| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 30.3 | Very low | 32.4 | Very low | 242 Ų | 242 | 152.5 Ų | 152.5 | 100% | 1.192 | 85% | 0.851 | S | S | * | * | 0 | 95.1 | 0 | -163.2 | 177.5 | -167.7 | 0 | 0 | 107.4 | |||||
| 2 | M | 32 | Very low | 32.1 | Very low | 190 Ų | 190 | 152.8 Ų | 152.8 | 94% | 0.936 | 85% | 0.846 | S | S | * | * | trans | -144.4 | 120 | 172.8 | -141.2 | 174.1 | -173.7 | 0 | 0 | 107.7 | ||||
| 3 | V | 32.7 | Very low | 31.4 | Very low | 135 Ų | 135 | 157.8 Ų | 157.8 | 82% | 0.818 | 86% | 0.855 | S | S | * | * | trans | -77.4 | 122.4 | -160.3 | 174 | 0 | 0 | 0 | 0 | 110.2 | S5 | V3-S5 PolarHBondContact O-N 3.32Š| ||
| 4 | T | 40.6 | Very low | 31.1 | Very low | 136 Ų | 136 | 151.7 Ų | 151.7 | 83% | 0.834 | 85% | 0.848 | S | S | * | * | trans | -76.9 | 100.5 | 172.6 | 53.9 | 0 | 0 | 0 | 0 | 109.2 | S6 | T4-S6 PolarHBondContact O-N 3.08Š| ||
| 5 | S | 34.6 | Very low | 30.9 | Very low | 97 Ų | 97 | 147.7 Ų | 147.7 | 68% | 0.678 | 84% | 0.842 | S | S | * | * | trans | -81.3 | 105 | 171.6 | -177.4 | 0 | 0 | 0 | 0 | 109.2 | V3 | V3-S5 PolarHBondContact O-N 3.32Š| ||
| 6 | S | 38 | Very low | 31.2 | Very low | 105 Ų | 105 | 146.4 Ų | 146.4 | 73% | 0.734 | 84% | 0.84 | S | S | * | * | trans | -64.9 | 134 | 163.9 | 67.3 | 0 | 0 | 0 | 0 | 108.9 | T4 | T4-S6 PolarHBondContact O-N 3.08Š| ||
| 7 | R | 35.3 | Very low | 31.1 | Very low | 229 Ų | 229 | 144.2 Ų | 144.2 | 86% | 0.864 | 83% | 0.83 | S | S | * | * | trans | -115 | 119.3 | 166.6 | -77.1 | -171.4 | -179.4 | -175.6 | 1.2 | 108.1 | ||||
| 8 | N | 33.1 | Very low | 31 | Very low | 155 Ų | 155 | 145.1 Ų | 145.1 | 83% | 0.829 | 83% | 0.83 | S | S | * | * | trans | -49.9 | 131.1 | -178.3 | -76 | -13.4 | 0 | 0 | 0 | 112.9 | ||||
| 9 | T | 29.1 | Very low | 30.8 | Very low | 142 Ų | 142 | 144.4 Ų | 144.4 | 87% | 0.871 | 82% | 0.823 | S | S | * | * | trans | -72.1 | 114 | 165.1 | 47 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 10 | M | 27.1 | Very low | 30.7 | Very low | 175 Ų | 175 | 143.2 Ų | 143.2 | 86% | 0.862 | 82% | 0.819 | S | S | * | * | trans | -101.1 | 102.7 | 166.3 | -160 | 115.4 | 111.2 | 0 | 0 | 107.9 | ||||
| 11 | G | 24.1 | Very low | 30.5 | Very low | 72 Ų | 72 | 142.1 Ų | 142.1 | 74% | 0.742 | 82% | 0.817 | S | S | * | * | trans | -73 | 122.4 | 175 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 12 | I | 28.7 | Very low | 30.3 | Very low | 155 Ų | 155 | 139.8 Ų | 139.8 | 80% | 0.795 | 80% | 0.8 | S | S | * | * | trans | -118.7 | 105.3 | 168.5 | -62.3 | 176 | 0 | 0 | 0 | 106.5 | ||||
| 13 | F | 23.1 | Very low | 30.3 | Very low | 218 Ų | 218 | 134.5 Ų | 134.5 | 96% | 0.956 | 79% | 0.786 | S | S | * | * | trans | -70.7 | 119.7 | 167.3 | -86.3 | -93.6 | 0 | 0 | 0 | 108.7 | ||||
| 14 | G | 27 | Very low | 30 | Very low | 73 Ų | 73 | 134 Ų | 134 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -161.5 | 125.1 | 175 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 15 | A | 27.9 | Very low | 29.6 | Very low | 92 Ų | 92 | 133.9 Ų | 133.9 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | trans | -60.3 | 165.2 | -164.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | T17 | A15-T17 PolarHBondContact O-N 3.39Š| ||
| 16 | P | 36 | Very low | 29.3 | Very low | 126 Ų | 126 | 133.5 Ų | 133.5 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -85.2 | 109.1 | -157.3 | 33.7 | -30.3 | 0 | 0 | 0 | 111.4 | ||||
| 17 | T | 29.6 | Very low | 28.8 | Very low | 109 Ų | 109 | 134.4 Ų | 134.4 | 67% | 0.669 | 78% | 0.777 | S | S | * | * | trans | -91.9 | 118.5 | 158.4 | 56 | 0 | 0 | 0 | 0 | 108.5 | A15 N19 | A15-T17 PolarHBondContact O-N 3.39Å; T17-N19 VanDerWaalsContact C-N 3.31Å; T17-N19 PolarHBondContact O-N 3.41Å; T17-N19 PolarHBondContact OG1-ND2 3.38Å | ||
| 18 | I | 29.2 | Very low | 28.8 | Very low | 160 Ų | 160 | 129.9 Ų | 129.9 | 82% | 0.821 | 77% | 0.774 | S | S | * | * | trans | -51.9 | 91.3 | 172.2 | -61.6 | 164.1 | 0 | 0 | 0 | 108.8 | V20 | I18-V20 HydrophobicContact CG2-CG2 4.48Š| ||
| 19 | N | 26.3 | Very low | 28.4 | Very low | 133 Ų | 133 | 132.1 Ų | 132.1 | 71% | 0.711 | 78% | 0.777 | S | S | * | * | trans | -109.1 | 91.4 | 172.2 | -80.9 | -37.5 | 0 | 0 | 0 | 107.3 | T17 | T17-N19 VanDerWaalsContact C-N 3.31Å; T17-N19 PolarHBondContact O-N 3.41Å; T17-N19 PolarHBondContact OG1-ND2 3.38Å | ||
| 20 | V | 29.3 | Very low | 28.5 | Very low | 120 Ų | 120 | 130.5 Ų | 130.5 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | -54.8 | 121.9 | 165 | 178.7 | 0 | 0 | 0 | 0 | 107.1 | I18 K22 | I18-V20 HydrophobicContact CG2-CG2 4.48Å; V20-K22 PolarHBondContact O-N 2.85Å | ||
| 21 | P | 27 | Very low | 28.7 | Very low | 120 Ų | 120 | 128 Ų | 128 | 78% | 0.779 | 77% | 0.768 | S | S | * | * | trans | -67.9 | 109 | -173.4 | 25.5 | -31.3 | 0 | 0 | 0 | 109 | A23 | P21-A23 PolarHBondContact O-N 3.46Š| ||
| 22 | K | 26.4 | Very low | 28.9 | Very low | 193 Ų | 193 | 134.5 Ų | 134.5 | 84% | 0.839 | 78% | 0.776 | S | S | * | * | trans | -64 | 104.1 | 166.7 | -77.5 | 176.3 | 178.1 | 171.8 | 0 | 107.4 | V20 V24 | V20-K22 PolarHBondContact O-N 2.85Å; K22-V24 PolarHBondContact O-N 3.12Å | ||
| 23 | A | 30.3 | Very low | 29 | Very low | 79 Ų | 79 | 137.2 Ų | 137.2 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | -59.7 | 106.3 | 164.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | P21 I25 | P21-A23 PolarHBondContact O-N 3.46Å; A23-I25 PolarHBondContact O-N 2.78Å | ||
| 24 | V | 27.9 | Very low | 29.3 | Very low | 126 Ų | 126 | 130.4 Ų | 130.4 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | trans | -71.8 | 94.8 | 177.5 | 177.6 | 0 | 0 | 0 | 0 | 107.3 | K22 S26 | K22-V24 PolarHBondContact O-N 3.12Å; V24-S26 PolarHBondContact O-N 2.85Å; V24-S26 VanDerWaalsContact O-N 3.14Å | ||
| 25 | I | 31.7 | Very low | 29.2 | Very low | 133 Ų | 133 | 138.3 Ų | 138.3 | 68% | 0.682 | 78% | 0.781 | S | S | * | * | trans | -74.3 | 98.9 | 168.4 | -58.3 | 173.4 | 0 | 0 | 0 | 106.4 | A23 | A23-I25 PolarHBondContact O-N 2.78Š| ||
| 26 | S | 27.7 | Very low | 29.3 | Very low | 88 Ų | 88 | 145.9 Ų | 145.9 | 62% | 0.615 | 79% | 0.79 | S | S | * | * | trans | -62.1 | 124.8 | 175.2 | -47.9 | 0 | 0 | 0 | 0 | 110.1 | V24 V28 | V24-S26 PolarHBondContact O-N 2.85Å; V24-S26 VanDerWaalsContact O-N 3.14Å; S26-V28 PolarHBondContact O-N 3.38Å | ||
| 27 | P | 28.7 | Very low | 28.8 | Very low | 124 Ų | 124 | 147.5 Ų | 147.5 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -72.1 | 113.6 | 178.2 | 26.7 | -31 | 0 | 0 | 0 | 110.2 | K29 | P27-K29 PolarHBondContact O-N 2.95Š| ||
| 28 | V | 34.2 | Very low | 28.7 | Very low | 134 Ų | 134 | 152.2 Ų | 152.2 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | trans | -72.8 | 115 | 172.7 | 176.7 | 0 | 0 | 0 | 0 | 108.6 | S26 S30 | S26-V28 PolarHBondContact O-N 3.38Å; V28-S30 PolarHBondContact O-N 3.45Å; V28-S30 VanDerWaalsContact O-N 3.17Å | ||
| 29 | K | 25.8 | Very low | 28.6 | Very low | 202 Ų | 202 | 154.5 Ų | 154.5 | 88% | 0.878 | 81% | 0.806 | S | S | * | * | trans | -65.5 | 111 | 172.7 | -76.1 | -179.3 | 177 | 176 | 0 | 109.5 | P27 | P27-K29 PolarHBondContact O-N 2.95Š| ||
