | L53 R54 | P51-L53 PolarHBondContact O-N 2.8Å; P51-R54 PolarHBondContact O-N 3.13Å |
| 52 | Q | 39.1 | Very low | 38.1 | Very low | 161 Ų | 161 | 147.3 Ų | 147.3 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -74.2 | -30.3 | -169.5 | -70.9 | -162.8 | -49.5 | 0 | 0 | 114.2 | R54 | Q52-R54 PolarHBondContact O-N 3.26Å; Q52-R54 VanDerWaalsContact O-N 3.13Å |
| 53 | L | 39.8 | Very low | 38.2 | Very low | 139 Ų | 139 | 148.4 Ų | 148.4 | 73% | 0.728 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -63 | -18.1 | 174.1 | -101.6 | 79.5 | 0 | 0 | 0 | 113.4 | P51 | P51-L53 PolarHBondContact O-N 2.8Š|
| 54 | R | 41.1 | Very low | 37.9 | Very low | 194 Ų | 194 | 146 Ų | 146 | 73% | 0.732 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -81.2 | -23.7 | -172.8 | -159.3 | 174.9 | -65.2 | -136.6 | 2.3 | 113.7 | P51 Q52 | P51-R54 PolarHBondContact O-N 3.13Å; Q52-R54 PolarHBondContact O-N 3.26Å; Q52-R54 VanDerWaalsContact O-N 3.13Å |
| 55 | Q | 37.1 | Very low | 37.9 | Very low | 169 Ų | 169 | 141.7 Ų | 141.7 | 79% | 0.79 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -82.1 | -25.7 | 177.9 | -73.1 | -168.4 | -41 | 0 | 0 | 113.4 | K57 | Q55-K57 PolarHBondContact O-N 3.5Å; Q55-K57 VanDerWaalsContact O-N 3.1Å |
| 56 | L | 35.5 | Very low | 37.5 | Very low | 159 Ų | 159 | 137.8 Ų | 137.8 | 83% | 0.832 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -71.4 | 0.6 | 177.6 | -108.7 | 151.4 | 0 | 0 | 0 | 114.4 | ||
| 57 | K | 37.4 | Very low | 37.4 | Very low | 185 Ų | 185 | 137.3 Ų | 137.3 | 80% | 0.804 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -105.5 | 13.7 | -178.1 | -149.4 | -180 | -179 | 179.1 | 0 | 114 | Q55 | Q55-K57 PolarHBondContact O-N 3.5Å; Q55-K57 VanDerWaalsContact O-N 3.1Å |
| 58 | Y | 34.9 | Very low | 36.7 | Very low | 208 Ų | 208 | 141.4 Ų | 141.4 | 82% | 0.816 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -131.2 | 9.9 | -171.2 | -97.4 | -74.7 | 0 | 0 | 0 | 115.7 | ||
| 59 | L | 34.5 | Very low | 35.9 | Very low | 155 Ų | 155 | 142.5 Ų | 142.5 | 81% | 0.812 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -121.2 | 150.3 | 165.5 | -93.6 | 89 | 0 | 0 | 0 | 110.7 | ||
| 60 | V | 34.1 | Very low | 35.1 | Very low | 135 Ų | 135 | 145.6 Ų | 145.6 | 82% | 0.818 | 73% | 0.732 | S | S | * | * | trans | 61.7 | 65.8 | -176.8 | -161.3 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 61 | V | 33.4 | Very low | 34.4 | Very low | 128 Ų | 128 | 146.6 Ų | 146.6 | 78% | 0.776 | 74% | 0.739 | S | S | * | * | trans | -82.5 | 130.9 | 133.6 | 171 | 0 | 0 | 0 | 0 | 106.4 | E63 | V61-E63 HydrophobicContact CG1-CG 4.09Š| ||
| 62 | D | 29.8 | Very low | 33.8 | Very low | 150 Ų | 150 | 146.8 Ų | 146.8 | 80% | 0.802 | 74% | 0.743 | S | S | * | * | trans | -140.3 | 129.4 | 151.8 | -140.4 | -30.6 | 0 | 0 | 0 | 107.6 | ||||
| 63 | E | 35.3 | Very low | 33.3 | Very low | 119 Ų | 119 | 151 Ų | 151 | 56% | 0.556 | 75% | 0.752 | S | S | * | * | trans | -103.8 | 79 | -168.4 | -85.7 | -77.2 | 178.3 | 0 | 0 | 110.9 | V61 K66 | V61-E63 HydrophobicContact CG1-CG 4.09Å; E63-K66 WeakPolarHBondContact OE1-CD 3.5Å; E63-K66 IonicContact OE1-NZ 3.63Å; E63-K66 PolarHBondContact OE1-NZ 3.27Å; E63-K66 WeakPolarHBondContact OE2-CD 3.44Å; E63-K66 IonicContact OE2-NZ 2.76Å | ||
| 64 | A | 31.7 | Very low | 33.1 | Very low | 77 Ų | 77 | 148.2 Ų | 148.2 | 64% | 0.636 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -143.4 | 149.3 | 165 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 65 | I | 34.4 | Very low | 32.9 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 73% | 0.728 | 74% | 0.736 | S | S | * | * | S | Bend | trans | 65 | 53.3 | -178.7 | -37.5 | 171.4 | 0 | 0 | 0 | 113.3 | L69 | I65-L69 HydrophobicContact CG2-CD1 4.29Š|
| 66 | K | 29.8 | Very low | 33 | Very low | 136 Ų | 136 | 142.2 Ų | 142.2 | 59% | 0.591 | 73% | 0.731 | S | S | * | * | trans | -116.6 | -17.8 | 178.7 | -160.1 | 173.8 | -179.7 | -173.2 | 0 | 115.7 | E63 | E63-K66 WeakPolarHBondContact OE1-CD 3.5Å; E63-K66 IonicContact OE1-NZ 3.63Å; E63-K66 PolarHBondContact OE1-NZ 3.27Å; E63-K66 WeakPolarHBondContact OE2-CD 3.44Å; E63-K66 IonicContact OE2-NZ 2.76Å | ||
| 67 | E | 33.6 | Very low | 32.9 | Very low | 156 Ų | 156 | 140.4 Ų | 140.4 | 73% | 0.729 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -84.4 | -46.8 | 178.5 | -70.3 | -77 | 84.9 | 0 | 0 | 111.9 | ||
| 68 | D | 30.7 | Very low | 33.1 | Very low | 154 Ų | 154 | 137.1 Ų | 137.1 | 82% | 0.824 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -20.5 | -173.5 | -72.6 | -53.5 | 0 | 0 | 0 | 115.6 | K70 | D68-K70 VanDerWaalsContact C-N 3.29Å; D68-K70 PolarHBondContact O-N 3.35Å |
| 69 | L | 30 | Very low | 33.4 | Very low | 140 Ų | 140 | 132.4 Ų | 132.4 | 73% | 0.733 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | 14.9 | -178 | -120.2 | 87.9 | 0 | 0 | 0 | 114.7 | I65 S71 | I65-L69 HydrophobicContact CG2-CD1 4.29Å; L69-S71 PolarHBondContact O-N 3.11Å |
| 70 | K | 27.9 | Very low | 33.6 | Very low | 183 Ų | 183 | 128.2 Ų | 128.2 | 80% | 0.796 | 68% | 0.684 | S | S | * | * | trans | -74.5 | 20.3 | -177.1 | -148.9 | 169.8 | -173 | 169.5 | 0 | 114.5 | D68 | D68-K70 VanDerWaalsContact C-N 3.29Å; D68-K70 PolarHBondContact O-N 3.35Å | ||
| 71 | S | 30 | Very low | 34.3 | Very low | 105 Ų | 105 | 124.2 Ų | 124.2 | 73% | 0.734 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -133.1 | 44.9 | -169.2 | -170.5 | 0 | 0 | 0 | 0 | 114.5 | L69 | L69-S71 PolarHBondContact O-N 3.11Š|
| 72 | S | 29.1 | Very low | 35.2 | Very low | 87 Ų | 87 | 120.8 Ų | 120.8 | 61% | 0.608 | 65% | 0.647 | S | S | * | * | trans | -165.7 | 55.8 | 158.9 | -86.2 | 0 | 0 | 0 | 0 | 113.2 | S74 | S72-S74 PolarHBondContact O-N 3.04Š| ||
| 73 | R | 29.8 | Very low | 36.4 | Very low | 250 Ų | 250 | 118.4 Ų | 118.4 | 94% | 0.943 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | 53.4 | -177.3 | -156.5 | -177.6 | -168 | -173.1 | 4.1 | 113.6 | ||
| 74 | S | 34.5 | Very low | 37.1 | Very low | 81 Ų | 81 | 119.1 Ų | 119.1 | 57% | 0.566 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -149.1 | 2.6 | -172.3 | -172.3 | 0 | 0 | 0 | 0 | 114.6 | S72 I78 | S72-S74 PolarHBondContact O-N 3.04Å; S74-I78 WeakPolarHBondContact O-CD1 3.3Å |
| 75 | V | 37.7 | Very low | 38 | Very low | 92 Ų | 92 | 120.7 Ų | 120.7 | 56% | 0.558 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -107.1 | -46.4 | -169.4 | -176.1 | 0 | 0 | 0 | 0 | 113 | D77 I78 | V75-D77 PolarHBondContact O-N 3.48Å; V75-I78 PolarHBondContact O-N 2.85Å |
| 76 | E | 38.6 | Very low | 38.8 | Very low | 145 Ų | 145 | 122.2 Ų | 122.2 | 68% | 0.678 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -62.7 | -42.9 | -179.4 | -71.7 | 78.2 | -172.2 | 0 | 0 | 113.1 | I78 N79 S80 | E76-I78 PolarHBondContact O-N 3.08Å; E76-N79 PolarHBondContact O-N 3.27Å; E76-S80 PolarHBondContact O-N 2.68Å; E76-S80 PolarHBondContact O-OG 3.23Å |
| 77 | D | 33.9 | Very low | 40 | Very low | 120 Ų | 120 | 120.6 Ų | 120.6 | 64% | 0.642 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -63.2 | -22.3 | -178.2 | -73.5 | -33.1 | 0 | 0 | 0 | 113.4 | V75 A81 | V75-D77 PolarHBondContact O-N 3.48Å; D77-A81 WeakPolarHBondContact O-CB 3.26Å |
| 78 | I | 41.7 | Very low | 41.1 | Very low | 116 Ų | 116 | 116.9 Ų | 116.9 | 60% | 0.595 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -73.7 | -37.3 | 175.1 | -62.8 | 178.2 | 0 | 0 | 0 | 110.5 | S74 V75 E76 S82 | S74-I78 WeakPolarHBondContact O-CD1 3.3Å; V75-I78 PolarHBondContact O-N 2.85Å; E76-I78 PolarHBondContact O-N 3.08Å; I78-S82 WeakPolarHBondContact O-CB 3.29Å; I78-S82 PolarHBondContact O-N 2.85Å |
| 79 | N | 41.8 | Very low | 42.2 | Very low | 109 Ų | 109 | 117.2 Ų | 117.2 | 58% | 0.583 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -86.4 | -34.9 | -167.8 | -142.5 | 16.2 | 0 | 0 | 0 | 112.4 | E76 I83 | E76-N79 PolarHBondContact O-N 3.27Å; N79-I83 WeakPolarHBondContact O-CG1 3.49Å; N79-I83 PolarHBondContact O-N 3.44Å |
| 80 | S | 38.5 | Very low | 43.2 | Very low | 68 Ų | 68 | 117.4 Ų | 117.4 | 48% | 0.476 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.5 | -55.2 | 173.1 | 53.2 | 0 | 0 | 0 | 0 | 111.6 | E76 S82 I83 E84 | E76-S80 PolarHBondContact O-N 2.68Å; E76-S80 PolarHBondContact O-OG 3.23Å; S80-S82 VanDerWaalsContact C-N 3.29Å; S80-S82 PolarHBondContact O-N 3.21Å; S80-I83 PolarHBondContact O-N 3.4Å; S80-E84 PolarHBondContact O-N 2.71Å |
| 81 | A | 48.6 | Very low | 44.4 | Very low | 51 Ų | 51 | 113 Ų | 113 | 42% | 0.421 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -59.8 | -37.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | D77 I83 E84 E85 | D77-A81 WeakPolarHBondContact O-CB 3.26Å; A81-I83 PolarHBondContact O-N 3.02Å; A81-E84 PolarHBondContact O-N 3.12Å; A81-E85 WeakPolarHBondContact O-CB 3.35Å; A81-E85 PolarHBondContact O-N 3.19Å |
| 82 | S | 52.9 | Low | 44.7 | Very low | 55 Ų | 55 | 110.8 Ų | 110.8 | 39% | 0.385 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.8 | -40.3 | 176.8 | 175 | 0 | 0 | 0 | 0 | 113.2 | I78 S80 R86 | I78-S82 WeakPolarHBondContact O-CB 3.29Å; I78-S82 PolarHBondContact O-N 2.85Å; S80-S82 VanDerWaalsContact C-N 3.29Å; S80-S82 PolarHBondContact O-N 3.21Å; S82-R86 WeakPolarHBondContact O-CB 3.46Å; S82-R86 PolarHBondContact O-N 3.35Å |
| 83 | I | 52.9 | Low | 45.1 | Very low | 101 Ų | 101 | 115.4 Ų | 115.4 | 52% | 0.518 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -74.3 | -43.4 | 179.6 | -66 | 169.5 | 0 | 0 | 0 | 110.5 | N79 S80 A81 R86 I87 | N79-I83 WeakPolarHBondContact O-CG1 3.49Å; N79-I83 PolarHBondContact O-N 3.44Å; S80-I83 PolarHBondContact O-N 3.4Å; A81-I83 PolarHBondContact O-N 3.02Å; I83-R86 PolarHBondContact O-N 3.07Å; I83-R86 VanDerWaalsContact O-N 3.16Å; I83-I87 HydrophobicContact CG2-CD1 4.04Å; I83-I87 WeakPolarHBondContact O-CG1 3.09Å; I83-I87 PolarHBondContact O-N 3.41Å |
| 84 | E | 52 | Low | 45.5 | Very low | 133 Ų | 133 | 113 Ų | 113 | 62% | 0.621 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.8 | -45.1 | -179.3 | -163.7 | 168.5 | -151.4 | 0 | 0 | 111.9 | S80 A81 R86 I87 L88 | S80-E84 PolarHBondContact O-N 2.71Å; A81-E84 PolarHBondContact O-N 3.12Å; E84-R86 PolarHBondContact O-N 3.1Å; E84-I87 PolarHBondContact O-N 3.39Å; E84-L88 HydrophobicContact CG-CD1 4.07Å; E84-L88 WeakPolarHBondContact O-CB 3.39Å; E84-L88 WeakPolarHBondContact O-CG 3.41Å; E84-L88 PolarHBondContact O-N 3.28Å |
| 85 | E | 49.4 | Very low | 45.3 | Very low | 110 Ų | 110 | 112.1 Ų | 112.1 | 51% | 0.514 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -56.2 | -37.5 | 171 | -87.5 | -154.3 | 156.2 | 0 | 0 | 112.7 | A81 L88 R89 | A81-E85 WeakPolarHBondContact O-CB 3.35Å; A81-E85 PolarHBondContact O-N 3.19Å; E85-L88 PolarHBondContact O-N 2.98Å; E85-R89 WeakPolarHBondContact O-CB 3.21Å; E85-R89 WeakPolarHBondContact O-CG 3.44Å; E85-R89 PolarHBondContact O-N 2.85Å; E85-R89 PolarHBondContact O-NE 3.03Å; E85-R89 IonicContact OE2-CZ 2.65Å; E85-R89 IonicContact OE2-NE 2.96Å; E85-R89 IonicContact OE2-NH2 3.47Å; E85-R89 PolarHBondContact OE2-NH2 3Å |
| 86 | R | 52.3 | Low | 44.7 | Very low | 175 Ų | 175 | 116.1 Ų | 116.1 | 66% | 0.66 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -73.7 | -34.4 | -175.2 | -168.8 | 173 | 179.4 | -173.5 | -2.4 | 111.4 | S82 I83 E84 I90 | S82-R86 WeakPolarHBondContact O-CB 3.46Å; S82-R86 PolarHBondContact O-N 3.35Å; I83-R86 PolarHBondContact O-N 3.07Å; I83-R86 VanDerWaalsContact O-N 3.16Å; E84-R86 PolarHBondContact O-N 3.1Å; R86-I90 WeakPolarHBondContact O-CD1 3.38Å; R86-I90 WeakPolarHBondContact O-CG1 3.36Å; R86-I90 PolarHBondContact O-N 2.93Å |
| 87 | I | 55.2 | Low | 44 | Very low | 102 Ų | 102 | 117.6 Ų | 117.6 | 52% | 0.523 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -69 | -48.8 | 170.2 | -65.6 | 167.4 | 0 | 0 | 0 | 110 | I83 E84 R89 I90 T91 | I83-I87 HydrophobicContact CG2-CD1 4.04Å; I83-I87 WeakPolarHBondContact O-CG1 3.09Å; I83-I87 PolarHBondContact O-N 3.41Å; E84-I87 PolarHBondContact O-N 3.39Å; I87-R89 VanDerWaalsContact C-N 3.26Å; I87-R89 PolarHBondContact O-N 3.47Å; I87-I90 PolarHBondContact O-N 2.97Å; I87-T91 PolarHBondContact O-N 3.16Å; I87-T91 PolarHBondContact O-OG1 3.27Å |
| 88 | L | 56.7 | Low | 43.7 | Very low | 77 Ų | 77 | 115.8 Ų | 115.8 | 40% | 0.403 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -61.7 | -30.4 | 179.9 | -72.9 | 166.7 | 0 | 0 | 0 | 113.7 | E84 E85 T91 G92 Y93 | E84-L88 HydrophobicContact CG-CD1 4.07Å; E84-L88 WeakPolarHBondContact O-CB 3.39Å; E84-L88 WeakPolarHBondContact O-CG 3.41Å; E84-L88 PolarHBondContact O-N 3.28Å; E85-L88 PolarHBondContact O-N 2.98Å; L88-T91 WeakPolarHBondContact CA-OG1 3.48Å; L88-T91 PolarHBondContact O-OG1 3.37Å; L88-G92 PolarHBondContact O-N 3.18Å; L88-Y93 PolarHBondContact O-N 3.35Å; L88-Y93 VanDerWaalsContact O-N 3.12Å |
| 89 | R | 52.2 | Low | 42.9 | Very low | 161 Ų | 161 | 122.2 Ų | 122.2 | 61% | 0.608 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -74.4 | -29.5 | 172.3 | -80.7 | -175.6 | -94.2 | 147.3 | -12.4 | 113.6 | E85 I87 | E85-R89 WeakPolarHBondContact O-CB 3.21Å; E85-R89 WeakPolarHBondContact O-CG 3.44Å; E85-R89 PolarHBondContact O-N 2.85Å; E85-R89 PolarHBondContact O-NE 3.03Å; E85-R89 IonicContact OE2-CZ 2.65Å; E85-R89 IonicContact OE2-NE 2.96Å; E85-R89 IonicContact OE2-NH2 3.47Å; E85-R89 PolarHBondContact OE2-NH2 3Å; I87-R89 VanDerWaalsContact C-N 3.26Å; I87-R89 PolarHBondContact O-N 3.47Å |
| 90 | I | 51.2 | Low | 42.1 | Very low | 144 Ų | 144 | 122.2 Ų | 122.2 | 74% | 0.738 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -77.1 | -35.8 | 175.2 | -68.3 | 166.5 | 0 | 0 | 0 | 110.8 | R86 I87 G92 | R86-I90 WeakPolarHBondContact O-CD1 3.38Å; R86-I90 WeakPolarHBondContact O-CG1 3.36Å; R86-I90 PolarHBondContact O-N 2.93Å; I87-I90 PolarHBondContact O-N 2.97Å; I90-G92 PolarHBondContact O-N 3.42Å |
| 91 | T | 53.6 | Low | 41.6 | Very low | 90 Ų | 90 | 124.4 Ų | 124.4 | 55% | 0.552 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -0.3 | 174.6 | 59.1 | 0 | 0 | 0 | 0 | 113.9 | I87 L88 Y93 | I87-T91 PolarHBondContact O-N 3.16Å; I87-T91 PolarHBondContact O-OG1 3.27Å; L88-T91 WeakPolarHBondContact CA-OG1 3.48Å; L88-T91 PolarHBondContact O-OG1 3.37Å; T91-Y93 VanDerWaalsContact C-N 3.31Å; T91-Y93 PolarHBondContact O-N 2.81Å |
| 92 | G | 37.3 | Very low | 40.5 | Very low | 59 Ų | 59 | 126.8 Ų | 126.8 | 61% | 0.608 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70.2 | 19.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L88 I90 Y94 | L88-G92 PolarHBondContact O-N 3.18Å; I90-G92 PolarHBondContact O-N 3.42Å; G92-Y94 PolarHBondContact O-N 3.18Å; G92-Y94 VanDerWaalsContact O-N 3.13Å |
| 93 | Y | 36.7 | Very low | 39.4 | Very low | 185 Ų | 185 | 131.5 Ų | 131.5 | 73% | 0.725 | 65% | 0.651 | S | S | * | * | trans | -79.2 | 7 | -166.6 | -142.7 | -94.7 | 0 | 0 | 0 | 115.2 | L88 T91 | L88-Y93 PolarHBondContact O-N 3.35Å; L88-Y93 VanDerWaalsContact O-N 3.12Å; T91-Y93 VanDerWaalsContact C-N 3.31Å; T91-Y93 PolarHBondContact O-N 2.81Å | ||
| 94 | Y | 37.1 | Very low | 37.9 | Very low | 200 Ų | 200 | 135.7 Ų | 135.7 | 78% | 0.784 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -132.6 | 131.2 | 175.8 | -115.2 | -91.1 | 0 | 0 | 0 | 112.9 | G92 | G92-Y94 PolarHBondContact O-N 3.18Å; G92-Y94 VanDerWaalsContact O-N 3.13Å |
| 95 | G | 30.9 | Very low | 36.7 | Very low | 62 Ų | 62 | 139.7 Ų | 139.7 | 64% | 0.639 | 67% | 0.674 | S | S | * | * | trans | -67.3 | 142.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q97 | G95-Q97 PolarHBondContact O-N 2.89Å; G95-Q97 VanDerWaalsContact O-N 3.16Å | ||
| 96 | Y | 26.1 | Very low | 35.5 | Very low | 175 Ų | 175 | 140.8 Ų | 140.8 | 69% | 0.686 | 68% | 0.68 | S | S | * | * | trans | -58.2 | 110.4 | -174.5 | -168.2 | -90.8 | 0 | 0 | 0 | 113.1 | P98 | Y96-P98 HydrophobicContact CE1-CB 4.22Š| ||
| 97 | Q | 24.1 | Very low | 34.2 | Very low | 176 Ų | 176 | 140.2 Ų | 140.2 | 82% | 0.822 | 69% | 0.69 | S | S | * | * | trans | -102.3 | 122.6 | 162.2 | -81.1 | -166.9 | -38.7 | 0 | 0 | 109.8 | G95 | G95-Q97 PolarHBondContact O-N 2.89Å; G95-Q97 VanDerWaalsContact O-N 3.16Å | ||
| 98 | P | 27.3 | Very low | 32.8 | Very low | 83 Ų | 83 | 145.3 Ų | 145.3 | 54% | 0.539 | 70% | 0.702 | S | S | . | * | trans | -74.4 | 147.4 | 179.1 | 29.6 | -34 | 0 | 0 | 0 | 112 | Y96 S100 | Y96-P98 HydrophobicContact CE1-CB 4.22Å; P98-S100 VanDerWaalsContact C-N 3.31Å; P98-S100 PolarHBondContact O-N 3.23Å | ||
| 99 | W | 24.7 | Very low | 31.2 | Very low | 251 Ų | 251 | 147.3 Ų | 147.3 | 95% | 0.951 | 72% | 0.718 | S | S | * | * | trans | -74.5 | 76.4 | -174.8 | -163.8 | -77.1 | 0 | 0 | 0 | 111.9 | T101 | W99-T101 PolarHBondContact O-N 3.31Š| ||
| 100 | S | 25 | Very low | 29.9 | Very low | 109 Ų | 109 | 150.5 Ų | 150.5 | 76% | 0.762 | 73% | 0.73 | S | S | * | * | trans | -60.6 | 126.4 | 175.9 | 60.3 | 0 | 0 | 0 | 0 | 111.2 | P98 | P98-S100 VanDerWaalsContact C-N 3.31Å; P98-S100 PolarHBondContact O-N 3.23Å | ||
| 101 | T | 27.8 | Very low | 28.6 | Very low | 113 Ų | 113 | 152.5 Ų | 152.5 | 69% | 0.693 | 74% | 0.736 | S | S | * | * | trans | -67.1 | 137.3 | -177 | 42.7 | 0 | 0 | 0 | 0 | 111.3 | W99 Y103 | W99-T101 PolarHBondContact O-N 3.31Å; T101-Y103 VanDerWaalsContact C-N 3.31Å; T101-Y103 PolarHBondContact O-N 2.93Å | ||
| 102 | S | 25.6 | Very low | 27.2 | Very low | 102 Ų | 102 | 154.6 Ų | 154.6 | 71% | 0.713 | 74% | 0.744 | S | S | * | * | trans | -72.3 | 82 | -175.5 | -167.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 103 | Y | 28.6 | Very low | 26.6 | Very low | 154 Ų | 154 | 158.6 Ų | 158.6 | 60% | 0.604 | 76% | 0.756 | S | S | * | * | trans | -117.9 | 79.6 | 156.7 | -75.3 | -82.8 | 0 | 0 | 0 | 107.9 | T101 R105 | T101-Y103 VanDerWaalsContact C-N 3.31Å; T101-Y103 PolarHBondContact O-N 2.93Å; Y103-R105 PolarHBondContact O-N 3.36Å | ||
| 104 | K | 23 | Very low | 26.2 | Very low | 189 Ų | 189 | 156.2 Ų | 156.2 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | -58.7 | 107.9 | 169.5 | -83.4 | -172.9 | 174.1 | -178.6 | 0 | 108.8 | E106 | K104-E106 PolarHBondContact O-N 3.18Å; K104-E106 VanDerWaalsContact O-N 3.07Å | ||
| 105 | R | 25.8 | Very low | 25.5 | Very low | 216 Ų | 216 | 150.2 Ų | 150.2 | 82% | 0.815 | 76% | 0.76 | S | S | * | * | trans | -69.2 | 97.7 | 160.3 | 172.3 | 173.6 | -79.1 | 159.7 | -3.4 | 106.7 | Y103 | Y103-R105 PolarHBondContact O-N 3.36Š| ||
| 106 | E | 25.2 | Very low | 25.2 | Very low | 133 Ų | 133 | 153.1 Ų | 153.1 | 62% | 0.621 | 77% | 0.77 | S | S | * | * | trans | -55.2 | 147.3 | 170.5 | -72.1 | 166.8 | 140.4 | 0 | 0 | 110.1 | K104 K344 | K104-E106 PolarHBondContact O-N 3.18Å; K104-E106 VanDerWaalsContact O-N 3.07Å; E106-K344 IonicContact OE1-NZ 2.59Å; E106-K344 PolarHBondContact OE1-NZ 3.19Å; E106-K344 IonicContact OE2-NZ 3.71Å; E106-K344 PolarHBondContact OE2-NZ 3.19Å | ||
| 107 | D | 24.2 | Very low | 25.1 | Very low | 163 Ų | 163 | 150.4 Ų | 150.4 | 87% | 0.872 | 77% | 0.772 | S | S | * | * | trans | -62.4 | 151.4 | -160.7 | -71.8 | -80.3 | 0 | 0 | 0 | 115.1 | ||||
| 108 | R | 24.7 | Very low | 25.2 | Very low | 210 Ų | 210 | 149.1 Ų | 149.1 | 79% | 0.792 | 77% | 0.771 | S | S | * | * | trans | -108.6 | 94 | 163.9 | -125.6 | -178.3 | 178.9 | -148 | -8.7 | 109.9 | ||||
| 109 | T | 24.3 | Very low | 25.1 | Very low | 118 Ų | 118 | 149.2 Ų | 149.2 | 72% | 0.724 | 78% | 0.779 | S | S | * | * | trans | 25.5 | 116.3 | 153 | -39.1 | 0 | 0 | 0 | 0 | 117.5 | E111 | T109-E111 PolarHBondContact O-N 2.87Š| ||
| 110 | R | 24.8 | Very low | 25.1 | Very low | 229 Ų | 229 | 146.5 Ų | 146.5 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -58.6 | 119 | 157.6 | -79.6 | 172.3 | 153.4 | 146.6 | -10.7 | 109.7 | ||||
| 111 | E | 24.1 | Very low | 25.1 | Very low | 185 Ų | 185 | 147.2 Ų | 147.2 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | trans | -90.1 | 113.5 | 155.7 | -73.4 | -178.1 | 149 | 0 | 0 | 108.1 | T109 | T109-E111 PolarHBondContact O-N 2.87Š| ||
| 112 | N | 23.9 | Very low | 25 | Very low | 135 Ų | 135 | 146.6 Ų | 146.6 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | trans | -82.2 | 123.4 | 172.5 | -62.4 | -33.6 | 0 | 0 | 0 | 108.4 | ||||
| 113 | V | 25.8 | Very low | 24.9 | Very low | 142 Ų | 142 | 148 Ų | 148 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | trans | -104.3 | 106.7 | 161.2 | 179.2 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 114 | V | 27.1 | Very low | 25.1 | Very low | 136 Ų | 136 | 145.1 Ų | 145.1 | 82% | 0.824 | 81% | 0.806 | S | S | * | * | trans | -69.1 | 139.1 | 170.7 | 177.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 115 | G | 22.4 | Very low | 25.3 | Very low | 74 Ų | 74 | 141 Ų | 141 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | trans | -85.2 | 175 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 116 | S | 24.6 | Very low | 25.4 | Very low | 122 Ų | 122 | 135 Ų | 135 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -137.2 | 121.7 | 167.1 | 56 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 117 | T | 25.2 | Very low | 25.7 | Very low | 119 Ų | 119 | 131.6 Ų | 131.6 | 73% | 0.73 | 81% | 0.813 | S | S | * | * | trans | -97.4 | 151.1 | 176.1 | 52.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 118 | D | 24.2 | Very low | 26.1 | Very low | 148 Ų | 148 | 132.9 Ų | 132.9 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | 168.8 | 163 | 112.1 | -82.1 | -18.3 | 0 | 0 | 0 | 112.9 | |||||
| 119 | A | 25.2 | Very low | 26.6 | Very low | 86 Ų | 86 | 127.4 Ų | 127.4 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | 49.1 | 117.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 120 | Q | 26 | Very low | 27.1 | Very low | 194 Ų | 194 | 124 Ų | 124 | 91% | 0.907 | 80% | 0.796 | S | S | * | * | 59.5 | 139.2 | 76.4 | -62.7 | -174.4 | 4.7 | 0 | 0 | 114 | |||||
| 121 | S | 23.9 | Very low | 27.8 | Very low | 123 Ų | 123 | 118 Ų | 118 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | cis | -142.2 | -172.2 | 20.7 | 63.8 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 122 | A | 27.4 | Very low | 28.5 | Very low | 101 Ų | 101 | 113 Ų | 113 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | trans | -87.7 | 154 | -162.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 123 | S | 23.5 | Very low | 29.5 | Very low | 130 Ų | 130 | 116.4 Ų | 116.4 | 91% | 0.909 | 77% | 0.773 | S | S | * | * | trans | -158.3 | 164.9 | 136.6 | -167.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 124 | A | 31.8 | Very low | 30.3 | Very low | 95 Ų | 95 | 119.7 Ų | 119.7 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | trans | -125.5 | 133.4 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 125 | A | 26.9 | Very low | 31.1 | Very low | 103 Ų | 103 | 122.5 Ų | 122.5 | 85% | 0.851 | 77% | 0.765 | S | S | * | * | trans | -179.9 | 134.2 | 148.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 126 | G | 29 | Very low | 32.1 | Very low | 88 Ų | 88 | 124.6 Ų | 124.6 | 91% | 0.907 | 76% | 0.759 | S | S | * | * | trans | 72.3 | 137.6 | 150.3 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 127 | G | 30.3 | Very low | 32.9 | Very low | 62 Ų | 62 | 124.8 Ų | 124.8 | 64% | 0.639 | 75% | 0.746 | S | S | * | * | trans | 121.1 | 71.1 | 153.5 | 0 | 0 | 0 | 0 | 0 | 118 | S129 | G127-S129 PolarHBondContact O-N 3.41Š| ||
| 128 | E | 33.5 | Very low | 33.8 | Very low | 191 Ų | 191 | 122.9 Ų | 122.9 | 89% | 0.893 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | 0.7 | 174.2 | -64.8 | -169.8 | 100.6 | 0 | 0 | 115.1 | T131 | E128-T131 PolarHBondContact O-OG1 2.78Š|
| 129 | S | 34.2 | Very low | 35 | Very low | 95 Ų | 95 | 119.7 Ų | 119.7 | 66% | 0.664 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -75.4 | -22.3 | -177.5 | 64.5 | 0 | 0 | 0 | 0 | 114.6 | G127 T131 R133 | G127-S129 PolarHBondContact O-N 3.41Å; S129-T131 PolarHBondContact O-N 3.03Å; S129-R133 PolarHBondContact O-N 2.75Å |
| 130 | G | 35.6 | Very low | 36.4 | Very low | 46 Ų | 46 | 119.4 Ų | 119.4 | 47% | 0.474 | 71% | 0.714 | S | S | . | * | H | α-helix | trans | -68.5 | -35.6 | -172 | 0 | 0 | 0 | 0 | 0 | 114.9 | R134 | G130-R134 PolarHBondContact O-N 2.72Å |
| 131 | T | 38.6 | Very low | 37.7 | Very low | 102 Ų | 102 | 118.7 Ų | 118.7 | 63% | 0.626 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -71 | -42 | -176.8 | 53.6 | 0 | 0 | 0 | 0 | 112.1 | E128 S129 R134 R135 | E128-T131 PolarHBondContact O-OG1 2.78Å; S129-T131 PolarHBondContact O-N 3.03Å; T131-R134 PolarHBondContact O-N 2.77Å; T131-R135 PolarHBondContact O-N 3.32Å |
| 132 | S | 39.6 | Very low | 39.3 | Very low | 81 Ų | 81 | 116.5 Ų | 116.5 | 57% | 0.566 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -62.1 | -47.4 | 176.7 | -174.3 | 0 | 0 | 0 | 0 | 111.3 | R134 R135 L136 | S132-R134 VanDerWaalsContact C-N 3.33Å; S132-R134 PolarHBondContact O-N 3.24Å; S132-R135 PolarHBondContact O-N 3.41Å; S132-R135 VanDerWaalsContact O-N 3.15Å; S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 PolarHBondContact O-N 3.2Å |
| 133 | R | 44.7 | Very low | 41 | Very low | 206 Ų | 206 | 115.1 Ų | 115.1 | 78% | 0.777 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -61.7 | -38.3 | 179.1 | -150.8 | 174.8 | -169.5 | -177.7 | 3.5 | 112.2 | S129 H137 | S129-R133 PolarHBondContact O-N 2.75Å; R133-H137 WeakPolarHBondContact O-CB 3.47Å; R133-H137 PolarHBondContact O-N 3.31Å |
| 134 | R | 42.8 | Very low | 43.1 | Very low | 212 Ų | 212 | 111.6 Ų | 111.6 | 80% | 0.8 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66.2 | -42.6 | 173.3 | -111 | -179.1 | 178.3 | 179.3 | 0.6 | 112.8 | G130 T131 S132 C138 | G130-R134 PolarHBondContact O-N 2.72Å; T131-R134 PolarHBondContact O-N 2.77Å; S132-R134 VanDerWaalsContact C-N 3.33Å; S132-R134 PolarHBondContact O-N 3.24Å; R134-C138 WeakPolarHBondContact O-CB 3.21Å; R134-C138 PolarHBondContact O-N 2.94Å; R134-C138 VanDerWaalsContact O-N 3.07Å |
| 135 | R | 42.7 | Very low | 45 | Very low | 194 Ų | 194 | 110.8 Ų | 110.8 | 73% | 0.732 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -63.2 | -47.4 | 175 | -73.7 | -173.1 | -175.3 | -163.9 | 3.8 | 111.4 | T131 S132 H137 C138 C139 | T131-R135 PolarHBondContact O-N 3.32Å; S132-R135 PolarHBondContact O-N 3.41Å; S132-R135 VanDerWaalsContact O-N 3.15Å; R135-H137 PolarHBondContact O-N 3.09Å; R135-C138 WeakPolarHBondContact O-CB 3.2Å; R135-C138 PolarHBondContact O-N 3.17Å; R135-C138 VanDerWaalsContact O-N 3.13Å; R135-C139 PolarHBondContact O-N 3.26Å; R135-C139 PolarHBondContact O-SG 3.08Å; R135-C139 VanDerWaalsContact O-SG 3.39Å |
| 136 | L | 44.1 | Very low | 47.3 | Very low | 119 Ų | 119 | 111.4 Ų | 111.4 | 62% | 0.623 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -58.4 | -47.3 | 178.6 | -163.9 | 76.8 | 0 | 0 | 0 | 111.3 | S132 C138 C139 V140 | S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 PolarHBondContact O-N 3.2Å; L136-C138 VanDerWaalsContact C-N 3.26Å; L136-C138 PolarHBondContact O-N 2.96Å; L136-C139 PolarHBondContact O-N 3.18Å; L136-V140 WeakPolarHBondContact O-CB 3.41Å; L136-V140 VanDerWaalsContact O-CG2 3.29Å; L136-V140 WeakPolarHBondContact O-CG2 3.11Å; L136-V140 PolarHBondContact O-N 3.33Å |
| 137 | H | 41.7 | Very low | 49.8 | Very low | 125 Ų | 125 | 111.8 Ų | 111.8 | 58% | 0.579 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.6 | -26.7 | 178.8 | -157 | -41.4 | 0 | 0 | 0 | 113.2 | R133 R135 R141 | R133-H137 WeakPolarHBondContact O-CB 3.47Å; R133-H137 PolarHBondContact O-N 3.31Å; R135-H137 PolarHBondContact O-N 3.09Å; H137-R141 WeakPolarHBondContact O-CB 3.36Å; H137-R141 PolarHBondContact O-N 3.32Å; H137-R141 VanDerWaalsContact O-N 3.14Å |
| 138 | C | 44.1 | Very low | 52.1 | Low | 79 Ų | 79 | 117.3 Ų | 117.3 | 53% | 0.534 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -75 | -47.8 | 172.5 | -161.1 | 0 | 0 | 0 | 0 | 111.4 | R134 R135 L136 V140 R141 V142 | R134-C138 WeakPolarHBondContact O-CB 3.21Å; R134-C138 PolarHBondContact O-N 2.94Å; R134-C138 VanDerWaalsContact O-N 3.07Å; R135-C138 WeakPolarHBondContact O-CB 3.2Å; R135-C138 PolarHBondContact O-N 3.17Å; R135-C138 VanDerWaalsContact O-N 3.13Å; L136-C138 VanDerWaalsContact C-N 3.26Å; L136-C138 PolarHBondContact O-N 2.96Å; C138-V140 VanDerWaalsContact C-N 3.33Å; C138-V140 PolarHBondContact O-N 2.97Å; C138-R141 WeakPolarHBondContact O-CB 3.41Å; C138-R141 PolarHBondContact O-N 2.88Å; C138-R141 VanDerWaalsContact O-N 3.1Å; C138-V142 WeakPolarHBondContact O-CG2 3.48Å; C138-V142 PolarHBondContact O-N 3.31Å |
| 139 | C | 49.1 | Very low | 54.4 | Low | 81 Ų | 81 | 115.3 Ų | 115.3 | 55% | 0.547 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -58.8 | -42.8 | 175 | -67.8 | 0 | 0 | 0 | 0 | 112 | R135 L136 V142 T143 | R135-C139 PolarHBondContact O-N 3.26Å; R135-C139 PolarHBondContact O-SG 3.08Å; R135-C139 VanDerWaalsContact O-SG 3.39Å; L136-C139 PolarHBondContact O-N 3.18Å; C139-V142 PolarHBondContact O-N 2.85Å; C139-V142 VanDerWaalsContact O-N 3.13Å; C139-T143 PolarHBondContact O-N 3.48Å; C139-T143 PolarHBondContact O-OG1 3.16Å |
| 140 | V | 55.2 | Low | 56.7 | Low | 81 Ų | 81 | 113.7 Ų | 113.7 | 49% | 0.491 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.9 | -36 | 174.8 | 170.6 | 0 | 0 | 0 | 0 | 111.9 | L136 C138 T143 A144 | L136-V140 WeakPolarHBondContact O-CB 3.41Å; L136-V140 VanDerWaalsContact O-CG2 3.29Å; L136-V140 WeakPolarHBondContact O-CG2 3.11Å; L136-V140 PolarHBondContact O-N 3.33Å; C138-V140 VanDerWaalsContact C-N 3.33Å; C138-V140 PolarHBondContact O-N 2.97Å; V140-T143 WeakPolarHBondContact CA-OG1 3.28Å; V140-T143 PolarHBondContact O-OG1 3.42Å; V140-A144 WeakPolarHBondContact O-CB 3.45Å; V140-A144 PolarHBondContact O-N 2.98Å |
| 141 | R | 52.3 | Low | 59.1 | Low | 178 Ų | 178 | 116.9 Ų | 116.9 | 67% | 0.672 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.8 | -38.9 | 170 | -93.8 | -174.2 | 169 | -173.6 | -2.2 | 112 | H137 C138 A144 V145 | H137-R141 WeakPolarHBondContact O-CB 3.36Å; H137-R141 PolarHBondContact O-N 3.32Å; H137-R141 VanDerWaalsContact O-N 3.14Å; C138-R141 WeakPolarHBondContact O-CB 3.41Å; C138-R141 PolarHBondContact O-N 2.88Å; C138-R141 VanDerWaalsContact O-N 3.1Å; R141-A144 PolarHBondContact O-N 3.47Å; R141-V145 WeakPolarHBondContact O-CB 3.24Å; R141-V145 VanDerWaalsContact O-CG2 3.28Å; R141-V145 WeakPolarHBondContact O-CG2 3.22Å; R141-V145 PolarHBondContact O-N 3.36Å |
| 142 | V | 58.2 | Low | 61.4 | Low | 77 Ų | 77 | 119.4 Ų | 119.4 | 47% | 0.467 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.4 | -47.3 | 178 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | C138 C139 V145 Q146 | C138-V142 WeakPolarHBondContact O-CG2 3.48Å; C138-V142 PolarHBondContact O-N 3.31Å; C139-V142 PolarHBondContact O-N 2.85Å; C139-V142 VanDerWaalsContact O-N 3.13Å; V142-V145 PolarHBondContact O-N 3.17Å; V142-Q146 WeakPolarHBondContact O-CG 3.27Å; V142-Q146 PolarHBondContact O-N 2.8Å |
| 143 | T | 62.8 | Low | 63.6 | Low | 73 Ų | 73 | 116 Ų | 116 | 45% | 0.448 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65 | -40.7 | 174.1 | 43.4 | 0 | 0 | 0 | 0 | 111.8 | C139 V140 V145 Q146 V147 | C139-T143 PolarHBondContact O-N 3.48Å; C139-T143 PolarHBondContact O-OG1 3.16Å; V140-T143 WeakPolarHBondContact CA-OG1 3.28Å; V140-T143 PolarHBondContact O-OG1 3.42Å; T143-V145 VanDerWaalsContact C-N 3.32Å; T143-V145 PolarHBondContact O-N 3.09Å; T143-Q146 PolarHBondContact O-N 3.26Å; T143-Q146 VanDerWaalsContact O-N 3.17Å; T143-V147 WeakPolarHBondContact O-CB 3.1Å; T143-V147 VanDerWaalsContact O-CG2 3.3Å; T143-V147 WeakPolarHBondContact O-CG2 3.44Å; T143-V147 PolarHBondContact O-N 3.43Å |
| 144 | A | 67.1 | Low | 65.7 | Low | 55 Ų | 55 | 110.4 Ų | 110.4 | 46% | 0.455 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.8 | -38.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V140 R141 R148 | V140-A144 WeakPolarHBondContact O-CB 3.45Å; V140-A144 PolarHBondContact O-N 2.98Å; R141-A144 PolarHBondContact O-N 3.47Å; A144-R148 VanDerWaalsContact O-CB 3.23Å; A144-R148 WeakPolarHBondContact O-CB 3.47Å; A144-R148 PolarHBondContact O-N 3.49Å |
| 145 | V | 73 | Confident | 68.1 | Low | 78 Ų | 78 | 102.4 Ų | 102.4 | 47% | 0.473 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -70.4 | -36.5 | 174.6 | 168.6 | 0 | 0 | 0 | 0 | 111.9 | R141 V142 T143 K149 | R141-V145 WeakPolarHBondContact O-CB 3.24Å; R141-V145 VanDerWaalsContact O-CG2 3.28Å; R141-V145 WeakPolarHBondContact O-CG2 3.22Å; R141-V145 PolarHBondContact O-N 3.36Å; V142-V145 PolarHBondContact O-N 3.17Å; T143-V145 VanDerWaalsContact C-N 3.32Å; T143-V145 PolarHBondContact O-N 3.09Å; V145-K149 WeakPolarHBondContact O-CG 3.33Å; V145-K149 PolarHBondContact O-N 3.33Å |
| 146 | Q | 75.7 | Confident | 70.4 | Confident | 117 Ų | 117 | 94.2 Ų | 94.2 | 55% | 0.547 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.1 | -46.6 | 174.4 | -73.6 | 171.6 | -16.3 | 0 | 0 | 111.7 | V142 T143 R148 K149 A150 | V142-Q146 WeakPolarHBondContact O-CG 3.27Å; V142-Q146 PolarHBondContact O-N 2.8Å; T143-Q146 PolarHBondContact O-N 3.26Å; T143-Q146 VanDerWaalsContact O-N 3.17Å; Q146-R148 PolarHBondContact O-N 2.99Å; Q146-K149 WeakPolarHBondContact O-CB 3Å; Q146-K149 PolarHBondContact O-N 2.96Å; Q146-K149 VanDerWaalsContact O-N 3.17Å; Q146-A150 PolarHBondContact O-N 2.95Å |
| 147 | V | 80.2 | Confident | 72.7 | Confident | 96 Ų | 96 | 89.2 Ų | 89.2 | 58% | 0.582 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60.7 | -42.9 | 174.5 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | T143 K149 A150 L151 | T143-V147 WeakPolarHBondContact O-CB 3.1Å; T143-V147 VanDerWaalsContact O-CG2 3.3Å; T143-V147 WeakPolarHBondContact O-CG2 3.44Å; T143-V147 PolarHBondContact O-N 3.43Å; V147-K149 VanDerWaalsContact C-N 3.33Å; V147-K149 PolarHBondContact O-N 3.21Å; V147-A150 PolarHBondContact O-N 3.44Å; V147-L151 VanDerWaalsContact O-CB 3.32Å; V147-L151 WeakPolarHBondContact O-CB 3.41Å; V147-L151 PolarHBondContact O-N 3.46Å |
| 148 | R | 80 | Confident | 75.1 | Confident | 177 Ų | 177 | 88.7 Ų | 88.7 | 67% | 0.668 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.6 | -38.8 | 174.9 | -171.3 | 174.9 | -176.9 | -175.2 | 1.7 | 112.2 | A144 Q146 W152 | A144-R148 VanDerWaalsContact O-CB 3.23Å; A144-R148 WeakPolarHBondContact O-CB 3.47Å; A144-R148 PolarHBondContact O-N 3.49Å; Q146-R148 PolarHBondContact O-N 2.99Å; R148-W152 VanDerWaalsContact O-CD1 3.31Å; R148-W152 PolarHBondContact O-N 2.87Å; R148-W152 VanDerWaalsContact O-N 3.1Å |
| 149 | K | 80.9 | Confident | 77.5 | Confident | 150 Ų | 150 | 87.8 Ų | 87.8 | 65% | 0.652 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -67.2 | -42.1 | 173.7 | -74.8 | 173.4 | 179.4 | -179.7 | 0 | 112.2 | V145 Q146 V147 W152 G153 | V145-K149 WeakPolarHBondContact O-CG 3.33Å; V145-K149 PolarHBondContact O-N 3.33Å; Q146-K149 WeakPolarHBondContact O-CB 3Å; Q146-K149 PolarHBondContact O-N 2.96Å; Q146-K149 VanDerWaalsContact O-N 3.17Å; V147-K149 VanDerWaalsContact C-N 3.33Å; V147-K149 PolarHBondContact O-N 3.21Å; K149-W152 PolarHBondContact O-N 3.12Å; K149-G153 PolarHBondContact O-N 2.93Å |
| 150 | A | 81.6 | Confident | 79.7 | Confident | 60 Ų | 60 | 84 Ų | 84 | 50% | 0.496 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q146 V147 W152 G153 V154 | Q146-A150 PolarHBondContact O-N 2.95Å; V147-A150 PolarHBondContact O-N 3.44Å; A150-W152 PolarHBondContact O-N 3.25Å; A150-G153 CarbonylContact O-C 3.55Å; A150-G153 WeakPolarHBondContact O-CA 3.39Å; A150-G153 PolarHBondContact O-N 3.28Å; A150-V154 WeakPolarHBondContact O-CG2 3.46Å; A150-V154 PolarHBondContact O-N 2.8Å |