| 30 | S | 30.5 | Very low | 28.4 | Very low | 108 Ų | 108 | 157.8 Ų | 157.8 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 128.9 | 176.4 | 49.5 | 0 | 0 | 0 | 0 | 111.6 | V28 | V28-S30 PolarHBondContact O-N 3.45Å; V28-S30 VanDerWaalsContact O-N 3.17Å |
| 31 | P | 31.7 | Very low | 28.2 | Very low | 123 Ų | 123 | 160.5 Ų | 160.5 | 80% | 0.799 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 127 | 174 | 28.8 | -29 | 0 | 0 | 0 | 110.6 | K33 | P31-K33 PolarHBondContact O-N 3Š|
| 32 | K | 27.2 | Very low | 27.9 | Very low | 209 Ų | 209 | 160.9 Ų | 160.9 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 118.5 | 174.9 | -64.6 | 174.9 | 178.5 | 175.6 | 0 | 110.6 | ||
| 33 | K | 32.1 | Very low | 28 | Very low | 211 Ų | 211 | 157.9 Ų | 157.9 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | trans | -148.9 | 112.4 | 160.6 | -109.3 | 174.5 | -176.1 | 178.1 | 0 | 113.1 | P31 | P31-K33 PolarHBondContact O-N 3Š| ||
| 34 | G | 28.4 | Very low | 27.7 | Very low | 76 Ų | 76 | 159.3 Ų | 159.3 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | trans | 65.9 | 86.3 | 133.2 | 0 | 0 | 0 | 0 | 0 | 119.8 | R36 | G34-R36 PolarHBondContact O-N 3.34Š| ||
| 35 | R | 26.2 | Very low | 27.4 | Very low | 238 Ų | 238 | 162.1 Ų | 162.1 | 90% | 0.898 | 82% | 0.817 | S | S | * | * | trans | -48.5 | 122.5 | 159.4 | -115.4 | 175.3 | 176.2 | 172.7 | -2 | 111.2 | ||||
| 36 | R | 29.4 | Very low | 27.1 | Very low | 252 Ų | 252 | 162.1 Ų | 162.1 | 95% | 0.951 | 82% | 0.823 | S | S | * | * | trans | -115.2 | 104.5 | 154.9 | -93 | -174.1 | 170.8 | -170.8 | -1.7 | 109.2 | G34 | G34-R36 PolarHBondContact O-N 3.34Š| ||
| 37 | L | 24.5 | Very low | 26.8 | Very low | 159 Ų | 159 | 165 Ų | 165 | 83% | 0.832 | 83% | 0.831 | S | S | * | * | trans | -71.2 | 123.3 | 173.4 | -146.6 | 81.2 | 0 | 0 | 0 | 108.2 | ||||
| 38 | K | 29.2 | Very low | 26.7 | Very low | 208 Ų | 208 | 164.9 Ų | 164.9 | 90% | 0.904 | 83% | 0.833 | S | S | * | * | trans | -131 | 130.4 | 162.5 | -152.4 | 172.3 | -177.6 | -178.4 | 0 | 110.3 | ||||
| 39 | K | 26.7 | Very low | 26.1 | Very low | 208 Ų | 208 | 166.9 Ų | 166.9 | 90% | 0.904 | 83% | 0.834 | S | S | * | * | trans | -68.1 | 142.8 | -159 | -128 | 171.6 | 177.3 | 179.7 | 0 | 113.1 | ||||
| 40 | R | 20.9 | Very low | 26.1 | Very low | 202 Ų | 202 | 163 Ų | 163 | 76% | 0.762 | 83% | 0.832 | S | S | * | * | trans | -60.3 | 138.2 | 170.7 | -164.8 | -177.3 | -165.9 | -178 | 3.3 | 110.9 | E42 | R40-E42 WeakPolarHBondContact CD-OE1 3.46Å; R40-E42 HydrophobicContact CG-CG 3.89Å; R40-E42 IonicContact CZ-OE1 3.23Å; R40-E42 IonicContact NE-OE1 2.96Å; R40-E42 PolarHBondContact NE-OE1 2.93Å; R40-E42 VanDerWaalsContact NE-OE1 3.09Å; R40-E42 IonicContact NH1-OE1 2.69Å; R40-E42 PolarHBondContact NH1-OE1 3.34Å; R40-E42 IonicContact NH2-OE1 2.69Å; R40-E42 PolarHBondContact NH2-OE1 3.36Å | ||
| 41 | L | 26.2 | Very low | 25.7 | Very low | 177 Ų | 177 | 166.3 Ų | 166.3 | 93% | 0.927 | 84% | 0.835 | S | S | * | * | trans | -114.4 | 117.4 | 157.7 | -134.9 | 90 | 0 | 0 | 0 | 106.4 | ||||
| 42 | E | 21 | Very low | 25.4 | Very low | 129 Ų | 129 | 169.4 Ų | 169.4 | 60% | 0.603 | 84% | 0.839 | S | S | * | * | trans | -101.6 | 136.2 | 173.9 | -64.5 | 171.8 | 162.6 | 0 | 0 | 107.8 | R40 | R40-E42 WeakPolarHBondContact CD-OE1 3.46Å; R40-E42 HydrophobicContact CG-CG 3.89Å; R40-E42 IonicContact CZ-OE1 3.23Å; R40-E42 IonicContact NE-OE1 2.96Å; R40-E42 PolarHBondContact NE-OE1 2.93Å; R40-E42 VanDerWaalsContact NE-OE1 3.09Å; R40-E42 IonicContact NH1-OE1 2.69Å; R40-E42 PolarHBondContact NH1-OE1 3.34Å; R40-E42 IonicContact NH2-OE1 2.69Å; R40-E42 PolarHBondContact NH2-OE1 3.36Å | ||
| 43 | V | 27.6 | Very low | 25.1 | Very low | 130 Ų | 130 | 168.1 Ų | 168.1 | 79% | 0.788 | 84% | 0.836 | S | S | * | * | trans | -168.7 | 90.2 | 154.3 | 173.8 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 44 | S | 25.1 | Very low | 24.7 | Very low | 108 Ų | 108 | 165.5 Ų | 165.5 | 76% | 0.755 | 83% | 0.831 | S | S | * | * | 94.1 | 117 | 79.9 | 67 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 45 | E | 20.6 | Very low | 24.3 | Very low | 186 Ų | 186 | 167.3 Ų | 167.3 | 87% | 0.869 | 83% | 0.827 | S | S | * | * | trans | -69.3 | 149.9 | -179 | -61.5 | 157.8 | 152.4 | 0 | 0 | 112.4 | ||||
| 46 | T | 25 | Very low | 24.2 | Very low | 132 Ų | 132 | 161.8 Ų | 161.8 | 81% | 0.81 | 82% | 0.821 | S | S | * | * | trans | -147.3 | 105.5 | 149.5 | 52.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 47 | N | 21.5 | Very low | 23.7 | Very low | 149 Ų | 149 | 155 Ų | 155 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | trans | 31.1 | 132.1 | 136 | -63 | -8 | 0 | 0 | 0 | 119.8 | ||||
| 48 | S | 27.4 | Very low | 23.7 | Very low | 121 Ų | 121 | 151 Ų | 151 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | -177.1 | 137 | 94.5 | -70.5 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 49 | E | 20.8 | Very low | 23.3 | Very low | 177 Ų | 177 | 149.6 Ų | 149.6 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | -69 | 147.1 | -177.5 | -61.7 | 158.4 | 139.8 | 0 | 0 | 112.9 | ||||
| 50 | S | 25.6 | Very low | 23.2 | Very low | 119 Ų | 119 | 147.6 Ų | 147.6 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | trans | -157.2 | 96.8 | 139 | 48 | 0 | 0 | 0 | 0 | 109.3 | Q52 | S50-Q52 PolarHBondContact O-N 3.3Š| ||
| 51 | H | 23.2 | Very low | 23.2 | Very low | 179 Ų | 179 | 146 Ų | 146 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | trans | -74.1 | 113.6 | 171 | -80.2 | -83 | 0 | 0 | 0 | 109.3 | ||||
| 52 | Q | 24.3 | Very low | 22.8 | Very low | 187 Ų | 187 | 144 Ų | 144 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | trans | -114.2 | 114.7 | 156 | -81.9 | -173.4 | -7.2 | 0 | 0 | 109.2 | S50 I54 | S50-Q52 PolarHBondContact O-N 3.3Å; Q52-I54 PolarHBondContact O-N 2.96Å | ||
| 53 | Q | 21.6 | Very low | 23.1 | Very low | 183 Ų | 183 | 145.8 Ų | 145.8 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -82.7 | 106.8 | -173.6 | -174.4 | 174.9 | -10.7 | 0 | 0 | 108.7 | ||||
| 54 | I | 22.9 | Very low | 22.9 | Very low | 156 Ų | 156 | 148.2 Ų | 148.2 | 80% | 0.8 | 79% | 0.785 | S | S | * | * | trans | -107.3 | 107.6 | 166.5 | -59.3 | 176.6 | 0 | 0 | 0 | 106.8 | Q52 P56 | Q52-I54 PolarHBondContact O-N 2.96Å; I54-P56 WeakPolarHBondContact O-CD 3.46Å | ||
| 55 | T | 20.8 | Very low | 22.8 | Very low | 113 Ų | 113 | 149 Ų | 149 | 69% | 0.693 | 78% | 0.781 | S | S | * | * | trans | -65 | 121.8 | 172.2 | 34 | 0 | 0 | 0 | 0 | 110.6 | S57 | T55-S57 PolarHBondContact O-N 2.93Š| ||
| 56 | P | 24.4 | Very low | 23 | Very low | 122 Ų | 122 | 147.8 Ų | 147.8 | 79% | 0.792 | 78% | 0.78 | S | S | * | * | trans | -82.1 | 117 | 171.6 | 30.6 | -28.1 | 0 | 0 | 0 | 109.6 | I54 | I54-P56 WeakPolarHBondContact O-CD 3.46Š| ||