| 151 | L | 87.6 | Confident | 81.5 | Confident | 114 Ų | 114 | 80.4 Ų | 80.4 | 60% | 0.597 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -59.6 | -43.2 | 176 | -175.4 | 66.8 | 0 | 0 | 0 | 111.9 | V147 G153 V154 A155 | V147-L151 VanDerWaalsContact O-CB 3.32Å; V147-L151 WeakPolarHBondContact O-CB 3.41Å; V147-L151 PolarHBondContact O-N 3.46Å; L151-G153 VanDerWaalsContact C-N 3.32Å; L151-G153 PolarHBondContact O-N 3.39Å; L151-V154 PolarHBondContact O-N 2.83Å; L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.44Å |
| 152 | W | 85.9 | Confident | 83.5 | Confident | 155 Ų | 155 | 75.1 Ų | 75.1 | 59% | 0.587 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63.6 | -35.7 | 172.2 | -92.5 | 93.7 | 0 | 0 | 0 | 112.9 | R148 K149 A150 M156 | R148-W152 VanDerWaalsContact O-CD1 3.31Å; R148-W152 PolarHBondContact O-N 2.87Å; R148-W152 VanDerWaalsContact O-N 3.1Å; K149-W152 PolarHBondContact O-N 3.12Å; A150-W152 PolarHBondContact O-N 3.25Å; W152-M156 VanDerWaalsContact O-CB 3.29Å; W152-M156 WeakPolarHBondContact O-CB 3.41Å; W152-M156 PolarHBondContact O-N 3.1Å |
| 153 | G | 86.3 | Confident | 85.3 | Confident | 8 Ų | 8 | 72 Ų | 72 | 8% | 0.082 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.6 | -46.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | K149 A150 L151 M156 V157 | K149-G153 PolarHBondContact O-N 2.93Å; A150-G153 CarbonylContact O-C 3.55Å; A150-G153 WeakPolarHBondContact O-CA 3.39Å; A150-G153 PolarHBondContact O-N 3.28Å; L151-G153 VanDerWaalsContact C-N 3.32Å; L151-G153 PolarHBondContact O-N 3.39Å; G153-M156 WeakPolarHBondContact O-CB 3.19Å; G153-M156 PolarHBondContact O-N 3.4Å; G153-V157 WeakPolarHBondContact O-CG2 3.33Å; G153-V157 PolarHBondContact O-N 3.39Å |
| 154 | V | 89.4 | Confident | 86.9 | Confident | 90 Ų | 90 | 69 Ų | 69 | 55% | 0.545 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.7 | -45.9 | 177.2 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | A150 L151 M156 V157 M158 | A150-V154 WeakPolarHBondContact O-CG2 3.46Å; A150-V154 PolarHBondContact O-N 2.8Å; L151-V154 PolarHBondContact O-N 2.83Å; V154-M156 VanDerWaalsContact C-N 3.29Å; V154-M156 PolarHBondContact O-N 3.28Å; V154-V157 PolarHBondContact O-N 2.72Å; V154-V157 VanDerWaalsContact O-N 3.17Å; V154-M158 HydrophobicContact CG1-CG 4.41Å; V154-M158 WeakPolarHBondContact O-CG 3.4Å; V154-M158 PolarHBondContact O-N 3.02Å |
| 155 | A | 91.4 | Very high | 88.1 | Confident | 43 Ų | 43 | 66.7 Ų | 66.7 | 36% | 0.355 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -58.1 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L151 M158 C159 | L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.44Å; A155-M158 PolarHBondContact O-N 3.1Å; A155-C159 PolarHBondContact O-N 2.83Å; A155-C159 PolarHBondContact O-SG 2.96Å |
| 156 | M | 90.8 | Very high | 89.1 | Confident | 22 Ų | 22 | 64 Ų | 64 | 11% | 0.108 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.9 | -170.8 | 72 | -162.4 | 0 | 0 | 112.2 | W152 G153 V154 M158 C159 V160 L402 G406 T410 | W152-M156 VanDerWaalsContact O-CB 3.29Å; W152-M156 WeakPolarHBondContact O-CB 3.41Å; W152-M156 PolarHBondContact O-N 3.1Å; G153-M156 WeakPolarHBondContact O-CB 3.19Å; G153-M156 PolarHBondContact O-N 3.4Å; V154-M156 VanDerWaalsContact C-N 3.29Å; V154-M156 PolarHBondContact O-N 3.28Å; M156-M158 PolarHBondContact O-N 2.91Å; M156-C159 PolarHBondContact O-N 3.46Å; M156-V160 HydrophobicContact CE-CG2 3.92Å; M156-V160 VanDerWaalsContact O-CG2 3.31Å; M156-V160 WeakPolarHBondContact O-CG2 3.49Å; M156-V160 PolarHBondContact O-N 3.48Å; M156-L402 HydrophobicContact CE-CB 3.56Å; M156-L402 HydrophobicContact CE-CD2 3.9Å; M156-L402 HydrophobicContact CE-CG 3.65Å; M156-L402 WeakPolarHBondContact CE-O 3.49Å; M156-L402 HydrophobicContact SD-CD2 4.26Å; M156-L402 HydrophobicContact SD-CG 4.35Å; M156-G406 VanDerWaalsContact CE-CA 3.47Å; M156-T410 HydrophobicContact CB-CG2 4.01Å; M156-T410 HydrophobicContact CG-CG2 3.96Å |
| 157 | V | 92.8 | Very high | 90 | Very high | 14 Ų | 14 | 58.8 Ų | 58.8 | 9% | 0.085 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 176.8 | 170.8 | 0 | 0 | 0 | 0 | 111 | G153 V154 V160 C161 L414 L421 | G153-V157 WeakPolarHBondContact O-CG2 3.33Å; G153-V157 PolarHBondContact O-N 3.39Å; V154-V157 PolarHBondContact O-N 2.72Å; V154-V157 VanDerWaalsContact O-N 3.17Å; V157-V160 PolarHBondContact O-N 3.05Å; V157-C161 VanDerWaalsContact O-CB 3.29Å; V157-C161 WeakPolarHBondContact O-CB 3.22Å; V157-C161 PolarHBondContact O-N 3.06Å; V157-L414 HydrophobicContact CG2-CB 3.89Å; V157-L414 HydrophobicContact CG2-CD2 4.12Å; V157-L421 HydrophobicContact CG1-CD1 3.61Å |
| 158 | M | 93.6 | Very high | 90.6 | Very high | 115 Ų | 115 | 54.2 Ų | 54.2 | 57% | 0.567 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -62.3 | -45 | 178.2 | -70.1 | -58.7 | -64 | 0 | 0 | 112.1 | V154 A155 M156 C161 S162 | V154-M158 HydrophobicContact CG1-CG 4.41Å; V154-M158 WeakPolarHBondContact O-CG 3.4Å; V154-M158 PolarHBondContact O-N 3.02Å; A155-M158 PolarHBondContact O-N 3.1Å; M156-M158 PolarHBondContact O-N 2.91Å; M158-C161 PolarHBondContact O-N 3.39Å; M158-S162 WeakPolarHBondContact O-CB 3.45Å; M158-S162 PolarHBondContact O-N 3.12Å; M158-S162 PolarHBondContact O-OG 3.3Å |
| 159 | C | 93.9 | Very high | 91.2 | Very high | 60 Ų | 60 | 46.8 Ų | 46.8 | 41% | 0.405 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -71.2 | -32.3 | 179.8 | -64.6 | 0 | 0 | 0 | 0 | 113.2 | A155 M156 S162 S163 L402 | A155-C159 PolarHBondContact O-N 2.83Å; A155-C159 PolarHBondContact O-SG 2.96Å; M156-C159 PolarHBondContact O-N 3.46Å; C159-S162 PolarHBondContact O-OG 3.32Å; C159-S163 VanDerWaalsContact O-CB 3.25Å; C159-S163 WeakPolarHBondContact O-CB 3.22Å; C159-S163 PolarHBondContact O-N 2.89Å; C159-S163 PolarHBondContact O-OG 3.1Å; C159-L402 HydrophobicContact CB-CD2 3.4Å |
| 160 | V | 94.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.3 | -47.7 | 170.5 | 171.9 | 0 | 0 | 0 | 0 | 110.2 | M156 V157 W164 F399 L402 I415 I419 | M156-V160 HydrophobicContact CE-CG2 3.92Å; M156-V160 VanDerWaalsContact O-CG2 3.31Å; M156-V160 WeakPolarHBondContact O-CG2 3.49Å; M156-V160 PolarHBondContact O-N 3.48Å; V157-V160 PolarHBondContact O-N 3.05Å; V160-W164 WeakPolarHBondContact O-CB 3.43Å; V160-W164 PolarHBondContact O-N 2.93Å; V160-W164 VanDerWaalsContact O-N 3.08Å; V160-F399 HydrophobicContact CG1-CD2 4.31Å; V160-F399 HydrophobicContact CG1-CE2 3.97Å; V160-L402 HydrophobicContact CG2-CB 3.98Å; V160-L402 HydrophobicContact CG2-CD2 3.93Å; V160-I415 HydrophobicContact CG1-CG2 4.37Å; V160-I415 HydrophobicContact CG2-CG2 4.18Å; V160-I419 HydrophobicContact CG1-CG1 3.99Å |
| 161 | C | 95 | Very high | 92.2 | Very high | 7 Ų | 7 | 38.6 Ų | 38.6 | 5% | 0.047 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.4 | -53.3 | 179 | 177.9 | 0 | 0 | 0 | 0 | 111.5 | V157 M158 S163 W164 A165 G418 L421 S422 | V157-C161 VanDerWaalsContact O-CB 3.29Å; V157-C161 WeakPolarHBondContact O-CB 3.22Å; V157-C161 PolarHBondContact O-N 3.06Å; M158-C161 PolarHBondContact O-N 3.39Å; C161-S163 PolarHBondContact O-N 3.36Å; C161-W164 PolarHBondContact O-N 3.46Å; C161-A165 WeakPolarHBondContact O-CB 3.32Å; C161-A165 PolarHBondContact O-N 3.09Å; C161-G418 WeakPolarHBondContact CA-O 3.2Å; C161-G418 WeakPolarHBondContact CB-O 3.22Å; C161-L421 HydrophobicContact CB-CB 4.46Å; C161-L421 PolarHBondContact SG-O 2.96Å; C161-L421 VanDerWaalsContact SG-O 3.41Å; C161-S422 PolarHBondContact SG-N 3.32Å |
| 162 | S | 94.3 | Very high | 92.4 | Very high | 67 Ų | 67 | 35.4 Ų | 35.4 | 47% | 0.469 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -67.1 | -36.2 | -178.3 | 65.4 | 0 | 0 | 0 | 0 | 113.3 | M158 C159 G166 | M158-S162 WeakPolarHBondContact O-CB 3.45Å; M158-S162 PolarHBondContact O-N 3.12Å; M158-S162 PolarHBondContact O-OG 3.3Å; C159-S162 PolarHBondContact O-OG 3.32Å; S162-G166 WeakPolarHBondContact O-CA 3.38Å; S162-G166 PolarHBondContact O-N 2.8Å |
| 163 | S | 95.6 | Very high | 92.5 | Very high | 11 Ų | 11 | 31 Ų | 31 | 8% | 0.077 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.9 | -44.5 | 176.3 | -56.1 | 0 | 0 | 0 | 0 | 111.4 | C159 C161 S167 | C159-S163 VanDerWaalsContact O-CB 3.25Å; C159-S163 WeakPolarHBondContact O-CB 3.22Å; C159-S163 PolarHBondContact O-N 2.89Å; C159-S163 PolarHBondContact O-OG 3.1Å; C161-S163 PolarHBondContact O-N 3.36Å; S163-S167 WeakPolarHBondContact O-CB 3.42Å; S163-S167 PolarHBondContact O-N 3.06Å; S163-S167 PolarHBondContact O-OG 2.65Å |
| 164 | W | 94.7 | Very high | 92.6 | Very high | 11 Ų | 11 | 30.6 Ų | 30.6 | 4% | 0.042 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -74.8 | -47.7 | -178.5 | -172.5 | -114.9 | 0 | 0 | 0 | 112.7 | V160 C161 G166 S167 T168 Y252 F268 L396 F399 S422 | V160-W164 WeakPolarHBondContact O-CB 3.43Å; V160-W164 PolarHBondContact O-N 2.93Å; V160-W164 VanDerWaalsContact O-N 3.08Å; C161-W164 PolarHBondContact O-N 3.46Å; W164-G166 VanDerWaalsContact C-N 3.34Å; W164-G166 PolarHBondContact O-N 3.29Å; W164-S167 PolarHBondContact O-N 3.38Å; W164-S167 PolarHBondContact O-OG 2.94Å; W164-T168 WeakPolarHBondContact O-CB 3.47Å; W164-T168 PolarHBondContact O-N 3.43Å; W164-T168 PolarHBondContact O-OG1 3.07Å; W164-Y252 HydrophobicContact CH2-CE1 4.25Å; W164-Y252 HydrophobicContact CH2-CE2 4.33Å; W164-Y252 HydrophobicContact CZ2-CE1 4.26Å; W164-Y252 AromaticContact CZ2-CE2 3.84Å; W164-Y252 HydrophobicContact CZ2-CE2 3.84Å; W164-Y252 AromaticContact CZ2-CZ 3.61Å; W164-F268 HydrophobicContact CH2-CD1 4.34Å; W164-F268 AromaticContact CH2-CE1 3.95Å; W164-F268 HydrophobicContact CH2-CE1 3.95Å; W164-F268 HydrophobicContact CH2-CZ 4.36Å; W164-F268 AromaticContact CZ2-CD1 3.59Å; W164-F268 HydrophobicContact CZ2-CD1 3.59Å; W164-F268 AromaticContact CZ2-CE1 3.63Å; W164-F268 HydrophobicContact CZ2-CE1 3.63Å; W164-F268 HydrophobicContact CZ2-CG 4.33Å; W164-F268 HydrophobicContact CZ2-CZ 4.4Å; W164-L396 HydrophobicContact CE3-CD1 4.4Å; W164-L396 HydrophobicContact CZ3-CD1 3.87Å; W164-F399 HydrophobicContact CB-CD2 3.73Å; W164-F399 HydrophobicContact CB-CE2 3.78Å; W164-F399 HydrophobicContact CD2-CD2 4.35Å; W164-F399 HydrophobicContact CD2-CE1 4.25Å; W164-F399 AromaticContact CD2-CE2 3.98Å; W164-F399 HydrophobicContact CD2-CE2 3.98Å; W164-F399 AromaticContact CD2-CZ 3.92Å; W164-F399 HydrophobicContact CD2-CZ 3.92Å; W164-F399 AromaticContact CE3-CD1 3.56Å; W164-F399 HydrophobicContact CE3-CD1 3.56Å; W164-F399 AromaticContact CE3-CD2 3.95Å; W164-F399 HydrophobicContact CE3-CD2 3.95Å; W164-F399 AromaticContact CE3-CE1 3.43Å; W164-F399 HydrophobicContact CE3-CE1 3.43Å; W164-F399 VanDerWaalsContact CE3-CE1 3.43Å; W164-F399 AromaticContact CE3-CE2 3.84Å; W164-F399 HydrophobicContact CE3-CE2 3.84Å; W164-F399 AromaticContact CE3-CG 3.81Å; W164-F399 HydrophobicContact CE3-CG 3.81Å; W164-F399 AromaticContact CE3-CZ 3.57Å; W164-F399 HydrophobicContact CE3-CZ 3.57Å; W164-F399 HydrophobicContact CG-CD2 4.29Å; W164-F399 AromaticContact CG-CE2 3.97Å; W164-F399 HydrophobicContact CG-CE2 3.97Å; W164-F399 HydrophobicContact CG-CZ 4.36Å; W164-F399 AromaticContact CZ3-CD1 3.87Å; W164-F399 HydrophobicContact CZ3-CD1 3.87Å; W164-F399 AromaticContact CZ3-CE1 3.6Å; W164-F399 HydrophobicContact CZ3-CE1 3.6Å; W164-F399 HydrophobicContact CZ3-CZ 4.07Å; W164-S422 VanDerWaalsContact CD1-OG 3.28Å |
| 165 | A | 94.3 | Very high | 92.5 | Very high | 5 Ų | 5 | 27.3 Ų | 27.3 | 4% | 0.041 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.6 | -49.2 | 174 | 0 | 0 | 0 | 0 | 0 | 110.8 | C161 S167 T168 Q169 V425 N426 | C161-A165 WeakPolarHBondContact O-CB 3.32Å; C161-A165 PolarHBondContact O-N 3.09Å; A165-S167 PolarHBondContact O-N 2.95Å; A165-T168 PolarHBondContact O-N 3.44Å; A165-Q169 WeakPolarHBondContact O-CB 3.5Å; A165-Q169 PolarHBondContact O-N 3.16Å; A165-V425 HydrophobicContact CB-CB 4.41Å; A165-V425 HydrophobicContact CB-CG1 3.83Å; A165-N426 WeakPolarHBondContact CA-OD1 3.46Å; A165-N426 VanDerWaalsContact CB-OD1 3.3Å; A165-N426 WeakPolarHBondContact CB-OD1 2.9Å; A165-N426 PolarHBondContact O-OD1 3.27Å |
| 166 | G | 93.4 | Very high | 92 | Very high | 23 Ų | 23 | 32 Ų | 32 | 24% | 0.237 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -58.2 | -48.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S162 W164 T168 L170 | S162-G166 WeakPolarHBondContact O-CA 3.38Å; S162-G166 PolarHBondContact O-N 2.8Å; W164-G166 VanDerWaalsContact C-N 3.34Å; W164-G166 PolarHBondContact O-N 3.29Å; G166-T168 VanDerWaalsContact C-N 3.28Å; G166-T168 PolarHBondContact O-N 3.28Å; G166-L170 WeakPolarHBondContact O-CB 3.48Å; G166-L170 PolarHBondContact O-N 3.29Å |
| 167 | S | 94.1 | Very high | 91.5 | Very high | 6 Ų | 6 | 36.8 Ų | 36.8 | 4% | 0.042 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.1 | -37.6 | 177.6 | 62.3 | 0 | 0 | 0 | 0 | 112.2 | S163 W164 A165 A171 | S163-S167 WeakPolarHBondContact O-CB 3.42Å; S163-S167 PolarHBondContact O-N 3.06Å; S163-S167 PolarHBondContact O-OG 2.65Å; W164-S167 PolarHBondContact O-N 3.38Å; W164-S167 PolarHBondContact O-OG 2.94Å; A165-S167 PolarHBondContact O-N 2.95Å; S167-A171 WeakPolarHBondContact O-CB 3.13Å; S167-A171 PolarHBondContact O-N 3.3Å |
| 168 | T | 93.1 | Very high | 90.8 | Very high | 1 Ų | 1 | 36.7 Ų | 36.7 | 1% | 0.006 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68 | -50.2 | -179.8 | -50.5 | 0 | 0 | 0 | 0 | 111.6 | W164 A165 G166 A171 K172 Y252 L256 | W164-T168 WeakPolarHBondContact O-CB 3.47Å; W164-T168 PolarHBondContact O-N 3.43Å; W164-T168 PolarHBondContact O-OG1 3.07Å; A165-T168 PolarHBondContact O-N 3.44Å; G166-T168 VanDerWaalsContact C-N 3.28Å; G166-T168 PolarHBondContact O-N 3.28Å; T168-A171 PolarHBondContact O-N 2.96Å; T168-K172 PolarHBondContact O-N 3.38Å; T168-Y252 HydrophobicContact CG2-CE1 4.42Å; T168-Y252 WeakPolarHBondContact CG2-OH 3.3Å; T168-Y252 PolarHBondContact OG1-OH 3.49Å; T168-Y252 VanDerWaalsContact OG1-OH 3.11Å; T168-L256 HydrophobicContact CG2-CD1 4.04Å; T168-L256 HydrophobicContact CG2-CD2 3.63Å; T168-L256 HydrophobicContact CG2-CG 4.46Å |
| 169 | Q | 92.4 | Very high | 90.1 | Very high | 21 Ų | 21 | 35.9 Ų | 35.9 | 10% | 0.098 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.4 | -44 | 179 | -75.3 | -71.5 | 8.7 | 0 | 0 | 111.8 | A165 A171 K172 L173 T261 N426 V429 D430 | A165-Q169 WeakPolarHBondContact O-CB 3.5Å; A165-Q169 PolarHBondContact O-N 3.16Å; Q169-A171 VanDerWaalsContact C-N 3.31Å; Q169-A171 PolarHBondContact O-N 3Å; Q169-K172 WeakPolarHBondContact O-CB 3.25Å; Q169-K172 PolarHBondContact O-N 3.49Å; Q169-K172 VanDerWaalsContact O-N 3.16Å; Q169-L173 WeakPolarHBondContact O-CG 3.26Å; Q169-L173 PolarHBondContact O-N 3.12Å; Q169-T261 PolarHBondContact NE2-OG1 3.26Å; Q169-N426 WeakPolarHBondContact CG-OD1 3.4Å; Q169-N426 PolarHBondContact NE2-O 3.04Å; Q169-V429 HydrophobicContact CG-CB 4.34Å; Q169-V429 HydrophobicContact CG-CG1 3.94Å; Q169-V429 VanDerWaalsContact NE2-CG1 3.33Å; Q169-D430 PolarHBondContact NE2-OD1 2.93Å |
| 170 | L | 92.3 | Very high | 89.7 | Confident | 37 Ų | 37 | 33.1 Ų | 33.1 | 19% | 0.194 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.4 | -32.7 | 179.4 | -158 | 67.6 | 0 | 0 | 0 | 111.8 | G166 L173 T174 Y388 V392 L395 | G166-L170 WeakPolarHBondContact O-CB 3.48Å; G166-L170 PolarHBondContact O-N 3.29Å; L170-L173 PolarHBondContact O-N 3.37Å; L170-T174 WeakPolarHBondContact O-CB 3.44Å; L170-T174 PolarHBondContact O-N 2.96Å; L170-T174 PolarHBondContact O-OG1 2.98Å; L170-Y388 HydrophobicContact CD1-CD1 3.57Å; L170-Y388 HydrophobicContact CD1-CE1 3.85Å; L170-Y388 HydrophobicContact CG-CD1 4.15Å; L170-V392 HydrophobicContact CB-CG2 3.86Å; L170-V392 HydrophobicContact CD2-CG2 4.13Å; L170-V392 HydrophobicContact CG-CG2 3.93Å; L170-L395 HydrophobicContact CD2-CD1 3.93Å |
| 171 | A | 91.6 | Very high | 89.2 | Confident | 1 Ų | 1 | 33.2 Ų | 33.2 | 1% | 0.008 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.9 | -42.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | S167 T168 Q169 L173 T174 F175 L184 L253 L256 V392 | S167-A171 WeakPolarHBondContact O-CB 3.13Å; S167-A171 PolarHBondContact O-N 3.3Å; T168-A171 PolarHBondContact O-N 2.96Å; Q169-A171 VanDerWaalsContact C-N 3.31Å; Q169-A171 PolarHBondContact O-N 3Å; A171-L173 VanDerWaalsContact C-N 3.3Å; A171-L173 PolarHBondContact O-N 3.31Å; A171-T174 WeakPolarHBondContact O-CB 3.37Å; A171-T174 PolarHBondContact O-N 2.79Å; A171-T174 VanDerWaalsContact O-N 3.16Å; A171-F175 HydrophobicContact CB-CE2 4.44Å; A171-F175 WeakPolarHBondContact O-CD2 3.22Å; A171-F175 WeakPolarHBondContact O-CG 3.43Å; A171-F175 PolarHBondContact O-N 3.04Å; A171-L184 HydrophobicContact CB-CD2 4.48Å; A171-L253 HydrophobicContact CB-CD2 3.92Å; A171-L256 HydrophobicContact CB-CD1 4.11Å; A171-V392 HydrophobicContact CB-CG1 4.19Å; A171-V392 HydrophobicContact CB-CG2 4.15Å |
| 172 | K | 90.4 | Very high | 88.8 | Confident | 47 Ų | 47 | 34.4 Ų | 34.4 | 20% | 0.204 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60 | -38.2 | 174.3 | -173.8 | 73.1 | 179.8 | -170.6 | 0 | 112.3 | T168 Q169 L256 I259 T261 | T168-K172 PolarHBondContact O-N 3.38Å; Q169-K172 WeakPolarHBondContact O-CB 3.25Å; Q169-K172 PolarHBondContact O-N 3.49Å; Q169-K172 VanDerWaalsContact O-N 3.16Å; K172-L256 WeakPolarHBondContact CD-O 3.39Å; K172-L256 WeakPolarHBondContact CE-O 3.21Å; K172-L256 PolarHBondContact NZ-O 2.99Å; K172-I259 PolarHBondContact NZ-O 2.94Å; K172-T261 HydrophobicContact CB-CG2 3.57Å; K172-T261 HydrophobicContact CD-CG2 4.12Å; K172-T261 HydrophobicContact CG-CG2 3.6Å |
| 173 | L | 88.8 | Confident | 88.4 | Confident | 62 Ų | 62 | 32.2 Ų | 32.2 | 33% | 0.325 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -70.1 | -40.8 | 172.9 | -68.3 | 174.7 | 0 | 0 | 0 | 112.1 | Q169 L170 A171 F175 K176 | Q169-L173 WeakPolarHBondContact O-CG 3.26Å; Q169-L173 PolarHBondContact O-N 3.12Å; L170-L173 PolarHBondContact O-N 3.37Å; A171-L173 VanDerWaalsContact C-N 3.3Å; A171-L173 PolarHBondContact O-N 3.31Å; L173-F175 VanDerWaalsContact C-N 3.27Å; L173-F175 PolarHBondContact O-N 3.34Å; L173-K176 HydrophobicContact CD2-CD 4.38Å; L173-K176 WeakPolarHBondContact O-CB 3.41Å; L173-K176 PolarHBondContact O-N 2.98Å |
| 174 | T | 88.1 | Confident | 88.1 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -55.9 | -43.5 | 174.4 | -55.3 | 0 | 0 | 0 | 0 | 110.5 | L170 A171 K176 Q177 F178 L184 L389 | L170-T174 WeakPolarHBondContact O-CB 3.44Å; L170-T174 PolarHBondContact O-N 2.96Å; L170-T174 PolarHBondContact O-OG1 2.98Å; A171-T174 WeakPolarHBondContact O-CB 3.37Å; A171-T174 PolarHBondContact O-N 2.79Å; A171-T174 VanDerWaalsContact O-N 3.16Å; T174-K176 PolarHBondContact O-N 3.19Å; T174-K176 VanDerWaalsContact O-N 3.14Å; T174-Q177 PolarHBondContact O-N 3.08Å; T174-F178 HydrophobicContact CG2-CB 4.09Å; T174-F178 HydrophobicContact CG2-CD1 4.22Å; T174-F178 PolarHBondContact O-N 3.18Å; T174-L184 HydrophobicContact CG2-CD2 4.04Å; T174-L389 HydrophobicContact CG2-CD1 4.14Å |
| 175 | F | 87.1 | Confident | 87.9 | Confident | 21 Ų | 21 | 31.2 Ų | 31.2 | 9% | 0.092 | 16% | 0.158 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.5 | -9.1 | 176.5 | -66.7 | -48.3 | 0 | 0 | 0 | 115.6 | A171 L173 Q177 F178 P181 L184 L253 L256 R257 | A171-F175 HydrophobicContact CB-CE2 4.44Å; A171-F175 WeakPolarHBondContact O-CD2 3.22Å; A171-F175 WeakPolarHBondContact O-CG 3.43Å; A171-F175 PolarHBondContact O-N 3.04Å; L173-F175 VanDerWaalsContact C-N 3.27Å; L173-F175 PolarHBondContact O-N 3.34Å; F175-Q177 VanDerWaalsContact C-N 3.33Å; F175-F178 WeakPolarHBondContact CD1-O 3.33Å; F175-P181 HydrophobicContact CE1-CB 3.75Å; F175-P181 HydrophobicContact CZ-CB 3.81Å; F175-L184 HydrophobicContact CE1-CD2 3.88Å; F175-L184 HydrophobicContact CE2-CD2 4.33Å; F175-L184 HydrophobicContact CZ-CD2 3.65Å; F175-L253 HydrophobicContact CE2-CB 4.18Å; F175-L253 HydrophobicContact CE2-CD2 4.3Å; F175-L253 WeakPolarHBondContact CE2-O 3.46Å; F175-L253 HydrophobicContact CZ-CB 3.95Å; F175-L253 HydrophobicContact CZ-CD1 4.37Å; F175-L256 HydrophobicContact CD2-CB 4.35Å; F175-L256 HydrophobicContact CE2-CB 4.26Å; F175-R257 HydrophobicContact CB-CG 4.29Å; F175-R257 HydrophobicContact CD1-CG 3.92Å; F175-R257 HydrophobicContact CD2-CG 3.85Å; F175-R257 HydrophobicContact CE1-CG 4.25Å; F175-R257 HydrophobicContact CE2-CG 4.15Å; F175-R257 HydrophobicContact CG-CG 3.75Å; F175-R257 HydrophobicContact CZ-CG 4.36Å |
| 176 | K | 82.3 | Confident | 87.7 | Confident | 140 Ų | 140 | 33 Ų | 33 | 61% | 0.609 | 16% | 0.164 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -14.4 | 168.1 | -62.5 | -174.2 | 178.3 | -177.6 | 0 | 113 | L173 T174 | L173-K176 HydrophobicContact CD2-CD 4.38Å; L173-K176 WeakPolarHBondContact O-CB 3.41Å; L173-K176 PolarHBondContact O-N 2.98Å; T174-K176 PolarHBondContact O-N 3.19Å; T174-K176 VanDerWaalsContact O-N 3.14Å |
| 177 | Q | 80.3 | Confident | 87.5 | Confident | 123 Ų | 123 | 33.8 Ų | 33.8 | 58% | 0.575 | 16% | 0.161 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -124.3 | -24.1 | -176 | -65 | -178.8 | -13.4 | 0 | 0 | 113.4 | T174 F175 P385 Y388 | T174-Q177 PolarHBondContact O-N 3.08Å; F175-Q177 VanDerWaalsContact C-N 3.33Å; Q177-P385 HydrophobicContact CB-CG 4.21Å; Q177-Y388 VanDerWaalsContact OE1-CD2 3.29Å |
| 178 | F | 78.3 | Confident | 87.3 | Confident | 12 Ų | 12 | 33.6 Ų | 33.6 | 5% | 0.053 | 16% | 0.159 | C | C | . | . | trans | -142.8 | 99.8 | -170.3 | -179.3 | -95.7 | 0 | 0 | 0 | 109.6 | T174 F175 A180 T183 L184 T378 I384 P385 L389 | T174-F178 HydrophobicContact CG2-CB 4.09Å; T174-F178 HydrophobicContact CG2-CD1 4.22Å; T174-F178 PolarHBondContact O-N 3.18Å; F175-F178 WeakPolarHBondContact CD1-O 3.33Å; F178-A180 VanDerWaalsContact C-N 3.27Å; F178-A180 HydrophobicContact CD1-CB 4.18Å; F178-A180 HydrophobicContact CE1-CB 3.66Å; F178-A180 HydrophobicContact CE2-CB 4.48Å; F178-A180 HydrophobicContact CZ-CB 3.82Å; F178-A180 PolarHBondContact O-N 2.97Å; F178-T183 HydrophobicContact CE1-CG2 4.48Å; F178-T183 HydrophobicContact CZ-CG2 4Å; F178-L184 HydrophobicContact CE1-CB 4.45Å; F178-T378 HydrophobicContact CD2-CG2 4.46Å; F178-T378 HydrophobicContact CE2-CG2 3.43Å; F178-T378 VanDerWaalsContact CE2-CG2 3.43Å; F178-T378 HydrophobicContact CZ-CG2 3.67Å; F178-I384 HydrophobicContact CD2-CG2 4.2Å; F178-I384 HydrophobicContact CE2-CD1 4.31Å; F178-I384 HydrophobicContact CE2-CG1 4.16Å; F178-I384 HydrophobicContact CE2-CG2 3.93Å; F178-P385 HydrophobicContact CB-CG 4.03Å; F178-L389 HydrophobicContact CD1-CD1 4.3Å; F178-L389 HydrophobicContact CE1-CD2 3.99Å; F178-L389 HydrophobicContact CE2-CD2 4.5Å; F178-L389 HydrophobicContact CG-CD1 4.28Å; F178-L389 HydrophobicContact CZ-CD2 3.98Å | ||
| 179 | D | 79.1 | Confident | 87 | Confident | 98 Ų | 98 | 33.7 Ų | 33.7 | 52% | 0.524 | 16% | 0.16 | S | C | . | . | trans | -90.3 | 25.4 | -164.7 | -160.6 | 42.4 | 0 | 0 | 0 | 114.4 | P181 R257 | D179-P181 VanDerWaalsContact C-CD 3.49Å; D179-P181 WeakPolarHBondContact O-CD 3.38Å; D179-R257 VanDerWaalsContact CG-CZ 3.45Å; D179-R257 PolarHBondContact O-NH1 2.9Å; D179-R257 VanDerWaalsContact O-NH1 3.15Å; D179-R257 IonicContact OD1-CZ 2.71Å; D179-R257 IonicContact OD1-NE 3.1Å; D179-R257 PolarHBondContact OD1-NE 2.9Å; D179-R257 IonicContact OD1-NH1 3.09Å; D179-R257 IonicContact OD1-NH2 3.76Å; D179-R257 PolarHBondContact OD1-NH2 3.47Å; D179-R257 IonicContact OD2-CZ 3.51Å; D179-R257 IonicContact OD2-NH2 3.82Å; D179-R257 PolarHBondContact OD2-NH2 2.72Å | ||
| 180 | A | 83.4 | Confident | 86.9 | Confident | 3 Ų | 3 | 33.7 Ų | 33.7 | 3% | 0.025 | 16% | 0.161 | C | C | . | . | trans | -110.9 | 78.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | F178 T183 L184 E376 T378 | F178-A180 VanDerWaalsContact C-N 3.27Å; F178-A180 HydrophobicContact CD1-CB 4.18Å; F178-A180 HydrophobicContact CE1-CB 3.66Å; F178-A180 HydrophobicContact CE2-CB 4.48Å; F178-A180 HydrophobicContact CZ-CB 3.82Å; F178-A180 PolarHBondContact O-N 2.97Å; A180-T183 PolarHBondContact O-N 2.9Å; A180-L184 PolarHBondContact O-N 2.88Å; A180-E376 VanDerWaalsContact CA-CD 3.5Å; A180-E376 HydrophobicContact CB-CB 3.81Å; A180-E376 HydrophobicContact CB-CG 4.06Å; A180-E376 WeakPolarHBondContact CB-OE2 3.5Å; A180-T378 HydrophobicContact CB-CG2 4.23Å | ||
| 181 | P | 84.9 | Confident | 86.8 | Confident | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.006 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -68.3 | -32.5 | -174.7 | 28.1 | -38.1 | 0 | 0 | 0 | 114.9 | F175 D179 T185 Y250 Q254 R257 E376 | F175-P181 HydrophobicContact CE1-CB 3.75Å; F175-P181 HydrophobicContact CZ-CB 3.81Å; D179-P181 VanDerWaalsContact C-CD 3.49Å; D179-P181 WeakPolarHBondContact O-CD 3.38Å; P181-T185 WeakPolarHBondContact O-CB 3.42Å; P181-T185 PolarHBondContact O-N 3.29Å; P181-T185 PolarHBondContact O-OG1 3.41Å; P181-Y250 HydrophobicContact CB-CE2 4.48Å; P181-Y250 HydrophobicContact CG-CE2 4.36Å; P181-Q254 VanDerWaalsContact CG-OE1 3.31Å; P181-R257 VanDerWaalsContact CD-NH1 3.29Å; P181-E376 WeakPolarHBondContact CD-OE1 3.19Å; P181-E376 WeakPolarHBondContact CG-OE1 3.37Å |
| 182 | F | 86.7 | Confident | 86.6 | Confident | 32 Ų | 32 | 35 Ų | 35 | 14% | 0.14 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -67.8 | -46.8 | 174.3 | -170.7 | -82.5 | 0 | 0 | 0 | 109.8 | L184 T185 W186 Y250 I363 V366 P367 L370 E376 | F182-L184 PolarHBondContact O-N 3.16Å; F182-T185 WeakPolarHBondContact O-CB 3.17Å; F182-T185 PolarHBondContact O-N 3.02Å; F182-T185 VanDerWaalsContact O-N 3.12Å; F182-W186 HydrophobicContact CE1-CB 4.4Å; F182-W186 PolarHBondContact O-N 3.4Å; F182-Y250 HydrophobicContact CB-CD2 4.16Å; F182-Y250 HydrophobicContact CB-CE2 3.92Å; F182-Y250 AromaticContact CD2-CD2 3.96Å; F182-Y250 HydrophobicContact CD2-CD2 3.96Å; F182-Y250 HydrophobicContact CD2-CE2 4.1Å; F182-Y250 HydrophobicContact CD2-CG 4.38Å; F182-I363 HydrophobicContact CE1-CG2 4.13Å; F182-I363 HydrophobicContact CZ-CG2 3.85Å; F182-V366 HydrophobicContact CD1-CG1 4.04Å; F182-V366 HydrophobicContact CE1-CB 3.67Å; F182-V366 HydrophobicContact CE1-CG1 3.43Å; F182-V366 VanDerWaalsContact CE1-CG1 3.43Å; F182-V366 HydrophobicContact CE2-CG1 4.3Å; F182-V366 HydrophobicContact CZ-CB 3.96Å; F182-V366 HydrophobicContact CZ-CG1 3.57Å; F182-P367 HydrophobicContact CD1-CG 4.1Å; F182-P367 HydrophobicContact CE1-CG 4.03Å; F182-L370 HydrophobicContact CB-CD2 3.86Å; F182-L370 HydrophobicContact CD1-CD2 4.2Å; F182-L370 HydrophobicContact CG-CD2 4.06Å; F182-E376 VanDerWaalsContact CB-OE1 3.27Å; F182-E376 WeakPolarHBondContact CB-OE1 3.3Å; F182-E376 PolarHBondContact N-OE1 3.29Å; F182-E376 PolarHBondContact N-OE2 3.04Å |
| 183 | T | 86.4 | Confident | 86.3 | Confident | 21 Ų | 21 | 34.3 Ų | 34.3 | 13% | 0.129 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.6 | -44.5 | 176.1 | -56.9 | 0 | 0 | 0 | 0 | 111.9 | F178 A180 W186 F187 P367 E376 | F178-T183 HydrophobicContact CE1-CG2 4.48Å; F178-T183 HydrophobicContact CZ-CG2 4Å; A180-T183 PolarHBondContact O-N 2.9Å; T183-W186 PolarHBondContact O-N 3.19Å; T183-F187 WeakPolarHBondContact O-CB 3.42Å; T183-F187 PolarHBondContact O-N 2.96Å; T183-P367 HydrophobicContact CG2-CB 4.37Å; T183-E376 WeakPolarHBondContact CB-OE2 3.4Å; T183-E376 PolarHBondContact N-OE2 2.91Å; T183-E376 PolarHBondContact OG1-OE2 3.35Å |
| 184 | L | 88.3 | Confident | 86.2 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -63.8 | -39.9 | 173.9 | -176.2 | 60.1 | 0 | 0 | 0 | 112.4 | A171 T174 F175 F178 A180 F182 A188 L253 L389 V392 | A171-L184 HydrophobicContact CB-CD2 4.48Å; T174-L184 HydrophobicContact CG2-CD2 4.04Å; F175-L184 HydrophobicContact CE1-CD2 3.88Å; F175-L184 HydrophobicContact CE2-CD2 4.33Å; F175-L184 HydrophobicContact CZ-CD2 3.65Å; F178-L184 HydrophobicContact CE1-CB 4.45Å; A180-L184 PolarHBondContact O-N 2.88Å; F182-L184 PolarHBondContact O-N 3.16Å; L184-A188 WeakPolarHBondContact O-CB 3.45Å; L184-A188 PolarHBondContact O-N 3.44Å; L184-L253 HydrophobicContact CB-CD1 4.28Å; L184-L253 HydrophobicContact CD2-CD1 4.09Å; L184-L253 HydrophobicContact CG-CD1 3.95Å; L184-L389 HydrophobicContact CD1-CB 4.5Å; L184-L389 HydrophobicContact CD1-CG 4.05Å; L184-V392 HydrophobicContact CD1-CB 4.45Å; L184-V392 HydrophobicContact CD1-CG1 4.29Å |
| 185 | T | 90 | Very high | 85.9 | Confident | 2 Ų | 2 | 35.4 Ų | 35.4 | 1% | 0.012 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.4 | -50.8 | 175.3 | -56.8 | 0 | 0 | 0 | 0 | 110.8 | P181 F182 F187 A188 T189 I246 N249 Y250 | P181-T185 WeakPolarHBondContact O-CB 3.42Å; P181-T185 PolarHBondContact O-N 3.29Å; P181-T185 PolarHBondContact O-OG1 3.41Å; F182-T185 WeakPolarHBondContact O-CB 3.17Å; F182-T185 PolarHBondContact O-N 3.02Å; F182-T185 VanDerWaalsContact O-N 3.12Å; T185-F187 PolarHBondContact O-N 3.26Å; T185-A188 PolarHBondContact O-N 3.27Å; T185-T189 HydrophobicContact CG2-CG2 4.27Å; T185-T189 WeakPolarHBondContact O-CB 3.29Å; T185-T189 WeakPolarHBondContact O-CG2 3.41Å; T185-T189 PolarHBondContact O-N 2.91Å; T185-T189 PolarHBondContact O-OG1 2.97Å; T185-I246 HydrophobicContact CG2-CG2 4.2Å; T185-N249 HydrophobicContact CG2-CB 3.78Å; T185-Y250 WeakPolarHBondContact OG1-CA 3.31Å |
| 186 | W | 89.8 | Confident | 85.6 | Confident | 42 Ų | 42 | 35.7 Ų | 35.7 | 16% | 0.159 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.9 | -43.1 | -178.8 | 165.8 | 79.6 | 0 | 0 | 0 | 111.6 | F182 T183 T189 T190 N359 F360 P367 | F182-W186 HydrophobicContact CE1-CB 4.4Å; F182-W186 PolarHBondContact O-N 3.4Å; T183-W186 PolarHBondContact O-N 3.19Å; W186-T189 PolarHBondContact O-OG1 3.08Å; W186-T190 VanDerWaalsContact O-CB 3.29Å; W186-T190 WeakPolarHBondContact O-CB 3.33Å; W186-T190 PolarHBondContact O-N 2.91Å; W186-T190 PolarHBondContact O-OG1 3.14Å; W186-N359 PolarHBondContact NE1-O 3.37Å; W186-N359 PolarHBondContact O-ND2 3.05Å; W186-N359 VanDerWaalsContact O-ND2 3.08Å; W186-F360 HydrophobicContact CZ2-CD2 4.05Å; W186-F360 HydrophobicContact CZ2-CE2 4.26Å; W186-P367 HydrophobicContact CB-CG 3.94Å; W186-P367 HydrophobicContact CD2-CG 3.8Å; W186-P367 HydrophobicContact CE3-CG 3.94Å; W186-P367 HydrophobicContact CG-CG 3.77Å |
| 187 | F | 89.4 | Confident | 85.6 | Confident | 39 Ų | 39 | 32.1 Ų | 32.1 | 17% | 0.171 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.3 | -49.9 | 178.1 | -175.8 | -101.1 | 0 | 0 | 0 | 111.6 | T183 T185 T189 T190 W191 L389 A393 | T183-F187 WeakPolarHBondContact O-CB 3.42Å; T183-F187 PolarHBondContact O-N 2.96Å; T185-F187 PolarHBondContact O-N 3.26Å; F187-T189 PolarHBondContact O-N 2.86Å; F187-T190 WeakPolarHBondContact O-CB 3.38Å; F187-T190 PolarHBondContact O-N 3.38Å; F187-W191 HydrophobicContact CE1-CZ2 4.45Å; F187-W191 AromaticContact CE1-NE1 3.6Å; F187-W191 HydrophobicContact CZ-CZ2 4.48Å; F187-W191 AromaticContact CZ-NE1 3.62Å; F187-W191 VanDerWaalsContact O-CD1 3.25Å; F187-L389 HydrophobicContact CD1-CB 4.23Å; F187-L389 HydrophobicContact CE1-CB 4.12Å; F187-A393 HydrophobicContact CD1-CB 3.98Å; F187-A393 HydrophobicContact CE1-CB 3.88Å |
| 188 | A | 90.1 | Very high | 85.7 | Confident | 2 Ų | 2 | 29.1 Ų | 29.1 | 2% | 0.017 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.7 | -36.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113 | L184 T185 W191 A393 L396 | L184-A188 WeakPolarHBondContact O-CB 3.45Å; L184-A188 PolarHBondContact O-N 3.44Å; T185-A188 PolarHBondContact O-N 3.27Å; A188-W191 PolarHBondContact O-N 3.39Å; A188-A393 HydrophobicContact CB-CB 4.15Å; A188-L396 HydrophobicContact CB-CD2 3.97Å |
| 189 | T | 88.4 | Confident | 85.7 | Confident | 4 Ų | 4 | 31.4 Ų | 31.4 | 3% | 0.025 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -76 | -24.2 | 176.8 | 54.1 | 0 | 0 | 0 | 0 | 113.3 | T185 W186 F187 W191 N192 N249 N359 | T185-T189 HydrophobicContact CG2-CG2 4.27Å; T185-T189 WeakPolarHBondContact O-CB 3.29Å; T185-T189 WeakPolarHBondContact O-CG2 3.41Å; T185-T189 PolarHBondContact O-N 2.91Å; T185-T189 PolarHBondContact O-OG1 2.97Å; W186-T189 PolarHBondContact O-OG1 3.08Å; F187-T189 PolarHBondContact O-N 2.86Å; T189-W191 VanDerWaalsContact C-N 3.27Å; T189-W191 PolarHBondContact O-N 2.8Å; T189-N192 WeakPolarHBondContact O-CB 3.2Å; T189-N192 PolarHBondContact O-N 3.46Å; T189-N249 HydrophobicContact CG2-CB 4.2Å; T189-N359 PolarHBondContact OG1-ND2 3.44Å |
| 190 | T | 89.6 | Confident | 85.6 | Confident | 20 Ų | 20 | 29 Ų | 29 | 12% | 0.123 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.9 | -33 | 170.9 | -72.8 | 0 | 0 | 0 | 0 | 112.3 | W186 F187 N192 C193 N359 F360 | W186-T190 VanDerWaalsContact O-CB 3.29Å; W186-T190 WeakPolarHBondContact O-CB 3.33Å; W186-T190 PolarHBondContact O-N 2.91Å; W186-T190 PolarHBondContact O-OG1 3.14Å; F187-T190 WeakPolarHBondContact O-CB 3.38Å; F187-T190 PolarHBondContact O-N 3.38Å; T190-N192 PolarHBondContact O-N 2.97Å; T190-C193 WeakPolarHBondContact O-CB 3.33Å; T190-C193 PolarHBondContact O-N 2.87Å; T190-C193 PolarHBondContact O-SG 2.76Å; T190-N359 PolarHBondContact N-ND2 3.17Å; T190-N359 PolarHBondContact OG1-ND2 3.32Å; T190-F360 HydrophobicContact CG2-CB 4.09Å; T190-F360 HydrophobicContact CG2-CD2 3.55Å; T190-F360 HydrophobicContact CG2-CE2 4.37Å; T190-F360 HydrophobicContact CG2-CG 4.11Å |
| 191 | W | 89.4 | Confident | 85.4 | Confident | 65 Ų | 65 | 32.9 Ų | 32.9 | 25% | 0.246 | 17% | 0.168 | C | C | . | . | G | 310 helix | trans | -61.3 | -19.7 | 179.2 | -77 | 45.7 | 0 | 0 | 0 | 113.2 | F187 A188 T189 C193 L194 C390 A393 A394 F397 | F187-W191 HydrophobicContact CE1-CZ2 4.45Å; F187-W191 AromaticContact CE1-NE1 3.6Å; F187-W191 HydrophobicContact CZ-CZ2 4.48Å; F187-W191 AromaticContact CZ-NE1 3.62Å; F187-W191 VanDerWaalsContact O-CD1 3.25Å; A188-W191 PolarHBondContact O-N 3.39Å; T189-W191 VanDerWaalsContact C-N 3.27Å; T189-W191 PolarHBondContact O-N 2.8Å; W191-C193 PolarHBondContact O-N 2.84Å; W191-C193 VanDerWaalsContact O-N 3.08Å; W191-L194 WeakPolarHBondContact O-CB 3.49Å; W191-L194 PolarHBondContact O-N 3.28Å; W191-C390 HydrophobicContact CH2-CB 4.45Å; W191-C390 HydrophobicContact CZ2-CB 4.22Å; W191-A393 HydrophobicContact CD2-CB 3.66Å; W191-A393 VanDerWaalsContact CE2-CB 3.48Å; W191-A393 HydrophobicContact CE3-CB 4.28Å; W191-A393 HydrophobicContact CG-CB 3.87Å; W191-A393 HydrophobicContact CZ2-CB 3.97Å; W191-A394 HydrophobicContact CE3-CB 4.42Å; W191-A394 HydrophobicContact CH2-CB 4.04Å; W191-A394 HydrophobicContact CZ3-CB 3.62Å; W191-F397 HydrophobicContact CB-CB 4.15Å; W191-F397 HydrophobicContact CB-CD2 4.29Å; W191-F397 HydrophobicContact CB-CG 4.3Å; W191-F397 HydrophobicContact CE3-CB 4.3Å; W191-F397 HydrophobicContact CE3-CD1 4.49Å; W191-F397 WeakPolarHBondContact O-CD2 3.37Å; W191-F397 WeakPolarHBondContact O-CE2 3.38Å |
| 192 | N | 87.4 | Confident | 84.7 | Confident | 2 Ų | 2 | 34.8 Ų | 34.8 | 1% | 0.011 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -59.8 | -16.8 | 171.8 | -70.5 | -24.2 | 0 | 0 | 0 | 113.7 | T189 T190 L194 F195 W245 L352 S353 N400 | T189-N192 WeakPolarHBondContact O-CB 3.2Å; T189-N192 PolarHBondContact O-N 3.46Å; T190-N192 PolarHBondContact O-N 2.97Å; N192-L194 PolarHBondContact O-N 3.24Å; N192-F195 VanDerWaalsContact O-CB 3.31Å; N192-F195 WeakPolarHBondContact O-CB 3.35Å; N192-F195 PolarHBondContact O-N 2.91Å; N192-W245 PolarHBondContact ND2-NE1 3.29Å; N192-L352 HydrophobicContact CB-CD1 4.39Å; N192-L352 HydrophobicContact CB-CG 4.27Å; N192-S353 WeakPolarHBondContact O-CA 3.34Å; N192-N400 PolarHBondContact OD1-ND2 3.02Å |
| 193 | C | 85.6 | Confident | 84 | Confident | 32 Ų | 32 | 35.4 Ų | 35.4 | 22% | 0.216 | 19% | 0.191 | C | C | . | . | G | 310 helix | trans | -53.1 | -34 | 168 | -63.6 | 0 | 0 | 0 | 0 | 112.6 | T190 W191 F195 P197 G356 S357 | T190-C193 WeakPolarHBondContact O-CB 3.33Å; T190-C193 PolarHBondContact O-N 2.87Å; T190-C193 PolarHBondContact O-SG 2.76Å; W191-C193 PolarHBondContact O-N 2.84Å; W191-C193 VanDerWaalsContact O-N 3.08Å; C193-F195 PolarHBondContact O-N 2.93Å; C193-P197 WeakPolarHBondContact O-CD 3.39Å; C193-G356 PolarHBondContact SG-O 2.97Å; C193-S357 VanDerWaalsContact SG-CA 3.55Å; C193-S357 PolarHBondContact SG-N 2.86Å |
| 194 | L | 85 | Confident | 83.2 | Confident | 84 Ų | 84 | 37.8 Ų | 37.8 | 44% | 0.44 | 20% | 0.203 | S | C | . | . | G | 310 helix | trans | -77.9 | -4.1 | -174.8 | -58.2 | 176.4 | 0 | 0 | 0 | 113.3 | W191 N192 P197 V198 F397 | W191-L194 WeakPolarHBondContact O-CB 3.49Å; W191-L194 PolarHBondContact O-N 3.28Å; N192-L194 PolarHBondContact O-N 3.24Å; L194-P197 WeakPolarHBondContact O-CD 3.44Å; L194-V198 WeakPolarHBondContact O-CB 3.32Å; L194-V198 WeakPolarHBondContact O-CG2 3.11Å; L194-V198 PolarHBondContact O-N 3.46Å; L194-F397 HydrophobicContact CB-CE1 4.24Å; L194-F397 HydrophobicContact CB-CE2 3.97Å; L194-F397 HydrophobicContact CB-CZ 3.56Å |
| 195 | F | 82.4 | Confident | 82.3 | Confident | 1 Ų | 1 | 43.2 Ų | 43.2 | 0% | 0.004 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.9 | -44.8 | -173.9 | -143.5 | -86.4 | 0 | 0 | 0 | 112.9 | N192 C193 V198 Y199 A349 L352 S353 F397 N400 I401 N404 F405 | N192-F195 VanDerWaalsContact O-CB 3.31Å; N192-F195 WeakPolarHBondContact O-CB 3.35Å; N192-F195 PolarHBondContact O-N 2.91Å; C193-F195 PolarHBondContact O-N 2.93Å; F195-V198 PolarHBondContact O-N 3.3Å; F195-Y199 WeakPolarHBondContact O-CB 3.4Å; F195-Y199 PolarHBondContact O-N 3.27Å; F195-A349 HydrophobicContact CD1-CB 3.84Å; F195-A349 HydrophobicContact CE1-CB 4.14Å; F195-L352 HydrophobicContact CD1-CD2 4.35Å; F195-L352 HydrophobicContact CD2-CD2 3.72Å; F195-L352 HydrophobicContact CE1-CD2 4.33Å; F195-L352 HydrophobicContact CE2-CD2 3.7Å; F195-L352 HydrophobicContact CG-CD2 4.06Å; F195-L352 HydrophobicContact CZ-CD2 4.02Å; F195-S353 WeakPolarHBondContact CB-OG 3.27Å; F195-F397 HydrophobicContact CB-CE2 4.3Å; F195-F397 HydrophobicContact CD2-CD2 4.35Å; F195-F397 AromaticContact CD2-CE2 3.78Å; F195-F397 HydrophobicContact CD2-CE2 3.78Å; F195-F397 HydrophobicContact CG-CE2 4.47Å; F195-N400 HydrophobicContact CE2-CB 3.97Å; F195-N400 WeakPolarHBondContact CZ-O 3.01Å; F195-I401 HydrophobicContact CD2-CG1 4.12Å; F195-I401 HydrophobicContact CE2-CB 4.3Å; F195-I401 HydrophobicContact CE2-CG1 3.61Å; F195-I401 HydrophobicContact CZ-CB 4.48Å; F195-I401 HydrophobicContact CZ-CG1 4.06Å; F195-N404 HydrophobicContact CE1-CB 4.1Å; F195-N404 HydrophobicContact CZ-CB 3.83Å; F195-F405 HydrophobicContact CD1-CE2 4.2Å; F195-F405 HydrophobicContact CE1-CD2 4.05Å; F195-F405 AromaticContact CE1-CE2 3.52Å; F195-F405 HydrophobicContact CE1-CE2 3.52Å; F195-F405 HydrophobicContact CE1-CZ 4.38Å; F195-F405 HydrophobicContact CZ-CD2 4.08Å; F195-F405 AromaticContact CZ-CE2 3.9Å; F195-F405 HydrophobicContact CZ-CE2 3.9Å |
| 196 | F | 80.5 | Confident | 81.1 | Confident | 27 Ų | 27 | 50.4 Ų | 50.4 | 12% | 0.118 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -71.4 | -41.5 | 176.1 | -179.4 | -114.4 | 0 | 0 | 0 | 113.4 | V198 Y199 Y200 L217 L350 S353 | F196-V198 VanDerWaalsContact C-N 3.34Å; F196-V198 PolarHBondContact O-N 3.38Å; F196-Y199 HydrophobicContact CD2-CD1 4.14Å; F196-Y199 HydrophobicContact CE2-CD1 4.21Å; F196-Y199 WeakPolarHBondContact O-CB 3.42Å; F196-Y199 PolarHBondContact O-N 3.3Å; F196-Y200 WeakPolarHBondContact O-CB 3.39Å; F196-Y200 PolarHBondContact O-N 3Å; F196-L217 HydrophobicContact CE1-CB 4.16Å; F196-L217 HydrophobicContact CE1-CD1 4.28Å; F196-L217 HydrophobicContact CZ-CB 4.1Å; F196-L350 HydrophobicContact CB-CD2 3.99Å; F196-L350 HydrophobicContact CB-CG 4.3Å; F196-L350 HydrophobicContact CD1-CD2 3.86Å; F196-L350 HydrophobicContact CD1-CG 4.48Å; F196-L350 HydrophobicContact CD2-CD1 3.81Å; F196-L350 HydrophobicContact CD2-CD2 3.76Å; F196-L350 HydrophobicContact CD2-CG 3.46Å; F196-L350 VanDerWaalsContact CD2-CG 3.46Å; F196-L350 HydrophobicContact CE1-CD2 4.23Å; F196-L350 HydrophobicContact CE2-CD1 3.56Å; F196-L350 HydrophobicContact CE2-CD2 4.14Å; F196-L350 HydrophobicContact CE2-CG 3.78Å; F196-L350 HydrophobicContact CG-CD1 4.48Å; F196-L350 HydrophobicContact CG-CD2 3.6Å; F196-L350 HydrophobicContact CG-CG 3.84Å; F196-L350 HydrophobicContact CZ-CD1 4.05Å; F196-L350 HydrophobicContact CZ-CD2 4.36Å; F196-L350 HydrophobicContact CZ-CG 4.42Å; F196-S353 VanDerWaalsContact CB-OG 3.22Å; F196-S353 WeakPolarHBondContact CB-OG 3.36Å; F196-S353 PolarHBondContact N-OG 3.49Å |
| 197 | P | 82.8 | Confident | 79.5 | Confident | 65 Ų | 65 | 50.4 Ų | 50.4 | 42% | 0.422 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -51 | -48.3 | 166.1 | -31.2 | 35.6 | 0 | 0 | 0 | 113.7 | C193 L194 Y200 V201 | C193-P197 WeakPolarHBondContact O-CD 3.39Å; L194-P197 WeakPolarHBondContact O-CD 3.44Å; P197-Y200 PolarHBondContact O-N 3.01Å; P197-V201 WeakPolarHBondContact O-CG2 3.35Å; P197-V201 PolarHBondContact O-N 3.01Å |
| 198 | V | 82.4 | Confident | 77.7 | Confident | 59 Ų | 59 | 55 Ų | 55 | 36% | 0.358 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65.4 | -40.9 | 177.5 | 171.2 | 0 | 0 | 0 | 0 | 111.8 | L194 F195 F196 Y200 G202 F397 I401 | L194-V198 WeakPolarHBondContact O-CB 3.32Å; L194-V198 WeakPolarHBondContact O-CG2 3.11Å; L194-V198 PolarHBondContact O-N 3.46Å; F195-V198 PolarHBondContact O-N 3.3Å; F196-V198 VanDerWaalsContact C-N 3.34Å; F196-V198 PolarHBondContact O-N 3.38Å; V198-Y200 PolarHBondContact O-N 3.21Å; V198-G202 PolarHBondContact O-N 3.27Å; V198-F397 HydrophobicContact CG2-CE1 4.27Å; V198-F397 HydrophobicContact CG2-CZ 4.09Å; V198-I401 HydrophobicContact CG1-CD1 4.04Å |
| 199 | Y | 79.2 | Confident | 75.8 | Confident | 61 Ų | 61 | 61.1 Ų | 61.1 | 24% | 0.239 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -57.6 | -46.2 | 172.8 | 177.8 | -89.4 | 0 | 0 | 0 | 112.1 | F195 F196 G202 H203 A349 F405 | F195-Y199 WeakPolarHBondContact O-CB 3.4Å; F195-Y199 PolarHBondContact O-N 3.27Å; F196-Y199 HydrophobicContact CD2-CD1 4.14Å; F196-Y199 HydrophobicContact CE2-CD1 4.21Å; F196-Y199 WeakPolarHBondContact O-CB 3.42Å; F196-Y199 PolarHBondContact O-N 3.3Å; Y199-G202 PolarHBondContact O-N 3.12Å; Y199-H203 PolarHBondContact O-N 3.25Å; Y199-A349 HydrophobicContact CD2-CB 4.12Å; Y199-A349 HydrophobicContact CG-CB 4.37Å; Y199-F405 AromaticContact CD2-CE1 3.71Å; Y199-F405 HydrophobicContact CD2-CE1 3.71Å; Y199-F405 AromaticContact CD2-CZ 3.78Å; Y199-F405 HydrophobicContact CD2-CZ 3.78Å; Y199-F405 HydrophobicContact CE2-CE1 4.45Å; Y199-F405 HydrophobicContact CG-CZ 4.36Å |
| 200 | Y | 75.4 | Confident | 74 | Confident | 47 Ų | 47 | 72 Ų | 72 | 18% | 0.184 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -68.2 | -43.5 | -179 | -178.6 | -101.9 | 0 | 0 | 0 | 112.1 | F196 P197 V198 G202 H203 L204 Q211 P213 | F196-Y200 WeakPolarHBondContact O-CB 3.39Å; F196-Y200 PolarHBondContact O-N 3Å; P197-Y200 PolarHBondContact O-N 3.01Å; V198-Y200 PolarHBondContact O-N 3.21Å; Y200-G202 VanDerWaalsContact C-N 3.33Å; Y200-G202 PolarHBondContact O-N 3.37Å; Y200-H203 WeakPolarHBondContact O-CB 3.37Å; Y200-H203 PolarHBondContact O-N 3.46Å; Y200-H203 VanDerWaalsContact O-N 3.16Å; Y200-L204 HydrophobicContact CD1-CD1 4.18Å; Y200-L204 HydrophobicContact CD1-CD2 4.35Å; Y200-L204 HydrophobicContact CD2-CD1 4.11Å; Y200-L204 HydrophobicContact CE1-CD1 3.7Å; Y200-L204 HydrophobicContact CE1-CD2 3.63Å; Y200-L204 HydrophobicContact CE1-CG 4.32Å; Y200-L204 HydrophobicContact CE2-CD1 3.61Å; Y200-L204 HydrophobicContact CG-CD1 4.36Å; Y200-L204 WeakPolarHBondContact O-CD1 3.5Å; Y200-L204 PolarHBondContact O-N 3.38Å; Y200-Q211 PolarHBondContact OH-O 3.44Å; Y200-P213 HydrophobicContact CD1-CB 4.38Å; Y200-P213 HydrophobicContact CD2-CB 4.13Å; Y200-P213 HydrophobicContact CE1-CB 4.03Å; Y200-P213 HydrophobicContact CE1-CG 4.43Å; Y200-P213 HydrophobicContact CE2-CB 3.76Å; Y200-P213 HydrophobicContact CG-CB 4.44Å; Y200-P213 WeakPolarHBondContact OH-CD 3.15Å |
| 201 | V | 78.9 | Confident | 72.4 | Confident | 85 Ų | 85 | 73.6 Ų | 73.6 | 52% | 0.515 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 172.3 | 172 | 0 | 0 | 0 | 0 | 110.8 | P197 H203 L204 C205 | P197-V201 WeakPolarHBondContact O-CG2 3.35Å; P197-V201 PolarHBondContact O-N 3.01Å; V201-H203 VanDerWaalsContact C-N 3.25Å; V201-H203 PolarHBondContact O-N 3.33Å; V201-L204 PolarHBondContact O-N 3.47Å; V201-L204 VanDerWaalsContact O-N 3.17Å; V201-C205 PolarHBondContact O-N 2.86Å; V201-C205 PolarHBondContact O-SG 3.45Å; V201-C205 VanDerWaalsContact O-SG 3.37Å |
| 202 | G | 71.6 | Confident | 71.2 | Confident | 41 Ų | 41 | 73.6 Ų | 73.6 | 42% | 0.423 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.4 | -28 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | V198 Y199 Y200 K206 | V198-G202 PolarHBondContact O-N 3.27Å; Y199-G202 PolarHBondContact O-N 3.12Å; Y200-G202 VanDerWaalsContact C-N 3.33Å; Y200-G202 PolarHBondContact O-N 3.37Å; G202-K206 WeakPolarHBondContact O-CB 3.31Å |
| 203 | H | 70.6 | Confident | 69.9 | Low | 44 Ų | 44 | 76.4 Ų | 76.4 | 20% | 0.204 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -74.4 | -46.1 | 170.8 | -173.5 | -82.6 | 0 | 0 | 0 | 111.5 | Y199 Y200 V201 C205 K206 S207 | Y199-H203 PolarHBondContact O-N 3.25Å; Y200-H203 WeakPolarHBondContact O-CB 3.37Å; Y200-H203 PolarHBondContact O-N 3.46Å; Y200-H203 VanDerWaalsContact O-N 3.16Å; V201-H203 VanDerWaalsContact C-N 3.25Å; V201-H203 PolarHBondContact O-N 3.33Å; H203-C205 VanDerWaalsContact C-N 3.31Å; H203-C205 PolarHBondContact O-N 3.4Å; H203-K206 PolarHBondContact O-N 3.05Å; H203-S207 PolarHBondContact O-N 3.1Å |
| 204 | L | 70.9 | Confident | 68.7 | Low | 72 Ų | 72 | 84.8 Ų | 84.8 | 38% | 0.377 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.4 | -35.6 | 178.5 | -98.2 | 60.2 | 0 | 0 | 0 | 113.1 | Y200 V201 K206 | Y200-L204 HydrophobicContact CD1-CD1 4.18Å; Y200-L204 HydrophobicContact CD1-CD2 4.35Å; Y200-L204 HydrophobicContact CD2-CD1 4.11Å; Y200-L204 HydrophobicContact CE1-CD1 3.7Å; Y200-L204 HydrophobicContact CE1-CD2 3.63Å; Y200-L204 HydrophobicContact CE1-CG 4.32Å; Y200-L204 HydrophobicContact CE2-CD1 3.61Å; Y200-L204 HydrophobicContact CG-CD1 4.36Å; Y200-L204 WeakPolarHBondContact O-CD1 3.5Å; Y200-L204 PolarHBondContact O-N 3.38Å; V201-L204 PolarHBondContact O-N 3.47Å; V201-L204 VanDerWaalsContact O-N 3.17Å; L204-K206 PolarHBondContact O-N 3.31Å |
| 205 | C | 68.8 | Low | 67.9 | Low | 113 Ų | 113 | 85.8 Ų | 85.8 | 76% | 0.764 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | -2.3 | 174.7 | -65.2 | 0 | 0 | 0 | 0 | 114.1 | V201 H203 | V201-C205 PolarHBondContact O-N 2.86Å; V201-C205 PolarHBondContact O-SG 3.45Å; V201-C205 VanDerWaalsContact O-SG 3.37Å; H203-C205 VanDerWaalsContact C-N 3.31Å; H203-C205 PolarHBondContact O-N 3.4Å |
| 206 | K | 66 | Low | 67.2 | Low | 153 Ų | 153 | 89.2 Ų | 89.2 | 67% | 0.665 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -131.5 | -17.1 | -168.4 | -161.7 | 173.9 | -175.6 | 177.3 | 0 | 115.1 | G202 H203 L204 | G202-K206 WeakPolarHBondContact O-CB 3.31Å; H203-K206 PolarHBondContact O-N 3.05Å; L204-K206 PolarHBondContact O-N 3.31Å |
| 207 | S | 54.7 | Low | 66.6 | Low | 43 Ų | 43 | 91.2 Ų | 91.2 | 30% | 0.301 | 47% | 0.465 | S | S | . | . | trans | -126.7 | 132.3 | 172.4 | -74 | 0 | 0 | 0 | 0 | 110.1 | H203 E209 | H203-S207 PolarHBondContact O-N 3.1Å; S207-E209 PolarHBondContact O-N 3.12Å | ||
| 208 | P | 51.3 | Low | 65.9 | Low | 135 Ų | 135 | 97.2 Ų | 97.2 | 88% | 0.877 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -69.9 | -16 | 174.2 | 30.2 | -35.4 | 0 | 0 | 0 | 112.8 | R210 | P208-R210 PolarHBondContact O-N 2.7Š|
| 209 | E | 50.3 | Low | 65.4 | Low | 131 Ų | 131 | 98.5 Ų | 98.5 | 61% | 0.612 | 48% | 0.481 | S | S | * | . | trans | -79.9 | 99.1 | -175.6 | -163.8 | 171.7 | -148 | 0 | 0 | 111.7 | S207 Q211 | S207-E209 PolarHBondContact O-N 3.12Å; E209-Q211 VanDerWaalsContact C-N 3.28Å; E209-Q211 HydrophobicContact CG-CG 4.4Å; E209-Q211 PolarHBondContact O-N 2.9Å | ||
| 210 | R | 52 | Low | 64.8 | Low | 231 Ų | 231 | 96.4 Ų | 96.4 | 87% | 0.872 | 48% | 0.476 | S | S | * | . | trans | -73.8 | 68.5 | -177.2 | -70.1 | -175.9 | 171.7 | -172.1 | -1.3 | 113.4 | P208 | P208-R210 PolarHBondContact O-N 2.7Š| ||
| 211 | Q | 55.5 | Low | 64.4 | Low | 55 Ų | 55 | 95.4 Ų | 95.4 | 26% | 0.257 | 48% | 0.475 | S | S | . | . | trans | -68.1 | 138.4 | 168.6 | -67.3 | 172 | -15.7 | 0 | 0 | 110.6 | Y200 E209 | Y200-Q211 PolarHBondContact OH-O 3.44Å; E209-Q211 VanDerWaalsContact C-N 3.28Å; E209-Q211 HydrophobicContact CG-CG 4.4Å; E209-Q211 PolarHBondContact O-N 2.9Å | ||
| 212 | T | 64.5 | Low | 63.8 | Low | 64 Ų | 64 | 99.7 Ų | 99.7 | 39% | 0.393 | 48% | 0.482 | S | S | . | . | trans | -73.2 | 150.7 | -172 | 71.3 | 0 | 0 | 0 | 0 | 112.3 | R214 Q215 R216 | T212-R214 PolarHBondContact O-N 3.48Å; T212-Q215 VanDerWaalsContact N-OE1 3.13Å; T212-Q215 PolarHBondContact O-N 3.42Å; T212-Q215 VanDerWaalsContact O-N 3.11Å; T212-Q215 VanDerWaalsContact OG1-CD 3.23Å; T212-Q215 VanDerWaalsContact OG1-CG 3.29Å; T212-Q215 WeakPolarHBondContact OG1-CG 3.36Å; T212-Q215 PolarHBondContact OG1-N 2.86Å; T212-Q215 PolarHBondContact OG1-OE1 3.43Å; T212-R216 PolarHBondContact O-N 2.67Å | ||
| 213 | P | 59.9 | Low | 63.6 | Low | 61 Ų | 61 | 100.3 Ų | 100.3 | 40% | 0.396 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.8 | -30 | -176.9 | 26.7 | -31.8 | 0 | 0 | 0 | 111.6 | Y200 L217 | Y200-P213 HydrophobicContact CD1-CB 4.38Å; Y200-P213 HydrophobicContact CD2-CB 4.13Å; Y200-P213 HydrophobicContact CE1-CB 4.03Å; Y200-P213 HydrophobicContact CE1-CG 4.43Å; Y200-P213 HydrophobicContact CE2-CB 3.76Å; Y200-P213 HydrophobicContact CG-CB 4.44Å; Y200-P213 WeakPolarHBondContact OH-CD 3.15Å; P213-L217 WeakPolarHBondContact O-CB 3.28Å; P213-L217 PolarHBondContact O-N 2.99Å |
| 214 | R | 60.8 | Low | 63.4 | Low | 209 Ų | 209 | 99.3 Ų | 99.3 | 79% | 0.789 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -68.3 | -31.7 | 175.2 | -73.3 | -176.7 | 172.3 | -179.4 | -2.6 | 112.9 | T212 R218 | T212-R214 PolarHBondContact O-N 3.48Å; R214-R218 VanDerWaalsContact O-CB 3.26Å; R214-R218 WeakPolarHBondContact O-CB 3.5Å; R214-R218 PolarHBondContact O-N 3.34Å |
| 215 | Q | 66.5 | Low | 63.1 | Low | 104 Ų | 104 | 97.4 Ų | 97.4 | 49% | 0.486 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -70 | -50.6 | 173.9 | -77.8 | 161.5 | -44.1 | 0 | 0 | 111 | T212 L217 R218 E219 | T212-Q215 VanDerWaalsContact N-OE1 3.13Å; T212-Q215 PolarHBondContact O-N 3.42Å; T212-Q215 VanDerWaalsContact O-N 3.11Å; T212-Q215 VanDerWaalsContact OG1-CD 3.23Å; T212-Q215 VanDerWaalsContact OG1-CG 3.29Å; T212-Q215 WeakPolarHBondContact OG1-CG 3.36Å; T212-Q215 PolarHBondContact OG1-N 2.86Å; T212-Q215 PolarHBondContact OG1-OE1 3.43Å; Q215-L217 VanDerWaalsContact C-N 3.34Å; Q215-L217 PolarHBondContact O-N 3.12Å; Q215-R218 PolarHBondContact O-N 3.48Å; Q215-R218 VanDerWaalsContact O-N 3.08Å; Q215-E219 WeakPolarHBondContact O-CG 3.33Å; Q215-E219 PolarHBondContact O-N 3.05Å |
| 216 | R | 68.4 | Low | 62.5 | Low | 74 Ų | 74 | 99.7 Ų | 99.7 | 28% | 0.279 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.4 | -36.8 | 177.8 | -71.2 | -52.4 | -161.5 | 158.8 | 3.1 | 113.5 | T212 E219 C220 | T212-R216 PolarHBondContact O-N 2.67Å; R216-E219 WeakPolarHBondContact CD-OE2 3.27Å; R216-E219 IonicContact CZ-OE2 3.15Å; R216-E219 IonicContact NE-OE2 2.7Å; R216-E219 IonicContact NH1-OE2 2.75Å; R216-E219 PolarHBondContact NH1-OE2 2.89Å; R216-C220 PolarHBondContact O-N 2.9Å |
| 217 | L | 67.3 | Low | 62.1 | Low | 69 Ų | 69 | 100.6 Ų | 100.6 | 36% | 0.361 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.1 | -50 | 169.5 | 179.1 | 62 | 0 | 0 | 0 | 110.9 | F196 P213 Q215 E219 C220 C221 L350 | F196-L217 HydrophobicContact CE1-CB 4.16Å; F196-L217 HydrophobicContact CE1-CD1 4.28Å; F196-L217 HydrophobicContact CZ-CB 4.1Å; P213-L217 WeakPolarHBondContact O-CB 3.28Å; P213-L217 PolarHBondContact O-N 2.99Å; Q215-L217 VanDerWaalsContact C-N 3.34Å; Q215-L217 PolarHBondContact O-N 3.12Å; L217-E219 PolarHBondContact O-N 3.49Å; L217-C220 PolarHBondContact O-N 3.46Å; L217-C221 VanDerWaalsContact O-CB 3.3Å; L217-C221 WeakPolarHBondContact O-CB 3.41Å; L217-C221 PolarHBondContact O-N 2.98Å; L217-C221 PolarHBondContact O-SG 3.32Å; L217-L350 HydrophobicContact CD1-CD1 4.07Å; L217-L350 HydrophobicContact CD1-CD2 3.44Å; L217-L350 VanDerWaalsContact CD1-CD2 3.44Å; L217-L350 HydrophobicContact CD1-CG 4.43Å |
| 218 | R | 69.3 | Low | 62.4 | Low | 191 Ų | 191 | 99.1 Ų | 99.1 | 72% | 0.721 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62.9 | -40.9 | 179.8 | -176.4 | 179 | -69.2 | -177 | -4 | 113.1 | R214 Q215 C221 R222 | R214-R218 VanDerWaalsContact O-CB 3.26Å; R214-R218 WeakPolarHBondContact O-CB 3.5Å; R214-R218 PolarHBondContact O-N 3.34Å; Q215-R218 PolarHBondContact O-N 3.48Å; Q215-R218 VanDerWaalsContact O-N 3.08Å; R218-C221 PolarHBondContact O-N 3.42Å; R218-R222 PolarHBondContact O-N 2.8Å |
| 219 | E | 70.8 | Confident | 63.1 | Low | 85 Ų | 85 | 96.2 Ų | 96.2 | 40% | 0.397 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -57.1 | -55.8 | 175.3 | -76.7 | 168.7 | -154.7 | 0 | 0 | 111.2 | Q215 R216 L217 C221 R222 | Q215-E219 WeakPolarHBondContact O-CG 3.33Å; Q215-E219 PolarHBondContact O-N 3.05Å; R216-E219 WeakPolarHBondContact CD-OE2 3.27Å; R216-E219 IonicContact CZ-OE2 3.15Å; R216-E219 IonicContact NE-OE2 2.7Å; R216-E219 IonicContact NH1-OE2 2.75Å; R216-E219 PolarHBondContact NH1-OE2 2.89Å; L217-E219 PolarHBondContact O-N 3.49Å; E219-C221 VanDerWaalsContact C-N 3.3Å; E219-C221 PolarHBondContact O-N 3.24Å; E219-R222 WeakPolarHBondContact O-CB 3.3Å; E219-R222 PolarHBondContact O-N 3.19Å |
| 220 | C | 68.2 | Low | 64.3 | Low | 18 Ų | 18 | 92 Ų | 92 | 12% | 0.122 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -74.3 | -17.8 | -179.1 | -70.7 | 0 | 0 | 0 | 0 | 113.1 | R216 L217 R222 F223 E347 L350 | R216-C220 PolarHBondContact O-N 2.9Å; L217-C220 PolarHBondContact O-N 3.46Å; C220-R222 VanDerWaalsContact C-N 3.32Å; C220-F223 WeakPolarHBondContact O-CB 3.26Å; C220-F223 PolarHBondContact O-N 3.14Å; C220-E347 HydrophobicContact CB-CG 4.18Å; C220-L350 HydrophobicContact CB-CD1 3.3Å |
| 221 | C | 66.4 | Low | 65.3 | Low | 25 Ų | 25 | 85.4 Ų | 85.4 | 17% | 0.169 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -70.5 | -24.1 | 169.6 | -79.8 | 0 | 0 | 0 | 0 | 113.3 | L217 R218 E219 F223 F224 | L217-C221 VanDerWaalsContact O-CB 3.3Å; L217-C221 WeakPolarHBondContact O-CB 3.41Å; L217-C221 PolarHBondContact O-N 2.98Å; L217-C221 PolarHBondContact O-SG 3.32Å; R218-C221 PolarHBondContact O-N 3.42Å; E219-C221 VanDerWaalsContact C-N 3.3Å; E219-C221 PolarHBondContact O-N 3.24Å; C221-F223 PolarHBondContact O-N 3.36Å; C221-F224 PolarHBondContact O-N 2.88Å; C221-F224 VanDerWaalsContact O-N 3.12Å |
| 222 | R | 65.5 | Low | 66.3 | Low | 175 Ų | 175 | 90.6 Ų | 90.6 | 66% | 0.66 | 44% | 0.438 | S | S | * | . | G | 310 helix | trans | -62.5 | -19.4 | 172.2 | -71.9 | 177.2 | 162.4 | 172.5 | -7.7 | 113.1 | R218 E219 C220 F224 G225 | R218-R222 PolarHBondContact O-N 2.8Å; E219-R222 WeakPolarHBondContact O-CB 3.3Å; E219-R222 PolarHBondContact O-N 3.19Å; C220-R222 VanDerWaalsContact C-N 3.32Å; R222-F224 PolarHBondContact O-N 3.38Å; R222-F224 VanDerWaalsContact O-N 3.16Å; R222-G225 CarbonylContact O-C 3.57Å; R222-G225 PolarHBondContact O-N 2.79Å |
| 223 | F | 68.2 | Low | 67 | Low | 54 Ų | 54 | 89.4 Ų | 89.4 | 24% | 0.237 | 43% | 0.43 | C | S | . | . | G | 310 helix | trans | -57.3 | -24.7 | 172.2 | -173.7 | -115 | 0 | 0 | 0 | 113.6 | C220 C221 L340 A343 E347 | C220-F223 WeakPolarHBondContact O-CB 3.26Å; C220-F223 PolarHBondContact O-N 3.14Å; C221-F223 PolarHBondContact O-N 3.36Å; F223-L340 HydrophobicContact CE1-CB 4.06Å; F223-L340 HydrophobicContact CE1-CD2 3.99Å; F223-L340 HydrophobicContact CE1-CG 4.41Å; F223-L340 HydrophobicContact CZ-CB 3.83Å; F223-L340 HydrophobicContact CZ-CD2 4.44Å; F223-L340 VanDerWaalsContact CZ-O 3.27Å; F223-L340 WeakPolarHBondContact CZ-O 3.28Å; F223-A343 HydrophobicContact CE1-CB 4.2Å; F223-A343 HydrophobicContact CE2-CB 4.02Å; F223-A343 HydrophobicContact CZ-CB 3.47Å; F223-A343 VanDerWaalsContact CZ-CB 3.47Å; F223-E347 HydrophobicContact CB-CB 4.31Å; F223-E347 HydrophobicContact CB-CG 3.97Å; F223-E347 HydrophobicContact CD1-CB 3.95Å; F223-E347 HydrophobicContact CD2-CB 4.14Å; F223-E347 HydrophobicContact CD2-CG 4.03Å; F223-E347 WeakPolarHBondContact CD2-OE2 3.45Å; F223-E347 HydrophobicContact CE1-CB 4.26Å; F223-E347 HydrophobicContact CE2-CB 4.45Å; F223-E347 WeakPolarHBondContact CE2-OE2 3.42Å; F223-E347 HydrophobicContact CG-CB 3.88Å; F223-E347 HydrophobicContact CG-CG 3.93Å |
| 224 | F | 66.4 | Low | 67.8 | Low | 23 Ų | 23 | 87.7 Ų | 87.7 | 10% | 0.101 | 42% | 0.417 | C | S | . | . | G | 310 helix | trans | -86.3 | -7.4 | 176.6 | -67.6 | -86.2 | 0 | 0 | 0 | 113.8 | C221 R222 L229 V233 V238 F351 I354 | C221-F224 PolarHBondContact O-N 2.88Å; C221-F224 VanDerWaalsContact O-N 3.12Å; R222-F224 PolarHBondContact O-N 3.38Å; R222-F224 VanDerWaalsContact O-N 3.16Å; F224-L229 HydrophobicContact CD1-CD1 4.45Å; F224-L229 HydrophobicContact CD2-CD1 3.96Å; F224-L229 HydrophobicContact CE2-CD1 4.07Å; F224-L229 HydrophobicContact CG-CD1 4.15Å; F224-L229 HydrophobicContact CZ-CD1 4.36Å; F224-V233 HydrophobicContact CB-CG1 4.17Å; F224-V233 HydrophobicContact CD1-CG1 4.26Å; F224-V238 HydrophobicContact CE1-CG2 3.79Å; F224-V238 HydrophobicContact CZ-CG2 4.45Å; F224-F351 AromaticContact CE1-CD2 3.9Å; F224-F351 HydrophobicContact CE1-CD2 3.9Å; F224-F351 HydrophobicContact CE1-CE2 4.27Å; F224-F351 AromaticContact CZ-CD2 3.76Å; F224-F351 HydrophobicContact CZ-CD2 3.76Å; F224-I354 HydrophobicContact CE2-CD1 3.74Å; F224-I354 HydrophobicContact CZ-CD1 3.93Å |
| 225 | G | 63.6 | Low | 68.7 | Low | 33 Ų | 33 | 83.5 Ų | 83.5 | 34% | 0.34 | 40% | 0.404 | S | S | . | . | trans | 131 | 167 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | R222 E227 G228 | R222-G225 CarbonylContact O-C 3.57Å; R222-G225 PolarHBondContact O-N 2.79Å; G225-E227 VanDerWaalsContact C-N 3.32Å; G225-E227 PolarHBondContact O-N 3.41Å; G225-G228 WeakPolarHBondContact O-CA 3.42Å; G225-G228 PolarHBondContact O-N 2.82Å | ||
| 226 | D | 57.6 | Low | 69.2 | Low | 160 Ų | 160 | 83.3 Ų | 83.3 | 86% | 0.856 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -29.2 | -176.4 | -68.5 | -64 | 0 | 0 | 0 | 114.1 | G228 | D226-G228 VanDerWaalsContact C-N 3.27Š|
| 227 | E | 56.5 | Low | 69.6 | Low | 172 Ų | 172 | 83.7 Ų | 83.7 | 80% | 0.804 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -9.4 | 170.3 | -63.4 | -168 | 161.5 | 0 | 0 | 113.5 | G225 | G225-E227 VanDerWaalsContact C-N 3.32Å; G225-E227 PolarHBondContact O-N 3.41Å |
| 228 | G | 62.2 | Low | 70.3 | Confident | 12 Ų | 12 | 80.4 Ų | 80.4 | 12% | 0.124 | 40% | 0.397 | C | S | . | . | trans | 76.5 | -136.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | G225 D226 T230 | G225-G228 WeakPolarHBondContact O-CA 3.42Å; G225-G228 PolarHBondContact O-N 2.82Å; D226-G228 VanDerWaalsContact C-N 3.27Å; G228-T230 VanDerWaalsContact C-N 3.26Å; G228-T230 PolarHBondContact O-N 3.46Å | ||
| 229 | L | 64.4 | Low | 71 | Confident | 75 Ų | 75 | 73.1 Ų | 73.1 | 39% | 0.393 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -86.1 | 50.2 | -166.8 | -155.2 | 94.6 | 0 | 0 | 0 | 113.6 | F224 F234 I354 | F224-L229 HydrophobicContact CD1-CD1 4.45Å; F224-L229 HydrophobicContact CD2-CD1 3.96Å; F224-L229 HydrophobicContact CE2-CD1 4.07Å; F224-L229 HydrophobicContact CG-CD1 4.15Å; F224-L229 HydrophobicContact CZ-CD1 4.36Å; L229-F234 HydrophobicContact CD2-CD2 4.48Å; L229-I354 HydrophobicContact CD1-CD1 3.99Å |
| 230 | T | 76.6 | Confident | 71.7 | Confident | 41 Ų | 41 | 71.7 Ų | 71.7 | 25% | 0.252 | 38% | 0.376 | S | S | . | . | trans | -55.8 | 137 | 177.9 | -53.9 | 0 | 0 | 0 | 0 | 110.8 | G228 K232 V233 F234 | G228-T230 VanDerWaalsContact C-N 3.26Å; G228-T230 PolarHBondContact O-N 3.46Å; T230-K232 HydrophobicContact CG2-CB 4.35Å; T230-K232 PolarHBondContact O-N 3.5Å; T230-K232 VanDerWaalsContact O-N 3.1Å; T230-V233 WeakPolarHBondContact O-CA 3.27Å; T230-V233 WeakPolarHBondContact O-CB 3.34Å; T230-V233 PolarHBondContact O-N 3.48Å; T230-F234 PolarHBondContact O-N 2.94Å | ||
| 231 | P | 73.7 | Confident | 72.5 | Confident | 93 Ų | 93 | 71.3 Ų | 71.3 | 60% | 0.604 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -57.5 | -32 | -175.8 | 19.2 | -32.5 | 0 | 0 | 0 | 113.6 | F234 F235 | P231-F234 WeakPolarHBondContact O-CB 3.33Å; P231-F234 PolarHBondContact O-N 3.4Å; P231-F235 WeakPolarHBondContact O-CD2 3.41Å; P231-F235 PolarHBondContact O-N 3.16Å |
| 232 | K | 76.4 | Confident | 73.5 | Confident | 164 Ų | 164 | 70.5 Ų | 70.5 | 71% | 0.713 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -59.4 | -45.1 | 171.3 | -171.4 | 177.1 | -177.6 | 179.6 | 0 | 112 | T230 T236 | T230-K232 HydrophobicContact CG2-CB 4.35Å; T230-K232 PolarHBondContact O-N 3.5Å; T230-K232 VanDerWaalsContact O-N 3.1Å; K232-T236 WeakPolarHBondContact O-CB 3.25Å; K232-T236 PolarHBondContact O-N 3.45Å; K232-T236 PolarHBondContact O-OG1 3.04Å; K232-T236 VanDerWaalsContact O-OG1 3.07Å |
| 233 | V | 77.3 | Confident | 74.6 | Confident | 39 Ų | 39 | 67.5 Ų | 67.5 | 24% | 0.236 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 175.5 | -179.9 | 0 | 0 | 0 | 0 | 110.3 | F224 T230 T236 K237 | F224-V233 HydrophobicContact CB-CG1 4.17Å; F224-V233 HydrophobicContact CD1-CG1 4.26Å; T230-V233 WeakPolarHBondContact O-CA 3.27Å; T230-V233 WeakPolarHBondContact O-CB 3.34Å; T230-V233 PolarHBondContact O-N 3.48Å; V233-T236 PolarHBondContact O-N 2.96Å; V233-K237 HydrophobicContact CG1-CB 4.26Å; V233-K237 HydrophobicContact CG1-CG 4.15Å; V233-K237 WeakPolarHBondContact O-CA 3.37Å; V233-K237 VanDerWaalsContact O-CB 3.24Å; V233-K237 WeakPolarHBondContact O-CB 3.34Å; V233-K237 PolarHBondContact O-N 3.19Å |
| 234 | F | 77.6 | Confident | 75.7 | Confident | 26 Ų | 26 | 66.1 Ų | 66.1 | 11% | 0.114 | 36% | 0.359 | C | S | . | . | I | π-helix | trans | -58.1 | -51.1 | 176 | 179.2 | -92.4 | 0 | 0 | 0 | 112.5 | L229 T230 P231 V238 A239 I354 A358 F362 | L229-F234 HydrophobicContact CD2-CD2 4.48Å; T230-F234 PolarHBondContact O-N 2.94Å; P231-F234 WeakPolarHBondContact O-CB 3.33Å; P231-F234 PolarHBondContact O-N 3.4Å; F234-V238 HydrophobicContact CD2-CB 3.92Å; F234-V238 HydrophobicContact CD2-CG1 4.12Å; F234-V238 HydrophobicContact CD2-CG2 4.09Å; F234-V238 HydrophobicContact CE2-CB 4.2Å; F234-V238 HydrophobicContact CE2-CG1 3.93Å; F234-V238 HydrophobicContact CG-CB 4.39Å; F234-V238 WeakPolarHBondContact O-CA 3.39Å; F234-V238 VanDerWaalsContact O-CB 3.28Å; F234-V238 WeakPolarHBondContact O-CB 3.44Å; F234-V238 PolarHBondContact O-N 3.5Å; F234-A239 PolarHBondContact O-N 3.33Å; F234-I354 HydrophobicContact CD2-CG2 4.25Å; F234-I354 HydrophobicContact CE2-CG2 3.98Å; F234-A358 HydrophobicContact CE2-CB 4Å; F234-A358 HydrophobicContact CZ-CB 3.59Å; F234-F362 HydrophobicContact CE1-CD2 4.07Å; F234-F362 AromaticContact CE1-CE2 3.47Å; F234-F362 HydrophobicContact CE1-CE2 3.47Å; F234-F362 VanDerWaalsContact CE1-CE2 3.47Å; F234-F362 HydrophobicContact CE1-CZ 4.04Å; F234-F362 AromaticContact CZ-CD2 3.99Å; F234-F362 HydrophobicContact CZ-CD2 3.99Å; F234-F362 AromaticContact CZ-CE2 3.54Å; F234-F362 HydrophobicContact CZ-CE2 3.54Å; F234-F362 HydrophobicContact CZ-CZ 4.49Å |
| 235 | F | 78.9 | Confident | 76.7 | Confident | 120 Ų | 120 | 66.6 Ų | 66.6 | 53% | 0.526 | 36% | 0.36 | S | S | . | . | I | π-helix | trans | -69.1 | -33.7 | 179 | -79.8 | -72.8 | 0 | 0 | 0 | 113.5 | P231 A239 P240 F362 | P231-F235 WeakPolarHBondContact O-CD2 3.41Å; P231-F235 PolarHBondContact O-N 3.16Å; F235-A239 HydrophobicContact CD1-CB 4.24Å; F235-P240 WeakPolarHBondContact O-CD 3.47Å; F235-F362 HydrophobicContact CZ-CE1 4.21Å; F235-F362 HydrophobicContact CZ-CZ 4.35Å |
| 236 | T | 76.9 | Confident | 78 | Confident | 100 Ų | 100 | 65.4 Ų | 65.4 | 61% | 0.613 | 35% | 0.346 | S | S | * | . | I | π-helix | trans | -83.2 | -29.6 | 179.1 | -56.1 | 0 | 0 | 0 | 0 | 114.1 | K232 V233 | K232-T236 WeakPolarHBondContact O-CB 3.25Å; K232-T236 PolarHBondContact O-N 3.45Å; K232-T236 PolarHBondContact O-OG1 3.04Å; K232-T236 VanDerWaalsContact O-OG1 3.07Å; V233-T236 PolarHBondContact O-N 2.96Å |
| 237 | K | 77.6 | Confident | 79.6 | Confident | 82 Ų | 82 | 60.6 Ų | 60.6 | 36% | 0.357 | 32% | 0.32 | S | S | . | . | I | π-helix | trans | -117.6 | -18.7 | -172.1 | -64.9 | -89.5 | -163.2 | 160.4 | 0 | 115.2 | V233 F241 V339 | V233-K237 HydrophobicContact CG1-CB 4.26Å; V233-K237 HydrophobicContact CG1-CG 4.15Å; V233-K237 WeakPolarHBondContact O-CA 3.37Å; V233-K237 VanDerWaalsContact O-CB 3.24Å; V233-K237 WeakPolarHBondContact O-CB 3.34Å; V233-K237 PolarHBondContact O-N 3.19Å; K237-F241 WeakPolarHBondContact O-CD2 3.42Å; K237-V339 HydrophobicContact CD-CG1 3.57Å |
| 238 | V | 81.3 | Confident | 81.4 | Confident | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.006 | 29% | 0.285 | C | S | . | . | I | π-helix | trans | -108.5 | -49.5 | -179.5 | -176.3 | 0 | 0 | 0 | 0 | 111.3 | F224 F234 F241 G242 I354 V355 | F224-V238 HydrophobicContact CE1-CG2 3.79Å; F224-V238 HydrophobicContact CZ-CG2 4.45Å; F234-V238 HydrophobicContact CD2-CB 3.92Å; F234-V238 HydrophobicContact CD2-CG1 4.12Å; F234-V238 HydrophobicContact CD2-CG2 4.09Å; F234-V238 HydrophobicContact CE2-CB 4.2Å; F234-V238 HydrophobicContact CE2-CG1 3.93Å; F234-V238 HydrophobicContact CG-CB 4.39Å; F234-V238 WeakPolarHBondContact O-CA 3.39Å; F234-V238 VanDerWaalsContact O-CB 3.28Å; F234-V238 WeakPolarHBondContact O-CB 3.44Å; F234-V238 PolarHBondContact O-N 3.5Å; V238-F241 PolarHBondContact O-N 3.28Å; V238-F241 VanDerWaalsContact O-N 3.1Å; V238-G242 PolarHBondContact O-N 2.97Å; V238-I354 HydrophobicContact CG1-CG2 4.09Å; V238-V355 HydrophobicContact CG1-CG2 3.81Å |
| 239 | A | 84.4 | Confident | 82.8 | Confident | 37 Ų | 37 | 53.3 Ų | 53.3 | 31% | 0.306 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -53 | -47.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | F234 F235 F241 G242 L243 | F234-A239 PolarHBondContact O-N 3.33Å; F235-A239 HydrophobicContact CD1-CB 4.24Å; A239-F241 VanDerWaalsContact C-N 3.3Å; A239-F241 PolarHBondContact O-N 3.39Å; A239-G242 PolarHBondContact O-N 3.13Å; A239-L243 WeakPolarHBondContact O-CB 3.43Å; A239-L243 PolarHBondContact O-N 2.7Å |
| 240 | P | 85.8 | Confident | 84.2 | Confident | 55 Ų | 55 | 52.9 Ų | 52.9 | 36% | 0.357 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -65.5 | -31.8 | 178.3 | 24.1 | -33.9 | 0 | 0 | 0 | 113.2 | F235 L244 | F235-P240 WeakPolarHBondContact O-CD 3.47Å; P240-L244 WeakPolarHBondContact O-CB 3.42Å; P240-L244 WeakPolarHBondContact O-CG 3.38Å; P240-L244 PolarHBondContact O-N 3.29Å |
| 241 | F | 86 | Confident | 85 | Confident | 10 Ų | 10 | 51.9 Ų | 51.9 | 4% | 0.044 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -73.6 | -38.1 | 175.9 | -78.1 | -93.4 | 0 | 0 | 0 | 112.4 | K237 V238 A239 L244 W245 Y332 L335 F336 V339 F351 | K237-F241 WeakPolarHBondContact O-CD2 3.42Å; V238-F241 PolarHBondContact O-N 3.28Å; V238-F241 VanDerWaalsContact O-N 3.1Å; A239-F241 VanDerWaalsContact C-N 3.3Å; A239-F241 PolarHBondContact O-N 3.39Å; F241-L244 PolarHBondContact O-N 3.02Å; F241-W245 WeakPolarHBondContact O-CB 3.37Å; F241-W245 PolarHBondContact O-N 3.34Å; F241-Y332 HydrophobicContact CB-CD2 4.49Å; F241-Y332 HydrophobicContact CB-CE2 4.22Å; F241-Y332 AromaticContact CD1-CD2 3.85Å; F241-Y332 HydrophobicContact CD1-CD2 3.85Å; F241-Y332 AromaticContact CD1-CE2 3.84Å; F241-Y332 HydrophobicContact CD1-CE2 3.84Å; F241-L335 HydrophobicContact CE1-CB 3.77Å; F241-L335 HydrophobicContact CZ-CB 3.79Å; F241-F336 HydrophobicContact CE1-CB 4.13Å; F241-V339 HydrophobicContact CE2-CB 4.37Å; F241-V339 HydrophobicContact CE2-CG1 4.19Å; F241-V339 HydrophobicContact CE2-CG2 4.48Å; F241-V339 HydrophobicContact CZ-CB 3.96Å; F241-V339 HydrophobicContact CZ-CG1 4.27Å; F241-V339 HydrophobicContact CZ-CG2 4.07Å; F241-F351 HydrophobicContact CB-CE1 4.08Å; F241-F351 HydrophobicContact CB-CZ 3.6Å; F241-F351 HydrophobicContact CD1-CE1 4.49Å; F241-F351 HydrophobicContact CD1-CZ 4.09Å; F241-F351 HydrophobicContact CD2-CZ 4.26Å; F241-F351 HydrophobicContact CG-CE1 4.42Å; F241-F351 AromaticContact CG-CZ 3.73Å; F241-F351 HydrophobicContact CG-CZ 3.73Å |
| 242 | G | 87.3 | Confident | 86 | Confident | 8 Ų | 8 | 48 Ų | 48 | 8% | 0.082 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.7 | -43.8 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V238 A239 W245 I246 | V238-G242 PolarHBondContact O-N 2.97Å; A239-G242 PolarHBondContact O-N 3.13Å; G242-W245 WeakPolarHBondContact O-CB 3.36Å; G242-W245 PolarHBondContact O-N 2.85Å; G242-I246 WeakPolarHBondContact O-CB 3.48Å; G242-I246 WeakPolarHBondContact O-CD1 3.37Å; G242-I246 VanDerWaalsContact O-CG1 3.28Å; G242-I246 WeakPolarHBondContact O-CG1 3.37Å; G242-I246 PolarHBondContact O-N 3.4Å |
| 243 | L | 88.3 | Confident | 86.8 | Confident | 113 Ų | 113 | 41 Ų | 41 | 59% | 0.592 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -61.6 | -46.7 | 175 | -175.9 | 61.8 | 0 | 0 | 0 | 111.8 | A239 W245 I246 L247 | A239-L243 WeakPolarHBondContact O-CB 3.43Å; A239-L243 PolarHBondContact O-N 2.7Å; L243-W245 VanDerWaalsContact C-N 3.33Å; L243-W245 PolarHBondContact O-N 2.83Å; L243-I246 PolarHBondContact O-N 3.08Å; L243-L247 WeakPolarHBondContact O-CB 3.17Å; L243-L247 PolarHBondContact O-N 3.21Å |
| 244 | L | 89.9 | Confident | 87.5 | Confident | 24 Ų | 24 | 41.1 Ų | 41.1 | 13% | 0.126 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.8 | -42.1 | 174.1 | -82.3 | 163.8 | 0 | 0 | 0 | 112.5 | P240 F241 T248 M328 L331 Y332 L335 | P240-L244 WeakPolarHBondContact O-CB 3.42Å; P240-L244 WeakPolarHBondContact O-CG 3.38Å; P240-L244 PolarHBondContact O-N 3.29Å; F241-L244 PolarHBondContact O-N 3.02Å; L244-T248 VanDerWaalsContact O-CB 3.3Å; L244-T248 WeakPolarHBondContact O-CB 3.38Å; L244-T248 PolarHBondContact O-N 2.95Å; L244-T248 PolarHBondContact O-OG1 3.3Å; L244-M328 HydrophobicContact CD2-SD 3.76Å; L244-L331 HydrophobicContact CD2-CD2 4.05Å; L244-L331 HydrophobicContact CD2-CG 4.47Å; L244-Y332 HydrophobicContact CB-CD2 4.37Å; L244-L335 HydrophobicContact CD1-CD1 3.72Å |
| 245 | W | 89.4 | Confident | 88.2 | Confident | 33 Ų | 33 | 39.9 Ų | 39.9 | 13% | 0.125 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.5 | -48 | 177.6 | -178.8 | -85.2 | 0 | 0 | 0 | 111.8 | N192 F241 G242 L243 T248 N249 Y332 L352 N400 | N192-W245 PolarHBondContact ND2-NE1 3.29Å; F241-W245 WeakPolarHBondContact O-CB 3.37Å; F241-W245 PolarHBondContact O-N 3.34Å; G242-W245 WeakPolarHBondContact O-CB 3.36Å; G242-W245 PolarHBondContact O-N 2.85Å; L243-W245 VanDerWaalsContact C-N 3.33Å; L243-W245 PolarHBondContact O-N 2.83Å; W245-T248 WeakPolarHBondContact O-CB 3.45Å; W245-T248 PolarHBondContact O-N 3.35Å; W245-N249 PolarHBondContact NE1-ND2 3.13Å; W245-N249 PolarHBondContact O-N 2.86Å; W245-N249 VanDerWaalsContact O-N 3.13Å; W245-N249 PolarHBondContact O-ND2 3.16Å; W245-Y332 HydrophobicContact CB-CE2 4.46Å; W245-Y332 HydrophobicContact CE3-CD1 4.34Å; W245-Y332 HydrophobicContact CE3-CD2 4.5Å; W245-Y332 AromaticContact CE3-CE1 3.81Å; W245-Y332 HydrophobicContact CE3-CE1 3.81Å; W245-Y332 AromaticContact CE3-CE2 3.98Å; W245-Y332 HydrophobicContact CE3-CE2 3.98Å; W245-Y332 AromaticContact CE3-CZ 3.63Å; W245-Y332 AromaticContact CZ3-CE1 3.89Å; W245-Y332 HydrophobicContact CZ3-CE1 3.89Å; W245-L352 HydrophobicContact CH2-CD1 4Å; W245-L352 HydrophobicContact CZ2-CD1 4.02Å; W245-L352 HydrophobicContact CZ3-CD1 4.26Å; W245-N400 WeakPolarHBondContact CH2-OD1 3.35Å |