| 57 | S | 19.2 | Very low | 23.1 | Very low | 110 Ų | 110 | 147.4 Ų | 147.4 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | trans | -87.9 | 103.7 | 167.3 | 151.4 | 0 | 0 | 0 | 0 | 108.2 | T55 | T55-S57 PolarHBondContact O-N 2.93Š| ||
| 58 | S | 24 | Very low | 23.3 | Very low | 75 Ų | 75 | 147.5 Ų | 147.5 | 52% | 0.524 | 77% | 0.773 | S | S | . | * | trans | -134.1 | 104.9 | 160.1 | 57.1 | 0 | 0 | 0 | 0 | 110.2 | Y60 | S58-Y60 PolarHBondContact O-N 3.33Å; S58-Y60 VanDerWaalsContact O-N 3.13Å | ||
| 59 | H | 20.3 | Very low | 23.3 | Very low | 178 Ų | 178 | 147.4 Ų | 147.4 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | -68.6 | 98.4 | 172.3 | -88.1 | -85.1 | 0 | 0 | 0 | 109.5 | K61 | H59-K61 PolarHBondContact O-N 3.46Š| ||
| 60 | Y | 23.7 | Very low | 23.7 | Very low | 166 Ų | 166 | 142.2 Ų | 142.2 | 65% | 0.651 | 76% | 0.764 | S | S | * | * | trans | -79.2 | 104.6 | 165.4 | -74.2 | -80.1 | 0 | 0 | 0 | 109.4 | S58 | S58-Y60 PolarHBondContact O-N 3.33Å; S58-Y60 VanDerWaalsContact O-N 3.13Å | ||
| 61 | K | 21.4 | Very low | 23.9 | Very low | 168 Ų | 168 | 143.7 Ų | 143.7 | 73% | 0.73 | 76% | 0.758 | S | S | * | * | trans | -81.2 | 113.4 | 164.2 | -81.8 | -177.1 | 177 | 177.7 | 0 | 108.8 | H59 F63 | H59-K61 PolarHBondContact O-N 3.46Å; K61-F63 HydrophobicContact CB-CD2 4.21Å; K61-F63 HydrophobicContact CB-CE2 3.79Å; K61-F63 WeakPolarHBondContact O-CD2 3.32Å; K61-F63 PolarHBondContact O-N 3.16Å | ||
| 62 | T | 19.3 | Very low | 24.1 | Very low | 137 Ų | 137 | 139.7 Ų | 139.7 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -60.5 | 116.1 | 166.8 | -43.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 63 | F | 26.3 | Very low | 24.5 | Very low | 166 Ų | 166 | 134.4 Ų | 134.4 | 73% | 0.728 | 73% | 0.726 | S | S | * | * | trans | -105.2 | 119.2 | 173.6 | -83.6 | -82.5 | 0 | 0 | 0 | 110 | K61 | K61-F63 HydrophobicContact CB-CD2 4.21Å; K61-F63 HydrophobicContact CB-CE2 3.79Å; K61-F63 WeakPolarHBondContact O-CD2 3.32Å; K61-F63 PolarHBondContact O-N 3.16Å | ||
| 64 | E | 22.4 | Very low | 24.9 | Very low | 181 Ų | 181 | 130.4 Ų | 130.4 | 85% | 0.846 | 72% | 0.718 | S | S | * | * | trans | -69.5 | 142.3 | 170.3 | -80.4 | 175.2 | 136.2 | 0 | 0 | 110.8 | D66 | E64-D66 PolarHBondContact O-N 3.26Š| ||
| 65 | N | 24.5 | Very low | 25.3 | Very low | 124 Ų | 124 | 130.3 Ų | 130.3 | 66% | 0.663 | 72% | 0.719 | S | S | * | * | trans | -79.7 | 91.8 | -176.3 | -70.8 | -31 | 0 | 0 | 0 | 111 | ||||
| 66 | D | 24.2 | Very low | 25.6 | Very low | 160 Ų | 160 | 133.8 Ų | 133.8 | 86% | 0.856 | 73% | 0.727 | S | S | * | * | trans | -100.8 | 75 | 162.6 | -77.6 | -26.6 | 0 | 0 | 0 | 109.9 | E64 N68 | E64-D66 PolarHBondContact O-N 3.26Å; D66-N68 PolarHBondContact O-N 3.47Å | ||
| 67 | L | 27.6 | Very low | 26 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 65% | 0.649 | 73% | 0.725 | S | S | * | * | trans | -82.6 | 98.4 | 171.8 | -87.5 | 143.7 | 0 | 0 | 0 | 109.1 | F103 | L67-F103 HydrophobicContact CD2-CE1 4.3Š| ||
| 68 | N | 25.4 | Very low | 26.4 | Very low | 151 Ų | 151 | 132.9 Ų | 132.9 | 81% | 0.807 | 73% | 0.729 | S | S | * | * | trans | -81.7 | 118.5 | 174.3 | -148.7 | -8.1 | 0 | 0 | 0 | 109.7 | D66 G70 | D66-N68 PolarHBondContact O-N 3.47Å; N68-G70 PolarHBondContact O-N 3.33Å | ||
| 69 | P | 27.8 | Very low | 26.6 | Very low | 119 Ų | 119 | 133 Ų | 133 | 77% | 0.773 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | 87.4 | -176.3 | 31.8 | -32.1 | 0 | 0 | 0 | 110 | ||
| 70 | G | 29.4 | Very low | 27.3 | Very low | 69 Ų | 69 | 130.6 Ų | 130.6 | 71% | 0.711 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -157.5 | -7.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | N68 C72 | N68-G70 PolarHBondContact O-N 3.33Å; G70-C72 PolarHBondContact O-N 3.45Å |
| 71 | Q | 28.9 | Very low | 27.4 | Very low | 149 Ų | 149 | 132 Ų | 132 | 70% | 0.696 | 74% | 0.736 | S | S | * | * | trans | -83.8 | 83.7 | 177.6 | -74.3 | -179.3 | -4.6 | 0 | 0 | 110.4 | ||||
| 72 | C | 28.5 | Very low | 27.8 | Very low | 96 Ų | 96 | 131.6 Ų | 131.6 | 65% | 0.649 | 74% | 0.74 | S | S | * | * | trans | -72.8 | 132.6 | 163.2 | -123.2 | 0 | 0 | 0 | 0 | 108.4 | G70 S74 | G70-C72 PolarHBondContact O-N 3.45Å; C72-S74 PolarHBondContact O-N 3.4Å | ||
| 73 | L | 32.5 | Very low | 28.4 | Very low | 75 Ų | 75 | 130.2 Ų | 130.2 | 39% | 0.393 | 73% | 0.733 | S | S | . | * | trans | -56.9 | 100.1 | 172.5 | -73 | 162.5 | 0 | 0 | 0 | 109.1 | L75 F255 N333 I337 | L73-L75 PolarHBondContact O-N 2.8Å; L73-F255 HydrophobicContact CD1-CD1 4.01Å; L73-F255 HydrophobicContact CD1-CE1 4.01Å; L73-N333 HydrophobicContact CD2-CB 3.74Å; L73-I337 HydrophobicContact CD1-CD1 4.5Å; L73-I337 HydrophobicContact CD2-CD1 3.99Å; L73-I337 HydrophobicContact CG-CD1 4.18Å | ||
| 74 | S | 28.7 | Very low | 28.7 | Very low | 99 Ų | 99 | 128 Ų | 128 | 69% | 0.692 | 73% | 0.733 | S | S | * | * | trans | -74 | 96.4 | 168.7 | 59.2 | 0 | 0 | 0 | 0 | 107.5 | C72 Q76 | C72-S74 PolarHBondContact O-N 3.4Å; S74-Q76 VanDerWaalsContact C-N 3.27Å; S74-Q76 PolarHBondContact O-N 2.98Å | ||
| 75 | L | 32.3 | Very low | 29.6 | Very low | 155 Ų | 155 | 127.4 Ų | 127.4 | 81% | 0.812 | 73% | 0.73 | S | S | * | * | trans | -56.4 | 95.8 | 162.1 | -85.4 | 137.7 | 0 | 0 | 0 | 107.6 | L73 A77 | L73-L75 PolarHBondContact O-N 2.8Å; L75-A77 VanDerWaalsContact C-N 3.27Å; L75-A77 PolarHBondContact O-N 2.85Å | ||
| 76 | Q | 27.8 | Very low | 30.3 | Very low | 185 Ų | 185 | 130 Ų | 130 | 86% | 0.864 | 74% | 0.736 | S | S | * | * | trans | -75.6 | 87.6 | 179.6 | -150.3 | 173.2 | -20.4 | 0 | 0 | 107.3 | S74 S78 | S74-Q76 VanDerWaalsContact C-N 3.27Å; S74-Q76 PolarHBondContact O-N 2.98Å; Q76-S78 PolarHBondContact O-N 3.02Å; Q76-S78 VanDerWaalsContact O-N 3.12Å | ||
| 77 | A | 32.4 | Very low | 31.8 | Very low | 90 Ų | 90 | 126.1 Ų | 126.1 | 74% | 0.744 | 72% | 0.72 | S | S | * | * | trans | -68.1 | 104.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | L75 S79 | L75-A77 VanDerWaalsContact C-N 3.27Å; L75-A77 PolarHBondContact O-N 2.85Å; A77-S79 PolarHBondContact O-N 2.61Å; A77-S79 VanDerWaalsContact O-N 3.16Å | ||
| 78 | S | 27.4 | Very low | 33.7 | Very low | 123 Ų | 123 | 124 Ų | 124 | 86% | 0.86 | 72% | 0.715 | S | S | * | * | trans | -76.4 | 81.9 | 164.2 | 41.5 | 0 | 0 | 0 | 0 | 110 | Q76 | Q76-S78 PolarHBondContact O-N 3.02Å; Q76-S78 VanDerWaalsContact O-N 3.12Å | ||
| 79 | S | 27.4 | Very low | 36 | Very low | 78 Ų | 78 | 123.9 Ų | 123.9 | 55% | 0.545 | 71% | 0.713 | S | S | . | * | S | Bend | trans | 176.9 | 133.8 | 149.2 | -172.1 | 0 | 0 | 0 | 0 | 110 | A77 Y81 | A77-S79 PolarHBondContact O-N 2.61Å; A77-S79 VanDerWaalsContact O-N 3.16Å; S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 2.84Å |
| 80 | P | 34.8 | Very low | 38 | Very low | 127 Ų | 127 | 125.5 Ų | 125.5 | 83% | 0.825 | 70% | 0.704 | S | S | * | * | trans | -82.7 | 75.6 | -178.9 | 35.5 | -32.5 | 0 | 0 | 0 | 110.3 | ||||
| 81 | Y | 27.1 | Very low | 40.2 | Very low | 196 Ų | 196 | 123.1 Ų | 123.1 | 77% | 0.769 | 68% | 0.676 | S | S | * | * | trans | -121 | 108.9 | 155 | -82.5 | -82 | 0 | 0 | 0 | 106.2 | S79 P83 | S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 2.84Å; Y81-P83 WeakPolarHBondContact O-CD 3.1Å; Y81-P83 WeakPolarHBondContact O-CG 3.22Å; Y81-P83 VanDerWaalsContact O-N 3.08Å | ||
| 82 | I | 29.2 | Very low | 42.7 | Very low | 160 Ų | 160 | 120.2 Ų | 120.2 | 82% | 0.821 | 66% | 0.662 | S | S | * | * | trans | -48.9 | 110.5 | 177.5 | -59.1 | 163.1 | 0 | 0 | 0 | 109.1 | T84 | I82-T84 HydrophobicContact CG2-CG2 4.14Š| ||
| 83 | P | 32.9 | Very low | 45.2 | Very low | 107 Ų | 107 | 118.4 Ų | 118.4 | 70% | 0.695 | 65% | 0.654 | S | S | * | * | trans | -114.8 | 92.1 | 166.3 | 20.7 | 4.4 | 0 | 0 | 0 | 106 | Y81 H85 | Y81-P83 WeakPolarHBondContact O-CD 3.1Å; Y81-P83 WeakPolarHBondContact O-CG 3.22Å; Y81-P83 VanDerWaalsContact O-N 3.08Å; P83-H85 PolarHBondContact O-N 3.21Å | ||
| 84 | T | 31.6 | Very low | 47.5 | Very low | 119 Ų | 119 | 115.9 Ų | 115.9 | 73% | 0.73 | 64% | 0.64 | S | S | * | * | trans | -69.3 | 51.6 | 160.9 | 45.2 | 0 | 0 | 0 | 0 | 109.7 | I82 F86 | I82-T84 HydrophobicContact CG2-CG2 4.14Å; T84-F86 PolarHBondContact O-N 3.39Å | ||
| 85 | H | 41.8 | Very low | 50.1 | Low | 169 Ų | 169 | 114.7 Ų | 114.7 | 78% | 0.782 | 62% | 0.621 | S | S | * | * | trans | -92.8 | 88.8 | 167.1 | -125.6 | -68.6 | 0 | 0 | 0 | 106 | P83 P87 | P83-H85 PolarHBondContact O-N 3.21Å; H85-P87 VanDerWaalsContact O-N 3.14Å | ||
| 86 | F | 39.7 | Very low | 52.7 | Low | 178 Ų | 178 | 113 Ų | 113 | 78% | 0.781 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 124.9 | 160.5 | -76.2 | -86.8 | 0 | 0 | 0 | 106.8 | T84 S88 | T84-F86 PolarHBondContact O-N 3.39Å; F86-S88 PolarHBondContact O-N 3.3Å; F86-S88 VanDerWaalsContact O-N 3.11Å |
| 87 | P | 55.2 | Low | 55.5 | Low | 80 Ų | 80 | 106.1 Ų | 106.1 | 52% | 0.519 | 58% | 0.579 | S | S | . | * | P | Polyproline II helix | trans | -54.5 | 127.2 | 176.3 | 19.9 | -29.1 | 0 | 0 | 0 | 107.2 | H85 I89 C91 | H85-P87 VanDerWaalsContact O-N 3.14Å; P87-I89 PolarHBondContact O-N 3.4Å; P87-C91 HydrophobicContact CB-CB 4.34Å |
| 88 | S | 67.4 | Low | 58.1 | Low | 79 Ų | 79 | 101.9 Ų | 101.9 | 55% | 0.552 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -48.2 | 140.5 | 178.4 | 177.6 | 0 | 0 | 0 | 0 | 109 | F86 R90 C91 Q92 | F86-S88 PolarHBondContact O-N 3.3Å; F86-S88 VanDerWaalsContact O-N 3.11Å; S88-R90 CarbonylContact O-C 3.59Å; S88-R90 PolarHBondContact O-N 3.12Å; S88-C91 WeakPolarHBondContact O-CA 3.28Å; S88-C91 WeakPolarHBondContact O-CB 3.17Å; S88-C91 PolarHBondContact O-N 2.85Å; S88-Q92 PolarHBondContact O-N 3.3Å |
| 89 | I | 72.9 | Confident | 61.1 | Low | 148 Ų | 148 | 98.5 Ų | 98.5 | 76% | 0.759 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -47.2 | -35 | -178.8 | -65.3 | 167.5 | 0 | 0 | 0 | 111.5 | P87 Q92 A93 | P87-I89 PolarHBondContact O-N 3.4Å; I89-Q92 PolarHBondContact O-N 2.92Å; I89-A93 WeakPolarHBondContact O-CB 2.83Å; I89-A93 PolarHBondContact O-N 3.17Å |
| 90 | R | 70.7 | Confident | 64.1 | Low | 154 Ų | 154 | 101.8 Ų | 101.8 | 58% | 0.581 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65 | -40.3 | 176 | -165.5 | -171.1 | -110.8 | -169.7 | -8.3 | 113.4 | S88 F94 F259 | S88-R90 CarbonylContact O-C 3.59Å; S88-R90 PolarHBondContact O-N 3.12Å; R90-F94 WeakPolarHBondContact O-CB 3.44Å; R90-F94 PolarHBondContact O-N 2.91Å; R90-F259 HydrophobicContact CB-CZ 4.16Å; R90-F259 HydrophobicContact CG-CZ 3.8Å |
| 91 | C | 75.5 | Confident | 66.8 | Low | 19 Ų | 19 | 98.9 Ų | 98.9 | 13% | 0.128 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -65.5 | -45.1 | 177.5 | -171.9 | 0 | 0 | 0 | 0 | 110.6 | P87 S88 F94 Y95 F259 | P87-C91 HydrophobicContact CB-CB 4.34Å; S88-C91 WeakPolarHBondContact O-CA 3.28Å; S88-C91 WeakPolarHBondContact O-CB 3.17Å; S88-C91 PolarHBondContact O-N 2.85Å; C91-F94 WeakPolarHBondContact O-CB 3.3Å; C91-F94 PolarHBondContact O-N 3.28Å; C91-Y95 VanDerWaalsContact O-CD2 3.22Å; C91-Y95 WeakPolarHBondContact O-CD2 3.22Å; C91-Y95 PolarHBondContact O-N 3.38Å; C91-Y95 VanDerWaalsContact O-N 3.07Å; C91-Y95 VanDerWaalsContact SG-CE2 3.5Å; C91-F259 HydrophobicContact CB-CD1 4.02Å; C91-F259 HydrophobicContact CB-CD2 4.49Å; C91-F259 HydrophobicContact CB-CE1 4.04Å; C91-F259 HydrophobicContact CB-CG 4.25Å; C91-F259 HydrophobicContact CB-CZ 4.29Å |
| 92 | Q | 80.4 | Confident | 70 | Confident | 88 Ų | 88 | 89.6 Ų | 89.6 | 41% | 0.411 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64 | -45 | 176.5 | -175.4 | 174.3 | 10.5 | 0 | 0 | 111.9 | S88 I89 F94 Y95 Y96 | S88-Q92 PolarHBondContact O-N 3.3Å; I89-Q92 PolarHBondContact O-N 2.92Å; Q92-F94 VanDerWaalsContact C-N 3.28Å; Q92-F94 PolarHBondContact O-N 3.34Å; Q92-Y95 PolarHBondContact O-N 3.11Å; Q92-Y96 HydrophobicContact CG-CD2 3.68Å; Q92-Y96 HydrophobicContact CG-CE2 3.27Å; Q92-Y96 VanDerWaalsContact NE2-CE2 3.31Å; Q92-Y96 PolarHBondContact NE2-OH 2.74Å; Q92-Y96 WeakPolarHBondContact O-CD2 3.39Å; Q92-Y96 PolarHBondContact O-N 2.65Å |
| 93 | A | 82.1 | Confident | 73.1 | Confident | 57 Ų | 57 | 85.5 Ų | 85.5 | 47% | 0.471 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.2 | -37.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | I89 A97 | I89-A93 WeakPolarHBondContact O-CB 2.83Å; I89-A93 PolarHBondContact O-N 3.17Å; A93-A97 PolarHBondContact O-N 2.91Å |
| 94 | F | 81.5 | Confident | 76.1 | Confident | 23 Ų | 23 | 83.1 Ų | 83.1 | 10% | 0.101 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -61.8 | -53.9 | 175.2 | 174.6 | -103.1 | 0 | 0 | 0 | 111.5 | R90 C91 Q92 Y96 A97 I98 F259 Y262 | R90-F94 WeakPolarHBondContact O-CB 3.44Å; R90-F94 PolarHBondContact O-N 2.91Å; C91-F94 WeakPolarHBondContact O-CB 3.3Å; C91-F94 PolarHBondContact O-N 3.28Å; Q92-F94 VanDerWaalsContact C-N 3.28Å; Q92-F94 PolarHBondContact O-N 3.34Å; F94-Y96 VanDerWaalsContact C-N 3.32Å; F94-Y96 PolarHBondContact O-N 3.12Å; F94-A97 WeakPolarHBondContact O-CB 3.29Å; F94-A97 PolarHBondContact O-N 3.05Å; F94-A97 VanDerWaalsContact O-N 3.1Å; F94-I98 HydrophobicContact CD1-CD1 3.74Å; F94-I98 HydrophobicContact CE1-CD1 3.3Å; F94-I98 HydrophobicContact CE1-CG1 4.32Å; F94-I98 HydrophobicContact CE2-CD1 4.26Å; F94-I98 HydrophobicContact CG-CD1 4.41Å; F94-I98 HydrophobicContact CZ-CD1 3.6Å; F94-I98 HydrophobicContact CZ-CG1 4.33Å; F94-I98 WeakPolarHBondContact O-CG1 3.39Å; F94-I98 PolarHBondContact O-N 3.11Å; F94-I98 VanDerWaalsContact O-N 3.08Å; F94-F259 HydrophobicContact CB-CD2 4.03Å; F94-F259 HydrophobicContact CB-CE2 3.66Å; F94-F259 AromaticContact CD1-CD2 3.62Å; F94-F259 HydrophobicContact CD1-CD2 3.62Å; F94-F259 HydrophobicContact CD1-CE2 4.11Å; F94-F259 HydrophobicContact CD2-CE2 4.39Å; F94-F259 HydrophobicContact CE1-CD2 4.15Å; F94-F259 AromaticContact CG-CD2 3.83Å; F94-F259 HydrophobicContact CG-CD2 3.83Å; F94-F259 AromaticContact CG-CE2 3.82Å; F94-F259 HydrophobicContact CG-CE2 3.82Å; F94-Y262 AromaticContact CE2-CD1 3.83Å; F94-Y262 HydrophobicContact CE2-CD1 3.83Å; F94-Y262 HydrophobicContact CE2-CD2 4.28Å; F94-Y262 AromaticContact CE2-CE1 3.77Å; F94-Y262 HydrophobicContact CE2-CE1 3.77Å; F94-Y262 HydrophobicContact CE2-CE2 4.21Å; F94-Y262 HydrophobicContact CE2-CG 4.06Å; F94-Y262 AromaticContact CE2-CZ 3.95Å; F94-Y262 HydrophobicContact CZ-CD1 4.08Å; F94-Y262 AromaticContact CZ-CD2 3.69Å; F94-Y262 HydrophobicContact CZ-CD2 3.69Å; F94-Y262 HydrophobicContact CZ-CE1 4.12Å; F94-Y262 AromaticContact CZ-CE2 3.71Å; F94-Y262 HydrophobicContact CZ-CE2 3.71Å; F94-Y262 AromaticContact CZ-CG 3.85Å; F94-Y262 HydrophobicContact CZ-CG 3.85Å; F94-Y262 AromaticContact CZ-CZ 3.91Å |