| 246 | I | 89.9 | Confident | 88.8 | Confident | 9 Ų | 9 | 34.2 Ų | 34.2 | 5% | 0.046 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -70.5 | -43.2 | -177.6 | -65.8 | 159.2 | 0 | 0 | 0 | 110.3 | T185 G242 L243 T248 N249 Y250 N359 I363 | T185-I246 HydrophobicContact CG2-CG2 4.2Å; G242-I246 WeakPolarHBondContact O-CB 3.48Å; G242-I246 WeakPolarHBondContact O-CD1 3.37Å; G242-I246 VanDerWaalsContact O-CG1 3.28Å; G242-I246 WeakPolarHBondContact O-CG1 3.37Å; G242-I246 PolarHBondContact O-N 3.4Å; L243-I246 PolarHBondContact O-N 3.08Å; I246-T248 VanDerWaalsContact C-N 3.3Å; I246-T248 PolarHBondContact O-N 2.65Å; I246-N249 PolarHBondContact O-N 2.91Å; I246-Y250 VanDerWaalsContact O-CB 3.28Å; I246-Y250 WeakPolarHBondContact O-CB 3.4Å; I246-Y250 PolarHBondContact O-N 3.3Å; I246-N359 HydrophobicContact CD1-CB 3.99Å; I246-N359 WeakPolarHBondContact CD1-OD1 3.26Å; I246-I363 HydrophobicContact CD1-CD1 3.28Å |
| 247 | L | 91.6 | Very high | 89.4 | Confident | 59 Ų | 59 | 33 Ų | 33 | 31% | 0.309 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -58.2 | -42.1 | 173.9 | -177.2 | 62.4 | 0 | 0 | 0 | 111.5 | L243 N249 Y250 L251 M328 | L243-L247 WeakPolarHBondContact O-CB 3.17Å; L243-L247 PolarHBondContact O-N 3.21Å; L247-N249 PolarHBondContact O-N 2.85Å; L247-Y250 PolarHBondContact O-N 3.39Å; L247-L251 HydrophobicContact CD1-CD1 3.85Å; L247-L251 HydrophobicContact CD1-CD2 4.4Å; L247-L251 HydrophobicContact CD1-CG 3.93Å; L247-L251 HydrophobicContact CG-CD1 3.82Å; L247-L251 HydrophobicContact CG-CG 4.32Å; L247-L251 WeakPolarHBondContact O-CB 3.41Å; L247-L251 WeakPolarHBondContact O-CG 3.28Å; L247-L251 PolarHBondContact O-N 3.35Å; L247-M328 HydrophobicContact CD2-CE 3.96Å; L247-M328 HydrophobicContact CD2-CG 4.23Å; L247-M328 HydrophobicContact CD2-SD 4.06Å; L247-M328 HydrophobicContact CG-CG 4.49Å |
| 248 | T | 93.2 | Very high | 89.8 | Confident | 10 Ų | 10 | 33.8 Ų | 33.8 | 6% | 0.061 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56.2 | -51.6 | 173.9 | -64.3 | 0 | 0 | 0 | 0 | 111.7 | L244 W245 I246 Y252 S325 M328 S329 | L244-T248 VanDerWaalsContact O-CB 3.3Å; L244-T248 WeakPolarHBondContact O-CB 3.38Å; L244-T248 PolarHBondContact O-N 2.95Å; L244-T248 PolarHBondContact O-OG1 3.3Å; W245-T248 WeakPolarHBondContact O-CB 3.45Å; W245-T248 PolarHBondContact O-N 3.35Å; I246-T248 VanDerWaalsContact C-N 3.3Å; I246-T248 PolarHBondContact O-N 2.65Å; T248-Y252 PolarHBondContact O-N 2.84Å; T248-S325 WeakPolarHBondContact O-CB 3.43Å; T248-S325 PolarHBondContact O-OG 3.48Å; T248-M328 VanDerWaalsContact OG1-CB 3.31Å; T248-M328 WeakPolarHBondContact OG1-CB 3.16Å; T248-S329 PolarHBondContact OG1-N 3.47Å |
| 249 | N | 92.7 | Very high | 90.2 | Very high | 21 Ų | 21 | 34.1 Ų | 34.1 | 11% | 0.112 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -70.7 | -39.2 | -177.4 | -73.7 | -90.9 | 0 | 0 | 0 | 111.9 | T185 T189 W245 I246 L247 Y252 L253 | T185-N249 HydrophobicContact CG2-CB 3.78Å; T189-N249 HydrophobicContact CG2-CB 4.2Å; W245-N249 PolarHBondContact NE1-ND2 3.13Å; W245-N249 PolarHBondContact O-N 2.86Å; W245-N249 VanDerWaalsContact O-N 3.13Å; W245-N249 PolarHBondContact O-ND2 3.16Å; I246-N249 PolarHBondContact O-N 2.91Å; L247-N249 PolarHBondContact O-N 2.85Å; N249-Y252 WeakPolarHBondContact O-CB 3.34Å; N249-Y252 PolarHBondContact O-N 3.01Å; N249-L253 WeakPolarHBondContact O-CG 3.42Å; N249-L253 PolarHBondContact O-N 3.32Å |
| 250 | Y | 92.6 | Very high | 90.4 | Very high | 65 Ų | 65 | 34.1 Ų | 34.1 | 26% | 0.255 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.8 | -47.5 | 177.2 | 173.6 | -113.6 | 0 | 0 | 0 | 112 | P181 F182 T185 I246 L247 Y252 L253 Q254 | P181-Y250 HydrophobicContact CB-CE2 4.48Å; P181-Y250 HydrophobicContact CG-CE2 4.36Å; F182-Y250 HydrophobicContact CB-CD2 4.16Å; F182-Y250 HydrophobicContact CB-CE2 3.92Å; F182-Y250 AromaticContact CD2-CD2 3.96Å; F182-Y250 HydrophobicContact CD2-CD2 3.96Å; F182-Y250 HydrophobicContact CD2-CE2 4.1Å; F182-Y250 HydrophobicContact CD2-CG 4.38Å; T185-Y250 WeakPolarHBondContact OG1-CA 3.31Å; I246-Y250 VanDerWaalsContact O-CB 3.28Å; I246-Y250 WeakPolarHBondContact O-CB 3.4Å; I246-Y250 PolarHBondContact O-N 3.3Å; L247-Y250 PolarHBondContact O-N 3.39Å; Y250-Y252 VanDerWaalsContact C-N 3.27Å; Y250-Y252 PolarHBondContact O-N 3.36Å; Y250-L253 PolarHBondContact O-N 2.86Å; Y250-Q254 VanDerWaalsContact O-CB 3.23Å; Y250-Q254 WeakPolarHBondContact O-CB 3.4Å; Y250-Q254 PolarHBondContact O-N 2.94Å |
| 251 | L | 94.9 | Very high | 90.7 | Very high | 21 Ų | 21 | 31.5 Ų | 31.5 | 11% | 0.11 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.4 | -34.8 | 176.9 | -68.2 | 171.4 | 0 | 0 | 0 | 112 | L247 A255 L321 A324 M328 | L247-L251 HydrophobicContact CD1-CD1 3.85Å; L247-L251 HydrophobicContact CD1-CD2 4.4Å; L247-L251 HydrophobicContact CD1-CG 3.93Å; L247-L251 HydrophobicContact CG-CD1 3.82Å; L247-L251 HydrophobicContact CG-CG 4.32Å; L247-L251 WeakPolarHBondContact O-CB 3.41Å; L247-L251 WeakPolarHBondContact O-CG 3.28Å; L247-L251 PolarHBondContact O-N 3.35Å; L251-A255 WeakPolarHBondContact O-CB 3.34Å; L251-A255 PolarHBondContact O-N 2.94Å; L251-L321 HydrophobicContact CD2-CD2 3.51Å; L251-A324 HydrophobicContact CD1-CB 4.01Å; L251-M328 HydrophobicContact CD1-CG 4.36Å |
| 252 | Y | 94.2 | Very high | 91 | Very high | 11 Ų | 11 | 31.1 Ų | 31.1 | 4% | 0.043 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -66.6 | -49.1 | 174.9 | -173.7 | -95.8 | 0 | 0 | 0 | 112 | W164 T168 T248 N249 Y250 A255 L256 V264 F268 | W164-Y252 HydrophobicContact CH2-CE1 4.25Å; W164-Y252 HydrophobicContact CH2-CE2 4.33Å; W164-Y252 HydrophobicContact CZ2-CE1 4.26Å; W164-Y252 AromaticContact CZ2-CE2 3.84Å; W164-Y252 HydrophobicContact CZ2-CE2 3.84Å; W164-Y252 AromaticContact CZ2-CZ 3.61Å; T168-Y252 HydrophobicContact CG2-CE1 4.42Å; T168-Y252 WeakPolarHBondContact CG2-OH 3.3Å; T168-Y252 PolarHBondContact OG1-OH 3.49Å; T168-Y252 VanDerWaalsContact OG1-OH 3.11Å; T248-Y252 PolarHBondContact O-N 2.84Å; N249-Y252 WeakPolarHBondContact O-CB 3.34Å; N249-Y252 PolarHBondContact O-N 3.01Å; Y250-Y252 VanDerWaalsContact C-N 3.27Å; Y250-Y252 PolarHBondContact O-N 3.36Å; Y252-A255 WeakPolarHBondContact O-CB 3.3Å; Y252-A255 PolarHBondContact O-N 3.35Å; Y252-L256 HydrophobicContact CD1-CD1 4.17Å; Y252-L256 HydrophobicContact CE1-CD1 3.85Å; Y252-L256 HydrophobicContact CE1-CG 4.49Å; Y252-L256 PolarHBondContact O-N 2.88Å; Y252-L256 VanDerWaalsContact O-N 3.11Å; Y252-V264 HydrophobicContact CD2-CG1 3.82Å; Y252-V264 HydrophobicContact CE1-CG1 4.28Å; Y252-V264 HydrophobicContact CE2-CG1 3.31Å; Y252-V264 HydrophobicContact CG-CG1 4.48Å; Y252-F268 HydrophobicContact CD2-CB 4.35Å; Y252-F268 AromaticContact CD2-CD2 3.77Å; Y252-F268 HydrophobicContact CD2-CD2 3.77Å; Y252-F268 HydrophobicContact CD2-CE2 4.29Å; Y252-F268 HydrophobicContact CD2-CG 4.11Å; Y252-F268 HydrophobicContact CE2-CB 3.84Å; Y252-F268 HydrophobicContact CE2-CD1 4.43Å; Y252-F268 HydrophobicContact CE2-CD2 4.01Å; Y252-F268 AromaticContact CE2-CG 3.84Å; Y252-F268 HydrophobicContact CE2-CG 3.84Å |
| 253 | L | 93 | Very high | 91.2 | Very high | 16 Ų | 16 | 30.9 Ų | 30.9 | 8% | 0.084 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -66.5 | -37.9 | 177.9 | -71.3 | -165.2 | 0 | 0 | 0 | 112.5 | A171 F175 L184 N249 Y250 A255 L256 R257 | A171-L253 HydrophobicContact CB-CD2 3.92Å; F175-L253 HydrophobicContact CE2-CB 4.18Å; F175-L253 HydrophobicContact CE2-CD2 4.3Å; F175-L253 WeakPolarHBondContact CE2-O 3.46Å; F175-L253 HydrophobicContact CZ-CB 3.95Å; F175-L253 HydrophobicContact CZ-CD1 4.37Å; L184-L253 HydrophobicContact CB-CD1 4.28Å; L184-L253 HydrophobicContact CD2-CD1 4.09Å; L184-L253 HydrophobicContact CG-CD1 3.95Å; N249-L253 WeakPolarHBondContact O-CG 3.42Å; N249-L253 PolarHBondContact O-N 3.32Å; Y250-L253 PolarHBondContact O-N 2.86Å; L253-A255 VanDerWaalsContact C-N 3.3Å; L253-A255 PolarHBondContact O-N 3.48Å; L253-L256 HydrophobicContact CD2-CD1 3.92Å; L253-L256 WeakPolarHBondContact O-CB 3.32Å; L253-L256 PolarHBondContact O-N 3.49Å; L253-R257 PolarHBondContact O-N 2.84Å |
| 254 | Q | 91.4 | Very high | 91.5 | Very high | 43 Ų | 43 | 25.5 Ų | 25.5 | 20% | 0.201 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -65.3 | -33.2 | 174.9 | -173.4 | 68.3 | -20.9 | 0 | 0 | 112 | P181 Y250 R257 L321 | P181-Q254 VanDerWaalsContact CG-OE1 3.31Å; Y250-Q254 VanDerWaalsContact O-CB 3.23Å; Y250-Q254 WeakPolarHBondContact O-CB 3.4Å; Y250-Q254 PolarHBondContact O-N 2.94Å; Q254-R257 PolarHBondContact O-N 3.41Å; Q254-L321 HydrophobicContact CB-CD1 4.39Å; Q254-L321 HydrophobicContact CG-CD1 3.81Å |
| 255 | A | 92.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -69.5 | -37.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L251 Y252 L253 R257 K258 I259 V264 L321 V322 | L251-A255 WeakPolarHBondContact O-CB 3.34Å; L251-A255 PolarHBondContact O-N 2.94Å; Y252-A255 WeakPolarHBondContact O-CB 3.3Å; Y252-A255 PolarHBondContact O-N 3.35Å; L253-A255 VanDerWaalsContact C-N 3.3Å; L253-A255 PolarHBondContact O-N 3.48Å; A255-R257 PolarHBondContact O-N 3.44Å; A255-K258 PolarHBondContact O-N 2.96Å; A255-I259 WeakPolarHBondContact O-CG1 3.32Å; A255-I259 PolarHBondContact O-N 2.87Å; A255-V264 HydrophobicContact CB-CG2 4.28Å; A255-L321 HydrophobicContact CB-CB 3.92Å; A255-V322 HydrophobicContact CB-CB 4.49Å; A255-V322 HydrophobicContact CB-CG2 3.33Å |
| 256 | L | 91.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -60.3 | -24.9 | 173.8 | -74.4 | 171.2 | 0 | 0 | 0 | 112.9 | T168 A171 K172 F175 Y252 L253 K258 T261 V264 | T168-L256 HydrophobicContact CG2-CD1 4.04Å; T168-L256 HydrophobicContact CG2-CD2 3.63Å; T168-L256 HydrophobicContact CG2-CG 4.46Å; A171-L256 HydrophobicContact CB-CD1 4.11Å; K172-L256 WeakPolarHBondContact CD-O 3.39Å; K172-L256 WeakPolarHBondContact CE-O 3.21Å; K172-L256 PolarHBondContact NZ-O 2.99Å; F175-L256 HydrophobicContact CD2-CB 4.35Å; F175-L256 HydrophobicContact CE2-CB 4.26Å; Y252-L256 HydrophobicContact CD1-CD1 4.17Å; Y252-L256 HydrophobicContact CE1-CD1 3.85Å; Y252-L256 HydrophobicContact CE1-CG 4.49Å; Y252-L256 PolarHBondContact O-N 2.88Å; Y252-L256 VanDerWaalsContact O-N 3.11Å; L253-L256 HydrophobicContact CD2-CD1 3.92Å; L253-L256 WeakPolarHBondContact O-CB 3.32Å; L253-L256 PolarHBondContact O-N 3.49Å; L256-K258 VanDerWaalsContact C-N 3.29Å; L256-K258 PolarHBondContact O-N 3.43Å; L256-T261 HydrophobicContact CD2-CG2 4.2Å; L256-V264 HydrophobicContact CD2-CB 3.89Å; L256-V264 HydrophobicContact CD2-CG1 3.92Å; L256-V264 HydrophobicContact CD2-CG2 3.83Å; L256-V264 HydrophobicContact CG-CG1 4.12Å; L256-V264 HydrophobicContact CG-CG2 4.3Å |
| 257 | R | 88.9 | Confident | 92.2 | Very high | 74 Ų | 74 | 22.4 Ų | 22.4 | 28% | 0.279 | 10% | 0.103 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -21.9 | 170.4 | -67 | -177.2 | 62.5 | -169.2 | -7.3 | 113.6 | F175 D179 P181 L253 Q254 A255 | F175-R257 HydrophobicContact CB-CG 4.29Å; F175-R257 HydrophobicContact CD1-CG 3.92Å; F175-R257 HydrophobicContact CD2-CG 3.85Å; F175-R257 HydrophobicContact CE1-CG 4.25Å; F175-R257 HydrophobicContact CE2-CG 4.15Å; F175-R257 HydrophobicContact CG-CG 3.75Å; F175-R257 HydrophobicContact CZ-CG 4.36Å; D179-R257 VanDerWaalsContact CG-CZ 3.45Å; D179-R257 PolarHBondContact O-NH1 2.9Å; D179-R257 VanDerWaalsContact O-NH1 3.15Å; D179-R257 IonicContact OD1-CZ 2.71Å; D179-R257 IonicContact OD1-NE 3.1Å; D179-R257 PolarHBondContact OD1-NE 2.9Å; D179-R257 IonicContact OD1-NH1 3.09Å; D179-R257 IonicContact OD1-NH2 3.76Å; D179-R257 PolarHBondContact OD1-NH2 3.47Å; D179-R257 IonicContact OD2-CZ 3.51Å; D179-R257 IonicContact OD2-NH2 3.82Å; D179-R257 PolarHBondContact OD2-NH2 2.72Å; P181-R257 VanDerWaalsContact CD-NH1 3.29Å; L253-R257 PolarHBondContact O-N 2.84Å; Q254-R257 PolarHBondContact O-N 3.41Å; A255-R257 PolarHBondContact O-N 3.44Å |
| 258 | K | 87.6 | Confident | 92.3 | Very high | 99 Ų | 99 | 20.5 Ų | 20.5 | 43% | 0.43 | 9% | 0.092 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | -34.1 | -173.2 | -61.3 | -56.5 | -177 | -171.8 | 0 | 115.3 | A255 L256 | A255-K258 PolarHBondContact O-N 2.96Å; L256-K258 VanDerWaalsContact C-N 3.29Å; L256-K258 PolarHBondContact O-N 3.43Å |
| 259 | I | 89.5 | Confident | 92.3 | Very high | 9 Ų | 9 | 20.1 Ų | 20.1 | 5% | 0.046 | 9% | 0.09 | C | C | . | . | S | Bend | trans | -129.8 | 173.8 | -175.1 | 47.7 | 160.5 | 0 | 0 | 0 | 112.6 | K172 A255 V264 L267 S315 I319 V322 | K172-I259 PolarHBondContact NZ-O 2.94Å; A255-I259 WeakPolarHBondContact O-CG1 3.32Å; A255-I259 PolarHBondContact O-N 2.87Å; I259-V264 HydrophobicContact CD1-CG2 3.56Å; I259-V264 HydrophobicContact CG1-CG2 3.57Å; I259-L267 HydrophobicContact CD1-CD1 4.12Å; I259-S315 VanDerWaalsContact CG2-OG 3.27Å; I259-S315 WeakPolarHBondContact CG2-OG 3.12Å; I259-I319 HydrophobicContact CD1-CG1 4.27Å; I259-V322 HydrophobicContact CD1-CG2 3.92Å |
| 260 | N | 88.9 | Confident | 92.3 | Very high | 36 Ų | 36 | 19.3 Ų | 19.3 | 19% | 0.193 | 9% | 0.086 | C | C | . | . | trans | -75.3 | 158.5 | -174.9 | -65.9 | -16 | 0 | 0 | 0 | 112.3 | T262 D263 V264 R442 | N260-T262 VanDerWaalsContact C-N 3.34Å; N260-T262 PolarHBondContact O-N 3.47Å; N260-D263 WeakPolarHBondContact CB-OD2 3.24Å; N260-D263 PolarHBondContact O-N 2.78Å; N260-V264 WeakPolarHBondContact O-CG2 3.1Å; N260-V264 PolarHBondContact O-N 3.42Å; N260-R442 PolarHBondContact ND2-NH1 3.18Å | ||
| 261 | T | 91.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -69.1 | -36.1 | -173.6 | 79 | 0 | 0 | 0 | 0 | 111.9 | Q169 K172 L256 S265 D430 | Q169-T261 PolarHBondContact NE2-OG1 3.26Å; K172-T261 HydrophobicContact CB-CG2 3.57Å; K172-T261 HydrophobicContact CD-CG2 4.12Å; K172-T261 HydrophobicContact CG-CG2 3.6Å; L256-T261 HydrophobicContact CD2-CG2 4.2Å; T261-S265 VanDerWaalsContact O-CB 3.3Å; T261-S265 WeakPolarHBondContact O-CB 3.32Å; T261-S265 PolarHBondContact O-N 2.84Å; T261-S265 PolarHBondContact O-OG 3.5Å; T261-D430 PolarHBondContact N-OD2 3.46Å; T261-D430 VanDerWaalsContact OG1-CG 3.28Å; T261-D430 PolarHBondContact OG1-OD1 3.44Å; T261-D430 PolarHBondContact OG1-OD2 3.43Å; T261-D430 VanDerWaalsContact OG1-OD2 3.13Å |
| 262 | T | 92.2 | Very high | 92.1 | Very high | 2 Ų | 2 | 18.4 Ų | 18.4 | 1% | 0.012 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -57.1 | -49.6 | 172.3 | -57.7 | 0 | 0 | 0 | 0 | 111.1 | N260 S265 A266 V423 N426 A427 D430 | N260-T262 VanDerWaalsContact C-N 3.34Å; N260-T262 PolarHBondContact O-N 3.47Å; T262-S265 PolarHBondContact O-N 2.85Å; T262-A266 WeakPolarHBondContact O-CB 3.22Å; T262-A266 PolarHBondContact O-N 2.82Å; T262-V423 HydrophobicContact CG2-CG1 4.32Å; T262-N426 VanDerWaalsContact OG1-C 3.24Å; T262-N426 PolarHBondContact OG1-O 3.37Å; T262-A427 HydrophobicContact CG2-CB 3.83Å; T262-A427 WeakPolarHBondContact OG1-CA 3.22Å; T262-A427 PolarHBondContact OG1-N 2.76Å; T262-A427 VanDerWaalsContact OG1-N 3.13Å; T262-D430 WeakPolarHBondContact CB-OD2 3.45Å; T262-D430 PolarHBondContact N-OD2 2.71Å; T262-D430 PolarHBondContact OG1-OD2 3.27Å |
| 263 | D | 91.5 | Very high | 92.1 | Very high | 4 Ų | 4 | 17.9 Ų | 17.9 | 2% | 0.021 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -67.1 | -43.2 | -175.9 | -57.3 | -31.6 | 0 | 0 | 0 | 111 | N260 S265 A266 L267 M305 R442 | N260-D263 WeakPolarHBondContact CB-OD2 3.24Å; N260-D263 PolarHBondContact O-N 2.78Å; D263-S265 VanDerWaalsContact C-N 3.33Å; D263-S265 PolarHBondContact O-N 2.95Å; D263-A266 PolarHBondContact O-N 2.92Å; D263-L267 VanDerWaalsContact O-CB 3.31Å; D263-L267 WeakPolarHBondContact O-CB 3.16Å; D263-L267 WeakPolarHBondContact O-CD1 3.38Å; D263-L267 WeakPolarHBondContact O-CG 3.17Å; D263-L267 PolarHBondContact O-N 2.66Å; D263-M305 HydrophobicContact CB-CE 3.86Å; D263-M305 HydrophobicContact CB-SD 4.46Å; D263-R442 WeakPolarHBondContact OD1-CD 3.32Å; D263-R442 IonicContact OD2-CZ 2.89Å; D263-R442 IonicContact OD2-NE 2.68Å; D263-R442 IonicContact OD2-NH1 2.99Å; D263-R442 PolarHBondContact OD2-NH1 2.93Å |
| 264 | V | 94.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -59.7 | -42.5 | 172.2 | 172.8 | 0 | 0 | 0 | 0 | 111.7 | Y252 A255 L256 I259 N260 F268 V322 | Y252-V264 HydrophobicContact CD2-CG1 3.82Å; Y252-V264 HydrophobicContact CE1-CG1 4.28Å; Y252-V264 HydrophobicContact CE2-CG1 3.31Å; Y252-V264 HydrophobicContact CG-CG1 4.48Å; A255-V264 HydrophobicContact CB-CG2 4.28Å; L256-V264 HydrophobicContact CD2-CB 3.89Å; L256-V264 HydrophobicContact CD2-CG1 3.92Å; L256-V264 HydrophobicContact CD2-CG2 3.83Å; L256-V264 HydrophobicContact CG-CG1 4.12Å; L256-V264 HydrophobicContact CG-CG2 4.3Å; I259-V264 HydrophobicContact CD1-CG2 3.56Å; I259-V264 HydrophobicContact CG1-CG2 3.57Å; N260-V264 WeakPolarHBondContact O-CG2 3.1Å; N260-V264 PolarHBondContact O-N 3.42Å; V264-F268 VanDerWaalsContact O-CB 3.27Å; V264-F268 WeakPolarHBondContact O-CB 3.05Å; V264-F268 PolarHBondContact O-N 3.42Å; V264-V322 HydrophobicContact CB-CG2 4.19Å; V264-V322 HydrophobicContact CG1-CG1 4.38Å; V264-V322 HydrophobicContact CG1-CG2 4Å; V264-V322 HydrophobicContact CG2-CG2 3.87Å; V264-V322 WeakPolarHBondContact O-CG1 3.43Å |
| 265 | S | 93.6 | Very high | 92.1 | Very high | 1 Ų | 1 | 17.8 Ų | 17.8 | 1% | 0.007 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -69.2 | -41.9 | -178.8 | -56.9 | 0 | 0 | 0 | 0 | 112 | T261 T262 D263 F268 C269 N426 | T261-S265 VanDerWaalsContact O-CB 3.3Å; T261-S265 WeakPolarHBondContact O-CB 3.32Å; T261-S265 PolarHBondContact O-N 2.84Å; T261-S265 PolarHBondContact O-OG 3.5Å; T262-S265 PolarHBondContact O-N 2.85Å; D263-S265 VanDerWaalsContact C-N 3.33Å; D263-S265 PolarHBondContact O-N 2.95Å; S265-F268 PolarHBondContact O-N 2.86Å; S265-C269 PolarHBondContact O-N 3.47Å; S265-C269 PolarHBondContact O-SG 3.18Å; S265-N426 PolarHBondContact OG-ND2 2.62Å |
| 266 | A | 94.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 19.1 Ų | 19.1 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -62.1 | -53.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | T262 D263 F268 C269 M305 V423 V446 I449 | T262-A266 WeakPolarHBondContact O-CB 3.22Å; T262-A266 PolarHBondContact O-N 2.82Å; D263-A266 PolarHBondContact O-N 2.92Å; A266-F268 VanDerWaalsContact C-N 3.28Å; A266-F268 PolarHBondContact O-N 3.31Å; A266-C269 WeakPolarHBondContact O-CB 3.44Å; A266-C269 PolarHBondContact O-N 3.35Å; A266-M305 HydrophobicContact CB-CE 4.43Å; A266-V423 HydrophobicContact CB-CG1 3.94Å; A266-V446 HydrophobicContact CB-CB 4.44Å; A266-V446 HydrophobicContact CB-CG1 4.08Å; A266-V446 HydrophobicContact CB-CG2 4.02Å; A266-I449 HydrophobicContact CB-CD1 4.46Å; A266-I449 WeakPolarHBondContact O-CG2 3.31Å |
| 267 | L | 95.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -60.6 | -35.7 | 179.3 | -70.6 | 166.1 | 0 | 0 | 0 | 112.6 | I259 D263 C269 C270 I302 M305 I319 V322 V323 I449 | I259-L267 HydrophobicContact CD1-CD1 4.12Å; D263-L267 VanDerWaalsContact O-CB 3.31Å; D263-L267 WeakPolarHBondContact O-CB 3.16Å; D263-L267 WeakPolarHBondContact O-CD1 3.38Å; D263-L267 WeakPolarHBondContact O-CG 3.17Å; D263-L267 PolarHBondContact O-N 2.66Å; L267-C269 VanDerWaalsContact C-N 3.27Å; L267-C269 PolarHBondContact O-N 3.5Å; L267-C270 VanDerWaalsContact O-CB 3.3Å; L267-C270 WeakPolarHBondContact O-CB 3.27Å; L267-C270 PolarHBondContact O-N 2.94Å; L267-I302 HydrophobicContact CD2-CB 4.28Å; L267-I302 HydrophobicContact CD2-CG1 3.95Å; L267-I302 HydrophobicContact CD2-CG2 4.12Å; L267-M305 HydrophobicContact CD1-CG 4.31Å; L267-M305 HydrophobicContact CD2-CB 4.35Å; L267-M305 HydrophobicContact CD2-CG 4.22Å; L267-M305 HydrophobicContact CG-CE 4.44Å; L267-M305 HydrophobicContact CG-CG 4.45Å; L267-I319 HydrophobicContact CD1-CB 4.15Å; L267-I319 HydrophobicContact CD1-CG1 3.94Å; L267-I319 HydrophobicContact CD1-CG2 3.8Å; L267-I319 HydrophobicContact CD2-CG2 4.1Å; L267-V322 HydrophobicContact CB-CB 3.97Å; L267-V322 HydrophobicContact CB-CG1 3.59Å; L267-V322 HydrophobicContact CD1-CB 4.4Å; L267-V322 HydrophobicContact CD1-CG2 4.43Å; L267-V323 HydrophobicContact CD2-CG2 4.48Å; L267-I449 HydrophobicContact CD2-CD1 4.17Å |
| 268 | F | 94.6 | Very high | 92 | Very high | 19 Ų | 19 | 19.8 Ų | 19.8 | 8% | 0.083 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -68.9 | -23.5 | 176.3 | -170 | -101.6 | 0 | 0 | 0 | 113.2 | W164 Y252 V264 S265 A266 C270 N271 V322 A326 | W164-F268 HydrophobicContact CH2-CD1 4.34Å; W164-F268 AromaticContact CH2-CE1 3.95Å; W164-F268 HydrophobicContact CH2-CE1 3.95Å; W164-F268 HydrophobicContact CH2-CZ 4.36Å; W164-F268 AromaticContact CZ2-CD1 3.59Å; W164-F268 HydrophobicContact CZ2-CD1 3.59Å; W164-F268 AromaticContact CZ2-CE1 3.63Å; W164-F268 HydrophobicContact CZ2-CE1 3.63Å; W164-F268 HydrophobicContact CZ2-CG 4.33Å; W164-F268 HydrophobicContact CZ2-CZ 4.4Å; Y252-F268 HydrophobicContact CD2-CB 4.35Å; Y252-F268 AromaticContact CD2-CD2 3.77Å; Y252-F268 HydrophobicContact CD2-CD2 3.77Å; Y252-F268 HydrophobicContact CD2-CE2 4.29Å; Y252-F268 HydrophobicContact CD2-CG 4.11Å; Y252-F268 HydrophobicContact CE2-CB 3.84Å; Y252-F268 HydrophobicContact CE2-CD1 4.43Å; Y252-F268 HydrophobicContact CE2-CD2 4.01Å; Y252-F268 AromaticContact CE2-CG 3.84Å; Y252-F268 HydrophobicContact CE2-CG 3.84Å; V264-F268 VanDerWaalsContact O-CB 3.27Å; V264-F268 WeakPolarHBondContact O-CB 3.05Å; V264-F268 PolarHBondContact O-N 3.42Å; S265-F268 PolarHBondContact O-N 2.86Å; A266-F268 VanDerWaalsContact C-N 3.28Å; A266-F268 PolarHBondContact O-N 3.31Å; F268-C270 PolarHBondContact O-N 3.29Å; F268-N271 WeakPolarHBondContact CZ-ND2 3.34Å; F268-N271 WeakPolarHBondContact O-CB 3.07Å; F268-N271 PolarHBondContact O-N 2.78Å; F268-N271 VanDerWaalsContact O-N 3.11Å; F268-V322 HydrophobicContact CB-CG1 3.99Å; F268-A326 HydrophobicContact CD2-CB 4.16Å |
| 269 | C | 93.1 | Very high | 92 | Very high | 2 Ų | 2 | 15.8 Ų | 15.8 | 1% | 0.014 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -58.4 | -33.3 | 172.5 | -70.9 | 0 | 0 | 0 | 0 | 111.5 | S265 A266 L267 N271 K272 I449 F453 | S265-C269 PolarHBondContact O-N 3.47Å; S265-C269 PolarHBondContact O-SG 3.18Å; A266-C269 WeakPolarHBondContact O-CB 3.44Å; A266-C269 PolarHBondContact O-N 3.35Å; L267-C269 VanDerWaalsContact C-N 3.27Å; L267-C269 PolarHBondContact O-N 3.5Å; C269-N271 PolarHBondContact O-N 2.77Å; C269-K272 PolarHBondContact O-N 2.68Å; C269-I449 HydrophobicContact CB-CG2 4.28Å; C269-F453 HydrophobicContact CB-CB 4.49Å; C269-F453 HydrophobicContact CB-CD2 3.47Å; C269-F453 VanDerWaalsContact CB-CD2 3.47Å; C269-F453 HydrophobicContact CB-CE2 3.84Å; C269-F453 HydrophobicContact CB-CG 4.28Å; C269-F453 WeakPolarHBondContact O-CD2 3.41Å; C269-F453 VanDerWaalsContact O-CE2 3.26Å; C269-F453 WeakPolarHBondContact O-CE2 3.46Å |
| 270 | C | 92.8 | Very high | 91.9 | Very high | 3 Ų | 3 | 20.6 Ų | 20.6 | 2% | 0.02 | 10% | 0.098 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -15.6 | 176.9 | -61.6 | 0 | 0 | 0 | 0 | 114.5 | L267 F268 K272 A273 F274 I302 I449 | L267-C270 VanDerWaalsContact O-CB 3.3Å; L267-C270 WeakPolarHBondContact O-CB 3.27Å; L267-C270 PolarHBondContact O-N 2.94Å; F268-C270 PolarHBondContact O-N 3.29Å; C270-K272 PolarHBondContact O-N 2.92Å; C270-K272 VanDerWaalsContact O-N 3.11Å; C270-A273 WeakPolarHBondContact O-CA 3.37Å; C270-A273 WeakPolarHBondContact O-CB 3.39Å; C270-A273 PolarHBondContact O-N 2.82Å; C270-F274 HydrophobicContact CB-CE2 3.97Å; C270-F274 HydrophobicContact CB-CZ 4.29Å; C270-F274 WeakPolarHBondContact O-CD2 3.44Å; C270-F274 PolarHBondContact O-N 3.04Å; C270-I302 HydrophobicContact CB-CD1 3.92Å; C270-I302 HydrophobicContact CB-CG1 4.48Å; C270-I449 VanDerWaalsContact SG-CG2 3.51Å |
| 271 | N | 93.8 | Very high | 91.9 | Very high | 20 Ų | 20 | 24.2 Ų | 24.2 | 11% | 0.107 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -42.5 | -41.3 | 164.3 | -177.8 | -19.6 | 0 | 0 | 0 | 112.3 | F268 C269 A273 F274 V275 A326 S329 | F268-N271 WeakPolarHBondContact CZ-ND2 3.34Å; F268-N271 WeakPolarHBondContact O-CB 3.07Å; F268-N271 PolarHBondContact O-N 2.78Å; F268-N271 VanDerWaalsContact O-N 3.11Å; C269-N271 PolarHBondContact O-N 2.77Å; N271-A273 PolarHBondContact O-N 3.22Å; N271-F274 PolarHBondContact O-N 3.05Å; N271-V275 WeakPolarHBondContact O-CG2 3.35Å; N271-V275 PolarHBondContact O-N 2.83Å; N271-V275 WeakPolarHBondContact OD1-CG2 3.28Å; N271-A326 HydrophobicContact CB-CB 4.02Å; N271-S329 WeakPolarHBondContact ND2-CB 3.29Å; N271-S329 PolarHBondContact ND2-OG 2.99Å |
| 272 | K | 89.8 | Confident | 91.7 | Very high | 48 Ų | 48 | 27.2 Ų | 27.2 | 21% | 0.209 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.5 | -34.1 | 177 | -74 | -57.4 | -154.6 | 70.4 | 0 | 114.4 | C269 C270 F276 S416 F453 L456 L457 | C269-K272 PolarHBondContact O-N 2.68Å; C270-K272 PolarHBondContact O-N 2.92Å; C270-K272 VanDerWaalsContact O-N 3.11Å; K272-F276 PolarHBondContact O-N 2.97Å; K272-F276 VanDerWaalsContact O-N 3.12Å; K272-S416 WeakPolarHBondContact CE-OG 3.33Å; K272-S416 VanDerWaalsContact NZ-CB 3.32Å; K272-S416 PolarHBondContact NZ-OG 3.33Å; K272-F453 HydrophobicContact CB-CD2 3.88Å; K272-F453 HydrophobicContact CB-CE2 3.81Å; K272-F453 HydrophobicContact CB-CZ 4.45Å; K272-F453 HydrophobicContact CG-CD2 3.8Å; K272-F453 HydrophobicContact CG-CE1 4.28Å; K272-F453 HydrophobicContact CG-CE2 3.2Å; K272-F453 HydrophobicContact CG-CZ 3.51Å; K272-L456 HydrophobicContact CB-CD1 4.27Å; K272-L457 VanDerWaalsContact NZ-CD1 3.3Å |
| 273 | A | 92.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -67.8 | -45 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110 | C270 N271 V275 F276 L277 A295 A298 L456 | C270-A273 WeakPolarHBondContact O-CA 3.37Å; C270-A273 WeakPolarHBondContact O-CB 3.39Å; C270-A273 PolarHBondContact O-N 2.82Å; N271-A273 PolarHBondContact O-N 3.22Å; A273-V275 PolarHBondContact O-N 3.36Å; A273-F276 PolarHBondContact O-N 3.47Å; A273-L277 WeakPolarHBondContact O-CG 3.03Å; A273-L277 PolarHBondContact O-N 2.8Å; A273-A295 HydrophobicContact CB-CB 4.07Å; A273-A298 HydrophobicContact CB-CB 4.18Å; A273-L456 HydrophobicContact CB-CD1 3.75Å |
| 274 | F | 93.3 | Very high | 90.9 | Very high | 31 Ų | 31 | 39.9 Ų | 39.9 | 14% | 0.136 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.6 | -39 | 176.9 | -55.9 | -41.6 | 0 | 0 | 0 | 112.7 | C270 N271 F276 L277 L278 I302 V323 A326 A330 | C270-F274 HydrophobicContact CB-CE2 3.97Å; C270-F274 HydrophobicContact CB-CZ 4.29Å; C270-F274 WeakPolarHBondContact O-CD2 3.44Å; C270-F274 PolarHBondContact O-N 3.04Å; N271-F274 PolarHBondContact O-N 3.05Å; F274-F276 VanDerWaalsContact C-N 3.34Å; F274-F276 PolarHBondContact O-N 2.71Å; F274-L277 PolarHBondContact O-N 2.91Å; F274-L278 VanDerWaalsContact O-CB 3.26Å; F274-L278 WeakPolarHBondContact O-CB 3.49Å; F274-L278 VanDerWaalsContact O-CG 3.31Å; F274-L278 WeakPolarHBondContact O-CG 3.23Å; F274-L278 PolarHBondContact O-N 3.26Å; F274-I302 HydrophobicContact CZ-CD1 3.92Å; F274-V323 HydrophobicContact CE2-CG1 4.18Å; F274-V323 HydrophobicContact CZ-CG1 3.98Å; F274-A326 HydrophobicContact CD2-CB 3.99Å; F274-A326 HydrophobicContact CE2-CB 3.99Å; F274-A330 HydrophobicContact CB-CB 3.6Å |
| 275 | V | 91 | Very high | 90.1 | Very high | 25 Ų | 25 | 43.2 Ų | 43.2 | 15% | 0.152 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60 | -43.3 | 172.3 | 168.1 | 0 | 0 | 0 | 0 | 111 | N271 A273 S279 A330 K333 | N271-V275 WeakPolarHBondContact O-CG2 3.35Å; N271-V275 PolarHBondContact O-N 2.83Å; N271-V275 WeakPolarHBondContact OD1-CG2 3.28Å; A273-V275 PolarHBondContact O-N 3.36Å; V275-S279 WeakPolarHBondContact O-CB 3.44Å; V275-S279 PolarHBondContact O-N 3.21Å; V275-S279 PolarHBondContact O-OG 3.45Å; V275-A330 HydrophobicContact CB-CB 4.4Å; V275-A330 HydrophobicContact CG2-CB 3.59Å; V275-K333 HydrophobicContact CG2-CB 4.5Å; V275-K333 HydrophobicContact CG2-CD 4.29Å |
| 276 | F | 90.1 | Very high | 89.2 | Confident | 28 Ų | 28 | 53.3 Ų | 53.3 | 12% | 0.123 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.9 | -49.6 | 178.2 | 169.8 | -111 | 0 | 0 | 0 | 111.7 | K272 A273 F274 S279 W280 R291 I292 A295 L456 | K272-F276 PolarHBondContact O-N 2.97Å; K272-F276 VanDerWaalsContact O-N 3.12Å; A273-F276 PolarHBondContact O-N 3.47Å; F274-F276 VanDerWaalsContact C-N 3.34Å; F274-F276 PolarHBondContact O-N 2.71Å; F276-S279 PolarHBondContact O-N 2.83Å; F276-W280 PolarHBondContact O-N 2.87Å; F276-R291 HydrophobicContact CD1-CB 3.97Å; F276-R291 HydrophobicContact CD2-CB 4.14Å; F276-R291 HydrophobicContact CE1-CB 3.55Å; F276-R291 HydrophobicContact CE2-CB 3.74Å; F276-R291 HydrophobicContact CE2-CG 4.36Å; F276-R291 HydrophobicContact CG-CB 4.25Å; F276-R291 HydrophobicContact CZ-CB 3.43Å; F276-R291 VanDerWaalsContact CZ-CB 3.43Å; F276-R291 HydrophobicContact CZ-CG 4.49Å; F276-I292 HydrophobicContact CE1-CG1 3.77Å; F276-I292 HydrophobicContact CZ-CG1 4.04Å; F276-A295 HydrophobicContact CD1-CB 4.47Å; F276-L456 HydrophobicContact CB-CD2 4.35Å; F276-L456 HydrophobicContact CD1-CD2 4.28Å; F276-L456 HydrophobicContact CG-CD2 4.35Å |
| 277 | L | 90.9 | Very high | 87.9 | Confident | 44 Ų | 44 | 59.6 Ų | 59.6 | 23% | 0.23 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.5 | -45.5 | 179.3 | -67.2 | 172.4 | 0 | 0 | 0 | 112.1 | A273 F274 W280 I281 A295 I299 | A273-L277 WeakPolarHBondContact O-CG 3.03Å; A273-L277 PolarHBondContact O-N 2.8Å; F274-L277 PolarHBondContact O-N 2.91Å; L277-W280 PolarHBondContact O-N 3.46Å; L277-I281 VanDerWaalsContact O-CG1 3.32Å; L277-I281 WeakPolarHBondContact O-CG1 3.12Å; L277-I281 PolarHBondContact O-N 3.18Å; L277-A295 HydrophobicContact CD1-CB 4.46Å; L277-A295 HydrophobicContact CG-CB 4.47Å; L277-I299 HydrophobicContact CD1-CD1 4.2Å |
| 278 | L | 90.3 | Very high | 87.2 | Confident | 45 Ų | 45 | 62.3 Ų | 62.3 | 24% | 0.236 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.7 | -34.9 | 176.6 | -70.5 | 172.9 | 0 | 0 | 0 | 112.3 | F274 I281 V282 A330 L331 V334 | F274-L278 VanDerWaalsContact O-CB 3.26Å; F274-L278 WeakPolarHBondContact O-CB 3.49Å; F274-L278 VanDerWaalsContact O-CG 3.31Å; F274-L278 WeakPolarHBondContact O-CG 3.23Å; F274-L278 PolarHBondContact O-N 3.26Å; L278-I281 PolarHBondContact O-N 2.9Å; L278-V282 VanDerWaalsContact O-CB 3.27Å; L278-V282 WeakPolarHBondContact O-CB 3.41Å; L278-V282 VanDerWaalsContact O-CG2 3.28Å; L278-V282 WeakPolarHBondContact O-CG2 3.47Å; L278-V282 PolarHBondContact O-N 3.07Å; L278-A330 HydrophobicContact CD1-CB 3.99Å; L278-L331 HydrophobicContact CD1-CB 4.25Å; L278-V334 HydrophobicContact CB-CB 4.39Å; L278-V334 HydrophobicContact CB-CG1 4.37Å; L278-V334 HydrophobicContact CB-CG2 3.89Å |
| 279 | S | 88.4 | Confident | 86.5 | Confident | 14 Ų | 14 | 63.2 Ų | 63.2 | 10% | 0.098 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66.7 | -39.8 | 174.1 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | V275 F276 L283 R284 | V275-S279 WeakPolarHBondContact O-CB 3.44Å; V275-S279 PolarHBondContact O-N 3.21Å; V275-S279 PolarHBondContact O-OG 3.45Å; F276-S279 PolarHBondContact O-N 2.83Å; S279-L283 WeakPolarHBondContact O-CA 3.42Å; S279-L283 WeakPolarHBondContact O-CB 3.44Å; S279-L283 PolarHBondContact O-N 3.29Å; S279-R284 PolarHBondContact O-N 2.71Å |
| 280 | W | 87.4 | Confident | 86.1 | Confident | 111 Ų | 111 | 67.4 Ų | 67.4 | 42% | 0.42 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 174.6 | 175.9 | 49.7 | 0 | 0 | 0 | 112 | F276 L277 R284 F287 | F276-W280 PolarHBondContact O-N 2.87Å; L277-W280 PolarHBondContact O-N 3.46Å; W280-R284 VanDerWaalsContact O-CA 3.25Å; W280-R284 WeakPolarHBondContact O-CA 3.37Å; W280-R284 PolarHBondContact O-N 3.2Å; W280-F287 HydrophobicContact CZ2-CD2 4.44Å |
| 281 | I | 88.6 | Confident | 85.8 | Confident | 111 Ų | 111 | 69.9 Ų | 69.9 | 57% | 0.569 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -70.6 | -50.2 | -179.4 | -66.1 | 165 | 0 | 0 | 0 | 111.8 | L277 L278 | L277-I281 VanDerWaalsContact O-CG1 3.32Å; L277-I281 WeakPolarHBondContact O-CG1 3.12Å; L277-I281 PolarHBondContact O-N 3.18Å; L278-I281 PolarHBondContact O-N 2.9Å |
| 282 | V | 87.4 | Confident | 85.6 | Confident | 64 Ų | 64 | 70.7 Ų | 70.7 | 39% | 0.388 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -86.4 | -39.6 | -168.7 | -174.2 | 0 | 0 | 0 | 0 | 112.3 | L278 V334 M338 | L278-V282 VanDerWaalsContact O-CB 3.27Å; L278-V282 WeakPolarHBondContact O-CB 3.41Å; L278-V282 VanDerWaalsContact O-CG2 3.28Å; L278-V282 WeakPolarHBondContact O-CG2 3.47Å; L278-V282 PolarHBondContact O-N 3.07Å; V282-V334 HydrophobicContact CB-CG1 4.08Å; V282-V334 HydrophobicContact CG1-CG1 4.39Å; V282-V334 HydrophobicContact CG2-CG1 4.38Å; V282-M338 HydrophobicContact CG1-SD 3.51Å; V282-M338 VanDerWaalsContact CG1-SD 3.51Å |
| 283 | L | 83.1 | Confident | 85.6 | Confident | 49 Ų | 49 | 72.7 Ų | 72.7 | 26% | 0.257 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -99.8 | -8.3 | -177.9 | -79.4 | 67.3 | 0 | 0 | 0 | 113.4 | S279 D285 V334 K337 M338 | S279-L283 WeakPolarHBondContact O-CA 3.42Å; S279-L283 WeakPolarHBondContact O-CB 3.44Å; S279-L283 PolarHBondContact O-N 3.29Å; L283-D285 PolarHBondContact O-N 3.12Å; L283-V334 HydrophobicContact CD1-CG1 3.68Å; L283-K337 HydrophobicContact CD2-CB 4.45Å; L283-K337 HydrophobicContact CD2-CD 3.35Å; L283-K337 HydrophobicContact CD2-CG 3.77Å; L283-M338 HydrophobicContact CD1-CB 4.3Å |
| 284 | R | 82.9 | Confident | 85.6 | Confident | 222 Ų | 222 | 72.7 Ų | 72.7 | 84% | 0.838 | 35% | 0.351 | S | S | * | . | trans | 56.4 | 33.7 | -176.4 | -58.1 | 177.7 | 177.1 | 167.1 | -2 | 112.8 | S279 W280 | S279-R284 PolarHBondContact O-N 2.71Å; W280-R284 VanDerWaalsContact O-CA 3.25Å; W280-R284 WeakPolarHBondContact O-CA 3.37Å; W280-R284 PolarHBondContact O-N 3.2Å | ||
| 285 | D | 78.7 | Confident | 85.6 | Confident | 71 Ų | 71 | 71.3 Ų | 71.3 | 38% | 0.38 | 35% | 0.345 | S | S | . | . | P | Polyproline II helix | trans | -55.9 | 152.3 | 171.6 | -82.4 | -40.8 | 0 | 0 | 0 | 110.6 | L283 K337 | L283-D285 PolarHBondContact O-N 3.12Å; D285-K337 IonicContact OD1-NZ 2.71Å; D285-K337 IonicContact OD2-NZ 3.46Å; D285-K337 PolarHBondContact OD2-NZ 3.36Å |
| 286 | R | 73.6 | Confident | 85.7 | Confident | 212 Ų | 212 | 75.3 Ų | 75.3 | 80% | 0.8 | 36% | 0.364 | S | S | * | . | P | Polyproline II helix | trans | -61 | 137.1 | -170.3 | -67 | -83.9 | -72.5 | -161 | -2.4 | 112.9 | M288 | R286-M288 PolarHBondContact O-N 2.81Š|
| 287 | F | 68 | Low | 85.8 | Confident | 133 Ų | 133 | 76.2 Ų | 76.2 | 58% | 0.583 | 37% | 0.37 | S | S | * | . | P | Polyproline II helix | trans | -61.3 | 122.3 | 175.4 | -178.7 | -83.5 | 0 | 0 | 0 | 111.3 | W280 I292 | W280-F287 HydrophobicContact CZ2-CD2 4.44Å; F287-I292 HydrophobicContact CD2-CD1 3.66Å; F287-I292 HydrophobicContact CE1-CD1 4.18Å; F287-I292 HydrophobicContact CE2-CD1 3.15Å; F287-I292 HydrophobicContact CG-CD1 4.36Å; F287-I292 HydrophobicContact CZ-CD1 3.46Å; F287-I292 VanDerWaalsContact CZ-CD1 3.46Å |
| 288 | M | 80.1 | Confident | 86 | Confident | 57 Ų | 57 | 74.2 Ų | 74.2 | 28% | 0.281 | 36% | 0.36 | S | S | . | . | trans | -127.2 | 97.6 | -178.9 | -73.4 | -74.9 | 105 | 0 | 0 | 109.7 | R286 V290 R291 I292 E460 | R286-M288 PolarHBondContact O-N 2.81Å; M288-V290 VanDerWaalsContact C-N 3.33Å; M288-V290 PolarHBondContact O-N 3.49Å; M288-R291 HydrophobicContact CB-CB 4.39Å; M288-R291 HydrophobicContact CB-CG 4.32Å; M288-R291 PolarHBondContact O-N 2.7Å; M288-I292 PolarHBondContact O-N 2.79Å; M288-E460 HydrophobicContact CG-CG 4.48Å; M288-E460 HydrophobicContact SD-CB 4.4Å; M288-E460 HydrophobicContact SD-CG 3.65Å | ||
| 289 | G | 81 | Confident | 86.1 | Confident | 37 Ų | 37 | 75.3 Ų | 75.3 | 38% | 0.381 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -55.3 | -40.5 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | R291 I292 V293 | G289-R291 VanDerWaalsContact C-N 3.27Å; G289-R291 PolarHBondContact O-N 3.22Å; G289-I292 WeakPolarHBondContact O-CB 3.43Å; G289-I292 PolarHBondContact O-N 3.14Å; G289-V293 PolarHBondContact O-N 3.45Å |
| 290 | V | 83.4 | Confident | 86.4 | Confident | 91 Ų | 91 | 77 Ų | 77 | 55% | 0.552 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -59 | -37.9 | 178.2 | -177.1 | 0 | 0 | 0 | 0 | 112 | M288 I292 V293 A294 M455 | M288-V290 VanDerWaalsContact C-N 3.33Å; M288-V290 PolarHBondContact O-N 3.49Å; V290-I292 VanDerWaalsContact C-N 3.32Å; V290-I292 PolarHBondContact O-N 2.93Å; V290-V293 PolarHBondContact O-N 2.75Å; V290-A294 WeakPolarHBondContact O-CB 3.41Å; V290-A294 PolarHBondContact O-N 2.88Å; V290-M455 HydrophobicContact CG1-CE 4Å |
| 291 | R | 87.8 | Confident | 86.7 | Confident | 54 Ų | 54 | 71.7 Ų | 71.7 | 20% | 0.204 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -71.7 | -25.8 | 178.1 | -68.1 | -170.7 | -179 | 129.8 | 9.2 | 112.9 | F276 M288 G289 A295 L456 E460 | F276-R291 HydrophobicContact CD1-CB 3.97Å; F276-R291 HydrophobicContact CD2-CB 4.14Å; F276-R291 HydrophobicContact CE1-CB 3.55Å; F276-R291 HydrophobicContact CE2-CB 3.74Å; F276-R291 HydrophobicContact CE2-CG 4.36Å; F276-R291 HydrophobicContact CG-CB 4.25Å; F276-R291 HydrophobicContact CZ-CB 3.43Å; F276-R291 VanDerWaalsContact CZ-CB 3.43Å; F276-R291 HydrophobicContact CZ-CG 4.49Å; M288-R291 HydrophobicContact CB-CB 4.39Å; M288-R291 HydrophobicContact CB-CG 4.32Å; M288-R291 PolarHBondContact O-N 2.7Å; G289-R291 VanDerWaalsContact C-N 3.27Å; G289-R291 PolarHBondContact O-N 3.22Å; R291-A295 WeakPolarHBondContact O-CB 3.29Å; R291-A295 PolarHBondContact O-N 2.97Å; R291-L456 HydrophobicContact CB-CD2 3.84Å; R291-L456 HydrophobicContact CG-CD2 4.12Å; R291-L456 WeakPolarHBondContact O-CD2 3.47Å; R291-E460 IonicContact CZ-OE1 3.87Å; R291-E460 IonicContact NH1-OE1 2.73Å; R291-E460 PolarHBondContact NH1-OE1 2.83Å; R291-E460 IonicContact NH2-OE1 2.95Å; R291-E460 PolarHBondContact NH2-OE1 2.68Å |
| 292 | I | 89 | Confident | 87 | Confident | 38 Ų | 38 | 67.4 Ų | 67.4 | 20% | 0.195 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -73 | -44.7 | 175 | -65.4 | 168.7 | 0 | 0 | 0 | 110 | F276 F287 M288 G289 V290 A294 A295 I296 | F276-I292 HydrophobicContact CE1-CG1 3.77Å; F276-I292 HydrophobicContact CZ-CG1 4.04Å; F287-I292 HydrophobicContact CD2-CD1 3.66Å; F287-I292 HydrophobicContact CE1-CD1 4.18Å; F287-I292 HydrophobicContact CE2-CD1 3.15Å; F287-I292 HydrophobicContact CG-CD1 4.36Å; F287-I292 HydrophobicContact CZ-CD1 3.46Å; F287-I292 VanDerWaalsContact CZ-CD1 3.46Å; M288-I292 PolarHBondContact O-N 2.79Å; G289-I292 WeakPolarHBondContact O-CB 3.43Å; G289-I292 PolarHBondContact O-N 3.14Å; V290-I292 VanDerWaalsContact C-N 3.32Å; V290-I292 PolarHBondContact O-N 2.93Å; I292-A294 VanDerWaalsContact C-N 3.28Å; I292-A294 PolarHBondContact O-N 3.06Å; I292-A295 PolarHBondContact O-N 3.23Å; I292-I296 HydrophobicContact CG2-CD1 3.9Å; I292-I296 HydrophobicContact CG2-CG1 4.5Å; I292-I296 VanDerWaalsContact O-CG1 3.3Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.68Å |
| 293 | V | 90.6 | Very high | 87.2 | Confident | 89 Ų | 89 | 68.6 Ų | 68.6 | 54% | 0.539 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -57.6 | -44.2 | 172 | 179.8 | 0 | 0 | 0 | 0 | 110.6 | G289 V290 A295 I296 L297 | G289-V293 PolarHBondContact O-N 3.45Å; V290-V293 PolarHBondContact O-N 2.75Å; V293-A295 PolarHBondContact O-N 3.21Å; V293-I296 PolarHBondContact O-N 2.92Å; V293-L297 WeakPolarHBondContact O-CB 3.24Å; V293-L297 PolarHBondContact O-N 2.65Å |
| 294 | A | 92.3 | Very high | 87.6 | Confident | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -64.5 | -36.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | V290 I292 A298 M455 L456 | V290-A294 WeakPolarHBondContact O-CB 3.41Å; V290-A294 PolarHBondContact O-N 2.88Å; I292-A294 VanDerWaalsContact C-N 3.28Å; I292-A294 PolarHBondContact O-N 3.06Å; A294-A298 PolarHBondContact O-N 2.73Å; A294-M455 HydrophobicContact CB-CB 3.51Å; A294-L456 HydrophobicContact CB-CD2 4.04Å; A294-L456 HydrophobicContact CB-CG 3.77Å |
| 295 | A | 91.9 | Very high | 88 | Confident | 2 Ų | 2 | 58.9 Ų | 58.9 | 2% | 0.017 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -70.5 | -41 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A273 F276 L277 R291 I292 V293 L297 A298 I299 | A273-A295 HydrophobicContact CB-CB 4.07Å; F276-A295 HydrophobicContact CD1-CB 4.47Å; L277-A295 HydrophobicContact CD1-CB 4.46Å; L277-A295 HydrophobicContact CG-CB 4.47Å; R291-A295 WeakPolarHBondContact O-CB 3.29Å; R291-A295 PolarHBondContact O-N 2.97Å; I292-A295 PolarHBondContact O-N 3.23Å; V293-A295 PolarHBondContact O-N 3.21Å; A295-L297 VanDerWaalsContact C-N 3.32Å; A295-A298 PolarHBondContact O-N 2.81Å; A295-I299 VanDerWaalsContact O-CG1 3.31Å; A295-I299 WeakPolarHBondContact O-CG1 3.35Å; A295-I299 PolarHBondContact O-N 3Å |
| 296 | I | 93.5 | Very high | 88.5 | Confident | 109 Ų | 109 | 57 Ų | 57 | 56% | 0.559 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -60.5 | -44.2 | 173 | -68.3 | 164.5 | 0 | 0 | 0 | 110 | I292 V293 A298 I299 A300 | I292-I296 HydrophobicContact CG2-CD1 3.9Å; I292-I296 HydrophobicContact CG2-CG1 4.5Å; I292-I296 VanDerWaalsContact O-CG1 3.3Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.68Å; V293-I296 PolarHBondContact O-N 2.92Å; I296-A298 PolarHBondContact O-N 3.3Å; I296-I299 PolarHBondContact O-N 3.41Å; I296-A300 WeakPolarHBondContact O-CB 3.36Å; I296-A300 PolarHBondContact O-N 3.21Å |
| 297 | L | 93.4 | Very high | 89.2 | Confident | 47 Ų | 47 | 54.8 Ų | 54.8 | 25% | 0.246 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 177.1 | -171.9 | 65.6 | 0 | 0 | 0 | 111.8 | V293 A295 A300 G301 I448 L451 M455 | V293-L297 WeakPolarHBondContact O-CB 3.24Å; V293-L297 PolarHBondContact O-N 2.65Å; A295-L297 VanDerWaalsContact C-N 3.32Å; L297-A300 PolarHBondContact O-N 3.03Å; L297-G301 PolarHBondContact O-N 2.95Å; L297-I448 HydrophobicContact CD1-CG2 3.79Å; L297-I448 HydrophobicContact CG-CG2 3.98Å; L297-I448 VanDerWaalsContact O-CG2 3.22Å; L297-I448 WeakPolarHBondContact O-CG2 3.37Å; L297-L451 HydrophobicContact CD2-CB 4.3Å; L297-L451 HydrophobicContact CD2-CD2 4.1Å; L297-L451 HydrophobicContact CD2-CG 3.97Å; L297-M455 HydrophobicContact CD2-SD 4.47Å |
| 298 | A | 93.6 | Very high | 90 | Very high | 2 Ų | 2 | 49 Ų | 49 | 2% | 0.017 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.2 | -41.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | A273 A294 A295 I296 G301 I302 | A273-A298 HydrophobicContact CB-CB 4.18Å; A294-A298 PolarHBondContact O-N 2.73Å; A295-A298 PolarHBondContact O-N 2.81Å; I296-A298 PolarHBondContact O-N 3.3Å; A298-G301 PolarHBondContact O-N 3.15Å; A298-I302 PolarHBondContact O-N 3.18Å; A298-I302 VanDerWaalsContact O-N 3.13Å |
| 299 | I | 93.3 | Very high | 89.9 | Confident | 68 Ų | 68 | 47.5 Ų | 47.5 | 35% | 0.349 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -67.8 | -42.5 | 177.2 | -67.8 | 163.8 | 0 | 0 | 0 | 111.1 | L277 A295 I296 G301 I302 V303 | L277-I299 HydrophobicContact CD1-CD1 4.2Å; A295-I299 VanDerWaalsContact O-CG1 3.31Å; A295-I299 WeakPolarHBondContact O-CG1 3.35Å; A295-I299 PolarHBondContact O-N 3Å; I296-I299 PolarHBondContact O-N 3.41Å; I299-G301 PolarHBondContact O-N 3.46Å; I299-I302 WeakPolarHBondContact O-CB 3.48Å; I299-I302 PolarHBondContact O-N 3.5Å; I299-I302 VanDerWaalsContact O-N 3.09Å; I299-V303 PolarHBondContact O-N 3.36Å; I299-V303 VanDerWaalsContact O-N 3.09Å |
| 300 | A | 94.7 | Very high | 89.5 | Confident | 50 Ų | 50 | 46.9 Ų | 46.9 | 41% | 0.413 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.1 | -36.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | I296 L297 V303 M304 | I296-A300 WeakPolarHBondContact O-CB 3.36Å; I296-A300 PolarHBondContact O-N 3.21Å; L297-A300 PolarHBondContact O-N 3.03Å; A300-V303 PolarHBondContact O-N 3.38Å; A300-M304 WeakPolarHBondContact O-CB 3.02Å; A300-M304 PolarHBondContact O-N 2.94Å |
| 301 | G | 94.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.7 | -40.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L297 A298 I299 M304 M305 | L297-G301 PolarHBondContact O-N 2.95Å; A298-G301 PolarHBondContact O-N 3.15Å; I299-G301 PolarHBondContact O-N 3.46Å; G301-M304 PolarHBondContact O-N 2.97Å; G301-M305 WeakPolarHBondContact O-CB 3.34Å; G301-M305 PolarHBondContact O-N 3.38Å |
| 302 | I | 93.3 | Very high | 88.1 | Confident | 20 Ų | 20 | 54.3 Ų | 54.3 | 10% | 0.103 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.3 | -46.2 | 172.6 | -61.2 | 167.3 | 0 | 0 | 0 | 110.5 | L267 C270 F274 A298 I299 M305 T306 I319 V323 | L267-I302 HydrophobicContact CD2-CB 4.28Å; L267-I302 HydrophobicContact CD2-CG1 3.95Å; L267-I302 HydrophobicContact CD2-CG2 4.12Å; C270-I302 HydrophobicContact CB-CD1 3.92Å; C270-I302 HydrophobicContact CB-CG1 4.48Å; F274-I302 HydrophobicContact CZ-CD1 3.92Å; A298-I302 PolarHBondContact O-N 3.18Å; A298-I302 VanDerWaalsContact O-N 3.13Å; I299-I302 WeakPolarHBondContact O-CB 3.48Å; I299-I302 PolarHBondContact O-N 3.5Å; I299-I302 VanDerWaalsContact O-N 3.09Å; I302-M305 WeakPolarHBondContact O-CB 3.39Å; I302-M305 PolarHBondContact O-N 3.08Å; I302-T306 PolarHBondContact O-N 3.06Å; I302-I319 HydrophobicContact CG2-CG2 4.4Å; I302-V323 HydrophobicContact CD1-CG2 4.12Å; I302-V323 HydrophobicContact CG1-CG2 4.46Å; I302-V323 HydrophobicContact CG2-CG2 3.77Å |
| 303 | V | 93.1 | Very high | 87 | Confident | 90 Ų | 90 | 56.6 Ų | 56.6 | 55% | 0.545 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64 | -44.1 | 179.9 | 177.9 | 0 | 0 | 0 | 0 | 110.7 | I299 A300 M305 T306 Y307 | I299-V303 PolarHBondContact O-N 3.36Å; I299-V303 VanDerWaalsContact O-N 3.09Å; A300-V303 PolarHBondContact O-N 3.38Å; V303-M305 VanDerWaalsContact C-N 3.3Å; V303-M305 PolarHBondContact O-N 2.66Å; V303-T306 PolarHBondContact O-N 3.44Å; V303-T306 PolarHBondContact O-OG1 2.96Å; V303-Y307 PolarHBondContact O-N 3.42Å |
| 304 | M | 91.6 | Very high | 86.3 | Confident | 66 Ų | 66 | 59 Ų | 59 | 33% | 0.325 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.7 | -35.9 | 175.5 | -169.8 | 177.8 | -75.1 | 0 | 0 | 112.2 | A300 G301 Y307 A308 V441 I444 A445 I448 | A300-M304 WeakPolarHBondContact O-CB 3.02Å; A300-M304 PolarHBondContact O-N 2.94Å; G301-M304 PolarHBondContact O-N 2.97Å; M304-Y307 PolarHBondContact O-N 3.39Å; M304-A308 WeakPolarHBondContact O-CB 3.32Å; M304-A308 PolarHBondContact O-N 3.49Å; M304-V441 HydrophobicContact CG-CG1 3.83Å; M304-V441 HydrophobicContact SD-CG1 4.34Å; M304-I444 HydrophobicContact SD-CB 4.3Å; M304-I444 HydrophobicContact SD-CG2 3.69Å; M304-A445 HydrophobicContact CB-CB 3.99Å; M304-A445 HydrophobicContact CG-CB 3.96Å; M304-A445 HydrophobicContact SD-CB 4.3Å; M304-I448 HydrophobicContact CE-CD1 3.99Å; M304-I448 HydrophobicContact SD-CD1 3.9Å |
| 305 | M | 90 | Very high | 85.9 | Confident | 1 Ų | 1 | 59.7 Ų | 59.7 | 1% | 0.005 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.4 | -46.9 | 172.2 | -174 | 71.8 | 96.3 | 0 | 0 | 111.3 | D263 A266 L267 G301 I302 V303 Y307 A308 I319 R442 A445 V446 | D263-M305 HydrophobicContact CB-CE 3.86Å; D263-M305 HydrophobicContact CB-SD 4.46Å; A266-M305 HydrophobicContact CB-CE 4.43Å; L267-M305 HydrophobicContact CD1-CG 4.31Å; L267-M305 HydrophobicContact CD2-CB 4.35Å; L267-M305 HydrophobicContact CD2-CG 4.22Å; L267-M305 HydrophobicContact CG-CE 4.44Å; L267-M305 HydrophobicContact CG-CG 4.45Å; G301-M305 WeakPolarHBondContact O-CB 3.34Å; G301-M305 PolarHBondContact O-N 3.38Å; I302-M305 WeakPolarHBondContact O-CB 3.39Å; I302-M305 PolarHBondContact O-N 3.08Å; V303-M305 VanDerWaalsContact C-N 3.3Å; V303-M305 PolarHBondContact O-N 2.66Å; M305-Y307 PolarHBondContact O-N 2.93Å; M305-A308 PolarHBondContact O-N 3.48Å; M305-I319 HydrophobicContact CG-CD1 4.09Å; M305-R442 HydrophobicContact CE-CG 4.44Å; M305-R442 HydrophobicContact SD-CG 3.55Å; M305-R442 VanDerWaalsContact SD-CG 3.55Å; M305-A445 HydrophobicContact CB-CB 4.14Å; M305-V446 HydrophobicContact CE-CG2 3.57Å |
| 306 | T | 89.9 | Confident | 85.7 | Confident | 30 Ų | 30 | 61.5 Ų | 61.5 | 18% | 0.184 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63 | -29.6 | 176.1 | 56.4 | 0 | 0 | 0 | 0 | 113.4 | I302 V303 I319 | I302-T306 PolarHBondContact O-N 3.06Å; V303-T306 PolarHBondContact O-N 3.44Å; V303-T306 PolarHBondContact O-OG1 2.96Å; T306-I319 HydrophobicContact CG2-CB 4.24Å; T306-I319 HydrophobicContact CG2-CD1 3.84Å; T306-I319 HydrophobicContact CG2-CG2 3.64Å |
| 307 | Y | 87.5 | Confident | 85.6 | Confident | 166 Ų | 166 | 60.4 Ų | 60.4 | 65% | 0.651 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -77 | -38.2 | 176.6 | -174.2 | -95.5 | 0 | 0 | 0 | 112.5 | V303 M304 M305 D309 G310 | V303-Y307 PolarHBondContact O-N 3.42Å; M304-Y307 PolarHBondContact O-N 3.39Å; M305-Y307 PolarHBondContact O-N 2.93Å; Y307-D309 PolarHBondContact O-N 3.35Å; Y307-G310 PolarHBondContact O-N 3.45Å; Y307-G310 VanDerWaalsContact O-N 3.1Å |
| 308 | A | 85.9 | Confident | 85.5 | Confident | 13 Ų | 13 | 58.2 Ų | 58.2 | 11% | 0.107 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.4 | -23.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | M304 M305 N439 V441 R442 | M304-A308 WeakPolarHBondContact O-CB 3.32Å; M304-A308 PolarHBondContact O-N 3.49Å; M305-A308 PolarHBondContact O-N 3.48Å; A308-N439 PolarHBondContact O-ND2 3.37Å; A308-V441 HydrophobicContact CB-CB 4Å; A308-V441 HydrophobicContact CB-CG1 3.9Å; A308-R442 HydrophobicContact CB-CB 3.94Å |
| 309 | D | 77.3 | Confident | 85.5 | Confident | 24 Ų | 24 | 58.3 Ų | 58.3 | 13% | 0.128 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | -11.6 | 179.5 | -80.4 | 28 | 0 | 0 | 0 | 113.4 | Y307 H312 S315 R442 | Y307-D309 PolarHBondContact O-N 3.35Å; D309-H312 PolarHBondContact O-ND1 3.1Å; D309-S315 PolarHBondContact OD2-OG 3.07Å; D309-R442 IonicContact OD1-CZ 3.59Å; D309-R442 IonicContact OD1-NE 3.86Å; D309-R442 PolarHBondContact OD1-NE 2.99Å; D309-R442 IonicContact OD1-NH2 2.77Å; D309-R442 PolarHBondContact OD1-NH2 3.01Å; D309-R442 IonicContact OD2-CZ 2.72Å; D309-R442 IonicContact OD2-NH2 3.97Å; D309-R442 PolarHBondContact OD2-NH2 3.36Å; D309-R442 VanDerWaalsContact OD2-NH2 3.09Å |
| 310 | G | 73 | Confident | 85.5 | Confident | 24 Ų | 24 | 59.1 Ų | 59.1 | 25% | 0.247 | 32% | 0.317 | C | S | . | . | trans | 65.8 | 169.2 | -164.8 | 0 | 0 | 0 | 0 | 0 | 113 | Y307 H312 | Y307-G310 PolarHBondContact O-N 3.45Å; Y307-G310 VanDerWaalsContact O-N 3.1Å; G310-H312 PolarHBondContact O-N 3.42Å | ||
| 311 | F | 71.1 | Confident | 85.5 | Confident | 164 Ų | 164 | 58.4 Ų | 58.4 | 72% | 0.719 | 31% | 0.305 | S | S | * | . | S | Bend | trans | -76.3 | 37.9 | -179.2 | -65 | -77.5 | 0 | 0 | 0 | 113.8 | S313 | F311-S313 PolarHBondContact O-N 2.86Š|
| 312 | H | 70 | Confident | 85.6 | Confident | 138 Ų | 138 | 58.4 Ų | 58.4 | 64% | 0.639 | 31% | 0.305 | S | S | * | . | trans | -68.8 | 111.1 | 171.3 | -63.7 | 105.7 | 0 | 0 | 0 | 109.5 | D309 G310 H314 S315 V316 | D309-H312 PolarHBondContact O-ND1 3.1Å; G310-H312 PolarHBondContact O-N 3.42Å; H312-H314 PolarHBondContact O-N 3.48Å; H312-S315 PolarHBondContact O-N 3.4Å; H312-V316 PolarHBondContact O-N 2.89Å | ||
| 313 | S | 67.3 | Low | 85.7 | Confident | 85 Ų | 85 | 59 Ų | 59 | 59% | 0.594 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -48.5 | -36.9 | -169.2 | -47.7 | 0 | 0 | 0 | 0 | 114.2 | F311 I317 | F311-S313 PolarHBondContact O-N 2.86Å; S313-I317 WeakPolarHBondContact O-CB 3.36Å; S313-I317 VanDerWaalsContact O-CD1 3.32Å; S313-I317 WeakPolarHBondContact O-CD1 3.42Å; S313-I317 WeakPolarHBondContact O-CG1 3.4Å; S313-I317 PolarHBondContact O-N 3.35Å |
| 314 | H | 76.1 | Confident | 85.8 | Confident | 139 Ų | 139 | 56.2 Ų | 56.2 | 64% | 0.644 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -69.7 | -35.7 | -179.4 | -62.3 | -38.5 | 0 | 0 | 0 | 114.7 | H312 G318 | H312-H314 PolarHBondContact O-N 3.48Å; H314-G318 PolarHBondContact O-N 2.91Å |
| 315 | S | 82.4 | Confident | 86 | Confident | 16 Ų | 16 | 53.1 Ų | 53.1 | 11% | 0.112 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -76.6 | -43 | 175 | -168.9 | 0 | 0 | 0 | 0 | 110.9 | I259 D309 H312 I317 G318 I319 | I259-S315 VanDerWaalsContact CG2-OG 3.27Å; I259-S315 WeakPolarHBondContact CG2-OG 3.12Å; D309-S315 PolarHBondContact OD2-OG 3.07Å; H312-S315 PolarHBondContact O-N 3.4Å; S315-I317 VanDerWaalsContact C-N 3.3Å; S315-I317 PolarHBondContact O-N 2.94Å; S315-G318 CarbonylContact O-C 3.6Å; S315-G318 WeakPolarHBondContact O-CA 3.31Å; S315-G318 PolarHBondContact O-N 3.26Å; S315-I319 WeakPolarHBondContact O-CG1 3.26Å; S315-I319 PolarHBondContact O-N 3.17Å |
| 316 | V | 88.8 | Confident | 86.3 | Confident | 40 Ų | 40 | 53 Ų | 53 | 24% | 0.242 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -57.1 | -43.4 | 177.2 | -178.8 | 0 | 0 | 0 | 0 | 111.3 | H312 G318 I319 T320 | H312-V316 PolarHBondContact O-N 2.89Å; V316-G318 PolarHBondContact O-N 3.1Å; V316-I319 PolarHBondContact O-N 3.48Å; V316-T320 WeakPolarHBondContact O-CB 3.37Å; V316-T320 PolarHBondContact O-N 3.37Å; V316-T320 PolarHBondContact O-OG1 3.33Å |
| 317 | I | 90.8 | Very high | 86.5 | Confident | 86 Ų | 86 | 53.6 Ų | 53.6 | 44% | 0.441 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -57.8 | -46.7 | 171.8 | -72.4 | 164.5 | 0 | 0 | 0 | 111.1 | S313 S315 I319 T320 L321 | S313-I317 WeakPolarHBondContact O-CB 3.36Å; S313-I317 VanDerWaalsContact O-CD1 3.32Å; S313-I317 WeakPolarHBondContact O-CD1 3.42Å; S313-I317 WeakPolarHBondContact O-CG1 3.4Å; S313-I317 PolarHBondContact O-N 3.35Å; S315-I317 VanDerWaalsContact C-N 3.3Å; S315-I317 PolarHBondContact O-N 2.94Å; I317-I319 PolarHBondContact O-N 3.49Å; I317-T320 PolarHBondContact O-N 2.88Å; I317-L321 HydrophobicContact CG2-CD1 3.83Å; I317-L321 HydrophobicContact CG2-CG 4.36Å; I317-L321 WeakPolarHBondContact O-CB 3.42Å; I317-L321 WeakPolarHBondContact O-CG 3.28Å; I317-L321 PolarHBondContact O-N 3.13Å |
| 318 | G | 91.7 | Very high | 86.8 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -56.3 | -48.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | H314 S315 V316 L321 V322 | H314-G318 PolarHBondContact O-N 2.91Å; S315-G318 CarbonylContact O-C 3.6Å; S315-G318 WeakPolarHBondContact O-CA 3.31Å; S315-G318 PolarHBondContact O-N 3.26Å; V316-G318 PolarHBondContact O-N 3.1Å; G318-L321 PolarHBondContact O-N 3.07Å; G318-V322 PolarHBondContact O-N 3.32Å |
| 319 | I | 92.9 | Very high | 87.2 | Confident | 4 Ų | 4 | 49 Ų | 49 | 2% | 0.021 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63 | -46.9 | 178.7 | -62.5 | 169.4 | 0 | 0 | 0 | 110.7 | I259 L267 I302 M305 T306 S315 V316 I317 L321 V322 V323 | I259-I319 HydrophobicContact CD1-CG1 4.27Å; L267-I319 HydrophobicContact CD1-CB 4.15Å; L267-I319 HydrophobicContact CD1-CG1 3.94Å; L267-I319 HydrophobicContact CD1-CG2 3.8Å; L267-I319 HydrophobicContact CD2-CG2 4.1Å; I302-I319 HydrophobicContact CG2-CG2 4.4Å; M305-I319 HydrophobicContact CG-CD1 4.09Å; T306-I319 HydrophobicContact CG2-CB 4.24Å; T306-I319 HydrophobicContact CG2-CD1 3.84Å; T306-I319 HydrophobicContact CG2-CG2 3.64Å; S315-I319 WeakPolarHBondContact O-CG1 3.26Å; S315-I319 PolarHBondContact O-N 3.17Å; V316-I319 PolarHBondContact O-N 3.48Å; I317-I319 PolarHBondContact O-N 3.49Å; I319-L321 VanDerWaalsContact C-N 3.3Å; I319-L321 PolarHBondContact O-N 3.13Å; I319-V322 PolarHBondContact O-N 3.15Å; I319-V323 HydrophobicContact CG2-CG2 4.37Å; I319-V323 WeakPolarHBondContact O-CG2 3.39Å; I319-V323 PolarHBondContact O-N 3.14Å |
| 320 | T | 93.8 | Very high | 87.9 | Confident | 86 Ų | 86 | 47.9 Ų | 47.9 | 53% | 0.528 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.4 | -39.8 | 176.4 | -59.9 | 0 | 0 | 0 | 0 | 112.1 | V316 I317 V323 A324 | V316-T320 WeakPolarHBondContact O-CB 3.37Å; V316-T320 PolarHBondContact O-N 3.37Å; V316-T320 PolarHBondContact O-OG1 3.33Å; I317-T320 PolarHBondContact O-N 2.88Å; T320-V323 PolarHBondContact O-N 3.4Å; T320-A324 VanDerWaalsContact O-CB 3.29Å; T320-A324 WeakPolarHBondContact O-CB 3.38Å; T320-A324 PolarHBondContact O-N 3.02Å |
| 321 | L | 94.9 | Very high | 88.9 | Confident | 34 Ų | 34 | 49.6 Ų | 49.6 | 18% | 0.178 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.7 | -40.6 | 176.8 | -71 | 166.3 | 0 | 0 | 0 | 112.4 | L251 Q254 A255 I317 G318 I319 S325 | L251-L321 HydrophobicContact CD2-CD2 3.51Å; Q254-L321 HydrophobicContact CB-CD1 4.39Å; Q254-L321 HydrophobicContact CG-CD1 3.81Å; A255-L321 HydrophobicContact CB-CB 3.92Å; I317-L321 HydrophobicContact CG2-CD1 3.83Å; I317-L321 HydrophobicContact CG2-CG 4.36Å; I317-L321 WeakPolarHBondContact O-CB 3.42Å; I317-L321 WeakPolarHBondContact O-CG 3.28Å; I317-L321 PolarHBondContact O-N 3.13Å; G318-L321 PolarHBondContact O-N 3.07Å; I319-L321 VanDerWaalsContact C-N 3.3Å; I319-L321 PolarHBondContact O-N 3.13Å; L321-S325 WeakPolarHBondContact O-CB 3.11Å; L321-S325 PolarHBondContact O-N 3.2Å |
| 322 | V | 95.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.8 | -43.1 | 174.8 | -170.1 | 0 | 0 | 0 | 0 | 111.4 | A255 I259 V264 L267 F268 G318 I319 A324 S325 A326 | A255-V322 HydrophobicContact CB-CB 4.49Å; A255-V322 HydrophobicContact CB-CG2 3.33Å; I259-V322 HydrophobicContact CD1-CG2 3.92Å; V264-V322 HydrophobicContact CB-CG2 4.19Å; V264-V322 HydrophobicContact CG1-CG1 4.38Å; V264-V322 HydrophobicContact CG1-CG2 4Å; V264-V322 HydrophobicContact CG2-CG2 3.87Å; V264-V322 WeakPolarHBondContact O-CG1 3.43Å; L267-V322 HydrophobicContact CB-CB 3.97Å; L267-V322 HydrophobicContact CB-CG1 3.59Å; L267-V322 HydrophobicContact CD1-CB 4.4Å; L267-V322 HydrophobicContact CD1-CG2 4.43Å; F268-V322 HydrophobicContact CB-CG1 3.99Å; G318-V322 PolarHBondContact O-N 3.32Å; I319-V322 PolarHBondContact O-N 3.15Å; V322-A324 VanDerWaalsContact C-N 3.29Å; V322-A324 PolarHBondContact O-N 3.41Å; V322-S325 WeakPolarHBondContact O-CB 3.48Å; V322-S325 PolarHBondContact O-N 3.35Å; V322-A326 WeakPolarHBondContact O-CB 3.4Å; V322-A326 PolarHBondContact O-N 3.49Å |
| 323 | V | 95.5 | Very high | 90.5 | Very high | 33 Ų | 33 | 41.8 Ų | 41.8 | 20% | 0.2 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.9 | -38.5 | 179.6 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | L267 F274 I302 I319 T320 S327 | L267-V323 HydrophobicContact CD2-CG2 4.48Å; F274-V323 HydrophobicContact CE2-CG1 4.18Å; F274-V323 HydrophobicContact CZ-CG1 3.98Å; I302-V323 HydrophobicContact CD1-CG2 4.12Å; I302-V323 HydrophobicContact CG1-CG2 4.46Å; I302-V323 HydrophobicContact CG2-CG2 3.77Å; I319-V323 HydrophobicContact CG2-CG2 4.37Å; I319-V323 WeakPolarHBondContact O-CG2 3.39Å; I319-V323 PolarHBondContact O-N 3.14Å; T320-V323 PolarHBondContact O-N 3.4Å; V323-S327 WeakPolarHBondContact O-CB 3.25Å; V323-S327 PolarHBondContact O-N 3.21Å; V323-S327 PolarHBondContact O-OG 3.11Å |
| 324 | A | 95.9 | Very high | 91.6 | Very high | 32 Ų | 32 | 37.8 Ų | 37.8 | 26% | 0.264 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -64.2 | -46.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L251 T320 V322 A326 S327 M328 | L251-A324 HydrophobicContact CD1-CB 4.01Å; T320-A324 VanDerWaalsContact O-CB 3.29Å; T320-A324 WeakPolarHBondContact O-CB 3.38Å; T320-A324 PolarHBondContact O-N 3.02Å; V322-A324 VanDerWaalsContact C-N 3.29Å; V322-A324 PolarHBondContact O-N 3.41Å; A324-A326 PolarHBondContact O-N 3.34Å; A324-S327 PolarHBondContact O-N 3.44Å; A324-M328 VanDerWaalsContact O-CG 3.3Å; A324-M328 WeakPolarHBondContact O-CG 3.33Å; A324-M328 PolarHBondContact O-N 2.7Å |
| 325 | S | 96.3 | Very high | 92 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -56.8 | -48.5 | 173.9 | 176.2 | 0 | 0 | 0 | 0 | 112.3 | T248 L321 V322 S327 M328 S329 | T248-S325 WeakPolarHBondContact O-CB 3.43Å; T248-S325 PolarHBondContact O-OG 3.48Å; L321-S325 WeakPolarHBondContact O-CB 3.11Å; L321-S325 PolarHBondContact O-N 3.2Å; V322-S325 WeakPolarHBondContact O-CB 3.48Å; V322-S325 PolarHBondContact O-N 3.35Å; S325-S327 VanDerWaalsContact C-N 3.28Å; S325-S327 PolarHBondContact O-N 3.11Å; S325-M328 PolarHBondContact O-N 2.98Å; S325-S329 WeakPolarHBondContact O-CB 3.19Å; S325-S329 PolarHBondContact O-N 3.04Å |
| 326 | A | 95.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.2 | -37.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | F268 N271 F274 V322 A324 A330 | F268-A326 HydrophobicContact CD2-CB 4.16Å; N271-A326 HydrophobicContact CB-CB 4.02Å; F274-A326 HydrophobicContact CD2-CB 3.99Å; F274-A326 HydrophobicContact CE2-CB 3.99Å; V322-A326 WeakPolarHBondContact O-CB 3.4Å; V322-A326 PolarHBondContact O-N 3.49Å; A324-A326 PolarHBondContact O-N 3.34Å; A326-A330 WeakPolarHBondContact O-CB 3.39Å; A326-A330 PolarHBondContact O-N 2.87Å |
| 327 | S | 94.6 | Very high | 91.7 | Very high | 42 Ų | 42 | 36.9 Ų | 36.9 | 29% | 0.294 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -70.8 | -41.5 | 175.9 | -58.4 | 0 | 0 | 0 | 0 | 112.4 | V323 A324 S325 A330 L331 | V323-S327 WeakPolarHBondContact O-CB 3.25Å; V323-S327 PolarHBondContact O-N 3.21Å; V323-S327 PolarHBondContact O-OG 3.11Å; A324-S327 PolarHBondContact O-N 3.44Å; S325-S327 VanDerWaalsContact C-N 3.28Å; S325-S327 PolarHBondContact O-N 3.11Å; S327-A330 PolarHBondContact O-N 2.94Å; S327-L331 WeakPolarHBondContact O-CB 3.43Å; S327-L331 PolarHBondContact O-N 3.28Å |
| 328 | M | 94.3 | Very high | 91.4 | Very high | 58 Ų | 58 | 37.3 Ų | 37.3 | 29% | 0.286 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -67.2 | -37.9 | 175.3 | -68.4 | -64.3 | 175.7 | 0 | 0 | 111.8 | L244 L247 T248 L251 A324 S325 L331 Y332 | L244-M328 HydrophobicContact CD2-SD 3.76Å; L247-M328 HydrophobicContact CD2-CE 3.96Å; L247-M328 HydrophobicContact CD2-CG 4.23Å; L247-M328 HydrophobicContact CD2-SD 4.06Å; L247-M328 HydrophobicContact CG-CG 4.49Å; T248-M328 VanDerWaalsContact OG1-CB 3.31Å; T248-M328 WeakPolarHBondContact OG1-CB 3.16Å; L251-M328 HydrophobicContact CD1-CG 4.36Å; A324-M328 VanDerWaalsContact O-CG 3.3Å; A324-M328 WeakPolarHBondContact O-CG 3.33Å; A324-M328 PolarHBondContact O-N 2.7Å; S325-M328 PolarHBondContact O-N 2.98Å; M328-L331 PolarHBondContact O-N 3Å; M328-L331 HydrophobicContact SD-CD2 4.47Å; M328-Y332 VanDerWaalsContact O-CB 3.32Å; M328-Y332 WeakPolarHBondContact O-CB 3.31Å; M328-Y332 PolarHBondContact O-N 2.86Å |
| 329 | S | 92.8 | Very high | 90.5 | Very high | 25 Ų | 25 | 39.4 Ų | 39.4 | 18% | 0.175 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.9 | -42.3 | 172.6 | -167.3 | 0 | 0 | 0 | 0 | 111.8 | T248 N271 S325 K333 | T248-S329 PolarHBondContact OG1-N 3.47Å; N271-S329 WeakPolarHBondContact ND2-CB 3.29Å; N271-S329 PolarHBondContact ND2-OG 2.99Å; S325-S329 WeakPolarHBondContact O-CB 3.19Å; S325-S329 PolarHBondContact O-N 3.04Å; S329-K333 WeakPolarHBondContact O-CB 3.23Å; S329-K333 PolarHBondContact O-N 2.88Å; S329-K333 VanDerWaalsContact O-N 3.08Å |
| 330 | A | 93.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.5 | -45.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F274 V275 L278 A326 S327 K333 V334 | F274-A330 HydrophobicContact CB-CB 3.6Å; V275-A330 HydrophobicContact CB-CB 4.4Å; V275-A330 HydrophobicContact CG2-CB 3.59Å; L278-A330 HydrophobicContact CD1-CB 3.99Å; A326-A330 WeakPolarHBondContact O-CB 3.39Å; A326-A330 PolarHBondContact O-N 2.87Å; S327-A330 PolarHBondContact O-N 2.94Å; A330-K333 PolarHBondContact O-N 3.07Å; A330-V334 WeakPolarHBondContact O-CG2 3.34Å; A330-V334 PolarHBondContact O-N 3.26Å |
| 331 | L | 92.3 | Very high | 87.9 | Confident | 59 Ų | 59 | 38.1 Ų | 38.1 | 31% | 0.309 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.7 | -48.1 | 176.6 | -178.4 | 61.5 | 0 | 0 | 0 | 111.5 | L244 L278 S327 M328 K333 V334 L335 | L244-L331 HydrophobicContact CD2-CD2 4.05Å; L244-L331 HydrophobicContact CD2-CG 4.47Å; L278-L331 HydrophobicContact CD1-CB 4.25Å; S327-L331 WeakPolarHBondContact O-CB 3.43Å; S327-L331 PolarHBondContact O-N 3.28Å; M328-L331 PolarHBondContact O-N 3Å; M328-L331 HydrophobicContact SD-CD2 4.47Å; L331-K333 VanDerWaalsContact C-N 3.27Å; L331-K333 PolarHBondContact O-N 3.29Å; L331-V334 PolarHBondContact O-N 2.91Å; L331-L335 HydrophobicContact CD1-CD1 3.89Å; L331-L335 HydrophobicContact CD1-CD2 4.46Å; L331-L335 HydrophobicContact CD1-CG 3.91Å; L331-L335 HydrophobicContact CG-CD1 3.82Å; L331-L335 HydrophobicContact CG-CG 4.25Å; L331-L335 VanDerWaalsContact O-CB 3.3Å; L331-L335 WeakPolarHBondContact O-CB 3.45Å; L331-L335 VanDerWaalsContact O-CG 3.26Å; L331-L335 WeakPolarHBondContact O-CG 3.46Å; L331-L335 PolarHBondContact O-N 3.34Å |
| 332 | Y | 89.2 | Confident | 86.2 | Confident | 29 Ų | 29 | 41.5 Ų | 41.5 | 11% | 0.114 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -50.1 | -48.1 | 171.8 | 167.9 | -91.3 | 0 | 0 | 0 | 111.3 | F241 L244 W245 M328 F336 F351 | F241-Y332 HydrophobicContact CB-CD2 4.49Å; F241-Y332 HydrophobicContact CB-CE2 4.22Å; F241-Y332 AromaticContact CD1-CD2 3.85Å; F241-Y332 HydrophobicContact CD1-CD2 3.85Å; F241-Y332 AromaticContact CD1-CE2 3.84Å; F241-Y332 HydrophobicContact CD1-CE2 3.84Å; L244-Y332 HydrophobicContact CB-CD2 4.37Å; W245-Y332 HydrophobicContact CB-CE2 4.46Å; W245-Y332 HydrophobicContact CE3-CD1 4.34Å; W245-Y332 HydrophobicContact CE3-CD2 4.5Å; W245-Y332 AromaticContact CE3-CE1 3.81Å; W245-Y332 HydrophobicContact CE3-CE1 3.81Å; W245-Y332 AromaticContact CE3-CE2 3.98Å; W245-Y332 HydrophobicContact CE3-CE2 3.98Å; W245-Y332 AromaticContact CE3-CZ 3.63Å; W245-Y332 AromaticContact CZ3-CE1 3.89Å; W245-Y332 HydrophobicContact CZ3-CE1 3.89Å; M328-Y332 VanDerWaalsContact O-CB 3.32Å; M328-Y332 WeakPolarHBondContact O-CB 3.31Å; M328-Y332 PolarHBondContact O-N 2.86Å; Y332-F336 VanDerWaalsContact O-CB 3.27Å; Y332-F336 WeakPolarHBondContact O-CB 3.17Å; Y332-F336 PolarHBondContact O-N 3.39Å; Y332-F351 HydrophobicContact CE2-CE1 4.49Å |
| 333 | K | 87.2 | Confident | 84.7 | Confident | 109 Ų | 109 | 42.4 Ų | 42.4 | 47% | 0.474 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -70.2 | -37.7 | -176.2 | -166.3 | 167.2 | -167.9 | 159.1 | 0 | 113.5 | V275 S329 A330 L331 K337 | V275-K333 HydrophobicContact CG2-CB 4.5Å; V275-K333 HydrophobicContact CG2-CD 4.29Å; S329-K333 WeakPolarHBondContact O-CB 3.23Å; S329-K333 PolarHBondContact O-N 2.88Å; S329-K333 VanDerWaalsContact O-N 3.08Å; A330-K333 PolarHBondContact O-N 3.07Å; L331-K333 VanDerWaalsContact C-N 3.27Å; L331-K333 PolarHBondContact O-N 3.29Å; K333-K337 PolarHBondContact O-N 2.85Å; K333-K337 VanDerWaalsContact O-N 3.14Å |
| 334 | V | 89.4 | Confident | 83.5 | Confident | 2 Ų | 2 | 45.8 Ų | 45.8 | 1% | 0.012 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -73.1 | -43.4 | 177.1 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | L278 V282 L283 A330 L331 F336 K337 M338 | L278-V334 HydrophobicContact CB-CB 4.39Å; L278-V334 HydrophobicContact CB-CG1 4.37Å; L278-V334 HydrophobicContact CB-CG2 3.89Å; V282-V334 HydrophobicContact CB-CG1 4.08Å; V282-V334 HydrophobicContact CG1-CG1 4.39Å; V282-V334 HydrophobicContact CG2-CG1 4.38Å; L283-V334 HydrophobicContact CD1-CG1 3.68Å; A330-V334 WeakPolarHBondContact O-CG2 3.34Å; A330-V334 PolarHBondContact O-N 3.26Å; L331-V334 PolarHBondContact O-N 2.91Å; V334-F336 VanDerWaalsContact C-N 3.28Å; V334-F336 PolarHBondContact O-N 3.46Å; V334-K337 PolarHBondContact O-N 3.28Å; V334-M338 WeakPolarHBondContact O-CB 3.42Å; V334-M338 PolarHBondContact O-N 3.31Å |
| 335 | L | 85.7 | Confident | 82.2 | Confident | 42 Ų | 42 | 49 Ų | 49 | 22% | 0.22 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.9 | -36.6 | 171.7 | -69.1 | 176.6 | 0 | 0 | 0 | 111.6 | F241 L244 L331 M338 V339 | F241-L335 HydrophobicContact CE1-CB 3.77Å; F241-L335 HydrophobicContact CZ-CB 3.79Å; L244-L335 HydrophobicContact CD1-CD1 3.72Å; L331-L335 HydrophobicContact CD1-CD1 3.89Å; L331-L335 HydrophobicContact CD1-CD2 4.46Å; L331-L335 HydrophobicContact CD1-CG 3.91Å; L331-L335 HydrophobicContact CG-CD1 3.82Å; L331-L335 HydrophobicContact CG-CG 4.25Å; L331-L335 VanDerWaalsContact O-CB 3.3Å; L331-L335 WeakPolarHBondContact O-CB 3.45Å; L331-L335 VanDerWaalsContact O-CG 3.26Å; L331-L335 WeakPolarHBondContact O-CG 3.46Å; L331-L335 PolarHBondContact O-N 3.34Å; L335-M338 HydrophobicContact CD2-CE 3.63Å; L335-M338 PolarHBondContact O-N 3.32Å; L335-V339 VanDerWaalsContact O-CB 3.25Å; L335-V339 WeakPolarHBondContact O-CB 3.47Å; L335-V339 VanDerWaalsContact O-CG2 3.26Å; L335-V339 WeakPolarHBondContact O-CG2 3.49Å; L335-V339 PolarHBondContact O-N 2.97Å |
| 336 | F | 82.6 | Confident | 80.9 | Confident | 37 Ų | 37 | 49.1 Ų | 49.1 | 16% | 0.162 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.3 | -50.6 | 176.4 | -172 | -78.3 | 0 | 0 | 0 | 110.5 | F241 Y332 V334 M338 L340 A343 A348 F351 | F241-F336 HydrophobicContact CE1-CB 4.13Å; Y332-F336 VanDerWaalsContact O-CB 3.27Å; Y332-F336 WeakPolarHBondContact O-CB 3.17Å; Y332-F336 PolarHBondContact O-N 3.39Å; V334-F336 VanDerWaalsContact C-N 3.28Å; V334-F336 PolarHBondContact O-N 3.46Å; F336-M338 PolarHBondContact O-N 3.15Å; F336-L340 HydrophobicContact CD2-CD1 3.61Å; F336-L340 HydrophobicContact CE2-CD1 3.56Å; F336-L340 HydrophobicContact CG-CD1 4.16Å; F336-L340 HydrophobicContact CZ-CD1 4.07Å; F336-L340 WeakPolarHBondContact O-CB 3.49Å; F336-L340 PolarHBondContact O-N 3.37Å; F336-L340 VanDerWaalsContact O-N 3.09Å; F336-A343 HydrophobicContact CE1-CB 4.14Å; F336-A343 HydrophobicContact CZ-CB 4.31Å; F336-A348 HydrophobicContact CZ-CB 4.2Å; F336-F351 HydrophobicContact CD2-CD1 4.32Å; F336-F351 HydrophobicContact CD2-CE1 4.13Å; F336-F351 AromaticContact CE2-CD1 3.71Å; F336-F351 HydrophobicContact CE2-CD1 3.71Å; F336-F351 AromaticContact CE2-CE1 3.98Å; F336-F351 HydrophobicContact CE2-CE1 3.98Å; F336-F351 HydrophobicContact CE2-CG 4.05Å |
| 337 | K | 82.3 | Confident | 80.1 | Confident | 96 Ų | 96 | 50.9 Ų | 50.9 | 42% | 0.417 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57.4 | -35.4 | 175 | -173.7 | -176.4 | 167.1 | -158.8 | 0 | 112.1 | L283 D285 K333 V334 G341 | L283-K337 HydrophobicContact CD2-CB 4.45Å; L283-K337 HydrophobicContact CD2-CD 3.35Å; L283-K337 HydrophobicContact CD2-CG 3.77Å; D285-K337 IonicContact OD1-NZ 2.71Å; D285-K337 IonicContact OD2-NZ 3.46Å; D285-K337 PolarHBondContact OD2-NZ 3.36Å; K333-K337 PolarHBondContact O-N 2.85Å; K333-K337 VanDerWaalsContact O-N 3.14Å; V334-K337 PolarHBondContact O-N 3.28Å; K337-G341 WeakPolarHBondContact O-CA 3.5Å; K337-G341 PolarHBondContact O-N 3.47Å |