| 95 | Y | 82.8 | Confident | 79.1 | Confident | 74 Ų | 74 | 77.7 Ų | 77.7 | 29% | 0.29 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.1 | -37.4 | 179.7 | -75.5 | -66.9 | 0 | 0 | 0 | 113.1 | C91 Q92 A97 I98 Q99 F255 | C91-Y95 VanDerWaalsContact O-CD2 3.22Å; C91-Y95 WeakPolarHBondContact O-CD2 3.22Å; C91-Y95 PolarHBondContact O-N 3.38Å; C91-Y95 VanDerWaalsContact O-N 3.07Å; C91-Y95 VanDerWaalsContact SG-CE2 3.5Å; Q92-Y95 PolarHBondContact O-N 3.11Å; Y95-A97 PolarHBondContact O-N 2.92Å; Y95-I98 HydrophobicContact CD1-CD1 4.06Å; Y95-I98 HydrophobicContact CE1-CD1 4.47Å; Y95-I98 PolarHBondContact O-N 2.85Å; Y95-Q99 WeakPolarHBondContact O-CB 3.21Å; Y95-Q99 PolarHBondContact O-N 3.34Å; Y95-F255 HydrophobicContact CD1-CD1 4.35Å; Y95-F255 HydrophobicContact CD1-CE1 4.41Å; Y95-F255 HydrophobicContact CE1-CD1 4.45Å |
| 96 | Y | 86.7 | Confident | 81.6 | Confident | 120 Ų | 120 | 71 Ų | 71 | 47% | 0.471 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62 | -41.4 | 173.3 | -77.6 | -53.4 | 0 | 0 | 0 | 112.6 | Q92 F94 I98 Q99 E100 | Q92-Y96 HydrophobicContact CG-CD2 3.68Å; Q92-Y96 HydrophobicContact CG-CE2 3.27Å; Q92-Y96 VanDerWaalsContact NE2-CE2 3.31Å; Q92-Y96 PolarHBondContact NE2-OH 2.74Å; Q92-Y96 WeakPolarHBondContact O-CD2 3.39Å; Q92-Y96 PolarHBondContact O-N 2.65Å; F94-Y96 VanDerWaalsContact C-N 3.32Å; F94-Y96 PolarHBondContact O-N 3.12Å; Y96-I98 VanDerWaalsContact C-N 3.32Å; Y96-I98 PolarHBondContact O-N 3.31Å; Y96-Q99 PolarHBondContact O-N 3.12Å; Y96-E100 WeakPolarHBondContact O-CB 3.32Å; Y96-E100 PolarHBondContact O-N 3.32Å |
| 97 | A | 87.2 | Confident | 84.3 | Confident | 40 Ų | 40 | 66.9 Ų | 66.9 | 33% | 0.331 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.1 | -37.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A93 F94 Y95 K101 | A93-A97 PolarHBondContact O-N 2.91Å; F94-A97 WeakPolarHBondContact O-CB 3.29Å; F94-A97 PolarHBondContact O-N 3.05Å; F94-A97 VanDerWaalsContact O-N 3.1Å; Y95-A97 PolarHBondContact O-N 2.92Å; A97-K101 WeakPolarHBondContact O-CB 3.42Å; A97-K101 PolarHBondContact O-N 3.08Å; A97-K101 VanDerWaalsContact O-N 3.15Å |
| 98 | I | 86.8 | Confident | 86.1 | Confident | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.6 | -47 | 173.3 | -53.2 | 171.4 | 0 | 0 | 0 | 110.1 | F94 Y95 Y96 K101 L102 I251 F255 W272 | F94-I98 HydrophobicContact CD1-CD1 3.74Å; F94-I98 HydrophobicContact CE1-CD1 3.3Å; F94-I98 HydrophobicContact CE1-CG1 4.32Å; F94-I98 HydrophobicContact CE2-CD1 4.26Å; F94-I98 HydrophobicContact CG-CD1 4.41Å; F94-I98 HydrophobicContact CZ-CD1 3.6Å; F94-I98 HydrophobicContact CZ-CG1 4.33Å; F94-I98 WeakPolarHBondContact O-CG1 3.39Å; F94-I98 PolarHBondContact O-N 3.11Å; F94-I98 VanDerWaalsContact O-N 3.08Å; Y95-I98 HydrophobicContact CD1-CD1 4.06Å; Y95-I98 HydrophobicContact CE1-CD1 4.47Å; Y95-I98 PolarHBondContact O-N 2.85Å; Y96-I98 VanDerWaalsContact C-N 3.32Å; Y96-I98 PolarHBondContact O-N 3.31Å; I98-K101 PolarHBondContact O-N 2.97Å; I98-L102 WeakPolarHBondContact O-CB 3.3Å; I98-L102 PolarHBondContact O-N 2.85Å; I98-I251 HydrophobicContact CG2-CG2 3.85Å; I98-F255 HydrophobicContact CB-CE2 4.39Å; I98-F255 HydrophobicContact CB-CZ 4.09Å; I98-F255 HydrophobicContact CG2-CD2 3.84Å; I98-F255 HydrophobicContact CG2-CE1 4.11Å; I98-F255 HydrophobicContact CG2-CE2 3.25Å; I98-F255 HydrophobicContact CG2-CG 4.5Å; I98-F255 HydrophobicContact CG2-CZ 3.4Å; I98-F255 VanDerWaalsContact CG2-CZ 3.4Å; I98-W272 HydrophobicContact CB-CH2 4.24Å; I98-W272 HydrophobicContact CB-CZ3 4.26Å; I98-W272 HydrophobicContact CG1-CH2 3.78Å; I98-W272 HydrophobicContact CG1-CZ3 3.68Å; I98-W272 HydrophobicContact CG2-CZ3 4.26Å |
| 99 | Q | 88.9 | Confident | 87.4 | Confident | 53 Ų | 53 | 62.3 Ų | 62.3 | 25% | 0.248 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.5 | -42.8 | -177.8 | -176.1 | 174.8 | 14.4 | 0 | 0 | 112.2 | Y95 Y96 K101 L102 F103 | Y95-Q99 WeakPolarHBondContact O-CB 3.21Å; Y95-Q99 PolarHBondContact O-N 3.34Å; Y96-Q99 PolarHBondContact O-N 3.12Å; Q99-K101 VanDerWaalsContact C-N 3.34Å; Q99-K101 PolarHBondContact O-N 3.12Å; Q99-L102 WeakPolarHBondContact O-CB 2.92Å; Q99-L102 PolarHBondContact O-N 2.87Å; Q99-F103 HydrophobicContact CG-CD2 3.7Å; Q99-F103 HydrophobicContact CG-CE2 3.29Å; Q99-F103 HydrophobicContact CG-CZ 4.18Å; Q99-F103 VanDerWaalsContact NE2-CE2 3.34Å; Q99-F103 WeakPolarHBondContact O-CD2 3.3Å; Q99-F103 PolarHBondContact O-N 2.74Å |
| 100 | E | 91.8 | Very high | 88.2 | Confident | 147 Ų | 147 | 63.1 Ų | 63.1 | 69% | 0.687 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.6 | -45.5 | 174.7 | -172.5 | -173.2 | 169 | 0 | 0 | 111.1 | Y96 L102 F103 S104 | Y96-E100 WeakPolarHBondContact O-CB 3.32Å; Y96-E100 PolarHBondContact O-N 3.32Å; E100-L102 PolarHBondContact O-N 2.77Å; E100-F103 PolarHBondContact O-N 3.42Å; E100-S104 WeakPolarHBondContact O-CB 3.43Å; E100-S104 PolarHBondContact O-N 3.49Å |
| 101 | K | 91.5 | Very high | 89.2 | Confident | 65 Ų | 65 | 59.4 Ų | 59.4 | 28% | 0.283 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63 | -42.5 | 176.6 | -170.7 | 176.7 | 178.3 | -175.5 | 0 | 111.7 | A97 I98 Q99 S104 S105 I251 W272 | A97-K101 WeakPolarHBondContact O-CB 3.42Å; A97-K101 PolarHBondContact O-N 3.08Å; A97-K101 VanDerWaalsContact O-N 3.15Å; I98-K101 PolarHBondContact O-N 2.97Å; Q99-K101 VanDerWaalsContact C-N 3.34Å; Q99-K101 PolarHBondContact O-N 3.12Å; K101-S104 PolarHBondContact O-N 3.44Å; K101-S105 WeakPolarHBondContact O-CB 3.31Å; K101-S105 PolarHBondContact O-N 3.42Å; K101-S105 PolarHBondContact O-OG 3.06Å; K101-I251 HydrophobicContact CD-CD1 4.35Å; K101-I251 HydrophobicContact CD-CG1 4.01Å; K101-I251 HydrophobicContact CG-CD1 3.95Å; K101-I251 HydrophobicContact CG-CG1 4.11Å; K101-W272 HydrophobicContact CD-CD2 4.38Å; K101-W272 HydrophobicContact CD-CH2 4.05Å; K101-W272 HydrophobicContact CD-CZ2 3.85Å; K101-W272 HydrophobicContact CD-CZ3 4.35Å |