| 338 | M | 82.8 | Confident | 79.3 | Confident | 96 Ų | 96 | 49.8 Ų | 49.8 | 47% | 0.473 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -79.9 | -44.8 | -178.3 | -172.9 | -175.1 | 76.4 | 0 | 0 | 114.1 | V282 L283 V334 L335 F336 | V282-M338 HydrophobicContact CG1-SD 3.51Å; V282-M338 VanDerWaalsContact CG1-SD 3.51Å; L283-M338 HydrophobicContact CD1-CB 4.3Å; V334-M338 WeakPolarHBondContact O-CB 3.42Å; V334-M338 PolarHBondContact O-N 3.31Å; L335-M338 HydrophobicContact CD2-CE 3.63Å; L335-M338 PolarHBondContact O-N 3.32Å; F336-M338 PolarHBondContact O-N 3.15Å |
| 339 | V | 73.8 | Confident | 78.6 | Confident | 44 Ų | 44 | 47.1 Ų | 47.1 | 27% | 0.267 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -89.3 | -24.1 | -169.2 | 177 | 0 | 0 | 0 | 0 | 112.7 | K237 F241 L335 | K237-V339 HydrophobicContact CD-CG1 3.57Å; F241-V339 HydrophobicContact CE2-CB 4.37Å; F241-V339 HydrophobicContact CE2-CG1 4.19Å; F241-V339 HydrophobicContact CE2-CG2 4.48Å; F241-V339 HydrophobicContact CZ-CB 3.96Å; F241-V339 HydrophobicContact CZ-CG1 4.27Å; F241-V339 HydrophobicContact CZ-CG2 4.07Å; L335-V339 VanDerWaalsContact O-CB 3.25Å; L335-V339 WeakPolarHBondContact O-CB 3.47Å; L335-V339 VanDerWaalsContact O-CG2 3.26Å; L335-V339 WeakPolarHBondContact O-CG2 3.49Å; L335-V339 PolarHBondContact O-N 2.97Å |
| 340 | L | 67.4 | Low | 78 | Confident | 22 Ų | 22 | 46.1 Ų | 46.1 | 12% | 0.115 | 25% | 0.246 | C | C | . | . | S | Bend | trans | -123 | -6.4 | -173 | -58 | 172.4 | 0 | 0 | 0 | 112.9 | F223 F336 F351 | F223-L340 HydrophobicContact CE1-CB 4.06Å; F223-L340 HydrophobicContact CE1-CD2 3.99Å; F223-L340 HydrophobicContact CE1-CG 4.41Å; F223-L340 HydrophobicContact CZ-CB 3.83Å; F223-L340 HydrophobicContact CZ-CD2 4.44Å; F223-L340 VanDerWaalsContact CZ-O 3.27Å; F223-L340 WeakPolarHBondContact CZ-O 3.28Å; F336-L340 HydrophobicContact CD2-CD1 3.61Å; F336-L340 HydrophobicContact CE2-CD1 3.56Å; F336-L340 HydrophobicContact CG-CD1 4.16Å; F336-L340 HydrophobicContact CZ-CD1 4.07Å; F336-L340 WeakPolarHBondContact O-CB 3.49Å; F336-L340 PolarHBondContact O-N 3.37Å; F336-L340 VanDerWaalsContact O-N 3.09Å; L340-F351 HydrophobicContact CD1-CD2 3.81Å; L340-F351 HydrophobicContact CD1-CE2 3.57Å; L340-F351 HydrophobicContact CD1-CG 4.44Å; L340-F351 HydrophobicContact CD1-CZ 3.99Å |
| 341 | G | 65.1 | Low | 77.5 | Confident | 41 Ų | 41 | 46.2 Ų | 46.2 | 42% | 0.423 | 25% | 0.246 | S | C | . | . | trans | 62.4 | -142.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | K337 A343 | K337-G341 WeakPolarHBondContact O-CA 3.5Å; K337-G341 PolarHBondContact O-N 3.47Å; G341-A343 VanDerWaalsContact C-N 3.27Å; G341-A343 PolarHBondContact O-N 2.95Å | ||
| 342 | S | 59.6 | Low | 77.1 | Confident | 105 Ų | 105 | 43.6 Ų | 43.6 | 73% | 0.734 | 23% | 0.232 | S | C | * | . | S | Bend | trans | -83.9 | 62.3 | -179.9 | 60.7 | 0 | 0 | 0 | 0 | 112.3 | K344 | S342-K344 PolarHBondContact O-N 2.87Š|
| 343 | A | 62.2 | Low | 77 | Confident | 18 Ų | 18 | 42.5 Ų | 42.5 | 15% | 0.149 | 23% | 0.229 | C | C | . | . | trans | -53.4 | 132.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F223 F336 G341 | F223-A343 HydrophobicContact CE1-CB 4.2Å; F223-A343 HydrophobicContact CE2-CB 4.02Å; F223-A343 HydrophobicContact CZ-CB 3.47Å; F223-A343 VanDerWaalsContact CZ-CB 3.47Å; F336-A343 HydrophobicContact CE1-CB 4.14Å; F336-A343 HydrophobicContact CZ-CB 4.31Å; G341-A343 VanDerWaalsContact C-N 3.27Å; G341-A343 PolarHBondContact O-N 2.95Å | ||
| 344 | K | 70.4 | Confident | 76.9 | Confident | 104 Ų | 104 | 38.4 Ų | 38.4 | 45% | 0.452 | 21% | 0.212 | S | C | . | . | trans | -70.2 | 154.8 | 170.6 | -62.7 | -166.2 | 173.6 | -159.9 | 0 | 110.2 | E106 S342 G346 E347 A348 | E106-K344 IonicContact OE1-NZ 2.59Å; E106-K344 PolarHBondContact OE1-NZ 3.19Å; E106-K344 IonicContact OE2-NZ 3.71Å; E106-K344 PolarHBondContact OE2-NZ 3.19Å; S342-K344 PolarHBondContact O-N 2.87Å; K344-G346 PolarHBondContact O-N 3.43Å; K344-G346 VanDerWaalsContact O-N 3.12Å; K344-E347 HydrophobicContact CB-CG 4.31Å; K344-E347 PolarHBondContact N-OE2 3.29Å; K344-E347 WeakPolarHBondContact O-CB 3.36Å; K344-E347 PolarHBondContact O-N 3.35Å; K344-A348 PolarHBondContact O-N 3.38Å | ||
| 345 | F | 70.2 | Confident | 76.7 | Confident | 99 Ų | 99 | 38.5 Ų | 38.5 | 43% | 0.434 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -55.4 | -35 | -175.2 | -60.4 | -75.8 | 0 | 0 | 0 | 114.4 | A349 I407 A408 | F345-A349 VanDerWaalsContact O-CB 3.32Å; F345-A349 WeakPolarHBondContact O-CB 3.47Å; F345-A349 PolarHBondContact O-N 3Å; F345-I407 HydrophobicContact CE1-CB 4.14Å; F345-I407 HydrophobicContact CE1-CG2 3.9Å; F345-I407 HydrophobicContact CZ-CG2 4.35Å; F345-A408 HydrophobicContact CD1-CB 4.17Å; F345-A408 HydrophobicContact CD2-CB 4.42Å; F345-A408 HydrophobicContact CE1-CB 3.92Å; F345-A408 HydrophobicContact CE2-CB 4.19Å; F345-A408 HydrophobicContact CG-CB 4.42Å; F345-A408 HydrophobicContact CZ-CB 3.93Å |
| 346 | G | 69.1 | Low | 76.7 | Confident | 4 Ų | 4 | 36.6 Ų | 36.6 | 4% | 0.041 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -71.2 | -34.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | K344 A349 L350 | K344-G346 PolarHBondContact O-N 3.43Å; K344-G346 VanDerWaalsContact O-N 3.12Å; G346-A349 PolarHBondContact O-N 3.11Å; G346-L350 WeakPolarHBondContact O-CB 3.4Å; G346-L350 PolarHBondContact O-N 2.91Å |
| 347 | E | 77 | Confident | 76.8 | Confident | 37 Ų | 37 | 37.5 Ų | 37.5 | 17% | 0.173 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -69.9 | -43.4 | 177.7 | -62 | 157.1 | -171.7 | 0 | 0 | 110.2 | C220 F223 K344 L350 F351 | C220-E347 HydrophobicContact CB-CG 4.18Å; F223-E347 HydrophobicContact CB-CB 4.31Å; F223-E347 HydrophobicContact CB-CG 3.97Å; F223-E347 HydrophobicContact CD1-CB 3.95Å; F223-E347 HydrophobicContact CD2-CB 4.14Å; F223-E347 HydrophobicContact CD2-CG 4.03Å; F223-E347 WeakPolarHBondContact CD2-OE2 3.45Å; F223-E347 HydrophobicContact CE1-CB 4.26Å; F223-E347 HydrophobicContact CE2-CB 4.45Å; F223-E347 WeakPolarHBondContact CE2-OE2 3.42Å; F223-E347 HydrophobicContact CG-CB 3.88Å; F223-E347 HydrophobicContact CG-CG 3.93Å; K344-E347 HydrophobicContact CB-CG 4.31Å; K344-E347 PolarHBondContact N-OE2 3.29Å; K344-E347 WeakPolarHBondContact O-CB 3.36Å; K344-E347 PolarHBondContact O-N 3.35Å; E347-L350 PolarHBondContact O-N 3.24Å; E347-F351 WeakPolarHBondContact O-CB 3.48Å; E347-F351 PolarHBondContact O-N 3.38Å |
| 348 | A | 78 | Confident | 76.9 | Confident | 18 Ų | 18 | 33.6 Ų | 33.6 | 15% | 0.149 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.3 | -41.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | F336 K344 L350 F351 L352 | F336-A348 HydrophobicContact CZ-CB 4.2Å; K344-A348 PolarHBondContact O-N 3.38Å; A348-L350 VanDerWaalsContact C-N 3.32Å; A348-L350 PolarHBondContact O-N 3.21Å; A348-F351 PolarHBondContact O-N 3.01Å; A348-L352 WeakPolarHBondContact O-CB 3.32Å; A348-L352 PolarHBondContact O-N 3.29Å |
| 349 | A | 79.8 | Confident | 77 | Confident | 3 Ų | 3 | 29.2 Ų | 29.2 | 3% | 0.025 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.8 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F195 Y199 F345 G346 S353 | F195-A349 HydrophobicContact CD1-CB 3.84Å; F195-A349 HydrophobicContact CE1-CB 4.14Å; Y199-A349 HydrophobicContact CD2-CB 4.12Å; Y199-A349 HydrophobicContact CG-CB 4.37Å; F345-A349 VanDerWaalsContact O-CB 3.32Å; F345-A349 WeakPolarHBondContact O-CB 3.47Å; F345-A349 PolarHBondContact O-N 3Å; G346-A349 PolarHBondContact O-N 3.11Å; A349-S353 PolarHBondContact O-N 3.11Å; A349-S353 VanDerWaalsContact O-N 3.1Å; A349-S353 PolarHBondContact O-OG 3.04Å |
| 350 | L | 80.8 | Confident | 77.6 | Confident | 4 Ų | 4 | 32.2 Ų | 32.2 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -73.1 | -41.7 | 175.2 | -95.7 | 163.1 | 0 | 0 | 0 | 112.9 | F196 L217 C220 G346 E347 A348 L352 S353 I354 | F196-L350 HydrophobicContact CB-CD2 3.99Å; F196-L350 HydrophobicContact CB-CG 4.3Å; F196-L350 HydrophobicContact CD1-CD2 3.86Å; F196-L350 HydrophobicContact CD1-CG 4.48Å; F196-L350 HydrophobicContact CD2-CD1 3.81Å; F196-L350 HydrophobicContact CD2-CD2 3.76Å; F196-L350 HydrophobicContact CD2-CG 3.46Å; F196-L350 VanDerWaalsContact CD2-CG 3.46Å; F196-L350 HydrophobicContact CE1-CD2 4.23Å; F196-L350 HydrophobicContact CE2-CD1 3.56Å; F196-L350 HydrophobicContact CE2-CD2 4.14Å; F196-L350 HydrophobicContact CE2-CG 3.78Å; F196-L350 HydrophobicContact CG-CD1 4.48Å; F196-L350 HydrophobicContact CG-CD2 3.6Å; F196-L350 HydrophobicContact CG-CG 3.84Å; F196-L350 HydrophobicContact CZ-CD1 4.05Å; F196-L350 HydrophobicContact CZ-CD2 4.36Å; F196-L350 HydrophobicContact CZ-CG 4.42Å; L217-L350 HydrophobicContact CD1-CD1 4.07Å; L217-L350 HydrophobicContact CD1-CD2 3.44Å; L217-L350 VanDerWaalsContact CD1-CD2 3.44Å; L217-L350 HydrophobicContact CD1-CG 4.43Å; C220-L350 HydrophobicContact CB-CD1 3.3Å; G346-L350 WeakPolarHBondContact O-CB 3.4Å; G346-L350 PolarHBondContact O-N 2.91Å; E347-L350 PolarHBondContact O-N 3.24Å; A348-L350 VanDerWaalsContact C-N 3.32Å; A348-L350 PolarHBondContact O-N 3.21Å; L350-L352 VanDerWaalsContact C-N 3.31Å; L350-L352 PolarHBondContact O-N 2.99Å; L350-S353 CarbonylContact O-C 3.55Å; L350-S353 WeakPolarHBondContact O-CB 3.43Å; L350-S353 PolarHBondContact O-N 2.89Å; L350-S353 VanDerWaalsContact O-N 3.1Å; L350-I354 WeakPolarHBondContact O-CB 3.46Å; L350-I354 WeakPolarHBondContact O-CD1 3.2Å; L350-I354 WeakPolarHBondContact O-CG1 3.43Å; L350-I354 PolarHBondContact O-N 3.38Å |
| 351 | F | 82.7 | Confident | 78.4 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 0% | 0.004 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -54.4 | -48.6 | 173.4 | -176.5 | -85.8 | 0 | 0 | 0 | 111.2 | F224 F241 Y332 F336 L340 E347 A348 S353 I354 V355 | F224-F351 AromaticContact CE1-CD2 3.9Å; F224-F351 HydrophobicContact CE1-CD2 3.9Å; F224-F351 HydrophobicContact CE1-CE2 4.27Å; F224-F351 AromaticContact CZ-CD2 3.76Å; F224-F351 HydrophobicContact CZ-CD2 3.76Å; F241-F351 HydrophobicContact CB-CE1 4.08Å; F241-F351 HydrophobicContact CB-CZ 3.6Å; F241-F351 HydrophobicContact CD1-CE1 4.49Å; F241-F351 HydrophobicContact CD1-CZ 4.09Å; F241-F351 HydrophobicContact CD2-CZ 4.26Å; F241-F351 HydrophobicContact CG-CE1 4.42Å; F241-F351 AromaticContact CG-CZ 3.73Å; F241-F351 HydrophobicContact CG-CZ 3.73Å; Y332-F351 HydrophobicContact CE2-CE1 4.49Å; F336-F351 HydrophobicContact CD2-CD1 4.32Å; F336-F351 HydrophobicContact CD2-CE1 4.13Å; F336-F351 AromaticContact CE2-CD1 3.71Å; F336-F351 HydrophobicContact CE2-CD1 3.71Å; F336-F351 AromaticContact CE2-CE1 3.98Å; F336-F351 HydrophobicContact CE2-CE1 3.98Å; F336-F351 HydrophobicContact CE2-CG 4.05Å; L340-F351 HydrophobicContact CD1-CD2 3.81Å; L340-F351 HydrophobicContact CD1-CE2 3.57Å; L340-F351 HydrophobicContact CD1-CG 4.44Å; L340-F351 HydrophobicContact CD1-CZ 3.99Å; E347-F351 WeakPolarHBondContact O-CB 3.48Å; E347-F351 PolarHBondContact O-N 3.38Å; A348-F351 PolarHBondContact O-N 3.01Å; F351-S353 VanDerWaalsContact C-N 3.31Å; F351-S353 PolarHBondContact O-N 3.04Å; F351-I354 PolarHBondContact O-N 3.12Å; F351-V355 HydrophobicContact CD1-CG2 4.11Å; F351-V355 HydrophobicContact CE1-CG2 3.78Å; F351-V355 HydrophobicContact CZ-CG2 4.21Å; F351-V355 WeakPolarHBondContact O-CG2 3.49Å; F351-V355 PolarHBondContact O-N 3.06Å |
| 352 | L | 83.4 | Confident | 79.2 | Confident | 4 Ų | 4 | 38.4 Ų | 38.4 | 2% | 0.021 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.7 | -35.4 | 177.5 | -173.7 | 59.7 | 0 | 0 | 0 | 112.6 | N192 F195 W245 A348 L350 G356 | N192-L352 HydrophobicContact CB-CD1 4.39Å; N192-L352 HydrophobicContact CB-CG 4.27Å; F195-L352 HydrophobicContact CD1-CD2 4.35Å; F195-L352 HydrophobicContact CD2-CD2 3.72Å; F195-L352 HydrophobicContact CE1-CD2 4.33Å; F195-L352 HydrophobicContact CE2-CD2 3.7Å; F195-L352 HydrophobicContact CG-CD2 4.06Å; F195-L352 HydrophobicContact CZ-CD2 4.02Å; W245-L352 HydrophobicContact CH2-CD1 4Å; W245-L352 HydrophobicContact CZ2-CD1 4.02Å; W245-L352 HydrophobicContact CZ3-CD1 4.26Å; A348-L352 WeakPolarHBondContact O-CB 3.32Å; A348-L352 PolarHBondContact O-N 3.29Å; L350-L352 VanDerWaalsContact C-N 3.31Å; L350-L352 PolarHBondContact O-N 2.99Å; L352-G356 PolarHBondContact O-N 3.49Å |
| 353 | S | 87.5 | Confident | 80.2 | Confident | 7 Ų | 7 | 35 Ų | 35 | 5% | 0.049 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -69.1 | -41.5 | 175.1 | -54.8 | 0 | 0 | 0 | 0 | 112.5 | N192 F195 F196 A349 L350 F351 V355 G356 S357 | N192-S353 WeakPolarHBondContact O-CA 3.34Å; F195-S353 WeakPolarHBondContact CB-OG 3.27Å; F196-S353 VanDerWaalsContact CB-OG 3.22Å; F196-S353 WeakPolarHBondContact CB-OG 3.36Å; F196-S353 PolarHBondContact N-OG 3.49Å; A349-S353 PolarHBondContact O-N 3.11Å; A349-S353 VanDerWaalsContact O-N 3.1Å; A349-S353 PolarHBondContact O-OG 3.04Å; L350-S353 CarbonylContact O-C 3.55Å; L350-S353 WeakPolarHBondContact O-CB 3.43Å; L350-S353 PolarHBondContact O-N 2.89Å; L350-S353 VanDerWaalsContact O-N 3.1Å; F351-S353 VanDerWaalsContact C-N 3.31Å; F351-S353 PolarHBondContact O-N 3.04Å; S353-V355 VanDerWaalsContact C-N 3.34Å; S353-G356 PolarHBondContact O-N 3.42Å; S353-S357 PolarHBondContact O-N 3.35Å; S353-S357 PolarHBondContact O-OG 3.19Å; S353-S357 VanDerWaalsContact O-OG 3.12Å |
| 354 | I | 84.9 | Confident | 81.1 | Confident | 23 Ų | 23 | 35.9 Ų | 35.9 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.7 | -38.7 | 177.3 | -64.8 | 159 | 0 | 0 | 0 | 109.8 | F224 L229 F234 V238 L350 F351 S357 A358 | F224-I354 HydrophobicContact CE2-CD1 3.74Å; F224-I354 HydrophobicContact CZ-CD1 3.93Å; L229-I354 HydrophobicContact CD1-CD1 3.99Å; F234-I354 HydrophobicContact CD2-CG2 4.25Å; F234-I354 HydrophobicContact CE2-CG2 3.98Å; V238-I354 HydrophobicContact CG1-CG2 4.09Å; L350-I354 WeakPolarHBondContact O-CB 3.46Å; L350-I354 WeakPolarHBondContact O-CD1 3.2Å; L350-I354 WeakPolarHBondContact O-CG1 3.43Å; L350-I354 PolarHBondContact O-N 3.38Å; F351-I354 PolarHBondContact O-N 3.12Å; I354-S357 PolarHBondContact O-N 3.48Å; I354-A358 WeakPolarHBondContact O-CB 3.48Å; I354-A358 PolarHBondContact O-N 2.91Å |
| 355 | V | 84.8 | Confident | 81.6 | Confident | 4 Ų | 4 | 37 Ų | 37 | 2% | 0.024 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.5 | -42 | 171.3 | 167.3 | 0 | 0 | 0 | 0 | 111.7 | V238 F351 S353 A358 N359 | V238-V355 HydrophobicContact CG1-CG2 3.81Å; F351-V355 HydrophobicContact CD1-CG2 4.11Å; F351-V355 HydrophobicContact CE1-CG2 3.78Å; F351-V355 HydrophobicContact CZ-CG2 4.21Å; F351-V355 WeakPolarHBondContact O-CG2 3.49Å; F351-V355 PolarHBondContact O-N 3.06Å; S353-V355 VanDerWaalsContact C-N 3.34Å; V355-A358 PolarHBondContact O-N 3.3Å; V355-N359 PolarHBondContact O-N 2.99Å |
| 356 | G | 86.1 | Confident | 82.1 | Confident | 1 Ų | 1 | 33.9 Ų | 33.9 | 1% | 0.01 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.1 | -48.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | C193 L352 S353 A358 N359 F360 | C193-G356 PolarHBondContact SG-O 2.97Å; L352-G356 PolarHBondContact O-N 3.49Å; S353-G356 PolarHBondContact O-N 3.42Å; G356-A358 VanDerWaalsContact C-N 3.33Å; G356-A358 PolarHBondContact O-N 3.03Å; G356-N359 WeakPolarHBondContact O-CB 3.37Å; G356-N359 PolarHBondContact O-N 3.27Å; G356-F360 PolarHBondContact O-N 3.22Å |
| 357 | S | 85.3 | Confident | 82.5 | Confident | 56 Ų | 56 | 34.2 Ų | 34.2 | 39% | 0.392 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65.3 | -36.5 | 177.5 | -61.6 | 0 | 0 | 0 | 0 | 112.1 | C193 S353 I354 F360 V361 | C193-S357 VanDerWaalsContact SG-CA 3.55Å; C193-S357 PolarHBondContact SG-N 2.86Å; S353-S357 PolarHBondContact O-N 3.35Å; S353-S357 PolarHBondContact O-OG 3.19Å; S353-S357 VanDerWaalsContact O-OG 3.12Å; I354-S357 PolarHBondContact O-N 3.48Å; S357-F360 PolarHBondContact O-N 2.95Å; S357-V361 WeakPolarHBondContact O-CG2 3.08Å; S357-V361 PolarHBondContact O-N 3.14Å |
| 358 | A | 84.3 | Confident | 82.5 | Confident | 15 Ų | 15 | 36 Ų | 36 | 12% | 0.124 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.4 | -43.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | F234 I354 V355 G356 V361 F362 | F234-A358 HydrophobicContact CE2-CB 4Å; F234-A358 HydrophobicContact CZ-CB 3.59Å; I354-A358 WeakPolarHBondContact O-CB 3.48Å; I354-A358 PolarHBondContact O-N 2.91Å; V355-A358 PolarHBondContact O-N 3.3Å; G356-A358 VanDerWaalsContact C-N 3.33Å; G356-A358 PolarHBondContact O-N 3.03Å; A358-V361 PolarHBondContact O-N 2.98Å; A358-F362 HydrophobicContact CB-CD2 4.33Å; A358-F362 WeakPolarHBondContact O-CA 3.29Å; A358-F362 WeakPolarHBondContact O-CB 3.36Å; A358-F362 PolarHBondContact O-N 2.84Å |
| 359 | N | 85.8 | Confident | 82.5 | Confident | 3 Ų | 3 | 39.3 Ų | 39.3 | 2% | 0.016 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62 | -42.9 | 173.9 | 177.2 | 70 | 0 | 0 | 0 | 112.1 | W186 T189 T190 I246 V355 G356 V361 I363 S364 | W186-N359 PolarHBondContact NE1-O 3.37Å; W186-N359 PolarHBondContact O-ND2 3.05Å; W186-N359 VanDerWaalsContact O-ND2 3.08Å; T189-N359 PolarHBondContact OG1-ND2 3.44Å; T190-N359 PolarHBondContact N-ND2 3.17Å; T190-N359 PolarHBondContact OG1-ND2 3.32Å; I246-N359 HydrophobicContact CD1-CB 3.99Å; I246-N359 WeakPolarHBondContact CD1-OD1 3.26Å; V355-N359 PolarHBondContact O-N 2.99Å; G356-N359 WeakPolarHBondContact O-CB 3.37Å; G356-N359 PolarHBondContact O-N 3.27Å; N359-V361 PolarHBondContact O-N 3.16Å; N359-I363 WeakPolarHBondContact O-CA 3.37Å; N359-I363 WeakPolarHBondContact O-CB 3.3Å; N359-I363 PolarHBondContact O-N 3.34Å; N359-I363 VanDerWaalsContact O-N 3.09Å; N359-S364 PolarHBondContact O-N 3.46Å |
| 360 | F | 85.6 | Confident | 82.5 | Confident | 107 Ų | 107 | 40.9 Ų | 40.9 | 47% | 0.469 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -63.4 | -41.1 | 177.9 | -175.3 | -112.9 | 0 | 0 | 0 | 112.7 | W186 T190 G356 S357 S364 | W186-F360 HydrophobicContact CZ2-CD2 4.05Å; W186-F360 HydrophobicContact CZ2-CE2 4.26Å; T190-F360 HydrophobicContact CG2-CB 4.09Å; T190-F360 HydrophobicContact CG2-CD2 3.55Å; T190-F360 HydrophobicContact CG2-CE2 4.37Å; T190-F360 HydrophobicContact CG2-CG 4.11Å; G356-F360 PolarHBondContact O-N 3.22Å; S357-F360 PolarHBondContact O-N 2.95Å; F360-S364 WeakPolarHBondContact O-CB 3.47Å |
| 361 | V | 83.8 | Confident | 82.3 | Confident | 98 Ų | 98 | 44.4 Ų | 44.4 | 59% | 0.594 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -83.6 | -54 | -178.7 | 176.7 | 0 | 0 | 0 | 0 | 112.3 | S357 A358 N359 | S357-V361 WeakPolarHBondContact O-CG2 3.08Å; S357-V361 PolarHBondContact O-N 3.14Å; A358-V361 PolarHBondContact O-N 2.98Å; N359-V361 PolarHBondContact O-N 3.16Å |
| 362 | F | 81.6 | Confident | 82 | Confident | 95 Ų | 95 | 51.6 Ų | 51.6 | 42% | 0.417 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -88.5 | -10.5 | -170.3 | -65.2 | -77.1 | 0 | 0 | 0 | 114.6 | F234 F235 A358 F365 | F234-F362 HydrophobicContact CE1-CD2 4.07Å; F234-F362 AromaticContact CE1-CE2 3.47Å; F234-F362 HydrophobicContact CE1-CE2 3.47Å; F234-F362 VanDerWaalsContact CE1-CE2 3.47Å; F234-F362 HydrophobicContact CE1-CZ 4.04Å; F234-F362 AromaticContact CZ-CD2 3.99Å; F234-F362 HydrophobicContact CZ-CD2 3.99Å; F234-F362 AromaticContact CZ-CE2 3.54Å; F234-F362 HydrophobicContact CZ-CE2 3.54Å; F234-F362 HydrophobicContact CZ-CZ 4.49Å; F235-F362 HydrophobicContact CZ-CE1 4.21Å; F235-F362 HydrophobicContact CZ-CZ 4.35Å; A358-F362 HydrophobicContact CB-CD2 4.33Å; A358-F362 WeakPolarHBondContact O-CA 3.29Å; A358-F362 WeakPolarHBondContact O-CB 3.36Å; A358-F362 PolarHBondContact O-N 2.84Å; F362-F365 WeakPolarHBondContact O-CD1 3.43Å; F362-F365 WeakPolarHBondContact O-CE1 3.03Å |
| 363 | I | 81.8 | Confident | 81.7 | Confident | 35 Ų | 35 | 55.1 Ų | 55.1 | 18% | 0.179 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -121.8 | -10.5 | -176.8 | -65.1 | 172.8 | 0 | 0 | 0 | 112.1 | F182 I246 N359 F365 V366 P367 | F182-I363 HydrophobicContact CE1-CG2 4.13Å; F182-I363 HydrophobicContact CZ-CG2 3.85Å; I246-I363 HydrophobicContact CD1-CD1 3.28Å; N359-I363 WeakPolarHBondContact O-CA 3.37Å; N359-I363 WeakPolarHBondContact O-CB 3.3Å; N359-I363 PolarHBondContact O-N 3.34Å; N359-I363 VanDerWaalsContact O-N 3.09Å; I363-F365 PolarHBondContact O-N 3.39Å; I363-V366 HydrophobicContact CG2-CB 4.42Å; I363-V366 HydrophobicContact CG2-CG2 4.3Å; I363-V366 WeakPolarHBondContact O-CB 3.47Å; I363-V366 PolarHBondContact O-N 2.92Å; I363-P367 WeakPolarHBondContact O-CD 3.33Å |
| 364 | S | 81.3 | Confident | 80.8 | Confident | 35 Ų | 35 | 60.9 Ų | 60.9 | 25% | 0.245 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -24.4 | 168.8 | 179.4 | 0 | 0 | 0 | 0 | 114.1 | N359 F360 V366 P367 V368 | N359-S364 PolarHBondContact O-N 3.46Å; F360-S364 WeakPolarHBondContact O-CB 3.47Å; S364-V366 PolarHBondContact O-N 2.96Å; S364-P367 WeakPolarHBondContact O-CD 3.39Å; S364-V368 WeakPolarHBondContact O-CG2 3.48Å |
| 365 | F | 80.3 | Confident | 79.9 | Confident | 127 Ų | 127 | 65.1 Ų | 65.1 | 56% | 0.557 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -66.6 | -25.1 | 171.8 | 76.2 | -112 | 0 | 0 | 0 | 113 | F362 I363 I369 | F362-F365 WeakPolarHBondContact O-CD1 3.43Å; F362-F365 WeakPolarHBondContact O-CE1 3.03Å; I363-F365 PolarHBondContact O-N 3.39Å; F365-I369 HydrophobicContact CD2-CD1 3.84Å; F365-I369 HydrophobicContact CE2-CD1 4.41Å; F365-I369 WeakPolarHBondContact O-CG1 3.3Å; F365-I369 PolarHBondContact O-N 3.45Å |
| 366 | V | 81.2 | Confident | 79 | Confident | 35 Ų | 35 | 65.7 Ų | 65.7 | 21% | 0.212 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -73.2 | -49.9 | -174.1 | -176.3 | 0 | 0 | 0 | 0 | 112 | F182 I363 S364 V368 I369 L370 | F182-V366 HydrophobicContact CD1-CG1 4.04Å; F182-V366 HydrophobicContact CE1-CB 3.67Å; F182-V366 HydrophobicContact CE1-CG1 3.43Å; F182-V366 VanDerWaalsContact CE1-CG1 3.43Å; F182-V366 HydrophobicContact CE2-CG1 4.3Å; F182-V366 HydrophobicContact CZ-CB 3.96Å; F182-V366 HydrophobicContact CZ-CG1 3.57Å; I363-V366 HydrophobicContact CG2-CB 4.42Å; I363-V366 HydrophobicContact CG2-CG2 4.3Å; I363-V366 WeakPolarHBondContact O-CB 3.47Å; I363-V366 PolarHBondContact O-N 2.92Å; S364-V366 PolarHBondContact O-N 2.96Å; V366-V368 VanDerWaalsContact C-N 3.25Å; V366-V368 PolarHBondContact O-N 2.92Å; V366-I369 PolarHBondContact O-N 2.86Å; V366-I369 VanDerWaalsContact O-N 3.16Å; V366-L370 HydrophobicContact CG1-CD1 3.93Å; V366-L370 WeakPolarHBondContact O-CD1 3.31Å; V366-L370 PolarHBondContact O-N 3.16Å |
| 367 | P | 75.9 | Confident | 77.9 | Confident | 11 Ų | 11 | 72 Ų | 72 | 7% | 0.071 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.9 | -36.9 | 172.4 | -24.3 | 34.5 | 0 | 0 | 0 | 112.9 | F182 T183 W186 I363 S364 L370 Y371 | F182-P367 HydrophobicContact CD1-CG 4.1Å; F182-P367 HydrophobicContact CE1-CG 4.03Å; T183-P367 HydrophobicContact CG2-CB 4.37Å; W186-P367 HydrophobicContact CB-CG 3.94Å; W186-P367 HydrophobicContact CD2-CG 3.8Å; W186-P367 HydrophobicContact CE3-CG 3.94Å; W186-P367 HydrophobicContact CG-CG 3.77Å; I363-P367 WeakPolarHBondContact O-CD 3.33Å; S364-P367 WeakPolarHBondContact O-CD 3.39Å; P367-L370 PolarHBondContact O-N 3.03Å; P367-Y371 WeakPolarHBondContact O-CB 3.48Å; P367-Y371 PolarHBondContact O-N 2.87Å |
| 368 | V | 77.3 | Confident | 76.8 | Confident | 73 Ų | 73 | 70.3 Ų | 70.3 | 44% | 0.442 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.2 | -41.3 | 177.1 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | S364 V366 Y371 F372 | S364-V368 WeakPolarHBondContact O-CG2 3.48Å; V366-V368 VanDerWaalsContact C-N 3.25Å; V366-V368 PolarHBondContact O-N 2.92Å; V368-Y371 PolarHBondContact O-N 3.48Å; V368-F372 HydrophobicContact CG1-CD2 3.85Å; V368-F372 HydrophobicContact CG1-CE2 3.63Å; V368-F372 WeakPolarHBondContact O-CD2 3.45Å; V368-F372 PolarHBondContact O-N 2.89Å; V368-F372 VanDerWaalsContact O-N 3.12Å |
| 369 | I | 79.3 | Confident | 75.6 | Confident | 88 Ų | 88 | 71 Ų | 71 | 45% | 0.451 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.5 | -40.2 | 172.9 | -68.5 | 172.6 | 0 | 0 | 0 | 111.4 | F365 V366 Y371 F372 T373 | F365-I369 HydrophobicContact CD2-CD1 3.84Å; F365-I369 HydrophobicContact CE2-CD1 4.41Å; F365-I369 WeakPolarHBondContact O-CG1 3.3Å; F365-I369 PolarHBondContact O-N 3.45Å; V366-I369 PolarHBondContact O-N 2.86Å; V366-I369 VanDerWaalsContact O-N 3.16Å; I369-Y371 VanDerWaalsContact C-N 3.28Å; I369-Y371 PolarHBondContact O-N 2.88Å; I369-F372 PolarHBondContact O-N 2.77Å; I369-T373 HydrophobicContact CG2-CG2 4.15Å; I369-T373 WeakPolarHBondContact O-CB 3.49Å; I369-T373 WeakPolarHBondContact O-CG2 3.5Å; I369-T373 PolarHBondContact O-N 3.18Å; I369-T373 PolarHBondContact O-OG1 3.36Å |
| 370 | L | 79.6 | Confident | 74.7 | Confident | 36 Ų | 36 | 73.8 Ų | 73.8 | 19% | 0.188 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -66.1 | -30.2 | 178.2 | -95.7 | 62.1 | 0 | 0 | 0 | 112.7 | F182 V366 P367 T373 H374 V375 E376 | F182-L370 HydrophobicContact CB-CD2 3.86Å; F182-L370 HydrophobicContact CD1-CD2 4.2Å; F182-L370 HydrophobicContact CG-CD2 4.06Å; V366-L370 HydrophobicContact CG1-CD1 3.93Å; V366-L370 WeakPolarHBondContact O-CD1 3.31Å; V366-L370 PolarHBondContact O-N 3.16Å; P367-L370 PolarHBondContact O-N 3.03Å; L370-T373 WeakPolarHBondContact CA-OG1 3.36Å; L370-T373 PolarHBondContact O-OG1 3.15Å; L370-H374 PolarHBondContact O-N 2.86Å; L370-V375 PolarHBondContact O-N 2.91Å; L370-V375 VanDerWaalsContact O-N 3.12Å; L370-E376 HydrophobicContact CB-CB 4.24Å; L370-E376 HydrophobicContact CD2-CG 4.04Å; L370-E376 PolarHBondContact O-N 3.17Å; L370-E376 VanDerWaalsContact O-N 3.1Å |
| 371 | Y | 76 | Confident | 73.6 | Confident | 78 Ų | 78 | 72.7 Ų | 72.7 | 31% | 0.306 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -67.7 | -54.8 | 171 | 177.4 | -98.9 | 0 | 0 | 0 | 111.2 | P367 V368 I369 T373 H374 Y377 T378 | P367-Y371 WeakPolarHBondContact O-CB 3.48Å; P367-Y371 PolarHBondContact O-N 2.87Å; V368-Y371 PolarHBondContact O-N 3.48Å; I369-Y371 VanDerWaalsContact C-N 3.28Å; I369-Y371 PolarHBondContact O-N 2.88Å; Y371-T373 VanDerWaalsContact C-N 3.29Å; Y371-T373 PolarHBondContact O-N 2.81Å; Y371-H374 PolarHBondContact O-N 3.22Å; Y371-Y377 HydrophobicContact CE2-CD2 4.28Å; Y371-Y377 HydrophobicContact CE2-CE2 4.16Å; Y371-T378 VanDerWaalsContact CD2-OG1 3.32Å; Y371-T378 WeakPolarHBondContact CD2-OG1 3.32Å; Y371-T378 WeakPolarHBondContact CE2-O 3.38Å; Y371-T378 WeakPolarHBondContact CE2-OG1 3.11Å |
| 372 | F | 76.6 | Confident | 72.7 | Confident | 152 Ų | 152 | 72.1 Ų | 72.1 | 67% | 0.667 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.9 | -25.4 | -179.9 | -74.7 | -59.5 | 0 | 0 | 0 | 114.2 | V368 I369 H374 | V368-F372 HydrophobicContact CG1-CD2 3.85Å; V368-F372 HydrophobicContact CG1-CE2 3.63Å; V368-F372 WeakPolarHBondContact O-CD2 3.45Å; V368-F372 PolarHBondContact O-N 2.89Å; V368-F372 VanDerWaalsContact O-N 3.12Å; I369-F372 PolarHBondContact O-N 2.77Å; F372-H374 VanDerWaalsContact C-N 3.27Å |
| 373 | T | 77.6 | Confident | 72 | Confident | 78 Ų | 78 | 73.4 Ų | 73.4 | 48% | 0.479 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 2 | 172.8 | 54.6 | 0 | 0 | 0 | 0 | 113.2 | I369 L370 Y371 V375 | I369-T373 HydrophobicContact CG2-CG2 4.15Å; I369-T373 WeakPolarHBondContact O-CB 3.49Å; I369-T373 WeakPolarHBondContact O-CG2 3.5Å; I369-T373 PolarHBondContact O-N 3.18Å; I369-T373 PolarHBondContact O-OG1 3.36Å; L370-T373 WeakPolarHBondContact CA-OG1 3.36Å; L370-T373 PolarHBondContact O-OG1 3.15Å; Y371-T373 VanDerWaalsContact C-N 3.29Å; Y371-T373 PolarHBondContact O-N 2.81Å; T373-V375 PolarHBondContact O-N 3.17Å |
| 374 | H | 68.1 | Low | 71.7 | Confident | 129 Ų | 129 | 72.7 Ų | 72.7 | 60% | 0.597 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.3 | 13.6 | -177.1 | -65.2 | -91.4 | 0 | 0 | 0 | 115.3 | L370 Y371 F372 Y377 | L370-H374 PolarHBondContact O-N 2.86Å; Y371-H374 PolarHBondContact O-N 3.22Å; F372-H374 VanDerWaalsContact C-N 3.27Å; H374-Y377 AromaticContact CE1-CD2 3.61Å; H374-Y377 AromaticContact CE1-CE2 3.71Å; H374-Y377 AromaticContact ND1-CD2 3.17Å; H374-Y377 WeakPolarHBondContact ND1-CD2 3.38Å; H374-Y377 AromaticContact ND1-CE2 3.74Å; H374-Y377 AromaticContact ND1-CG 3.72Å |
| 375 | V | 66.2 | Low | 71.7 | Confident | 111 Ų | 111 | 72.2 Ų | 72.2 | 67% | 0.673 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.4 | -37.3 | 178.3 | 178.7 | 0 | 0 | 0 | 0 | 111.3 | L370 T373 | L370-V375 PolarHBondContact O-N 2.91Å; L370-V375 VanDerWaalsContact O-N 3.12Å; T373-V375 PolarHBondContact O-N 3.17Å |
| 376 | E | 66.4 | Low | 71.9 | Confident | 16 Ų | 16 | 72.1 Ų | 72.1 | 8% | 0.075 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -123.2 | 69.9 | 164 | -69.2 | -169.3 | 169.7 | 0 | 0 | 108.6 | A180 P181 F182 T183 L370 T378 | A180-E376 VanDerWaalsContact CA-CD 3.5Å; A180-E376 HydrophobicContact CB-CB 3.81Å; A180-E376 HydrophobicContact CB-CG 4.06Å; A180-E376 WeakPolarHBondContact CB-OE2 3.5Å; P181-E376 WeakPolarHBondContact CD-OE1 3.19Å; P181-E376 WeakPolarHBondContact CG-OE1 3.37Å; F182-E376 VanDerWaalsContact CB-OE1 3.27Å; F182-E376 WeakPolarHBondContact CB-OE1 3.3Å; F182-E376 PolarHBondContact N-OE1 3.29Å; F182-E376 PolarHBondContact N-OE2 3.04Å; T183-E376 WeakPolarHBondContact CB-OE2 3.4Å; T183-E376 PolarHBondContact N-OE2 2.91Å; T183-E376 PolarHBondContact OG1-OE2 3.35Å; L370-E376 HydrophobicContact CB-CB 4.24Å; L370-E376 HydrophobicContact CD2-CG 4.04Å; L370-E376 PolarHBondContact O-N 3.17Å; L370-E376 VanDerWaalsContact O-N 3.1Å; E376-T378 PolarHBondContact O-N 3.43Å |
| 377 | Y | 63 | Low | 72.2 | Confident | 133 Ų | 133 | 74.5 Ų | 74.5 | 52% | 0.522 | 41% | 0.413 | S | S | . | . | trans | -69.5 | 96.1 | 175.4 | -173.9 | -104.6 | 0 | 0 | 0 | 110.7 | Y371 H374 | Y371-Y377 HydrophobicContact CE2-CD2 4.28Å; Y371-Y377 HydrophobicContact CE2-CE2 4.16Å; H374-Y377 AromaticContact CE1-CD2 3.61Å; H374-Y377 AromaticContact CE1-CE2 3.71Å; H374-Y377 AromaticContact ND1-CD2 3.17Å; H374-Y377 WeakPolarHBondContact ND1-CD2 3.38Å; H374-Y377 AromaticContact ND1-CE2 3.74Å; H374-Y377 AromaticContact ND1-CG 3.72Å | ||
| 378 | T | 60.2 | Low | 72.8 | Confident | 22 Ų | 22 | 78.5 Ų | 78.5 | 14% | 0.135 | 43% | 0.428 | C | S | . | . | trans | -67.9 | 144.8 | 161.5 | 64.6 | 0 | 0 | 0 | 0 | 109.1 | F178 A180 Y371 E376 | F178-T378 HydrophobicContact CD2-CG2 4.46Å; F178-T378 HydrophobicContact CE2-CG2 3.43Å; F178-T378 VanDerWaalsContact CE2-CG2 3.43Å; F178-T378 HydrophobicContact CZ-CG2 3.67Å; A180-T378 HydrophobicContact CB-CG2 4.23Å; Y371-T378 VanDerWaalsContact CD2-OG1 3.32Å; Y371-T378 WeakPolarHBondContact CD2-OG1 3.32Å; Y371-T378 WeakPolarHBondContact CE2-O 3.38Å; Y371-T378 WeakPolarHBondContact CE2-OG1 3.11Å; E376-T378 PolarHBondContact O-N 3.43Å | ||
| 379 | G | 60.7 | Low | 73.3 | Confident | 29 Ų | 29 | 75.3 Ų | 75.3 | 30% | 0.299 | 41% | 0.408 | S | S | . | . | trans | -68.5 | -153.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 380 | S | 66.2 | Low | 73.9 | Confident | 61 Ų | 61 | 73.3 Ų | 73.3 | 43% | 0.427 | 40% | 0.401 | S | S | . | . | trans | -57.9 | 142.6 | 169.4 | -173.4 | 0 | 0 | 0 | 0 | 109.2 | A382 D383 | S380-A382 PolarHBondContact O-N 2.87Å; S380-D383 WeakPolarHBondContact CB-OD2 3.3Å; S380-D383 PolarHBondContact N-OD2 2.87Å; S380-D383 PolarHBondContact O-N 3.44Å | ||
| 381 | P | 63 | Low | 74.5 | Confident | 85 Ų | 85 | 72.5 Ų | 72.5 | 55% | 0.552 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -17.3 | 175.1 | -27.5 | 36 | 0 | 0 | 0 | 114.5 | W386 | P381-W386 PolarHBondContact O-NE1 3.02Š|
| 382 | A | 64 | Low | 75.3 | Confident | 85 Ų | 85 | 69 Ų | 69 | 70% | 0.702 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | -28.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | S380 I384 | S380-A382 PolarHBondContact O-N 2.87Å; A382-I384 VanDerWaalsContact C-N 3.34Å |
| 383 | D | 68.3 | Low | 76.1 | Confident | 122 Ų | 122 | 61.7 Ų | 61.7 | 65% | 0.652 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -12.4 | -177.7 | -51.7 | -40.6 | 0 | 0 | 0 | 112.4 | S380 | S380-D383 WeakPolarHBondContact CB-OD2 3.3Å; S380-D383 PolarHBondContact N-OD2 2.87Å; S380-D383 PolarHBondContact O-N 3.44Å |
| 384 | I | 73.9 | Confident | 76.8 | Confident | 21 Ų | 21 | 59.9 Ų | 59.9 | 11% | 0.108 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -67.3 | 128.6 | 179.7 | -63.4 | 178.7 | 0 | 0 | 0 | 109.2 | F178 A382 W386 L389 | F178-I384 HydrophobicContact CD2-CG2 4.2Å; F178-I384 HydrophobicContact CE2-CD1 4.31Å; F178-I384 HydrophobicContact CE2-CG1 4.16Å; F178-I384 HydrophobicContact CE2-CG2 3.93Å; A382-I384 VanDerWaalsContact C-N 3.34Å; I384-W386 HydrophobicContact CB-CZ2 4.22Å; I384-W386 HydrophobicContact CD1-CZ2 4.07Å; I384-W386 HydrophobicContact CG2-CD2 4.06Å; I384-W386 HydrophobicContact CG2-CE3 4.47Å; I384-W386 HydrophobicContact CG2-CG 4.43Å; I384-W386 HydrophobicContact CG2-CZ2 4.13Å; I384-W386 PolarHBondContact O-N 3.47Å; I384-L389 HydrophobicContact CG2-CD1 3.92Å; I384-L389 HydrophobicContact CG2-CD2 4.12Å |
| 385 | P | 82.8 | Confident | 78.1 | Confident | 24 Ų | 24 | 56.3 Ų | 56.3 | 16% | 0.156 | 33% | 0.334 | C | S | . | . | trans | -77.9 | 69.8 | -178.5 | 30.7 | -34.5 | 0 | 0 | 0 | 111.9 | Q177 F178 A387 Y388 L389 | Q177-P385 HydrophobicContact CB-CG 4.21Å; F178-P385 HydrophobicContact CB-CG 4.03Å; P385-A387 PolarHBondContact O-N 3.2Å; P385-Y388 HydrophobicContact CB-CD2 3.92Å; P385-Y388 PolarHBondContact O-N 3.4Å; P385-L389 HydrophobicContact CG-CD1 3.87Å; P385-L389 WeakPolarHBondContact O-CD1 3.38Å; P385-L389 PolarHBondContact O-N 2.72Å; P385-L389 VanDerWaalsContact O-N 3.14Å | ||
| 386 | W | 83.6 | Confident | 79.3 | Confident | 126 Ų | 126 | 52 Ų | 52 | 48% | 0.477 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -50.9 | -34.5 | -176.1 | -66.7 | 103.4 | 0 | 0 | 0 | 114 | P381 I384 Y388 L389 C390 | P381-W386 PolarHBondContact O-NE1 3.02Å; I384-W386 HydrophobicContact CB-CZ2 4.22Å; I384-W386 HydrophobicContact CD1-CZ2 4.07Å; I384-W386 HydrophobicContact CG2-CD2 4.06Å; I384-W386 HydrophobicContact CG2-CE3 4.47Å; I384-W386 HydrophobicContact CG2-CG 4.43Å; I384-W386 HydrophobicContact CG2-CZ2 4.13Å; I384-W386 PolarHBondContact O-N 3.47Å; W386-Y388 PolarHBondContact O-N 2.91Å; W386-L389 PolarHBondContact O-N 2.67Å; W386-C390 WeakPolarHBondContact O-CB 3.47Å; W386-C390 PolarHBondContact O-N 2.92Å; W386-C390 PolarHBondContact O-SG 3.3Å; W386-C390 VanDerWaalsContact O-SG 3.35Å |
| 387 | A | 87.8 | Confident | 80.6 | Confident | 85 Ų | 85 | 52.1 Ų | 52.1 | 70% | 0.702 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -61.4 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | P385 G391 | P385-A387 PolarHBondContact O-N 3.2Å; A387-G391 PolarHBondContact O-N 3.49Å |
| 388 | Y | 88.2 | Confident | 82 | Confident | 95 Ų | 95 | 47.2 Ų | 47.2 | 37% | 0.373 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -73.7 | -43.4 | 177 | -71.2 | -51.2 | 0 | 0 | 0 | 111.7 | L170 Q177 P385 W386 C390 G391 V392 | L170-Y388 HydrophobicContact CD1-CD1 3.57Å; L170-Y388 HydrophobicContact CD1-CE1 3.85Å; L170-Y388 HydrophobicContact CG-CD1 4.15Å; Q177-Y388 VanDerWaalsContact OE1-CD2 3.29Å; P385-Y388 HydrophobicContact CB-CD2 3.92Å; P385-Y388 PolarHBondContact O-N 3.4Å; W386-Y388 PolarHBondContact O-N 2.91Å; Y388-C390 PolarHBondContact O-N 3.14Å; Y388-G391 PolarHBondContact O-N 3.41Å; Y388-V392 WeakPolarHBondContact O-CG2 3.49Å; Y388-V392 PolarHBondContact O-N 3.01Å |
| 389 | L | 88.9 | Confident | 83.5 | Confident | 5 Ų | 5 | 47 Ų | 47 | 3% | 0.026 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.7 | -48.4 | 175.8 | -79.8 | 82.3 | 0 | 0 | 0 | 111.9 | T174 F178 L184 F187 I384 P385 W386 G391 V392 A393 | T174-L389 HydrophobicContact CG2-CD1 4.14Å; F178-L389 HydrophobicContact CD1-CD1 4.3Å; F178-L389 HydrophobicContact CE1-CD2 3.99Å; F178-L389 HydrophobicContact CE2-CD2 4.5Å; F178-L389 HydrophobicContact CG-CD1 4.28Å; F178-L389 HydrophobicContact CZ-CD2 3.98Å; L184-L389 HydrophobicContact CD1-CB 4.5Å; L184-L389 HydrophobicContact CD1-CG 4.05Å; F187-L389 HydrophobicContact CD1-CB 4.23Å; F187-L389 HydrophobicContact CE1-CB 4.12Å; I384-L389 HydrophobicContact CG2-CD1 3.92Å; I384-L389 HydrophobicContact CG2-CD2 4.12Å; P385-L389 HydrophobicContact CG-CD1 3.87Å; P385-L389 WeakPolarHBondContact O-CD1 3.38Å; P385-L389 PolarHBondContact O-N 2.72Å; P385-L389 VanDerWaalsContact O-N 3.14Å; W386-L389 PolarHBondContact O-N 2.67Å; L389-G391 VanDerWaalsContact C-N 3.34Å; L389-V392 PolarHBondContact O-N 2.83Å; L389-A393 WeakPolarHBondContact O-CB 3.13Å; L389-A393 PolarHBondContact O-N 3.05Å |
| 390 | C | 90.8 | Very high | 84.9 | Confident | 46 Ų | 46 | 46.1 Ų | 46.1 | 31% | 0.311 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65.7 | -35.4 | 176.5 | -71.7 | 0 | 0 | 0 | 0 | 112.2 | W191 W386 Y388 A394 | W191-C390 HydrophobicContact CH2-CB 4.45Å; W191-C390 HydrophobicContact CZ2-CB 4.22Å; W386-C390 WeakPolarHBondContact O-CB 3.47Å; W386-C390 PolarHBondContact O-N 2.92Å; W386-C390 PolarHBondContact O-SG 3.3Å; W386-C390 VanDerWaalsContact O-SG 3.35Å; Y388-C390 PolarHBondContact O-N 3.14Å; C390-A394 WeakPolarHBondContact O-CB 3.29Å; C390-A394 PolarHBondContact O-N 3.44Å |
| 391 | G | 92.5 | Very high | 86 | Confident | 19 Ų | 19 | 45 Ų | 45 | 20% | 0.196 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63 | -46.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.7 | A387 Y388 L389 A394 L395 | A387-G391 PolarHBondContact O-N 3.49Å; Y388-G391 PolarHBondContact O-N 3.41Å; L389-G391 VanDerWaalsContact C-N 3.34Å; G391-A394 PolarHBondContact O-N 3.44Å; G391-L395 WeakPolarHBondContact O-CB 3.46Å; G391-L395 VanDerWaalsContact O-CG 3.28Å; G391-L395 WeakPolarHBondContact O-CG 3.3Å; G391-L395 PolarHBondContact O-N 3.26Å |
| 392 | V | 92.5 | Very high | 87.3 | Confident | 4 Ų | 4 | 42.4 Ų | 42.4 | 2% | 0.024 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.2 | -46.7 | 176.4 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | L170 A171 L184 Y388 L389 L395 L396 | L170-V392 HydrophobicContact CB-CG2 3.86Å; L170-V392 HydrophobicContact CD2-CG2 4.13Å; L170-V392 HydrophobicContact CG-CG2 3.93Å; A171-V392 HydrophobicContact CB-CG1 4.19Å; A171-V392 HydrophobicContact CB-CG2 4.15Å; L184-V392 HydrophobicContact CD1-CB 4.45Å; L184-V392 HydrophobicContact CD1-CG1 4.29Å; Y388-V392 WeakPolarHBondContact O-CG2 3.49Å; Y388-V392 PolarHBondContact O-N 3.01Å; L389-V392 PolarHBondContact O-N 2.83Å; V392-L395 PolarHBondContact O-N 3.49Å; V392-L396 WeakPolarHBondContact O-CB 3.4Å; V392-L396 PolarHBondContact O-N 2.94Å |
| 393 | A | 92.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.6 | -43.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F187 A188 W191 L389 F397 | F187-A393 HydrophobicContact CD1-CB 3.98Å; F187-A393 HydrophobicContact CE1-CB 3.88Å; A188-A393 HydrophobicContact CB-CB 4.15Å; W191-A393 HydrophobicContact CD2-CB 3.66Å; W191-A393 VanDerWaalsContact CE2-CB 3.48Å; W191-A393 HydrophobicContact CE3-CB 4.28Å; W191-A393 HydrophobicContact CG-CB 3.87Å; W191-A393 HydrophobicContact CZ2-CB 3.97Å; L389-A393 WeakPolarHBondContact O-CB 3.13Å; L389-A393 PolarHBondContact O-N 3.05Å; A393-F397 WeakPolarHBondContact O-CB 3.49Å; A393-F397 PolarHBondContact O-N 2.91Å |
| 394 | A | 93.8 | Very high | 89.1 | Confident | 40 Ų | 40 | 36.4 Ų | 36.4 | 33% | 0.331 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -64.3 | -43.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | W191 C390 G391 F397 A398 | W191-A394 HydrophobicContact CE3-CB 4.42Å; W191-A394 HydrophobicContact CH2-CB 4.04Å; W191-A394 HydrophobicContact CZ3-CB 3.62Å; C390-A394 WeakPolarHBondContact O-CB 3.29Å; C390-A394 PolarHBondContact O-N 3.44Å; G391-A394 PolarHBondContact O-N 3.44Å; A394-F397 PolarHBondContact O-N 3.45Å; A394-A398 VanDerWaalsContact O-CB 3.24Å; A394-A398 WeakPolarHBondContact O-CB 3.41Å; A394-A398 PolarHBondContact O-N 2.84Å |
| 395 | L | 94.1 | Very high | 89.4 | Confident | 54 Ų | 54 | 38.2 Ų | 38.2 | 28% | 0.283 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -68.4 | -39.6 | 178.6 | -70.9 | 167.2 | 0 | 0 | 0 | 112 | L170 G391 V392 A398 F399 | L170-L395 HydrophobicContact CD2-CD1 3.93Å; G391-L395 WeakPolarHBondContact O-CB 3.46Å; G391-L395 VanDerWaalsContact O-CG 3.28Å; G391-L395 WeakPolarHBondContact O-CG 3.3Å; G391-L395 PolarHBondContact O-N 3.26Å; V392-L395 PolarHBondContact O-N 3.49Å; L395-A398 PolarHBondContact O-N 3.14Å; L395-F399 WeakPolarHBondContact O-CB 3.29Å; L395-F399 PolarHBondContact O-N 3.01Å |
| 396 | L | 92.6 | Very high | 89.2 | Confident | 19 Ų | 19 | 37.1 Ų | 37.1 | 10% | 0.099 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -70.3 | -38 | 176 | -169.3 | 66 | 0 | 0 | 0 | 111.9 | W164 A188 V392 F399 N400 | W164-L396 HydrophobicContact CE3-CD1 4.4Å; W164-L396 HydrophobicContact CZ3-CD1 3.87Å; A188-L396 HydrophobicContact CB-CD2 3.97Å; V392-L396 WeakPolarHBondContact O-CB 3.4Å; V392-L396 PolarHBondContact O-N 2.94Å; L396-F399 HydrophobicContact CD1-CD1 4.49Å; L396-F399 PolarHBondContact O-N 3.26Å; L396-N400 PolarHBondContact O-N 3.18Å; L396-N400 PolarHBondContact O-ND2 2.91Å |
| 397 | F | 92.3 | Very high | 88.9 | Confident | 20 Ų | 20 | 33.8 Ų | 33.8 | 9% | 0.088 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.4 | -43 | 172.6 | 179.2 | -112.7 | 0 | 0 | 0 | 111.7 | W191 L194 F195 V198 A393 A394 N400 I401 | W191-F397 HydrophobicContact CB-CB 4.15Å; W191-F397 HydrophobicContact CB-CD2 4.29Å; W191-F397 HydrophobicContact CB-CG 4.3Å; W191-F397 HydrophobicContact CE3-CB 4.3Å; W191-F397 HydrophobicContact CE3-CD1 4.49Å; W191-F397 WeakPolarHBondContact O-CD2 3.37Å; W191-F397 WeakPolarHBondContact O-CE2 3.38Å; L194-F397 HydrophobicContact CB-CE1 4.24Å; L194-F397 HydrophobicContact CB-CE2 3.97Å; L194-F397 HydrophobicContact CB-CZ 3.56Å; F195-F397 HydrophobicContact CB-CE2 4.3Å; F195-F397 HydrophobicContact CD2-CD2 4.35Å; F195-F397 AromaticContact CD2-CE2 3.78Å; F195-F397 HydrophobicContact CD2-CE2 3.78Å; F195-F397 HydrophobicContact CG-CE2 4.47Å; V198-F397 HydrophobicContact CG2-CE1 4.27Å; V198-F397 HydrophobicContact CG2-CZ 4.09Å; A393-F397 WeakPolarHBondContact O-CB 3.49Å; A393-F397 PolarHBondContact O-N 2.91Å; A394-F397 PolarHBondContact O-N 3.45Å; F397-N400 PolarHBondContact O-N 2.91Å; F397-I401 HydrophobicContact CD1-CD1 3.9Å; F397-I401 HydrophobicContact CE1-CD1 3.43Å; F397-I401 VanDerWaalsContact CE1-CD1 3.43Å; F397-I401 HydrophobicContact CE1-CG1 4.41Å; F397-I401 HydrophobicContact CE2-CD1 4.36Å; F397-I401 HydrophobicContact CZ-CD1 3.69Å; F397-I401 HydrophobicContact CZ-CG1 4.31Å; F397-I401 WeakPolarHBondContact O-CG1 3.4Å; F397-I401 PolarHBondContact O-N 3.31Å |
| 398 | A | 92.9 | Very high | 88.2 | Confident | 30 Ų | 30 | 31.7 Ų | 31.7 | 25% | 0.248 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.5 | -45.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | A394 L395 N400 I401 L402 | A394-A398 VanDerWaalsContact O-CB 3.24Å; A394-A398 WeakPolarHBondContact O-CB 3.41Å; A394-A398 PolarHBondContact O-N 2.84Å; L395-A398 PolarHBondContact O-N 3.14Å; A398-N400 VanDerWaalsContact C-N 3.35Å; A398-N400 PolarHBondContact O-N 2.93Å; A398-I401 WeakPolarHBondContact O-CB 3.48Å; A398-I401 PolarHBondContact O-N 3.23Å; A398-I401 VanDerWaalsContact O-N 3.14Å; A398-L402 WeakPolarHBondContact O-CD1 3.32Å; A398-L402 PolarHBondContact O-N 2.96Å |
| 399 | F | 92.3 | Very high | 87.6 | Confident | 16 Ų | 16 | 32.5 Ų | 32.5 | 7% | 0.07 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -56.8 | -46.1 | 173.3 | 174.8 | -101.5 | 0 | 0 | 0 | 111.9 | V160 W164 L395 L396 I401 L402 V403 I419 | V160-F399 HydrophobicContact CG1-CD2 4.31Å; V160-F399 HydrophobicContact CG1-CE2 3.97Å; W164-F399 HydrophobicContact CB-CD2 3.73Å; W164-F399 HydrophobicContact CB-CE2 3.78Å; W164-F399 HydrophobicContact CD2-CD2 4.35Å; W164-F399 HydrophobicContact CD2-CE1 4.25Å; W164-F399 AromaticContact CD2-CE2 3.98Å; W164-F399 HydrophobicContact CD2-CE2 3.98Å; W164-F399 AromaticContact CD2-CZ 3.92Å; W164-F399 HydrophobicContact CD2-CZ 3.92Å; W164-F399 AromaticContact CE3-CD1 3.56Å; W164-F399 HydrophobicContact CE3-CD1 3.56Å; W164-F399 AromaticContact CE3-CD2 3.95Å; W164-F399 HydrophobicContact CE3-CD2 3.95Å; W164-F399 AromaticContact CE3-CE1 3.43Å; W164-F399 HydrophobicContact CE3-CE1 3.43Å; W164-F399 VanDerWaalsContact CE3-CE1 3.43Å; W164-F399 AromaticContact CE3-CE2 3.84Å; W164-F399 HydrophobicContact CE3-CE2 3.84Å; W164-F399 AromaticContact CE3-CG 3.81Å; W164-F399 HydrophobicContact CE3-CG 3.81Å; W164-F399 AromaticContact CE3-CZ 3.57Å; W164-F399 HydrophobicContact CE3-CZ 3.57Å; W164-F399 HydrophobicContact CG-CD2 4.29Å; W164-F399 AromaticContact CG-CE2 3.97Å; W164-F399 HydrophobicContact CG-CE2 3.97Å; W164-F399 HydrophobicContact CG-CZ 4.36Å; W164-F399 AromaticContact CZ3-CD1 3.87Å; W164-F399 HydrophobicContact CZ3-CD1 3.87Å; W164-F399 AromaticContact CZ3-CE1 3.6Å; W164-F399 HydrophobicContact CZ3-CE1 3.6Å; W164-F399 HydrophobicContact CZ3-CZ 4.07Å; L395-F399 WeakPolarHBondContact O-CB 3.29Å; L395-F399 PolarHBondContact O-N 3.01Å; L396-F399 HydrophobicContact CD1-CD1 4.49Å; L396-F399 PolarHBondContact O-N 3.26Å; F399-I401 VanDerWaalsContact C-N 3.34Å; F399-I401 PolarHBondContact O-N 2.86Å; F399-L402 PolarHBondContact O-N 3.13Å; F399-V403 HydrophobicContact CD1-CG2 4.18Å; F399-V403 HydrophobicContact CD2-CG2 4.17Å; F399-V403 HydrophobicContact CE1-CG2 3.78Å; F399-V403 HydrophobicContact CE2-CG2 3.77Å; F399-V403 HydrophobicContact CG-CG2 4.38Å; F399-V403 HydrophobicContact CZ-CG2 3.57Å; F399-V403 WeakPolarHBondContact O-CG2 3.31Å; F399-V403 PolarHBondContact O-N 3.46Å; F399-I419 HydrophobicContact CE2-CD1 4.18Å; F399-I419 HydrophobicContact CE2-CG1 3.89Å; F399-I419 HydrophobicContact CZ-CD1 3.93Å; F399-I419 HydrophobicContact CZ-CG1 4.06Å |
| 400 | N | 90.6 | Very high | 87.4 | Confident | 11 Ų | 11 | 33.1 Ų | 33.1 | 6% | 0.059 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.1 | -38.8 | 175.8 | -75.6 | -45.9 | 0 | 0 | 0 | 112.4 | N192 F195 W245 L396 F397 A398 V403 N404 | N192-N400 PolarHBondContact OD1-ND2 3.02Å; F195-N400 HydrophobicContact CE2-CB 3.97Å; F195-N400 WeakPolarHBondContact CZ-O 3.01Å; W245-N400 WeakPolarHBondContact CH2-OD1 3.35Å; L396-N400 PolarHBondContact O-N 3.18Å; L396-N400 PolarHBondContact O-ND2 2.91Å; F397-N400 PolarHBondContact O-N 2.91Å; A398-N400 VanDerWaalsContact C-N 3.35Å; A398-N400 PolarHBondContact O-N 2.93Å; N400-V403 PolarHBondContact O-N 3.31Å; N400-N404 PolarHBondContact O-N 3.31Å; N400-N404 VanDerWaalsContact O-N 3.16Å; N400-N404 PolarHBondContact O-ND2 3.45Å |
| 401 | I | 88.6 | Confident | 86.9 | Confident | 37 Ų | 37 | 39.1 Ų | 39.1 | 19% | 0.19 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.9 | -52.4 | 172 | -75.7 | 172.2 | 0 | 0 | 0 | 109.4 | F195 V198 F397 A398 F399 V403 N404 F405 | F195-I401 HydrophobicContact CD2-CG1 4.12Å; F195-I401 HydrophobicContact CE2-CB 4.3Å; F195-I401 HydrophobicContact CE2-CG1 3.61Å; F195-I401 HydrophobicContact CZ-CB 4.48Å; F195-I401 HydrophobicContact CZ-CG1 4.06Å; V198-I401 HydrophobicContact CG1-CD1 4.04Å; F397-I401 HydrophobicContact CD1-CD1 3.9Å; F397-I401 HydrophobicContact CE1-CD1 3.43Å; F397-I401 VanDerWaalsContact CE1-CD1 3.43Å; F397-I401 HydrophobicContact CE1-CG1 4.41Å; F397-I401 HydrophobicContact CE2-CD1 4.36Å; F397-I401 HydrophobicContact CZ-CD1 3.69Å; F397-I401 HydrophobicContact CZ-CG1 4.31Å; F397-I401 WeakPolarHBondContact O-CG1 3.4Å; F397-I401 PolarHBondContact O-N 3.31Å; A398-I401 WeakPolarHBondContact O-CB 3.48Å; A398-I401 PolarHBondContact O-N 3.23Å; A398-I401 VanDerWaalsContact O-N 3.14Å; F399-I401 VanDerWaalsContact C-N 3.34Å; F399-I401 PolarHBondContact O-N 2.86Å; I401-V403 VanDerWaalsContact C-N 3.33Å; I401-V403 PolarHBondContact O-N 2.91Å; I401-N404 PolarHBondContact O-N 3.43Å; I401-F405 HydrophobicContact CB-CD2 4.33Å; I401-F405 HydrophobicContact CG1-CE2 4.48Å; I401-F405 HydrophobicContact CG2-CD2 3.77Å; I401-F405 HydrophobicContact CG2-CE2 4.28Å; I401-F405 WeakPolarHBondContact O-CB 3.34Å; I401-F405 WeakPolarHBondContact O-CD2 3.39Å; I401-F405 PolarHBondContact O-N 3.09Å |
| 402 | L | 89.8 | Confident | 86.5 | Confident | 32 Ų | 32 | 41.4 Ų | 41.4 | 17% | 0.168 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.1 | -34.7 | -178 | -87.5 | 80.8 | 0 | 0 | 0 | 112.7 | M156 C159 V160 A398 F399 G406 | M156-L402 HydrophobicContact CE-CB 3.56Å; M156-L402 HydrophobicContact CE-CD2 3.9Å; M156-L402 HydrophobicContact CE-CG 3.65Å; M156-L402 WeakPolarHBondContact CE-O 3.49Å; M156-L402 HydrophobicContact SD-CD2 4.26Å; M156-L402 HydrophobicContact SD-CG 4.35Å; C159-L402 HydrophobicContact CB-CD2 3.4Å; V160-L402 HydrophobicContact CG2-CB 3.98Å; V160-L402 HydrophobicContact CG2-CD2 3.93Å; A398-L402 WeakPolarHBondContact O-CD1 3.32Å; A398-L402 PolarHBondContact O-N 2.96Å; F399-L402 PolarHBondContact O-N 3.13Å; L402-G406 WeakPolarHBondContact O-CA 3.41Å; L402-G406 PolarHBondContact O-N 2.94Å |
| 403 | V | 86.3 | Confident | 86.2 | Confident | 30 Ų | 30 | 44.2 Ų | 44.2 | 18% | 0.182 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -69 | -40.2 | 177.1 | 170.1 | 0 | 0 | 0 | 0 | 112.5 | F399 N400 I401 I407 I415 | F399-V403 HydrophobicContact CD1-CG2 4.18Å; F399-V403 HydrophobicContact CD2-CG2 4.17Å; F399-V403 HydrophobicContact CE1-CG2 3.78Å; F399-V403 HydrophobicContact CE2-CG2 3.77Å; F399-V403 HydrophobicContact CG-CG2 4.38Å; F399-V403 HydrophobicContact CZ-CG2 3.57Å; F399-V403 WeakPolarHBondContact O-CG2 3.31Å; F399-V403 PolarHBondContact O-N 3.46Å; N400-V403 PolarHBondContact O-N 3.31Å; I401-V403 VanDerWaalsContact C-N 3.33Å; I401-V403 PolarHBondContact O-N 2.91Å; V403-I407 WeakPolarHBondContact O-CG1 3.22Å; V403-I415 HydrophobicContact CB-CG2 4.46Å; V403-I415 HydrophobicContact CG2-CG2 3.94Å |
| 404 | N | 83.2 | Confident | 86 | Confident | 50 Ų | 50 | 46.5 Ų | 46.5 | 27% | 0.267 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -85.4 | -50.8 | -178.1 | -66 | -83.9 | 0 | 0 | 0 | 112.5 | F195 N400 I401 G406 I407 | F195-N404 HydrophobicContact CE1-CB 4.1Å; F195-N404 HydrophobicContact CZ-CB 3.83Å; N400-N404 PolarHBondContact O-N 3.31Å; N400-N404 VanDerWaalsContact O-N 3.16Å; N400-N404 PolarHBondContact O-ND2 3.45Å; I401-N404 PolarHBondContact O-N 3.43Å; N404-G406 VanDerWaalsContact C-N 3.29Å; N404-G406 PolarHBondContact O-N 3.31Å; N404-I407 PolarHBondContact O-N 2.94Å |
| 405 | F | 80.3 | Confident | 85.8 | Confident | 60 Ų | 60 | 45 Ų | 45 | 26% | 0.263 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -70.2 | -28.2 | 178 | -71.6 | -88 | 0 | 0 | 0 | 112.2 | F195 Y199 I401 I407 A408 I409 | F195-F405 HydrophobicContact CD1-CE2 4.2Å; F195-F405 HydrophobicContact CE1-CD2 4.05Å; F195-F405 AromaticContact CE1-CE2 3.52Å; F195-F405 HydrophobicContact CE1-CE2 3.52Å; F195-F405 HydrophobicContact CE1-CZ 4.38Å; F195-F405 HydrophobicContact CZ-CD2 4.08Å; F195-F405 AromaticContact CZ-CE2 3.9Å; F195-F405 HydrophobicContact CZ-CE2 3.9Å; Y199-F405 AromaticContact CD2-CE1 3.71Å; Y199-F405 HydrophobicContact CD2-CE1 3.71Å; Y199-F405 AromaticContact CD2-CZ 3.78Å; Y199-F405 HydrophobicContact CD2-CZ 3.78Å; Y199-F405 HydrophobicContact CE2-CE1 4.45Å; Y199-F405 HydrophobicContact CG-CZ 4.36Å; I401-F405 HydrophobicContact CB-CD2 4.33Å; I401-F405 HydrophobicContact CG1-CE2 4.48Å; I401-F405 HydrophobicContact CG2-CD2 3.77Å; I401-F405 HydrophobicContact CG2-CE2 4.28Å; I401-F405 WeakPolarHBondContact O-CB 3.34Å; I401-F405 WeakPolarHBondContact O-CD2 3.39Å; I401-F405 PolarHBondContact O-N 3.09Å; F405-I407 PolarHBondContact O-N 3.44Å; F405-A408 PolarHBondContact O-N 3.47Å; F405-I409 PolarHBondContact O-N 3.35Å |
| 406 | G | 78.5 | Confident | 85.6 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.01 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56.7 | -32.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | M156 L402 N404 A408 I409 T410 | M156-G406 VanDerWaalsContact CE-CA 3.47Å; L402-G406 WeakPolarHBondContact O-CA 3.41Å; L402-G406 PolarHBondContact O-N 2.94Å; N404-G406 VanDerWaalsContact C-N 3.29Å; N404-G406 PolarHBondContact O-N 3.31Å; G406-A408 VanDerWaalsContact C-N 3.31Å; G406-A408 PolarHBondContact O-N 2.93Å; G406-I409 PolarHBondContact O-N 3.2Å; G406-T410 CarbonylContact O-C 3.59Å; G406-T410 WeakPolarHBondContact O-CA 3.26Å; G406-T410 PolarHBondContact O-N 3.45Å; G406-T410 VanDerWaalsContact O-O 3.09Å; G406-T410 PolarHBondContact O-OG1 3.09Å |
| 407 | I | 77.4 | Confident | 85.5 | Confident | 56 Ų | 56 | 44.8 Ų | 44.8 | 29% | 0.287 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -70.4 | -27.9 | 179.5 | -61 | 172.4 | 0 | 0 | 0 | 111.5 | F345 V403 N404 F405 P412 I415 | F345-I407 HydrophobicContact CE1-CB 4.14Å; F345-I407 HydrophobicContact CE1-CG2 3.9Å; F345-I407 HydrophobicContact CZ-CG2 4.35Å; V403-I407 WeakPolarHBondContact O-CG1 3.22Å; N404-I407 PolarHBondContact O-N 2.94Å; F405-I407 PolarHBondContact O-N 3.44Å; I407-P412 HydrophobicContact CG1-CG 4.24Å; I407-P412 HydrophobicContact CG2-CG 4.12Å; I407-I415 HydrophobicContact CG1-CD1 3.58Å |
| 408 | A | 74.5 | Confident | 85.5 | Confident | 40 Ų | 40 | 43.9 Ų | 43.9 | 33% | 0.331 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -80.4 | -23.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | F345 F405 G406 | F345-A408 HydrophobicContact CD1-CB 4.17Å; F345-A408 HydrophobicContact CD2-CB 4.42Å; F345-A408 HydrophobicContact CE1-CB 3.92Å; F345-A408 HydrophobicContact CE2-CB 4.19Å; F345-A408 HydrophobicContact CG-CB 4.42Å; F345-A408 HydrophobicContact CZ-CB 3.93Å; F405-A408 PolarHBondContact O-N 3.47Å; G406-A408 VanDerWaalsContact C-N 3.31Å; G406-A408 PolarHBondContact O-N 2.93Å |
| 409 | I | 74.8 | Confident | 85.5 | Confident | 112 Ų | 112 | 43.6 Ų | 43.6 | 57% | 0.574 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -101.1 | -38.9 | -175 | -56.6 | 172.6 | 0 | 0 | 0 | 111.8 | F405 G406 | F405-I409 PolarHBondContact O-N 3.35Å; G406-I409 PolarHBondContact O-N 3.2Å |
| 410 | T | 84.4 | Confident | 85.6 | Confident | 19 Ų | 19 | 43.6 Ų | 43.6 | 12% | 0.117 | 23% | 0.231 | C | C | . | . | S | Bend | trans | -138.3 | 176.6 | -169.5 | 69.7 | 0 | 0 | 0 | 0 | 111.2 | M156 G406 | M156-T410 HydrophobicContact CB-CG2 4.01Å; M156-T410 HydrophobicContact CG-CG2 3.96Å; G406-T410 CarbonylContact O-C 3.59Å; G406-T410 WeakPolarHBondContact O-CA 3.26Å; G406-T410 PolarHBondContact O-N 3.45Å; G406-T410 VanDerWaalsContact O-O 3.09Å; G406-T410 PolarHBondContact O-OG1 3.09Å |
| 411 | Y | 81.4 | Confident | 85.7 | Confident | 172 Ų | 172 | 46.5 Ų | 46.5 | 68% | 0.675 | 25% | 0.246 | S | C | * | . | trans | -79.2 | 140 | 179.4 | -60.5 | -80.1 | 0 | 0 | 0 | 111.8 | T413 L414 | Y411-T413 WeakPolarHBondContact CB-OG1 3.32Å; Y411-T413 PolarHBondContact O-N 3.25Å; Y411-L414 HydrophobicContact CD2-CD1 4.37Å; Y411-L414 WeakPolarHBondContact O-CB 3.37Å; Y411-L414 PolarHBondContact O-N 3.35Å | ||
| 412 | P | 83.7 | Confident | 86 | Confident | 66 Ų | 66 | 44.8 Ų | 44.8 | 43% | 0.429 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -56 | -24.1 | 175.6 | -26.4 | 33.6 | 0 | 0 | 0 | 114.8 | I407 S416 | I407-P412 HydrophobicContact CG1-CG 4.24Å; I407-P412 HydrophobicContact CG2-CG 4.12Å; P412-S416 WeakPolarHBondContact O-CB 3.32Å; P412-S416 PolarHBondContact O-N 3.44Å; P412-S416 PolarHBondContact O-OG 2.84Å |
| 413 | T | 86.2 | Confident | 86.2 | Confident | 63 Ų | 63 | 43.3 Ų | 43.3 | 39% | 0.387 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.1 | -38 | 172.7 | 46.4 | 0 | 0 | 0 | 0 | 112.4 | Y411 S416 L417 | Y411-T413 WeakPolarHBondContact CB-OG1 3.32Å; Y411-T413 PolarHBondContact O-N 3.25Å; T413-S416 WeakPolarHBondContact O-CB 3.47Å; T413-S416 PolarHBondContact O-N 2.97Å; T413-L417 WeakPolarHBondContact O-CB 3.15Å; T413-L417 PolarHBondContact O-N 3.05Å |
| 414 | L | 87.7 | Confident | 86.5 | Confident | 48 Ų | 48 | 45.1 Ų | 45.1 | 25% | 0.251 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -69.5 | -43.2 | 177.7 | -65.9 | 178.2 | 0 | 0 | 0 | 111.8 | V157 Y411 S416 L417 G418 | V157-L414 HydrophobicContact CG2-CB 3.89Å; V157-L414 HydrophobicContact CG2-CD2 4.12Å; Y411-L414 HydrophobicContact CD2-CD1 4.37Å; Y411-L414 WeakPolarHBondContact O-CB 3.37Å; Y411-L414 PolarHBondContact O-N 3.35Å; L414-S416 PolarHBondContact O-N 2.98Å; L414-L417 WeakPolarHBondContact O-CB 3.38Å; L414-L417 PolarHBondContact O-N 2.91Å; L414-L417 VanDerWaalsContact O-N 3.15Å; L414-G418 PolarHBondContact O-N 2.88Å |
| 415 | I | 89.9 | Confident | 87 | Confident | 8 Ų | 8 | 45.5 Ų | 45.5 | 4% | 0.041 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -57.1 | -44.5 | 172 | -51.3 | 173.9 | 0 | 0 | 0 | 109.7 | V160 V403 I407 L417 G418 I419 | V160-I415 HydrophobicContact CG1-CG2 4.37Å; V160-I415 HydrophobicContact CG2-CG2 4.18Å; V403-I415 HydrophobicContact CB-CG2 4.46Å; V403-I415 HydrophobicContact CG2-CG2 3.94Å; I407-I415 HydrophobicContact CG1-CD1 3.58Å; I415-L417 VanDerWaalsContact C-N 3.34Å; I415-L417 PolarHBondContact O-N 3.36Å; I415-G418 PolarHBondContact O-N 3.03Å; I415-I419 PolarHBondContact O-N 3.39Å |
| 416 | S | 90.3 | Very high | 87.5 | Confident | 12 Ų | 12 | 42.7 Ų | 42.7 | 8% | 0.084 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.6 | -36 | 178.6 | -53.7 | 0 | 0 | 0 | 0 | 112.8 | K272 P412 T413 L414 I419 V420 F453 | K272-S416 WeakPolarHBondContact CE-OG 3.33Å; K272-S416 VanDerWaalsContact NZ-CB 3.32Å; K272-S416 PolarHBondContact NZ-OG 3.33Å; P412-S416 WeakPolarHBondContact O-CB 3.32Å; P412-S416 PolarHBondContact O-N 3.44Å; P412-S416 PolarHBondContact O-OG 2.84Å; T413-S416 WeakPolarHBondContact O-CB 3.47Å; T413-S416 PolarHBondContact O-N 2.97Å; L414-S416 PolarHBondContact O-N 2.98Å; S416-I419 PolarHBondContact O-N 3.45Å; S416-V420 PolarHBondContact O-N 3.48Å; S416-F453 WeakPolarHBondContact O-CE1 3.45Å |
| 417 | L | 91.5 | Very high | 88 | Confident | 58 Ų | 58 | 43.7 Ų | 43.7 | 30% | 0.304 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.4 | -39.8 | 176 | -179.7 | 63.9 | 0 | 0 | 0 | 111.3 | T413 L414 I415 I419 V420 L421 L457 | T413-L417 WeakPolarHBondContact O-CB 3.15Å; T413-L417 PolarHBondContact O-N 3.05Å; L414-L417 WeakPolarHBondContact O-CB 3.38Å; L414-L417 PolarHBondContact O-N 2.91Å; L414-L417 VanDerWaalsContact O-N 3.15Å; I415-L417 VanDerWaalsContact C-N 3.34Å; I415-L417 PolarHBondContact O-N 3.36Å; L417-I419 PolarHBondContact O-N 3.47Å; L417-V420 PolarHBondContact O-N 3.43Å; L417-V420 VanDerWaalsContact O-N 3.14Å; L417-L421 HydrophobicContact CD1-CD1 4.39Å; L417-L421 HydrophobicContact CD1-CG 4.43Å; L417-L421 HydrophobicContact CG-CD1 3.99Å; L417-L421 HydrophobicContact CG-CG 4.47Å; L417-L421 WeakPolarHBondContact O-CG 3.38Å; L417-L421 PolarHBondContact O-N 2.8Å; L417-L457 HydrophobicContact CB-CD2 4.29Å |
| 418 | G | 91.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.1 | -34.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | C161 L414 I415 S422 | C161-G418 WeakPolarHBondContact CA-O 3.2Å; C161-G418 WeakPolarHBondContact CB-O 3.22Å; L414-G418 PolarHBondContact O-N 2.88Å; I415-G418 PolarHBondContact O-N 3.03Å; G418-S422 PolarHBondContact O-N 3.44Å |
| 419 | I | 92.7 | Very high | 89.2 | Confident | 25 Ų | 25 | 46.9 Ų | 46.9 | 13% | 0.128 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69 | -38.9 | 174.3 | -63.5 | 166 | 0 | 0 | 0 | 111.5 | V160 F399 I415 S416 L417 S422 | V160-I419 HydrophobicContact CG1-CG1 3.99Å; F399-I419 HydrophobicContact CE2-CD1 4.18Å; F399-I419 HydrophobicContact CE2-CG1 3.89Å; F399-I419 HydrophobicContact CZ-CD1 3.93Å; F399-I419 HydrophobicContact CZ-CG1 4.06Å; I415-I419 PolarHBondContact O-N 3.39Å; S416-I419 PolarHBondContact O-N 3.45Å; L417-I419 PolarHBondContact O-N 3.47Å; I419-S422 WeakPolarHBondContact O-CB 3.42Å; I419-S422 PolarHBondContact O-N 3.29Å; I419-S422 PolarHBondContact O-OG 2.85Å |
| 420 | V | 93.9 | Very high | 89.7 | Confident | 16 Ų | 16 | 42 Ų | 42 | 10% | 0.097 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.6 | -42.5 | 174.7 | -172.2 | 0 | 0 | 0 | 0 | 111.3 | S416 L417 S422 V423 P424 C450 F453 | S416-V420 PolarHBondContact O-N 3.48Å; L417-V420 PolarHBondContact O-N 3.43Å; L417-V420 VanDerWaalsContact O-N 3.14Å; V420-S422 PolarHBondContact O-N 2.92Å; V420-S422 VanDerWaalsContact O-N 3.14Å; V420-V423 VanDerWaalsContact O-CB 3.32Å; V420-V423 WeakPolarHBondContact O-CB 3.42Å; V420-V423 WeakPolarHBondContact O-CG2 3.42Å; V420-V423 PolarHBondContact O-N 3.38Å; V420-P424 VanDerWaalsContact O-CD 3.26Å; V420-P424 WeakPolarHBondContact O-CD 3.42Å; V420-C450 HydrophobicContact CG1-CB 4.19Å; V420-F453 HydrophobicContact CG2-CB 4.34Å; V420-F453 HydrophobicContact CG2-CD1 3.03Å; V420-F453 HydrophobicContact CG2-CD2 4.35Å; V420-F453 HydrophobicContact CG2-CE1 3.08Å; V420-F453 HydrophobicContact CG2-CE2 4.37Å; V420-F453 HydrophobicContact CG2-CG 3.7Å; V420-F453 HydrophobicContact CG2-CZ 3.77Å |
| 421 | L | 94 | Very high | 89.5 | Confident | 72 Ų | 72 | 46.4 Ų | 46.4 | 38% | 0.377 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -65.6 | -15.4 | -178 | -69.5 | 171.2 | 0 | 0 | 0 | 112.7 | V157 C161 L417 V423 P424 V425 | V157-L421 HydrophobicContact CG1-CD1 3.61Å; C161-L421 HydrophobicContact CB-CB 4.46Å; C161-L421 PolarHBondContact SG-O 2.96Å; C161-L421 VanDerWaalsContact SG-O 3.41Å; L417-L421 HydrophobicContact CD1-CD1 4.39Å; L417-L421 HydrophobicContact CD1-CG 4.43Å; L417-L421 HydrophobicContact CG-CD1 3.99Å; L417-L421 HydrophobicContact CG-CG 4.47Å; L417-L421 WeakPolarHBondContact O-CG 3.38Å; L417-L421 PolarHBondContact O-N 2.8Å; L421-V423 PolarHBondContact O-N 2.89Å; L421-P424 WeakPolarHBondContact O-CD 3.38Å; L421-P424 WeakPolarHBondContact O-CG 3.46Å; L421-V425 WeakPolarHBondContact O-CG2 3.1Å; L421-V425 PolarHBondContact O-N 3.42Å |
| 422 | S | 94 | Very high | 89.3 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66 | -26.9 | 168.7 | 87.8 | 0 | 0 | 0 | 0 | 112.7 | C161 W164 G418 I419 V420 V425 N426 | C161-S422 PolarHBondContact SG-N 3.32Å; W164-S422 VanDerWaalsContact CD1-OG 3.28Å; G418-S422 PolarHBondContact O-N 3.44Å; I419-S422 WeakPolarHBondContact O-CB 3.42Å; I419-S422 PolarHBondContact O-N 3.29Å; I419-S422 PolarHBondContact O-OG 2.85Å; V420-S422 PolarHBondContact O-N 2.92Å; V420-S422 VanDerWaalsContact O-N 3.14Å; S422-V425 PolarHBondContact O-N 2.8Å; S422-N426 VanDerWaalsContact O-CB 3.26Å; S422-N426 WeakPolarHBondContact O-CB 3.27Å; S422-N426 VanDerWaalsContact O-CG 3.27Å; S422-N426 PolarHBondContact O-N 2.96Å |
| 423 | V | 94.3 | Very high | 88.7 | Confident | 2 Ų | 2 | 48 Ų | 48 | 1% | 0.012 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.2 | -52.9 | -177 | -175.8 | 0 | 0 | 0 | 0 | 111.6 | T262 A266 V420 L421 V425 N426 A427 V446 | T262-V423 HydrophobicContact CG2-CG1 4.32Å; A266-V423 HydrophobicContact CB-CG1 3.94Å; V420-V423 VanDerWaalsContact O-CB 3.32Å; V420-V423 WeakPolarHBondContact O-CB 3.42Å; V420-V423 WeakPolarHBondContact O-CG2 3.42Å; V420-V423 PolarHBondContact O-N 3.38Å; L421-V423 PolarHBondContact O-N 2.89Å; V423-V425 VanDerWaalsContact C-N 3.32Å; V423-V425 PolarHBondContact O-N 2.87Å; V423-N426 PolarHBondContact O-N 3.13Å; V423-A427 PolarHBondContact O-N 3.45Å; V423-V446 HydrophobicContact CG1-CG1 3.72Å |
| 424 | P | 92.9 | Very high | 87.3 | Confident | 67 Ų | 67 | 47 Ų | 47 | 44% | 0.435 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.6 | -29.1 | 173.5 | 26.7 | -34.5 | 0 | 0 | 0 | 113.1 | V420 L421 A427 M428 | V420-P424 VanDerWaalsContact O-CD 3.26Å; V420-P424 WeakPolarHBondContact O-CD 3.42Å; L421-P424 WeakPolarHBondContact O-CD 3.38Å; L421-P424 WeakPolarHBondContact O-CG 3.46Å; P424-A427 PolarHBondContact O-N 3.13Å; P424-M428 WeakPolarHBondContact O-CG 3.26Å; P424-M428 PolarHBondContact O-N 2.88Å |
| 425 | V | 92.2 | Very high | 85.3 | Confident | 58 Ų | 58 | 53.2 Ų | 53.2 | 35% | 0.352 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65.6 | -43.3 | 172.7 | 170.1 | 0 | 0 | 0 | 0 | 111 | A165 L421 S422 V423 A427 M428 V429 | A165-V425 HydrophobicContact CB-CB 4.41Å; A165-V425 HydrophobicContact CB-CG1 3.83Å; L421-V425 WeakPolarHBondContact O-CG2 3.1Å; L421-V425 PolarHBondContact O-N 3.42Å; S422-V425 PolarHBondContact O-N 2.8Å; V423-V425 VanDerWaalsContact C-N 3.32Å; V423-V425 PolarHBondContact O-N 2.87Å; V425-A427 VanDerWaalsContact C-N 3.33Å; V425-M428 PolarHBondContact O-N 2.78Å; V425-V429 WeakPolarHBondContact O-CG2 3.48Å; V425-V429 PolarHBondContact O-N 3.31Å |
| 426 | N | 91.8 | Very high | 83.6 | Confident | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.005 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.4 | -35.2 | 173.6 | -76 | -14.9 | 0 | 0 | 0 | 111.6 | A165 Q169 T262 S265 S422 V423 V429 D430 | A165-N426 WeakPolarHBondContact CA-OD1 3.46Å; A165-N426 VanDerWaalsContact CB-OD1 3.3Å; A165-N426 WeakPolarHBondContact CB-OD1 2.9Å; A165-N426 PolarHBondContact O-OD1 3.27Å; Q169-N426 WeakPolarHBondContact CG-OD1 3.4Å; Q169-N426 PolarHBondContact NE2-O 3.04Å; T262-N426 VanDerWaalsContact OG1-C 3.24Å; T262-N426 PolarHBondContact OG1-O 3.37Å; S265-N426 PolarHBondContact OG-ND2 2.62Å; S422-N426 VanDerWaalsContact O-CB 3.26Å; S422-N426 WeakPolarHBondContact O-CB 3.27Å; S422-N426 VanDerWaalsContact O-CG 3.27Å; S422-N426 PolarHBondContact O-N 2.96Å; V423-N426 PolarHBondContact O-N 3.13Å; N426-V429 PolarHBondContact O-N 3.32Å; N426-D430 VanDerWaalsContact O-CB 3.27Å; N426-D430 WeakPolarHBondContact O-CB 3.4Å; N426-D430 VanDerWaalsContact O-CG 3.24Å; N426-D430 PolarHBondContact O-N 3.32Å |
| 427 | A | 89.1 | Confident | 81.9 | Confident | 22 Ų | 22 | 63.8 Ų | 63.8 | 18% | 0.182 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T262 V423 P424 V425 L431 | T262-A427 HydrophobicContact CG2-CB 3.83Å; T262-A427 WeakPolarHBondContact OG1-CA 3.22Å; T262-A427 PolarHBondContact OG1-N 2.76Å; T262-A427 VanDerWaalsContact OG1-N 3.13Å; V423-A427 PolarHBondContact O-N 3.45Å; P424-A427 PolarHBondContact O-N 3.13Å; V425-A427 VanDerWaalsContact C-N 3.33Å; A427-L431 VanDerWaalsContact O-CB 3.3Å; A427-L431 WeakPolarHBondContact O-CB 3.17Å; A427-L431 WeakPolarHBondContact O-CD1 3.31Å; A427-L431 WeakPolarHBondContact O-CG 3.32Å; A427-L431 PolarHBondContact O-N 2.95Å |
| 428 | M | 88.7 | Confident | 80.5 | Confident | 109 Ų | 109 | 64.2 Ų | 64.2 | 54% | 0.537 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 174.1 | -71.8 | 177.3 | 70.8 | 0 | 0 | 111.8 | P424 V425 L431 Y432 | P424-M428 WeakPolarHBondContact O-CG 3.26Å; P424-M428 PolarHBondContact O-N 2.88Å; V425-M428 PolarHBondContact O-N 2.78Å; M428-L431 PolarHBondContact O-N 3.32Å; M428-Y432 WeakPolarHBondContact O-CD2 3.43Å; M428-Y432 PolarHBondContact O-N 3.22Å; M428-Y432 VanDerWaalsContact O-N 3.07Å |
| 429 | V | 87.3 | Confident | 79.9 | Confident | 54 Ų | 54 | 67.3 Ų | 67.3 | 33% | 0.327 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.6 | -41.2 | 178.3 | 176.6 | 0 | 0 | 0 | 0 | 111.4 | Q169 V425 N426 L431 Y432 T433 | Q169-V429 HydrophobicContact CG-CB 4.34Å; Q169-V429 HydrophobicContact CG-CG1 3.94Å; Q169-V429 VanDerWaalsContact NE2-CG1 3.33Å; V425-V429 WeakPolarHBondContact O-CG2 3.48Å; V425-V429 PolarHBondContact O-N 3.31Å; N426-V429 PolarHBondContact O-N 3.32Å; V429-L431 VanDerWaalsContact C-N 3.35Å; V429-L431 PolarHBondContact O-N 2.8Å; V429-Y432 PolarHBondContact O-N 2.97Å; V429-T433 VanDerWaalsContact O-CB 3.23Å; V429-T433 WeakPolarHBondContact O-CB 3.44Å; V429-T433 PolarHBondContact O-N 2.61Å; V429-T433 PolarHBondContact O-OG1 3.44Å |
| 430 | D | 85.8 | Confident | 79.5 | Confident | 11 Ų | 11 | 70.8 Ų | 70.8 | 6% | 0.059 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60 | -43.6 | 173.8 | -74.6 | -6.1 | 0 | 0 | 0 | 110.4 | Q169 T261 T262 N426 Y432 T433 C434 F438 | Q169-D430 PolarHBondContact NE2-OD1 2.93Å; T261-D430 PolarHBondContact N-OD2 3.46Å; T261-D430 VanDerWaalsContact OG1-CG 3.28Å; T261-D430 PolarHBondContact OG1-OD1 3.44Å; T261-D430 PolarHBondContact OG1-OD2 3.43Å; T261-D430 VanDerWaalsContact OG1-OD2 3.13Å; T262-D430 WeakPolarHBondContact CB-OD2 3.45Å; T262-D430 PolarHBondContact N-OD2 2.71Å; T262-D430 PolarHBondContact OG1-OD2 3.27Å; N426-D430 VanDerWaalsContact O-CB 3.27Å; N426-D430 WeakPolarHBondContact O-CB 3.4Å; N426-D430 VanDerWaalsContact O-CG 3.24Å; N426-D430 PolarHBondContact O-N 3.32Å; D430-Y432 PolarHBondContact O-N 3.45Å; D430-T433 PolarHBondContact O-N 3.09Å; D430-C434 WeakPolarHBondContact O-CB 3.33Å; D430-C434 PolarHBondContact O-N 2.95Å; D430-F438 HydrophobicContact CB-CZ 4.49Å |
| 431 | L | 81.6 | Confident | 79.2 | Confident | 110 Ų | 110 | 72.3 Ų | 72.3 | 58% | 0.576 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -60.9 | -35.5 | 174.8 | -80.4 | 166.2 | 0 | 0 | 0 | 114 | A427 M428 V429 F438 | A427-L431 VanDerWaalsContact O-CB 3.3Å; A427-L431 WeakPolarHBondContact O-CB 3.17Å; A427-L431 WeakPolarHBondContact O-CD1 3.31Å; A427-L431 WeakPolarHBondContact O-CG 3.32Å; A427-L431 PolarHBondContact O-N 2.95Å; M428-L431 PolarHBondContact O-N 3.32Å; V429-L431 VanDerWaalsContact C-N 3.35Å; V429-L431 PolarHBondContact O-N 2.8Å; L431-F438 HydrophobicContact CD2-CD2 3.66Å; L431-F438 HydrophobicContact CD2-CE2 3.5Å; L431-F438 VanDerWaalsContact CD2-CE2 3.5Å; L431-F438 HydrophobicContact CD2-CZ 4.48Å; L431-F438 HydrophobicContact CG-CD2 4.31Å; L431-F438 HydrophobicContact CG-CE2 3.68Å; L431-F438 HydrophobicContact CG-CZ 4.26Å |
| 432 | Y | 77.3 | Confident | 78.9 | Confident | 199 Ų | 199 | 70.8 Ų | 70.8 | 78% | 0.78 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -84.3 | -15.2 | 177.2 | -75.5 | -60.2 | 0 | 0 | 0 | 114 | M428 V429 D430 | M428-Y432 WeakPolarHBondContact O-CD2 3.43Å; M428-Y432 PolarHBondContact O-N 3.22Å; M428-Y432 VanDerWaalsContact O-N 3.07Å; V429-Y432 PolarHBondContact O-N 2.97Å; D430-Y432 PolarHBondContact O-N 3.45Å |
| 433 | T | 69.4 | Low | 78.7 | Confident | 73 Ų | 73 | 75.6 Ų | 75.6 | 45% | 0.448 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -114.8 | -14.6 | -170.1 | -45.2 | 0 | 0 | 0 | 0 | 113.5 | V429 D430 | V429-T433 VanDerWaalsContact O-CB 3.23Å; V429-T433 WeakPolarHBondContact O-CB 3.44Å; V429-T433 PolarHBondContact O-N 2.61Å; V429-T433 PolarHBondContact O-OG1 3.44Å; D430-T433 PolarHBondContact O-N 3.09Å |
| 434 | C | 56.8 | Low | 78.6 | Confident | 43 Ų | 43 | 79.4 Ų | 79.4 | 29% | 0.291 | 42% | 0.421 | S | S | . | . | trans | -141.2 | 115.8 | -174.5 | -69.4 | 0 | 0 | 0 | 0 | 111.8 | D430 I436 | D430-C434 WeakPolarHBondContact O-CB 3.33Å; D430-C434 PolarHBondContact O-N 2.95Å; C434-I436 HydrophobicContact CB-CB 4.49Å; C434-I436 HydrophobicContact CB-CD1 3.9Å; C434-I436 HydrophobicContact CB-CG1 4Å; C434-I436 PolarHBondContact O-N 3.17Å | ||
| 435 | D | 45.8 | Very low | 78.6 | Confident | 178 Ų | 178 | 76.2 Ų | 76.2 | 95% | 0.952 | 40% | 0.401 | S | S | * | . | trans | -67.8 | 72 | 166.3 | -66 | -74.7 | 0 | 0 | 0 | 111.5 | ||||
| 436 | I | 54.5 | Low | 78.7 | Confident | 86 Ų | 86 | 74.2 Ų | 74.2 | 44% | 0.441 | 39% | 0.389 | S | S | . | . | trans | -129.5 | 128.6 | -176.6 | -61.1 | 178.4 | 0 | 0 | 0 | 110.8 | C434 F438 | C434-I436 HydrophobicContact CB-CB 4.49Å; C434-I436 HydrophobicContact CB-CD1 3.9Å; C434-I436 HydrophobicContact CB-CG1 4Å; C434-I436 PolarHBondContact O-N 3.17Å; I436-F438 PolarHBondContact O-N 3Å; I436-F438 VanDerWaalsContact O-N 3.15Å | ||