| 102 | L | 93.8 | Very high | 89.9 | Confident | 1 Ų | 1 | 59.4 Ų | 59.4 | 1% | 0.005 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.3 | -49.8 | 175.6 | -179.3 | 61.2 | 0 | 0 | 0 | 111.1 | I98 Q99 E100 S104 S105 L106 F248 I251 F252 F255 I337 | I98-L102 WeakPolarHBondContact O-CB 3.3Å; I98-L102 PolarHBondContact O-N 2.85Å; Q99-L102 WeakPolarHBondContact O-CB 2.92Å; Q99-L102 PolarHBondContact O-N 2.87Å; E100-L102 PolarHBondContact O-N 2.77Å; L102-S104 PolarHBondContact O-N 2.98Å; L102-S105 PolarHBondContact O-N 3.37Å; L102-L106 HydrophobicContact CD1-CD1 4.25Å; L102-L106 HydrophobicContact CD1-CG 4.31Å; L102-L106 HydrophobicContact CG-CD1 4.01Å; L102-L106 HydrophobicContact CG-CG 4.48Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 VanDerWaalsContact O-CG 3.31Å; L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 3.2Å; L102-F248 HydrophobicContact CD1-CD1 4.08Å; L102-F248 HydrophobicContact CD1-CE1 4.14Å; L102-I251 HydrophobicContact CB-CG2 3.89Å; L102-I251 HydrophobicContact CD1-CG2 4Å; L102-I251 HydrophobicContact CG-CG2 4.46Å; L102-F252 HydrophobicContact CD1-CE1 3.71Å; L102-F252 HydrophobicContact CD1-CZ 4.38Å; L102-F255 HydrophobicContact CD2-CE2 4.27Å; L102-F255 HydrophobicContact CD2-CZ 4.45Å; L102-I337 HydrophobicContact CD2-CG2 3.77Å |
| 103 | F | 94.8 | Very high | 90.3 | Very high | 75 Ų | 75 | 58.6 Ų | 58.6 | 33% | 0.329 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.6 | -38.7 | 179 | -71.8 | -53.7 | 0 | 0 | 0 | 112.8 | L67 Q99 E100 L106 S107 I337 | L67-F103 HydrophobicContact CD2-CE1 4.3Å; Q99-F103 HydrophobicContact CG-CD2 3.7Å; Q99-F103 HydrophobicContact CG-CE2 3.29Å; Q99-F103 HydrophobicContact CG-CZ 4.18Å; Q99-F103 VanDerWaalsContact NE2-CE2 3.34Å; Q99-F103 WeakPolarHBondContact O-CD2 3.3Å; Q99-F103 PolarHBondContact O-N 2.74Å; E100-F103 PolarHBondContact O-N 3.42Å; F103-L106 HydrophobicContact CD1-CD1 4.28Å; F103-L106 PolarHBondContact O-N 3.18Å; F103-S107 PolarHBondContact O-N 2.96Å; F103-I337 HydrophobicContact CE1-CG2 4.42Å |
| 104 | S | 94.7 | Very high | 90.5 | Very high | 57 Ų | 57 | 56.8 Ų | 56.8 | 40% | 0.399 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.4 | -46.7 | 172.5 | 179.4 | 0 | 0 | 0 | 0 | 111.3 | E100 K101 L102 S107 Q108 | E100-S104 WeakPolarHBondContact O-CB 3.43Å; E100-S104 PolarHBondContact O-N 3.49Å; K101-S104 PolarHBondContact O-N 3.44Å; L102-S104 PolarHBondContact O-N 2.98Å; S104-S107 PolarHBondContact O-N 3.22Å; S104-S107 PolarHBondContact O-OG 3.17Å; S104-Q108 WeakPolarHBondContact O-CG 3.41Å; S104-Q108 PolarHBondContact O-N 2.99Å |
| 105 | S | 94.6 | Very high | 90.6 | Very high | 4 Ų | 4 | 59.3 Ų | 59.3 | 3% | 0.028 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 177.3 | -67.8 | 0 | 0 | 0 | 0 | 112.3 | K101 L102 S107 Q108 E109 S242 A243 I251 | K101-S105 WeakPolarHBondContact O-CB 3.31Å; K101-S105 PolarHBondContact O-N 3.42Å; K101-S105 PolarHBondContact O-OG 3.06Å; L102-S105 PolarHBondContact O-N 3.37Å; S105-S107 VanDerWaalsContact C-N 3.3Å; S105-S107 PolarHBondContact O-N 3.27Å; S105-Q108 PolarHBondContact O-N 3.07Å; S105-Q108 VanDerWaalsContact O-N 3.12Å; S105-E109 PolarHBondContact O-N 3.34Å; S105-S242 WeakPolarHBondContact CB-O 3.39Å; S105-S242 PolarHBondContact OG-O 2.69Å; S105-A243 WeakPolarHBondContact O-CB 3.22Å; S105-I251 WeakPolarHBondContact OG-CD1 3.48Å |
| 106 | L | 95.7 | Very high | 90.7 | Very high | 30 Ų | 30 | 55.9 Ų | 55.9 | 16% | 0.157 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.8 | -38.6 | 175.4 | -73.3 | 170.8 | 0 | 0 | 0 | 112.1 | L102 F103 Q108 E109 F248 C338 | L102-L106 HydrophobicContact CD1-CD1 4.25Å; L102-L106 HydrophobicContact CD1-CG 4.31Å; L102-L106 HydrophobicContact CG-CD1 4.01Å; L102-L106 HydrophobicContact CG-CG 4.48Å; L102-L106 WeakPolarHBondContact O-CB 3.41Å; L102-L106 VanDerWaalsContact O-CG 3.31Å; L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 3.2Å; F103-L106 HydrophobicContact CD1-CD1 4.28Å; F103-L106 PolarHBondContact O-N 3.18Å; L106-Q108 PolarHBondContact O-N 3Å; L106-E109 WeakPolarHBondContact O-CB 3.36Å; L106-E109 PolarHBondContact O-N 3.42Å; L106-F248 HydrophobicContact CD2-CE1 3.84Å; L106-F248 HydrophobicContact CD2-CZ 4.02Å; L106-F248 HydrophobicContact CG-CE1 4.03Å; L106-F248 HydrophobicContact CG-CZ 4.44Å; L106-C338 HydrophobicContact CD2-CB 4.06Å |
| 107 | S | 94.6 | Very high | 90.5 | Very high | 90 Ų | 90 | 55.8 Ų | 55.8 | 63% | 0.629 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -63.3 | -28.3 | 177 | 78.3 | 0 | 0 | 0 | 0 | 113.3 | F103 S104 S105 | F103-S107 PolarHBondContact O-N 2.96Å; S104-S107 PolarHBondContact O-N 3.22Å; S104-S107 PolarHBondContact O-OG 3.17Å; S105-S107 VanDerWaalsContact C-N 3.3Å; S105-S107 PolarHBondContact O-N 3.27Å |
| 108 | Q | 93.3 | Very high | 90.5 | Very high | 58 Ų | 58 | 57.6 Ų | 57.6 | 27% | 0.271 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -94.2 | -10.4 | -179.6 | -63.8 | 178.7 | 0.5 | 0 | 0 | 113.3 | S104 S105 L106 K110 L111 S242 A243 | S104-Q108 WeakPolarHBondContact O-CG 3.41Å; S104-Q108 PolarHBondContact O-N 2.99Å; S105-Q108 PolarHBondContact O-N 3.07Å; S105-Q108 VanDerWaalsContact O-N 3.12Å; L106-Q108 PolarHBondContact O-N 3Å; Q108-K110 VanDerWaalsContact C-N 3.25Å; Q108-K110 PolarHBondContact O-N 2.9Å; Q108-L111 HydrophobicContact CB-CD1 4.4Å; Q108-L111 VanDerWaalsContact O-CB 3.26Å; Q108-L111 WeakPolarHBondContact O-CB 3.35Å; Q108-L111 PolarHBondContact O-N 3.32Å; Q108-S242 VanDerWaalsContact OE1-N 3.11Å; Q108-A243 HydrophobicContact CB-CB 4.11Å |
| 109 | E | 94.3 | Very high | 90.6 | Very high | 6 Ų | 6 | 57.7 Ų | 57.7 | 3% | 0.028 | 29% | 0.288 | C | S | . | . | G | 310 helix | trans | -57.5 | -36.7 | -171.5 | -173.5 | 176.7 | -151 | 0 | 0 | 113.1 | S105 L106 L111 L112 H113 A243 F248 R296 P297 S298 | S105-E109 PolarHBondContact O-N 3.34Å; L106-E109 WeakPolarHBondContact O-CB 3.36Å; L106-E109 PolarHBondContact O-N 3.42Å; E109-L111 PolarHBondContact O-N 3.4Å; E109-L112 PolarHBondContact O-N 2.9Å; E109-H113 PolarHBondContact O-N 2.8Å; E109-H113 VanDerWaalsContact O-N 3.07Å; E109-A243 HydrophobicContact CB-CB 4.39Å; E109-F248 HydrophobicContact CB-CE2 4.46Å; E109-F248 HydrophobicContact CB-CZ 4.25Å; E109-F248 HydrophobicContact CG-CE2 4.12Å; E109-F248 HydrophobicContact CG-CZ 4.29Å; E109-R296 WeakPolarHBondContact OE1-CB 3.38Å; E109-R296 IonicContact OE1-NE 2.66Å; E109-R296 IonicContact OE2-CZ 3.28Å; E109-R296 VanDerWaalsContact OE2-CZ 3.23Å; E109-R296 IonicContact OE2-NE 2.61Å; E109-R296 PolarHBondContact OE2-NE 2.89Å; E109-R296 IonicContact OE2-NH2 2.71Å; E109-R296 PolarHBondContact OE2-NH2 3.31Å; E109-P297 HydrophobicContact CG-CG 4.21Å; E109-P297 WeakPolarHBondContact OE1-CD 3.43Å; E109-S298 VanDerWaalsContact OE1-CB 3.22Å; E109-S298 WeakPolarHBondContact OE1-CB 3.48Å; E109-S298 PolarHBondContact OE1-N 2.88Å; E109-S298 PolarHBondContact OE1-OG 3.2Å; E109-S298 PolarHBondContact OE2-OG 3.15Å |
| 110 | K | 91.2 | Very high | 90.4 | Very high | 164 Ų | 164 | 59.5 Ų | 59.5 | 71% | 0.713 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -59.7 | -18.7 | 177.1 | -65.8 | -174.8 | -179.5 | -178.3 | 0 | 113.7 | Q108 L112 | Q108-K110 VanDerWaalsContact C-N 3.25Å; Q108-K110 PolarHBondContact O-N 2.9Å; K110-L112 VanDerWaalsContact C-N 3.34Å |
| 111 | L | 91 | Very high | 90.2 | Very high | 77 Ų | 77 | 56.8 Ų | 56.8 | 40% | 0.403 | 30% | 0.301 | S | S | . | . | G | 310 helix | trans | -75.1 | -25 | 174.9 | -63.8 | 171.3 | 0 | 0 | 0 | 112.7 | Q108 E109 A237 | Q108-L111 HydrophobicContact CB-CD1 4.4Å; Q108-L111 VanDerWaalsContact O-CB 3.26Å; Q108-L111 WeakPolarHBondContact O-CB 3.35Å; Q108-L111 PolarHBondContact O-N 3.32Å; E109-L111 PolarHBondContact O-N 3.4Å; L111-A237 HydrophobicContact CD1-CB 4.23Å |
| 112 | L | 89.7 | Confident | 90.1 | Very high | 18 Ų | 18 | 55.1 Ų | 55.1 | 9% | 0.094 | 30% | 0.297 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.5 | -17.3 | -176.1 | -65.2 | 177.7 | 0 | 0 | 0 | 113.3 | E109 K110 C162 I238 C241 A243 T244 P297 | E109-L112 PolarHBondContact O-N 2.9Å; K110-L112 VanDerWaalsContact C-N 3.34Å; L112-C162 HydrophobicContact CD2-CB 4.05Å; L112-C162 VanDerWaalsContact CD2-SG 3.53Å; L112-I238 HydrophobicContact CD2-CG2 3.88Å; L112-C241 HydrophobicContact CD1-CB 4.36Å; L112-C241 VanDerWaalsContact CD1-SG 3.54Å; L112-C241 HydrophobicContact CG-CB 4.43Å; L112-A243 HydrophobicContact CD1-CB 4.12Å; L112-A243 WeakPolarHBondContact CD1-O 3.43Å; L112-T244 HydrophobicContact CD1-CG2 3.73Å; L112-P297 HydrophobicContact CB-CG 4.22Å |
| 113 | H | 89.1 | Confident | 89.8 | Confident | 72 Ų | 72 | 58.5 Ų | 58.5 | 33% | 0.333 | 32% | 0.315 | S | S | . | . | trans | -84 | 112.3 | 174.1 | -176.1 | -144.6 | 0 | 0 | 0 | 110.3 | E109 C294 | E109-H113 PolarHBondContact O-N 2.8Å; E109-H113 VanDerWaalsContact O-N 3.07Å; H113-C294 PolarHBondContact NE2-O 3.46Å | ||
| 114 | I | 87.1 | Confident | 89.5 | Confident | 18 Ų | 18 | 56 Ų | 56 | 9% | 0.092 | 31% | 0.307 | C | S | . | . | trans | -121.6 | 129.6 | 179.8 | -62.9 | 154 | 0 | 0 | 0 | 108 | N116 C162 D165 L166 A169 | I114-N116 PolarHBondContact O-N 2.85Å; I114-C162 HydrophobicContact CD1-CB 4.33Å; I114-C162 WeakPolarHBondContact CD1-O 3.5Å; I114-C162 WeakPolarHBondContact CD1-SG 3.33Å; I114-D165 HydrophobicContact CB-CB 4.36Å; I114-D165 HydrophobicContact CD1-CB 3.94Å; I114-D165 HydrophobicContact CG2-CB 4.13Å; I114-L166 HydrophobicContact CD1-CB 3.68Å; I114-L166 HydrophobicContact CD1-CD1 4.42Å; I114-L166 HydrophobicContact CG1-CB 4.47Å; I114-L166 HydrophobicContact CG1-CD1 4.35Å; I114-A169 HydrophobicContact CG2-CB 4.37Å | ||
| 115 | D | 83.7 | Confident | 89.1 | Confident | 77 Ų | 77 | 60.4 Ų | 60.4 | 41% | 0.412 | 33% | 0.325 | S | S | . | . | trans | -76 | 104.8 | 177.4 | -174.9 | 0.5 | 0 | 0 | 0 | 110.8 | E117 H118 | D115-E117 WeakPolarHBondContact OD1-CB 3.22Å; D115-E117 PolarHBondContact OD1-N 2.9Å; D115-H118 PolarHBondContact O-CE1 3.44Å; D115-H118 VanDerWaalsContact O-CE1 3.24Å; D115-H118 PolarHBondContact O-ND1 3.16Å | ||
| 116 | N | 83.7 | Confident | 88.8 | Confident | 1 Ų | 1 | 67 Ų | 67 | 1% | 0.005 | 36% | 0.36 | C | S | . | . | trans | -96.2 | 6.4 | 178.9 | -71.6 | -34.5 | 0 | 0 | 0 | 113.1 | I114 H118 L119 D165 S293 | I114-N116 PolarHBondContact O-N 2.85Å; N116-H118 PolarHBondContact O-N 3.38Å; N116-H118 VanDerWaalsContact O-N 3.15Å; N116-L119 HydrophobicContact CB-CD1 4.05Å; N116-L119 HydrophobicContact CB-CG 4.49Å; N116-L119 WeakPolarHBondContact O-CB 3.5Å; N116-L119 WeakPolarHBondContact O-CG 3.28Å; N116-L119 PolarHBondContact O-N 3.24Å; N116-D165 VanDerWaalsContact ND2-CG 3.27Å; N116-D165 PolarHBondContact ND2-OD2 3.5Å; N116-D165 WeakPolarHBondContact OD1-CB 3.43Å; N116-S293 PolarHBondContact ND2-OG 2.91Å | ||
| 117 | E | 84.4 | Confident | 88.5 | Confident | 118 Ų | 118 | 68.5 Ų | 68.5 | 55% | 0.551 | 37% | 0.368 | S | S | * | . | G | 310 helix | trans | -57.2 | -35.7 | -175.3 | -171.5 | 177.9 | 178.1 | 0 | 0 | 111.9 | D115 L119 L120 | D115-E117 WeakPolarHBondContact OD1-CB 3.22Å; D115-E117 PolarHBondContact OD1-N 2.9Å; E117-L119 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact O-N 3.1Å; E117-L120 WeakPolarHBondContact O-CB 3.41Å; E117-L120 PolarHBondContact O-N 3.31Å |
| 118 | H | 86.9 | Confident | 88.4 | Confident | 78 Ų | 78 | 67 Ų | 67 | 36% | 0.361 | 35% | 0.353 | S | S | . | . | G | 310 helix | trans | -57.2 | -25.3 | 176.5 | 67.9 | -81.9 | 0 | 0 | 0 | 114.2 | D115 N116 L120 A121 V122 | D115-H118 PolarHBondContact O-CE1 3.44Å; D115-H118 VanDerWaalsContact O-CE1 3.24Å; D115-H118 PolarHBondContact O-ND1 3.16Å; N116-H118 PolarHBondContact O-N 3.38Å; N116-H118 VanDerWaalsContact O-N 3.15Å; H118-L120 VanDerWaalsContact C-N 3.28Å; H118-L120 PolarHBondContact O-N 3.45Å; H118-A121 PolarHBondContact O-N 2.99Å; H118-V122 WeakPolarHBondContact O-CG2 3.5Å |
| 119 | L | 87.3 | Confident | 88.5 | Confident | 2 Ų | 2 | 68 Ų | 68 | 1% | 0.01 | 36% | 0.356 | C | S | . | . | G | 310 helix | trans | -71.4 | -23.1 | 179 | -59.6 | -178.9 | 0 | 0 | 0 | 113.1 | N116 E117 A121 A132 V168 | N116-L119 HydrophobicContact CB-CD1 4.05Å; N116-L119 HydrophobicContact CB-CG 4.49Å; N116-L119 WeakPolarHBondContact O-CB 3.5Å; N116-L119 WeakPolarHBondContact O-CG 3.28Å; N116-L119 PolarHBondContact O-N 3.24Å; E117-L119 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact O-N 3.1Å; L119-A121 VanDerWaalsContact C-N 3.28Å; L119-A132 HydrophobicContact CB-CB 4.16Å; L119-A132 PolarHBondContact O-N 3.1Å; L119-V168 HydrophobicContact CD2-CG1 3.57Å |
| 120 | L | 85 | Confident | 88.5 | Confident | 91 Ų | 91 | 67.9 Ų | 67.9 | 48% | 0.476 | 36% | 0.356 | S | S | . | . | G | 310 helix | trans | -73.7 | -23 | 178.7 | -61.7 | 172.2 | 0 | 0 | 0 | 112.1 | E117 H118 A132 | E117-L120 WeakPolarHBondContact O-CB 3.41Å; E117-L120 PolarHBondContact O-N 3.31Å; H118-L120 VanDerWaalsContact C-N 3.28Å; H118-L120 PolarHBondContact O-N 3.45Å; L120-A132 HydrophobicContact CD2-CB 3.71Å |
| 121 | A | 87.5 | Confident | 88.6 | Confident | 90 Ų | 90 | 61 Ų | 61 | 74% | 0.744 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -94.5 | -8.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | H118 L119 | H118-A121 PolarHBondContact O-N 2.99Å; L119-A121 VanDerWaalsContact C-N 3.28Å |
| 122 | V | 89 | Confident | 88.8 | Confident | 31 Ų | 31 | 58.1 Ų | 58.1 | 19% | 0.188 | 31% | 0.314 | C | S | . | . | trans | -89.6 | 140.4 | -176.7 | 172.5 | 0 | 0 | 0 | 0 | 110.1 | H118 D127 K129 D131 | H118-V122 WeakPolarHBondContact O-CG2 3.5Å; V122-D127 HydrophobicContact CG1-CB 4.08Å; V122-K129 HydrophobicContact CG1-CB 3.66Å; V122-D131 HydrophobicContact CB-CB 4.24Å; V122-D131 HydrophobicContact CG1-CB 4.13Å; V122-D131 WeakPolarHBondContact O-CB 3.15Å | ||
| 123 | N | 89.1 | Confident | 88.9 | Confident | 71 Ų | 71 | 60.6 Ų | 60.6 | 38% | 0.38 | 34% | 0.337 | S | S | . | . | trans | -111 | 114.5 | 169.1 | -176.5 | -44 | 0 | 0 | 0 | 109.2 | D125 L126 D127 | N123-D125 VanDerWaalsContact C-N 3.28Å; N123-D125 PolarHBondContact O-N 2.94Å; N123-D125 PolarHBondContact OD1-N 2.96Å; N123-D125 VanDerWaalsContact OD1-N 3.07Å; N123-L126 HydrophobicContact CB-CB 4.32Å; N123-L126 HydrophobicContact CB-CD1 4.21Å; N123-L126 HydrophobicContact CB-CG 4.38Å; N123-L126 PolarHBondContact O-N 3.43Å; N123-L126 PolarHBondContact OD1-N 3.37Å; N123-D127 PolarHBondContact N-OD2 2.9Å; N123-D127 VanDerWaalsContact N-OD2 3.15Å; N123-D127 WeakPolarHBondContact O-CB 3.35Å; N123-D127 PolarHBondContact O-N 3.18Å | ||