| 437 | N | 55.2 | Low | 78.7 | Confident | 155 Ų | 155 | 81 Ų | 81 | 83% | 0.829 | 42% | 0.418 | S | S | * | . | trans | -63 | 110 | -178.5 | -63.1 | -71.7 | 0 | 0 | 0 | 112.3 | N439 | N437-N439 PolarHBondContact O-N 3.27Š| ||
| 438 | F | 61.7 | Low | 79 | Confident | 67 Ų | 67 | 81.4 Ų | 81.4 | 29% | 0.294 | 42% | 0.417 | S | S | . | . | trans | -70.2 | 97.6 | 165.6 | -81.9 | -92.7 | 0 | 0 | 0 | 109.9 | D430 L431 I436 T440 | D430-F438 HydrophobicContact CB-CZ 4.49Å; L431-F438 HydrophobicContact CD2-CD2 3.66Å; L431-F438 HydrophobicContact CD2-CE2 3.5Å; L431-F438 VanDerWaalsContact CD2-CE2 3.5Å; L431-F438 HydrophobicContact CD2-CZ 4.48Å; L431-F438 HydrophobicContact CG-CD2 4.31Å; L431-F438 HydrophobicContact CG-CE2 3.68Å; L431-F438 HydrophobicContact CG-CZ 4.26Å; I436-F438 PolarHBondContact O-N 3Å; I436-F438 VanDerWaalsContact O-N 3.15Å; F438-T440 PolarHBondContact O-N 3.3Å | ||
| 439 | N | 77.9 | Confident | 79.3 | Confident | 66 Ų | 66 | 76.3 Ų | 76.3 | 35% | 0.353 | 39% | 0.392 | S | S | . | . | trans | -56.2 | 128.2 | 168.3 | 178 | -3.6 | 0 | 0 | 0 | 109.5 | A308 N437 V441 R442 L443 | A308-N439 PolarHBondContact O-ND2 3.37Å; N437-N439 PolarHBondContact O-N 3.27Å; N439-V441 PolarHBondContact O-N 3.39Å; N439-V441 VanDerWaalsContact O-N 3.13Å; N439-V441 PolarHBondContact OD1-N 2.83Å; N439-R442 HydrophobicContact CB-CB 4.17Å; N439-R442 WeakPolarHBondContact O-CA 3.27Å; N439-R442 WeakPolarHBondContact O-CB 3.26Å; N439-R442 PolarHBondContact O-N 3.03Å; N439-L443 PolarHBondContact O-N 3.28Å | ||
| 440 | T | 85.1 | Confident | 79.6 | Confident | 98 Ų | 98 | 74.9 Ų | 74.9 | 60% | 0.601 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -51.4 | -36.7 | 177.1 | -45.6 | 0 | 0 | 0 | 0 | 112.3 | F438 L443 I444 | F438-T440 PolarHBondContact O-N 3.3Å; T440-L443 PolarHBondContact O-N 3.23Å; T440-I444 HydrophobicContact CG2-CD1 4.07Å; T440-I444 WeakPolarHBondContact O-CD1 3.27Å; T440-I444 VanDerWaalsContact O-CG1 3.25Å; T440-I444 WeakPolarHBondContact O-CG1 3.44Å; T440-I444 PolarHBondContact O-N 3.39Å |
| 441 | V | 87.9 | Confident | 80 | Confident | 48 Ų | 48 | 77.7 Ų | 77.7 | 29% | 0.291 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 176.8 | -171.4 | 0 | 0 | 0 | 0 | 111.6 | M304 A308 N439 I444 A445 | M304-V441 HydrophobicContact CG-CG1 3.83Å; M304-V441 HydrophobicContact SD-CG1 4.34Å; A308-V441 HydrophobicContact CB-CB 4Å; A308-V441 HydrophobicContact CB-CG1 3.9Å; N439-V441 PolarHBondContact O-N 3.39Å; N439-V441 VanDerWaalsContact O-N 3.13Å; N439-V441 PolarHBondContact OD1-N 2.83Å; V441-I444 PolarHBondContact O-N 3.46Å; V441-A445 WeakPolarHBondContact O-CB 3.47Å; V441-A445 PolarHBondContact O-N 3.27Å |
| 442 | R | 88.4 | Confident | 80.5 | Confident | 40 Ų | 40 | 72.4 Ų | 72.4 | 15% | 0.151 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 175.4 | -165.3 | -172.7 | -77.9 | -169.7 | 10.3 | 110.8 | N260 D263 M305 A308 D309 N439 I444 A445 V446 | N260-R442 PolarHBondContact ND2-NH1 3.18Å; D263-R442 WeakPolarHBondContact OD1-CD 3.32Å; D263-R442 IonicContact OD2-CZ 2.89Å; D263-R442 IonicContact OD2-NE 2.68Å; D263-R442 IonicContact OD2-NH1 2.99Å; D263-R442 PolarHBondContact OD2-NH1 2.93Å; M305-R442 HydrophobicContact CE-CG 4.44Å; M305-R442 HydrophobicContact SD-CG 3.55Å; M305-R442 VanDerWaalsContact SD-CG 3.55Å; A308-R442 HydrophobicContact CB-CB 3.94Å; D309-R442 IonicContact OD1-CZ 3.59Å; D309-R442 IonicContact OD1-NE 3.86Å; D309-R442 PolarHBondContact OD1-NE 2.99Å; D309-R442 IonicContact OD1-NH2 2.77Å; D309-R442 PolarHBondContact OD1-NH2 3.01Å; D309-R442 IonicContact OD2-CZ 2.72Å; D309-R442 IonicContact OD2-NH2 3.97Å; D309-R442 PolarHBondContact OD2-NH2 3.36Å; D309-R442 VanDerWaalsContact OD2-NH2 3.09Å; N439-R442 HydrophobicContact CB-CB 4.17Å; N439-R442 WeakPolarHBondContact O-CA 3.27Å; N439-R442 WeakPolarHBondContact O-CB 3.26Å; N439-R442 PolarHBondContact O-N 3.03Å; R442-I444 PolarHBondContact O-N 2.99Å; R442-A445 WeakPolarHBondContact O-CB 3.16Å; R442-A445 PolarHBondContact O-N 2.71Å; R442-V446 WeakPolarHBondContact O-CG2 3.42Å; R442-V446 PolarHBondContact O-N 2.87Å |
| 443 | L | 89.6 | Confident | 81.2 | Confident | 101 Ų | 101 | 63.2 Ų | 63.2 | 53% | 0.529 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 176.3 | -175.6 | 62.8 | 0 | 0 | 0 | 111.9 | N439 T440 V446 F447 | N439-L443 PolarHBondContact O-N 3.28Å; T440-L443 PolarHBondContact O-N 3.23Å; L443-V446 PolarHBondContact O-N 3.46Å; L443-F447 WeakPolarHBondContact O-CB 3.35Å; L443-F447 PolarHBondContact O-N 2.91Å |
| 444 | I | 92.2 | Very high | 82.2 | Confident | 81 Ų | 81 | 63.8 Ų | 63.8 | 42% | 0.415 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 173.9 | -68.1 | 163.5 | 0 | 0 | 0 | 110.7 | M304 T440 V441 R442 F447 I448 | M304-I444 HydrophobicContact SD-CB 4.3Å; M304-I444 HydrophobicContact SD-CG2 3.69Å; T440-I444 HydrophobicContact CG2-CD1 4.07Å; T440-I444 WeakPolarHBondContact O-CD1 3.27Å; T440-I444 VanDerWaalsContact O-CG1 3.25Å; T440-I444 WeakPolarHBondContact O-CG1 3.44Å; T440-I444 PolarHBondContact O-N 3.39Å; V441-I444 PolarHBondContact O-N 3.46Å; R442-I444 PolarHBondContact O-N 2.99Å; I444-F447 PolarHBondContact O-N 2.88Å; I444-I448 HydrophobicContact CG2-CD1 3.69Å; I444-I448 HydrophobicContact CG2-CG1 4.29Å; I444-I448 WeakPolarHBondContact O-CB 3.43Å; I444-I448 VanDerWaalsContact O-CG1 3.3Å; I444-I448 WeakPolarHBondContact O-CG1 3.37Å; I444-I448 PolarHBondContact O-N 3.09Å |
| 445 | A | 92.6 | Very high | 83.8 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59.9 | -47 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | M304 M305 V441 R442 F447 I448 I449 | M304-A445 HydrophobicContact CB-CB 3.99Å; M304-A445 HydrophobicContact CG-CB 3.96Å; M304-A445 HydrophobicContact SD-CB 4.3Å; M305-A445 HydrophobicContact CB-CB 4.14Å; V441-A445 WeakPolarHBondContact O-CB 3.47Å; V441-A445 PolarHBondContact O-N 3.27Å; R442-A445 WeakPolarHBondContact O-CB 3.16Å; R442-A445 PolarHBondContact O-N 2.71Å; A445-F447 VanDerWaalsContact C-N 3.34Å; A445-F447 PolarHBondContact O-N 3.3Å; A445-I448 PolarHBondContact O-N 3.32Å; A445-I449 VanDerWaalsContact O-CG1 3.31Å; A445-I449 WeakPolarHBondContact O-CG1 3.4Å; A445-I449 PolarHBondContact O-N 3.42Å |
| 446 | V | 93.1 | Very high | 85.8 | Confident | 17 Ų | 17 | 56.8 Ų | 56.8 | 10% | 0.103 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.8 | -44.3 | 175.1 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | A266 M305 V423 R442 L443 I449 C450 | A266-V446 HydrophobicContact CB-CB 4.44Å; A266-V446 HydrophobicContact CB-CG1 4.08Å; A266-V446 HydrophobicContact CB-CG2 4.02Å; M305-V446 HydrophobicContact CE-CG2 3.57Å; V423-V446 HydrophobicContact CG1-CG1 3.72Å; R442-V446 WeakPolarHBondContact O-CG2 3.42Å; R442-V446 PolarHBondContact O-N 2.87Å; L443-V446 PolarHBondContact O-N 3.46Å; V446-I449 PolarHBondContact O-N 2.88Å; V446-C450 PolarHBondContact O-N 3Å; V446-C450 PolarHBondContact O-SG 2.64Å |
| 447 | F | 93.7 | Very high | 87.2 | Confident | 142 Ų | 142 | 53.6 Ų | 53.6 | 62% | 0.623 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -63.7 | -44.2 | 178 | -176.2 | -97 | 0 | 0 | 0 | 112.3 | L443 I444 A445 I449 C450 L451 | L443-F447 WeakPolarHBondContact O-CB 3.35Å; L443-F447 PolarHBondContact O-N 2.91Å; I444-F447 PolarHBondContact O-N 2.88Å; A445-F447 VanDerWaalsContact C-N 3.34Å; A445-F447 PolarHBondContact O-N 3.3Å; F447-I449 PolarHBondContact O-N 3.35Å; F447-C450 PolarHBondContact O-N 3.08Å; F447-L451 HydrophobicContact CE1-CD2 4.32Å; F447-L451 WeakPolarHBondContact O-CB 3.4Å; F447-L451 PolarHBondContact O-N 2.96Å |
| 448 | I | 94.6 | Very high | 88.4 | Confident | 32 Ų | 32 | 48.8 Ų | 48.8 | 16% | 0.164 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.1 | -44.1 | 176 | -76.6 | 172.8 | 0 | 0 | 0 | 111.3 | L297 M304 I444 A445 L451 G452 | L297-I448 HydrophobicContact CD1-CG2 3.79Å; L297-I448 HydrophobicContact CG-CG2 3.98Å; L297-I448 VanDerWaalsContact O-CG2 3.22Å; L297-I448 WeakPolarHBondContact O-CG2 3.37Å; M304-I448 HydrophobicContact CE-CD1 3.99Å; M304-I448 HydrophobicContact SD-CD1 3.9Å; I444-I448 HydrophobicContact CG2-CD1 3.69Å; I444-I448 HydrophobicContact CG2-CG1 4.29Å; I444-I448 WeakPolarHBondContact O-CB 3.43Å; I444-I448 VanDerWaalsContact O-CG1 3.3Å; I444-I448 WeakPolarHBondContact O-CG1 3.37Å; I444-I448 PolarHBondContact O-N 3.09Å; A445-I448 PolarHBondContact O-N 3.32Å; I448-L451 PolarHBondContact O-N 2.81Å; I448-G452 PolarHBondContact O-N 3.47Å |
| 449 | I | 95 | Very high | 88.7 | Confident | 1 Ų | 1 | 48.9 Ų | 48.9 | 1% | 0.005 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64 | -45.4 | 176.8 | -64.3 | 164.7 | 0 | 0 | 0 | 111 | A266 L267 C269 C270 A445 V446 F447 L451 G452 F453 | A266-I449 HydrophobicContact CB-CD1 4.46Å; A266-I449 WeakPolarHBondContact O-CG2 3.31Å; L267-I449 HydrophobicContact CD2-CD1 4.17Å; C269-I449 HydrophobicContact CB-CG2 4.28Å; C270-I449 VanDerWaalsContact SG-CG2 3.51Å; A445-I449 VanDerWaalsContact O-CG1 3.31Å; A445-I449 WeakPolarHBondContact O-CG1 3.4Å; A445-I449 PolarHBondContact O-N 3.42Å; V446-I449 PolarHBondContact O-N 2.88Å; F447-I449 PolarHBondContact O-N 3.35Å; I449-L451 VanDerWaalsContact C-N 3.34Å; I449-L451 PolarHBondContact O-N 2.76Å; I449-G452 PolarHBondContact O-N 2.94Å; I449-F453 PolarHBondContact O-N 2.66Å |
| 450 | C | 93.6 | Very high | 88 | Confident | 24 Ų | 24 | 51.1 Ų | 51.1 | 16% | 0.162 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.2 | -39.2 | 178.5 | -66.6 | 0 | 0 | 0 | 0 | 112.1 | V420 V446 F447 F453 L454 | V420-C450 HydrophobicContact CG1-CB 4.19Å; V446-C450 PolarHBondContact O-N 3Å; V446-C450 PolarHBondContact O-SG 2.64Å; F447-C450 PolarHBondContact O-N 3.08Å; C450-F453 PolarHBondContact O-N 3.4Å; C450-L454 WeakPolarHBondContact O-CB 3.36Å; C450-L454 PolarHBondContact O-N 3.48Å |
| 451 | L | 93.1 | Very high | 86.8 | Confident | 70 Ų | 70 | 49.4 Ų | 49.4 | 37% | 0.366 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.2 | -44.6 | 175.9 | -177.5 | 59.6 | 0 | 0 | 0 | 111.7 | L297 F447 I448 I449 F453 L454 M455 | L297-L451 HydrophobicContact CD2-CB 4.3Å; L297-L451 HydrophobicContact CD2-CD2 4.1Å; L297-L451 HydrophobicContact CD2-CG 3.97Å; F447-L451 HydrophobicContact CE1-CD2 4.32Å; F447-L451 WeakPolarHBondContact O-CB 3.4Å; F447-L451 PolarHBondContact O-N 2.96Å; I448-L451 PolarHBondContact O-N 2.81Å; I449-L451 VanDerWaalsContact C-N 3.34Å; I449-L451 PolarHBondContact O-N 2.76Å; L451-F453 VanDerWaalsContact C-N 3.34Å; L451-F453 PolarHBondContact O-N 3.24Å; L451-L454 PolarHBondContact O-N 3Å; L451-M455 WeakPolarHBondContact O-CG 3.22Å; L451-M455 PolarHBondContact O-N 3.42Å |
| 452 | G | 92.6 | Very high | 85.6 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.4 | -42.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | I448 I449 M455 L456 | I448-G452 PolarHBondContact O-N 3.47Å; I449-G452 PolarHBondContact O-N 2.94Å; G452-M455 PolarHBondContact O-N 3.24Å; G452-L456 WeakPolarHBondContact O-CG 3.43Å; G452-L456 PolarHBondContact O-N 2.78Å |
| 453 | F | 92.2 | Very high | 84.3 | Confident | 6 Ų | 6 | 55 Ų | 55 | 3% | 0.026 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.6 | -43.9 | 173.2 | -168.2 | -75.4 | 0 | 0 | 0 | 112.5 | C269 K272 S416 V420 I449 C450 L451 M455 L456 L457 | C269-F453 HydrophobicContact CB-CB 4.49Å; C269-F453 HydrophobicContact CB-CD2 3.47Å; C269-F453 VanDerWaalsContact CB-CD2 3.47Å; C269-F453 HydrophobicContact CB-CE2 3.84Å; C269-F453 HydrophobicContact CB-CG 4.28Å; C269-F453 WeakPolarHBondContact O-CD2 3.41Å; C269-F453 VanDerWaalsContact O-CE2 3.26Å; C269-F453 WeakPolarHBondContact O-CE2 3.46Å; K272-F453 HydrophobicContact CB-CD2 3.88Å; K272-F453 HydrophobicContact CB-CE2 3.81Å; K272-F453 HydrophobicContact CB-CZ 4.45Å; K272-F453 HydrophobicContact CG-CD2 3.8Å; K272-F453 HydrophobicContact CG-CE1 4.28Å; K272-F453 HydrophobicContact CG-CE2 3.2Å; K272-F453 HydrophobicContact CG-CZ 3.51Å; S416-F453 WeakPolarHBondContact O-CE1 3.45Å; V420-F453 HydrophobicContact CG2-CB 4.34Å; V420-F453 HydrophobicContact CG2-CD1 3.03Å; V420-F453 HydrophobicContact CG2-CD2 4.35Å; V420-F453 HydrophobicContact CG2-CE1 3.08Å; V420-F453 HydrophobicContact CG2-CE2 4.37Å; V420-F453 HydrophobicContact CG2-CG 3.7Å; V420-F453 HydrophobicContact CG2-CZ 3.77Å; I449-F453 PolarHBondContact O-N 2.66Å; C450-F453 PolarHBondContact O-N 3.4Å; L451-F453 VanDerWaalsContact C-N 3.34Å; L451-F453 PolarHBondContact O-N 3.24Å; F453-M455 VanDerWaalsContact C-N 3.31Å; F453-M455 PolarHBondContact O-N 3.07Å; F453-L456 CarbonylContact O-C 3.55Å; F453-L456 WeakPolarHBondContact O-CB 3.48Å; F453-L456 PolarHBondContact O-N 3.48Å; F453-L456 VanDerWaalsContact O-N 3.12Å; F453-L457 HydrophobicContact CD1-CD1 3.54Å; F453-L457 HydrophobicContact CD1-CD2 3.95Å; F453-L457 HydrophobicContact CD1-CG 4.29Å; F453-L457 HydrophobicContact CE1-CD1 3.25Å; F453-L457 HydrophobicContact CE1-CD2 3.64Å; F453-L457 HydrophobicContact CE1-CG 4.07Å; F453-L457 HydrophobicContact CZ-CD1 4.13Å; F453-L457 PolarHBondContact O-N 2.99Å |
| 454 | L | 91.3 | Very high | 82.9 | Confident | 84 Ų | 84 | 52.9 Ų | 52.9 | 44% | 0.44 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63.1 | -39.9 | -179.6 | -173.6 | 61.1 | 0 | 0 | 0 | 111.1 | C450 L451 L456 L457 L458 | C450-L454 WeakPolarHBondContact O-CB 3.36Å; C450-L454 PolarHBondContact O-N 3.48Å; L451-L454 PolarHBondContact O-N 3Å; L454-L456 PolarHBondContact O-N 3.35Å; L454-L457 WeakPolarHBondContact O-CA 3.26Å; L454-L457 VanDerWaalsContact O-CB 3.29Å; L454-L457 WeakPolarHBondContact O-CB 3.45Å; L454-L457 PolarHBondContact O-N 3.4Å; L454-L458 PolarHBondContact O-N 2.89Å |
| 455 | M | 88.9 | Confident | 81.3 | Confident | 54 Ų | 54 | 52.3 Ų | 52.3 | 27% | 0.266 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65 | -34.3 | 172.6 | -70.1 | -172.1 | 74.5 | 0 | 0 | 113.1 | V290 A294 L297 L451 G452 F453 L457 L458 | V290-M455 HydrophobicContact CG1-CE 4Å; A294-M455 HydrophobicContact CB-CB 3.51Å; L297-M455 HydrophobicContact CD2-SD 4.47Å; L451-M455 WeakPolarHBondContact O-CG 3.22Å; L451-M455 PolarHBondContact O-N 3.42Å; G452-M455 PolarHBondContact O-N 3.24Å; F453-M455 VanDerWaalsContact C-N 3.31Å; F453-M455 PolarHBondContact O-N 3.07Å; M455-L457 PolarHBondContact O-N 2.9Å; M455-L458 PolarHBondContact O-N 3.4Å |
| 456 | L | 88 | Confident | 80.1 | Confident | 20 Ų | 20 | 56.7 Ų | 56.7 | 11% | 0.105 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69.6 | -16.2 | 170.4 | -71.9 | 167.2 | 0 | 0 | 0 | 113.6 | K272 A273 F276 R291 A294 G452 F453 L454 | K272-L456 HydrophobicContact CB-CD1 4.27Å; A273-L456 HydrophobicContact CB-CD1 3.75Å; F276-L456 HydrophobicContact CB-CD2 4.35Å; F276-L456 HydrophobicContact CD1-CD2 4.28Å; F276-L456 HydrophobicContact CG-CD2 4.35Å; R291-L456 HydrophobicContact CB-CD2 3.84Å; R291-L456 HydrophobicContact CG-CD2 4.12Å; R291-L456 WeakPolarHBondContact O-CD2 3.47Å; A294-L456 HydrophobicContact CB-CD2 4.04Å; A294-L456 HydrophobicContact CB-CG 3.77Å; G452-L456 WeakPolarHBondContact O-CG 3.43Å; G452-L456 PolarHBondContact O-N 2.78Å; F453-L456 CarbonylContact O-C 3.55Å; F453-L456 WeakPolarHBondContact O-CB 3.48Å; F453-L456 PolarHBondContact O-N 3.48Å; F453-L456 VanDerWaalsContact O-N 3.12Å; L454-L456 PolarHBondContact O-N 3.35Å |
| 457 | L | 85.4 | Confident | 78.9 | Confident | 19 Ų | 19 | 60.7 Ų | 60.7 | 10% | 0.099 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -88.9 | -13.2 | 177.1 | -109.2 | 58 | 0 | 0 | 0 | 114.2 | K272 L417 F453 L454 M455 P459 | K272-L457 VanDerWaalsContact NZ-CD1 3.3Å; L417-L457 HydrophobicContact CB-CD2 4.29Å; F453-L457 HydrophobicContact CD1-CD1 3.54Å; F453-L457 HydrophobicContact CD1-CD2 3.95Å; F453-L457 HydrophobicContact CD1-CG 4.29Å; F453-L457 HydrophobicContact CE1-CD1 3.25Å; F453-L457 HydrophobicContact CE1-CD2 3.64Å; F453-L457 HydrophobicContact CE1-CG 4.07Å; F453-L457 HydrophobicContact CZ-CD1 4.13Å; F453-L457 PolarHBondContact O-N 2.99Å; L454-L457 WeakPolarHBondContact O-CA 3.26Å; L454-L457 VanDerWaalsContact O-CB 3.29Å; L454-L457 WeakPolarHBondContact O-CB 3.45Å; L454-L457 PolarHBondContact O-N 3.4Å; M455-L457 PolarHBondContact O-N 2.9Å; L457-P459 WeakPolarHBondContact O-CD 3.38Å |
| 458 | L | 79.9 | Confident | 77.6 | Confident | 54 Ų | 54 | 61.2 Ų | 61.2 | 28% | 0.283 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -66.4 | 125.4 | 174.3 | -60.4 | 176.1 | 0 | 0 | 0 | 109.7 | L454 M455 W462 | L454-L458 PolarHBondContact O-N 2.89Å; M455-L458 PolarHBondContact O-N 3.4Å; L458-W462 HydrophobicContact CB-CG 4.21Å; L458-W462 HydrophobicContact CD2-CD2 3.79Å; L458-W462 HydrophobicContact CD2-CE3 4.41Å; L458-W462 HydrophobicContact CD2-CG 3.99Å; L458-W462 HydrophobicContact CD2-CZ2 4.03Å |
| 459 | P | 68 | Low | 76.5 | Confident | 69 Ų | 69 | 64.7 Ų | 64.7 | 45% | 0.448 | 33% | 0.325 | S | S | . | . | trans | -41.4 | 168.9 | 152.3 | -32.3 | 19.9 | 0 | 0 | 0 | 115.1 | L457 W462 | L457-P459 WeakPolarHBondContact O-CD 3.38Å; P459-W462 VanDerWaalsContact CG-NE1 3.35Å; P459-W462 VanDerWaalsContact O-CD1 3.32Å | ||
| 460 | E | 62.6 | Low | 75.4 | Confident | 113 Ų | 113 | 68.1 Ų | 68.1 | 53% | 0.528 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | -22.2 | -175.9 | -72.2 | 154.4 | -145.9 | 0 | 0 | 112.2 | M288 R291 | M288-E460 HydrophobicContact CG-CG 4.48Å; M288-E460 HydrophobicContact SD-CB 4.4Å; M288-E460 HydrophobicContact SD-CG 3.65Å; R291-E460 IonicContact CZ-OE1 3.87Å; R291-E460 IonicContact NH1-OE1 2.73Å; R291-E460 PolarHBondContact NH1-OE1 2.83Å; R291-E460 IonicContact NH2-OE1 2.95Å; R291-E460 PolarHBondContact NH2-OE1 2.68Å |
| 461 | D | 60.2 | Low | 74.3 | Confident | 63 Ų | 63 | 70.3 Ų | 70.3 | 34% | 0.337 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | 17 | -176.4 | -40.3 | -93.9 | 0 | 0 | 0 | 115.8 | D463 Q464 C465 | D461-D463 WeakPolarHBondContact CA-OD1 3.43Å; D461-D463 PolarHBondContact O-N 2.89Å; D461-Q464 PolarHBondContact O-N 2.95Å; D461-C465 PolarHBondContact O-N 2.88Å |
| 462 | W | 63 | Low | 73.2 | Confident | 113 Ų | 113 | 74.4 Ų | 74.4 | 43% | 0.428 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -68.2 | -24 | 179.8 | -79.6 | 84.9 | 0 | 0 | 0 | 113.3 | L458 P459 C465 I466 | L458-W462 HydrophobicContact CB-CG 4.21Å; L458-W462 HydrophobicContact CD2-CD2 3.79Å; L458-W462 HydrophobicContact CD2-CE3 4.41Å; L458-W462 HydrophobicContact CD2-CG 3.99Å; L458-W462 HydrophobicContact CD2-CZ2 4.03Å; P459-W462 VanDerWaalsContact CG-NE1 3.35Å; P459-W462 VanDerWaalsContact O-CD1 3.32Å; W462-C465 PolarHBondContact O-N 3.45Å; W462-I466 VanDerWaalsContact O-CB 3.31Å; W462-I466 WeakPolarHBondContact O-CB 3.44Å; W462-I466 VanDerWaalsContact O-CG1 3.26Å; W462-I466 WeakPolarHBondContact O-CG1 3.46Å; W462-I466 PolarHBondContact O-N 3.22Å |
| 463 | D | 60.3 | Low | 72 | Confident | 91 Ų | 91 | 78.6 Ų | 78.6 | 49% | 0.487 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57.5 | -51.3 | 170 | 66.8 | -36.2 | 0 | 0 | 0 | 110.4 | D461 C465 I466 I467 | D461-D463 WeakPolarHBondContact CA-OD1 3.43Å; D461-D463 PolarHBondContact O-N 2.89Å; D463-C465 VanDerWaalsContact C-N 3.33Å; D463-C465 PolarHBondContact O-N 3Å; D463-I466 PolarHBondContact O-N 3.27Å; D463-I467 WeakPolarHBondContact O-CB 3.31Å; D463-I467 WeakPolarHBondContact O-CD1 3.26Å; D463-I467 WeakPolarHBondContact O-CG1 3.48Å; D463-I467 PolarHBondContact O-N 3.49Å |
| 464 | Q | 61 | Low | 71 | Confident | 58 Ų | 58 | 86.9 Ų | 86.9 | 27% | 0.271 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.6 | -36.3 | 175.6 | -62.7 | -171.6 | 42.9 | 0 | 0 | 111.9 | D461 R468 | D461-Q464 PolarHBondContact O-N 2.95Å; Q464-R468 VanDerWaalsContact O-CB 3.27Å; Q464-R468 WeakPolarHBondContact O-CB 3.23Å; Q464-R468 WeakPolarHBondContact O-CD 3.47Å; Q464-R468 WeakPolarHBondContact O-CG 3.1Å; Q464-R468 PolarHBondContact O-N 2.96Å |
| 465 | C | 58.2 | Low | 69.5 | Low | 68 Ų | 68 | 90.8 Ų | 90.8 | 46% | 0.459 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65.5 | -47.9 | 177.8 | -162.3 | 0 | 0 | 0 | 0 | 111.3 | D461 W462 D463 R468 L469 | D461-C465 PolarHBondContact O-N 2.88Å; W462-C465 PolarHBondContact O-N 3.45Å; D463-C465 VanDerWaalsContact C-N 3.33Å; D463-C465 PolarHBondContact O-N 3Å; C465-R468 PolarHBondContact O-N 3.37Å; C465-L469 WeakPolarHBondContact O-CB 3.42Å; C465-L469 PolarHBondContact O-N 3.04Å |
| 466 | I | 67.4 | Low | 67.9 | Low | 93 Ų | 93 | 97.8 Ų | 97.8 | 48% | 0.477 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.9 | -45.1 | 176.9 | -69.9 | 168.9 | 0 | 0 | 0 | 110.2 | W462 D463 R468 L469 T470 | W462-I466 VanDerWaalsContact O-CB 3.31Å; W462-I466 WeakPolarHBondContact O-CB 3.44Å; W462-I466 VanDerWaalsContact O-CG1 3.26Å; W462-I466 WeakPolarHBondContact O-CG1 3.46Å; W462-I466 PolarHBondContact O-N 3.22Å; D463-I466 PolarHBondContact O-N 3.27Å; I466-R468 VanDerWaalsContact C-N 3.32Å; I466-R468 PolarHBondContact O-N 3.18Å; I466-L469 CarbonylContact O-C 3.49Å; I466-L469 WeakPolarHBondContact O-CA 3.33Å; I466-L469 WeakPolarHBondContact O-CB 3.48Å; I466-L469 PolarHBondContact O-N 3.44Å; I466-T470 HydrophobicContact CG2-CG2 4.06Å; I466-T470 WeakPolarHBondContact O-CG2 3.22Å; I466-T470 PolarHBondContact O-N 3.1Å; I466-T470 PolarHBondContact O-OG1 3.24Å; I466-T470 VanDerWaalsContact O-OG1 3.09Å |
| 467 | I | 68.9 | Low | 66.2 | Low | 100 Ų | 100 | 102.7 Ų | 102.7 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.5 | -40.5 | 176 | -69.9 | 164.1 | 0 | 0 | 0 | 111.1 | D463 L469 T470 T471 | D463-I467 WeakPolarHBondContact O-CB 3.31Å; D463-I467 WeakPolarHBondContact O-CD1 3.26Å; D463-I467 WeakPolarHBondContact O-CG1 3.48Å; D463-I467 PolarHBondContact O-N 3.49Å; I467-L469 VanDerWaalsContact C-N 3.3Å; I467-L469 PolarHBondContact O-N 2.91Å; I467-T470 PolarHBondContact O-OG1 2.82Å; I467-T471 HydrophobicContact CG2-CG2 4.46Å; I467-T471 VanDerWaalsContact O-CB 3.31Å; I467-T471 WeakPolarHBondContact O-CB 3.42Å; I467-T471 VanDerWaalsContact O-CG2 3.26Å; I467-T471 WeakPolarHBondContact O-CG2 3.3Å; I467-T471 PolarHBondContact O-N 3.41Å; I467-T471 PolarHBondContact O-OG1 2.76Å |
| 468 | R | 64.9 | Low | 64.6 | Low | 154 Ų | 154 | 108.1 Ų | 108.1 | 58% | 0.581 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -69.9 | -24.6 | 173.8 | -69.8 | 169.9 | -155.9 | -146 | 11.7 | 112.9 | Q464 C465 I466 T471 K472 | Q464-R468 VanDerWaalsContact O-CB 3.27Å; Q464-R468 WeakPolarHBondContact O-CB 3.23Å; Q464-R468 WeakPolarHBondContact O-CD 3.47Å; Q464-R468 WeakPolarHBondContact O-CG 3.1Å; Q464-R468 PolarHBondContact O-N 2.96Å; C465-R468 PolarHBondContact O-N 3.37Å; I466-R468 VanDerWaalsContact C-N 3.32Å; I466-R468 PolarHBondContact O-N 3.18Å; R468-T471 WeakPolarHBondContact CA-OG1 3.35Å; R468-K472 WeakPolarHBondContact O-CB 3.3Å; R468-K472 VanDerWaalsContact O-CG 3.26Å; R468-K472 WeakPolarHBondContact O-CG 3.45Å; R468-K472 PolarHBondContact O-N 3.32Å |
| 469 | L | 70.9 | Confident | 62.9 | Low | 105 Ų | 105 | 110.5 Ų | 110.5 | 55% | 0.55 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -81.5 | -47.9 | 176 | -156.2 | 80.4 | 0 | 0 | 0 | 111.2 | C465 I466 I467 K472 L473 | C465-L469 WeakPolarHBondContact O-CB 3.42Å; C465-L469 PolarHBondContact O-N 3.04Å; I466-L469 CarbonylContact O-C 3.49Å; I466-L469 WeakPolarHBondContact O-CA 3.33Å; I466-L469 WeakPolarHBondContact O-CB 3.48Å; I466-L469 PolarHBondContact O-N 3.44Å; I467-L469 VanDerWaalsContact C-N 3.3Å; I467-L469 PolarHBondContact O-N 2.91Å; L469-K472 CarbonylContact O-C 3.57Å; L469-K472 WeakPolarHBondContact O-CA 3.46Å; L469-K472 WeakPolarHBondContact O-CB 3.38Å; L469-K472 PolarHBondContact O-N 3.22Å; L469-K472 VanDerWaalsContact O-N 3.08Å; L469-L473 HydrophobicContact CG-CD1 4.4Å; L469-L473 WeakPolarHBondContact O-CG 3.27Å; L469-L473 PolarHBondContact O-N 2.93Å |
| 470 | T | 72.1 | Confident | 61.8 | Low | 73 Ų | 73 | 111.2 Ų | 111.2 | 45% | 0.448 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.6 | -35.7 | 178.1 | 57.9 | 0 | 0 | 0 | 0 | 111.9 | I466 I467 K472 L473 R474 | I466-T470 HydrophobicContact CG2-CG2 4.06Å; I466-T470 WeakPolarHBondContact O-CG2 3.22Å; I466-T470 PolarHBondContact O-N 3.1Å; I466-T470 PolarHBondContact O-OG1 3.24Å; I466-T470 VanDerWaalsContact O-OG1 3.09Å; I467-T470 PolarHBondContact O-OG1 2.82Å; T470-K472 VanDerWaalsContact C-N 3.3Å; T470-K472 PolarHBondContact O-N 3.19Å; T470-L473 PolarHBondContact O-N 2.99Å; T470-R474 VanDerWaalsContact O-CB 3.23Å; T470-R474 WeakPolarHBondContact O-CB 3.23Å; T470-R474 PolarHBondContact O-N 3.15Å |
| 471 | T | 72.2 | Confident | 60.7 | Low | 70 Ų | 70 | 115.4 Ų | 115.4 | 43% | 0.429 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -70 | -24.7 | 170.1 | 54.1 | 0 | 0 | 0 | 0 | 113.1 | I467 R468 K475 | I467-T471 HydrophobicContact CG2-CG2 4.46Å; I467-T471 VanDerWaalsContact O-CB 3.31Å; I467-T471 WeakPolarHBondContact O-CB 3.42Å; I467-T471 VanDerWaalsContact O-CG2 3.26Å; I467-T471 WeakPolarHBondContact O-CG2 3.3Å; I467-T471 PolarHBondContact O-N 3.41Å; I467-T471 PolarHBondContact O-OG1 2.76Å; R468-T471 WeakPolarHBondContact CA-OG1 3.35Å; T471-K475 VanDerWaalsContact O-CB 3.26Å; T471-K475 WeakPolarHBondContact O-CB 3.21Å; T471-K475 WeakPolarHBondContact O-CG 3.26Å; T471-K475 PolarHBondContact O-N 3.04Å |
| 472 | K | 68.9 | Low | 60 | Low | 156 Ų | 156 | 119.3 Ų | 119.3 | 68% | 0.678 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -79.2 | -34.3 | 170.8 | -84.4 | -177.5 | 175.1 | -171.6 | 0 | 113.3 | R468 L469 T470 R476 | R468-K472 WeakPolarHBondContact O-CB 3.3Å; R468-K472 VanDerWaalsContact O-CG 3.26Å; R468-K472 WeakPolarHBondContact O-CG 3.45Å; R468-K472 PolarHBondContact O-N 3.32Å; L469-K472 CarbonylContact O-C 3.57Å; L469-K472 WeakPolarHBondContact O-CA 3.46Å; L469-K472 WeakPolarHBondContact O-CB 3.38Å; L469-K472 PolarHBondContact O-N 3.22Å; L469-K472 VanDerWaalsContact O-N 3.08Å; T470-K472 VanDerWaalsContact C-N 3.3Å; T470-K472 PolarHBondContact O-N 3.19Å; K472-R476 WeakPolarHBondContact O-CB 3.25Å; K472-R476 PolarHBondContact O-N 2.86Å |
| 473 | L | 68.8 | Low | 58.9 | Low | 88 Ų | 88 | 118.4 Ų | 118.4 | 46% | 0.461 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -69.2 | -51.1 | 173.4 | -70.8 | 166.7 | 0 | 0 | 0 | 109.9 | L469 T470 K475 R476 D477 | L469-L473 HydrophobicContact CG-CD1 4.4Å; L469-L473 WeakPolarHBondContact O-CG 3.27Å; L469-L473 PolarHBondContact O-N 2.93Å; T470-L473 PolarHBondContact O-N 2.99Å; L473-K475 VanDerWaalsContact C-N 3.29Å; L473-K475 PolarHBondContact O-N 3.34Å; L473-R476 CarbonylContact O-C 3.47Å; L473-R476 VanDerWaalsContact O-CA 3.29Å; L473-R476 WeakPolarHBondContact O-CA 3.48Å; L473-R476 VanDerWaalsContact O-CB 3.27Å; L473-R476 WeakPolarHBondContact O-CB 3.29Å; L473-R476 PolarHBondContact O-N 2.98Å; L473-D477 VanDerWaalsContact C-OD2 3.32Å; L473-D477 PolarHBondContact O-N 2.81Å; L473-D477 VanDerWaalsContact O-OD2 3.05Å |
| 474 | R | 70.1 | Confident | 57.8 | Low | 180 Ų | 180 | 117.6 Ų | 117.6 | 68% | 0.679 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -55.2 | -40.2 | 174 | -175.2 | 172.3 | 175.4 | 162.1 | 1.9 | 113 | T470 R476 D477 E478 | T470-R474 VanDerWaalsContact O-CB 3.23Å; T470-R474 WeakPolarHBondContact O-CB 3.23Å; T470-R474 PolarHBondContact O-N 3.15Å; R474-R476 PolarHBondContact O-N 3.13Å; R474-D477 CarbonylContact O-C 3.57Å; R474-D477 PolarHBondContact O-N 3.18Å; R474-E478 PolarHBondContact O-N 3.24Å |
| 475 | K | 60.9 | Low | 56.4 | Low | 165 Ų | 165 | 124 Ų | 124 | 72% | 0.717 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -3.6 | 172.9 | -75.6 | -174.5 | 175.1 | -162.3 | 0 | 115.3 | T471 L473 | T471-K475 VanDerWaalsContact O-CB 3.26Å; T471-K475 WeakPolarHBondContact O-CB 3.21Å; T471-K475 WeakPolarHBondContact O-CG 3.26Å; T471-K475 PolarHBondContact O-N 3.04Å; L473-K475 VanDerWaalsContact C-N 3.29Å; L473-K475 PolarHBondContact O-N 3.34Å |
| 476 | R | 54.7 | Low | 55.2 | Low | 201 Ų | 201 | 127.9 Ų | 127.9 | 76% | 0.758 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | -25 | 169.8 | -174.6 | 174.9 | 178.2 | 81 | 0.6 | 111.1 | K472 L473 R474 E478 | K472-R476 WeakPolarHBondContact O-CB 3.25Å; K472-R476 PolarHBondContact O-N 2.86Å; L473-R476 CarbonylContact O-C 3.47Å; L473-R476 VanDerWaalsContact O-CA 3.29Å; L473-R476 WeakPolarHBondContact O-CA 3.48Å; L473-R476 VanDerWaalsContact O-CB 3.27Å; L473-R476 WeakPolarHBondContact O-CB 3.29Å; L473-R476 PolarHBondContact O-N 2.98Å; R474-R476 PolarHBondContact O-N 3.13Å; R476-E478 VanDerWaalsContact C-N 3.27Å |
| 477 | D | 52.1 | Low | 53.4 | Low | 123 Ų | 123 | 127.5 Ų | 127.5 | 66% | 0.658 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -81.7 | -2 | 170.9 | -50.8 | -36.6 | 0 | 0 | 0 | 112.7 | L473 R474 P479 | L473-D477 VanDerWaalsContact C-OD2 3.32Å; L473-D477 PolarHBondContact O-N 2.81Å; L473-D477 VanDerWaalsContact O-OD2 3.05Å; R474-D477 CarbonylContact O-C 3.57Å; R474-D477 PolarHBondContact O-N 3.18Å; D477-P479 WeakPolarHBondContact O-CD 3.13Å |
| 478 | E | 52.1 | Low | 51.5 | Low | 134 Ų | 134 | 127.7 Ų | 127.7 | 63% | 0.626 | 71% | 0.707 | S | S | * | * | trans | -105.8 | 65.2 | 168.7 | -70.5 | 179 | 97.3 | 0 | 0 | 113.2 | R474 R476 A480 | R474-E478 PolarHBondContact O-N 3.24Å; R476-E478 VanDerWaalsContact C-N 3.27Å; E478-A480 PolarHBondContact O-N 3.26Å | ||
| 479 | P | 43.4 | Very low | 49.8 | Very low | 104 Ų | 104 | 128.5 Ų | 128.5 | 68% | 0.675 | 72% | 0.723 | S | S | * | * | trans | -85 | 87.9 | 174.9 | 35.4 | -35.3 | 0 | 0 | 0 | 113.3 | D477 | D477-P479 WeakPolarHBondContact O-CD 3.13Š| ||
| 480 | A | 45.6 | Very low | 47.7 | Very low | 83 Ų | 83 | 127.9 Ų | 127.9 | 69% | 0.686 | 73% | 0.733 | S | S | * | * | trans | 51.5 | 74.9 | 147.9 | 0 | 0 | 0 | 0 | 0 | 120.4 | E478 V482 | E478-A480 PolarHBondContact O-N 3.26Å; A480-V482 VanDerWaalsContact C-N 3.27Å; A480-V482 PolarHBondContact O-N 3.29Å | ||
| 481 | E | 40.1 | Very low | 45.6 | Very low | 201 Ų | 201 | 129.6 Ų | 129.6 | 94% | 0.939 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -84.8 | 39.9 | 159.4 | -82.4 | -160.7 | 122.5 | 0 | 0 | 113.9 | ||
| 482 | V | 44.6 | Very low | 43.6 | Very low | 146 Ų | 146 | 133.8 Ų | 133.8 | 89% | 0.885 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -143.8 | 60.8 | 168.5 | -163.5 | 0 | 0 | 0 | 0 | 111 | A480 | A480-V482 VanDerWaalsContact C-N 3.27Å; A480-V482 PolarHBondContact O-N 3.29Å |
| 483 | A | 40.5 | Very low | 41.6 | Very low | 93 Ų | 93 | 132 Ų | 132 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | -153 | 47.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 484 | G | 35.8 | Very low | 39.5 | Very low | 74 Ų | 74 | 137.4 Ų | 137.4 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | -152.3 | 30.4 | -164.2 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 485 | E | 32.9 | Very low | 37.5 | Very low | 194 Ų | 194 | 139.6 Ų | 139.6 | 91% | 0.907 | 79% | 0.788 | S | S | * | * | trans | -156.1 | 102.5 | 164.8 | -123.9 | 168.2 | -148.2 | 0 | 0 | 113.3 | ||||
| 486 | T | 33.4 | Very low | 36 | Very low | 148 Ų | 148 | 135.4 Ų | 135.4 | 91% | 0.908 | 79% | 0.791 | S | S | * | * | trans | -143.2 | 107.3 | 166.9 | 49.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 487 | G | 29.1 | Very low | 34.9 | Very low | 86 Ų | 86 | 138 Ų | 138 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | trans | -173.4 | 19.8 | -169.2 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 488 | A | 28.3 | Very low | 33.7 | Very low | 103 Ų | 103 | 135.7 Ų | 135.7 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | trans | -152.2 | 131.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 489 | N | 28.9 | Very low | 32.7 | Very low | 171 Ų | 171 | 141.5 Ų | 141.5 | 91% | 0.914 | 82% | 0.823 | S | S | * | * | trans | -97.4 | 130.5 | 174.5 | -66.3 | -41.8 | 0 | 0 | 0 | 110.7 | ||||
| 490 | A | 28.1 | Very low | 31.9 | Very low | 92 Ų | 92 | 141.6 Ų | 141.6 | 76% | 0.76 | 83% | 0.826 | S | S | * | * | trans | -167.9 | 157.8 | 149.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 491 | S | 28 | Very low | 31.1 | Very low | 110 Ų | 110 | 142.9 Ų | 142.9 | 77% | 0.769 | 83% | 0.83 | S | S | * | * | trans | 54.2 | 112.7 | 156.3 | 55.5 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 492 | L | 29.3 | Very low | 30.7 | Very low | 157 Ų | 157 | 141 Ų | 141 | 82% | 0.822 | 83% | 0.826 | S | S | * | * | trans | -47.2 | 163.2 | 144.3 | -51.2 | 84.6 | 0 | 0 | 0 | 110.1 | ||||
| 493 | N | 26.2 | Very low | 30 | Very low | 119 Ų | 119 | 139.2 Ų | 139.2 | 64% | 0.636 | 82% | 0.819 | S | S | * | * | 174.4 | 165.1 | 66 | -156.3 | -8.2 | 0 | 0 | 0 | 111.9 | |||||
| 494 | W | 26.7 | Very low | 29.5 | Very low | 201 Ų | 201 | 140.2 Ų | 140.2 | 76% | 0.761 | 82% | 0.816 | S | S | * | * | trans | 61 | 134.2 | 174.5 | -55.8 | 93.6 | 0 | 0 | 0 | 117 | ||||
| 495 | R | 27.1 | Very low | 29.3 | Very low | 227 Ų | 227 | 147.1 Ų | 147.1 | 86% | 0.857 | 82% | 0.82 | S | S | * | * | cis | 78.9 | 124.9 | 41.5 | -75.5 | -173.4 | 172 | -130.4 | 4 | 115.2 | ||||
| 496 | G | 29.5 | Very low | 29.4 | Very low | 76 Ų | 76 | 142.3 Ų | 142.3 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | trans | 122.8 | 107.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 497 | R | 31 | Very low | 29.4 | Very low | 255 Ų | 255 | 150.7 Ų | 150.7 | 96% | 0.962 | 83% | 0.829 | S | S | * | * | cis | 81.2 | 109.6 | 39.2 | -162.8 | -166.5 | -162.1 | -155.5 | 7.3 | 113.9 | ||||
| 498 | G | 28.3 | Very low | 29.4 | Very low | 75 Ų | 75 | 153.9 Ų | 153.9 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | 105.6 | 128.6 | 151.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 499 | R | 29.2 | Very low | 29.5 | Very low | 257 Ų | 257 | 156.6 Ų | 156.6 | 97% | 0.97 | 82% | 0.824 | S | S | * | * | trans | -83.4 | 135.6 | 158.3 | -77.3 | 165.8 | 115.6 | 176.2 | 1.2 | 109 | ||||
| 500 | S | 28.5 | Very low | 29.5 | Very low | 106 Ų | 106 | 155.8 Ų | 155.8 | 74% | 0.741 | 82% | 0.82 | S | S | * | * | trans | -164.3 | 135.8 | 156.1 | 49.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 501 | S | 28.3 | Very low | 29.6 | Very low | 110 Ų | 110 | 159.5 Ų | 159.5 | 77% | 0.769 | 82% | 0.823 | S | S | * | * | trans | 25.7 | 120.5 | 154.8 | 51.1 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 502 | L | 30.7 | Very low | 29.7 | Very low | 162 Ų | 162 | 162.6 Ų | 162.6 | 85% | 0.848 | 83% | 0.826 | S | S | * | * | 79.7 | 92.4 | 57.6 | -168.8 | 161.3 | 0 | 0 | 0 | 114.2 | |||||
| 503 | S | 30.1 | Very low | 29.7 | Very low | 107 Ų | 107 | 163 Ų | 163 | 75% | 0.748 | 83% | 0.827 | S | S | * | * | trans | -173.7 | 128 | 138.2 | 49.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 504 | T | 30.9 | Very low | 30 | Very low | 114 Ų | 114 | 166.1 Ų | 166.1 | 70% | 0.699 | 84% | 0.84 | S | S | * | * | 85.9 | 133.2 | 65.4 | -46.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 505 | Y | 31 | Very low | 30.2 | Very low | 219 Ų | 219 | 163.5 Ų | 163.5 | 86% | 0.859 | 85% | 0.846 | S | S | * | * | trans | 65.8 | 118 | -169.4 | -69.7 | -84.2 | 0 | 0 | 0 | 114.5 | ||||
| 506 | A | 34.8 | Very low | 30.5 | Very low | 93 Ų | 93 | 158.2 Ų | 158.2 | 77% | 0.769 | 85% | 0.845 | S | S | * | * | cis | 81.4 | 106.6 | 23.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 507 | R | 33.5 | Very low | 30.6 | Very low | 324 Ų | 324 | 165.6 Ų | 165.6 | 100% | 1.223 | 85% | 0.851 | S | S | * | * | trans | -143 | 0 | 134.3 | -134.9 | 179.9 | -159.5 | 175.9 | 7 | 109.3 |
Retrieved 507 of 507 residues in 106.4 ms
(Link to these results)