| 124 | S | 87.9 | Confident | 89.1 | Confident | 23 Ų | 23 | 58.6 Ų | 58.6 | 16% | 0.161 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.3 | -32 | -173.8 | 53.4 | 0 | 0 | 0 | 0 | 114.7 | D128 K129 D131 | S124-D128 WeakPolarHBondContact O-CA 3.45Å; S124-D128 PolarHBondContact O-N 3Å; S124-K129 VanDerWaalsContact CA-O 3.25Å; S124-K129 WeakPolarHBondContact CA-O 3.37Å; S124-K129 WeakPolarHBondContact CB-O 3.47Å; S124-D131 WeakPolarHBondContact CB-OD2 3.21Å; S124-D131 PolarHBondContact N-OD2 2.92Å; S124-D131 PolarHBondContact OG-OD2 3.05Å |
| 125 | D | 86.7 | Confident | 89.5 | Confident | 149 Ų | 149 | 57.9 Ų | 57.9 | 80% | 0.797 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -71.5 | -35.1 | 179.7 | -68.5 | -35.6 | 0 | 0 | 0 | 112.2 | N123 | N123-D125 VanDerWaalsContact C-N 3.28Å; N123-D125 PolarHBondContact O-N 2.94Å; N123-D125 PolarHBondContact OD1-N 2.96Å; N123-D125 VanDerWaalsContact OD1-N 3.07Å |
| 126 | L | 88.5 | Confident | 90 | Very high | 144 Ų | 144 | 55.6 Ų | 55.6 | 75% | 0.754 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -88.9 | -43.4 | -177.9 | -61.1 | 176.9 | 0 | 0 | 0 | 112 | N123 | N123-L126 HydrophobicContact CB-CB 4.32Å; N123-L126 HydrophobicContact CB-CD1 4.21Å; N123-L126 HydrophobicContact CB-CG 4.38Å; N123-L126 PolarHBondContact O-N 3.43Å; N123-L126 PolarHBondContact OD1-N 3.37Å |
| 127 | D | 89.2 | Confident | 90.5 | Very high | 61 Ų | 61 | 60.3 Ų | 60.3 | 33% | 0.326 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -87.8 | -15.7 | -171.2 | -71.8 | -56 | 0 | 0 | 0 | 113.7 | V122 N123 K129 K172 | V122-D127 HydrophobicContact CG1-CB 4.08Å; N123-D127 PolarHBondContact N-OD2 2.9Å; N123-D127 VanDerWaalsContact N-OD2 3.15Å; N123-D127 WeakPolarHBondContact O-CB 3.35Å; N123-D127 PolarHBondContact O-N 3.18Å; D127-K129 HydrophobicContact CB-CB 4.04Å; D127-K129 HydrophobicContact CB-CD 4.11Å; D127-K129 HydrophobicContact CB-CG 3.97Å; D127-K129 PolarHBondContact O-N 3.46Å; D127-K172 WeakPolarHBondContact O-CE 3.44Å; D127-K172 PolarHBondContact O-NZ 3.11Å |
| 128 | D | 92.9 | Very high | 91.1 | Very high | 57 Ų | 57 | 55 Ų | 55 | 31% | 0.305 | 31% | 0.314 | S | S | . | . | S | Bend | trans | 52.1 | 46.7 | -168.4 | -175.8 | 34.5 | 0 | 0 | 0 | 110.3 | S124 K172 K174 P175 | S124-D128 WeakPolarHBondContact O-CA 3.45Å; S124-D128 PolarHBondContact O-N 3Å; D128-K172 WeakPolarHBondContact O-CE 3.35Å; D128-K174 VanDerWaalsContact OD2-CD 3.28Å; D128-K174 WeakPolarHBondContact OD2-CD 3.31Å; D128-K174 WeakPolarHBondContact OD2-CE 3.41Å; D128-K174 IonicContact OD2-NZ 3.92Å; D128-K174 PolarHBondContact OD2-NZ 3.33Å; D128-P175 WeakPolarHBondContact OD1-CD 3.46Å |
| 129 | K | 93.6 | Very high | 91.5 | Very high | 80 Ų | 80 | 51.2 Ų | 51.2 | 35% | 0.348 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -132.5 | 156.7 | -178.8 | -68.5 | -174.7 | -168.5 | 163.1 | 0 | 111.1 | V122 S124 D127 D131 K172 V173 | V122-K129 HydrophobicContact CG1-CB 3.66Å; S124-K129 VanDerWaalsContact CA-O 3.25Å; S124-K129 WeakPolarHBondContact CA-O 3.37Å; S124-K129 WeakPolarHBondContact CB-O 3.47Å; D127-K129 HydrophobicContact CB-CB 4.04Å; D127-K129 HydrophobicContact CB-CD 4.11Å; D127-K129 HydrophobicContact CB-CG 3.97Å; D127-K129 PolarHBondContact O-N 3.46Å; K129-D131 PolarHBondContact O-N 3.27Å; K129-K172 HydrophobicContact CD-CG 4.15Å; K129-K172 HydrophobicContact CG-CD 4.12Å; K129-K172 VanDerWaalsContact CG-CE 3.45Å; K129-K172 HydrophobicContact CG-CG 3.7Å; K129-V173 CarbonylContact C-O 3.26Å; K129-V173 WeakPolarHBondContact CA-O 3.36Å |
| 130 | V | 94.9 | Very high | 91.9 | Very high | 4 Ų | 4 | 52.9 Ų | 52.9 | 2% | 0.024 | 30% | 0.304 | C | S | . | . | trans | -67.6 | 124 | 168.1 | 177.7 | 0 | 0 | 0 | 0 | 109.1 | L134 R135 V168 V173 A178 | V130-L134 HydrophobicContact CG2-CD2 4.29Å; V130-R135 HydrophobicContact CG1-CB 4.05Å; V130-V168 HydrophobicContact CB-CG1 4.15Å; V130-V168 HydrophobicContact CG1-CG1 4.48Å; V130-V173 HydrophobicContact CG2-CB 3.92Å; V130-V173 HydrophobicContact CG2-CG1 3.75Å; V130-V173 PolarHBondContact N-O 2.96Å; V130-V173 VanDerWaalsContact N-O 3.1Å; V130-A178 HydrophobicContact CG2-CB 4.13Å | ||
| 131 | D | 94.2 | Very high | 92.3 | Very high | 20 Ų | 20 | 53.1 Ų | 53.1 | 11% | 0.107 | 30% | 0.301 | C | S | . | . | trans | -100.4 | 177.1 | 169.8 | 60.8 | 19.5 | 0 | 0 | 0 | 110.9 | V122 S124 K129 A133 L134 R135 | V122-D131 HydrophobicContact CB-CB 4.24Å; V122-D131 HydrophobicContact CG1-CB 4.13Å; V122-D131 WeakPolarHBondContact O-CB 3.15Å; S124-D131 WeakPolarHBondContact CB-OD2 3.21Å; S124-D131 PolarHBondContact N-OD2 2.92Å; S124-D131 PolarHBondContact OG-OD2 3.05Å; K129-D131 PolarHBondContact O-N 3.27Å; D131-A133 VanDerWaalsContact C-N 3.3Å; D131-A133 PolarHBondContact O-N 3.49Å; D131-A133 PolarHBondContact OD1-N 3.49Å; D131-L134 WeakPolarHBondContact OD1-CB 3.41Å; D131-L134 PolarHBondContact OD1-N 3.08Å; D131-R135 WeakPolarHBondContact O-CB 3.45Å; D131-R135 PolarHBondContact O-N 3.35Å | ||
| 132 | A | 93.7 | Very high | 92.7 | Very high | 15 Ų | 15 | 48.9 Ų | 48.9 | 12% | 0.124 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62 | -35.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L119 L120 A136 | L119-A132 HydrophobicContact CB-CB 4.16Å; L119-A132 PolarHBondContact O-N 3.1Å; L120-A132 HydrophobicContact CD2-CB 3.71Å; A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.37Å |
| 133 | A | 92.5 | Very high | 93 | Very high | 71 Ų | 71 | 48 Ų | 48 | 59% | 0.587 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -70.4 | -47.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | D131 R135 A136 E137 | D131-A133 VanDerWaalsContact C-N 3.3Å; D131-A133 PolarHBondContact O-N 3.49Å; D131-A133 PolarHBondContact OD1-N 3.49Å; A133-R135 VanDerWaalsContact C-N 3.32Å; A133-R135 PolarHBondContact O-N 3.06Å; A133-A136 PolarHBondContact O-N 2.83Å; A133-E137 PolarHBondContact O-N 2.97Å |
| 134 | L | 94.2 | Very high | 93.1 | Very high | 30 Ų | 30 | 46.8 Ų | 46.8 | 16% | 0.157 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.8 | -36.4 | 176.7 | -176.7 | 64.3 | 0 | 0 | 0 | 111.7 | V130 D131 T138 P175 A178 | V130-L134 HydrophobicContact CG2-CD2 4.29Å; D131-L134 WeakPolarHBondContact OD1-CB 3.41Å; D131-L134 PolarHBondContact OD1-N 3.08Å; L134-T138 WeakPolarHBondContact O-CB 3.43Å; L134-T138 PolarHBondContact O-N 3.22Å; L134-T138 PolarHBondContact O-OG1 2.89Å; L134-P175 VanDerWaalsContact CD2-CA 3.48Å; L134-P175 HydrophobicContact CD2-CB 3.46Å; L134-P175 VanDerWaalsContact CD2-CB 3.46Å; L134-P175 HydrophobicContact CD2-CG 3.98Å; L134-A178 HydrophobicContact CD2-CB 4.12Å; L134-A178 HydrophobicContact CG-CB 4.24Å |
| 135 | R | 95.6 | Very high | 93.3 | Very high | 2 Ų | 2 | 46 Ų | 46 | 1% | 0.008 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.5 | -52.9 | 171 | 174 | -178.7 | 174.8 | -76.1 | -5.5 | 110.4 | V130 D131 A133 E137 T138 L139 D165 L287 V288 S290 | V130-R135 HydrophobicContact CG1-CB 4.05Å; D131-R135 WeakPolarHBondContact O-CB 3.45Å; D131-R135 PolarHBondContact O-N 3.35Å; A133-R135 VanDerWaalsContact C-N 3.32Å; A133-R135 PolarHBondContact O-N 3.06Å; R135-E137 PolarHBondContact O-N 3.01Å; R135-T138 PolarHBondContact O-N 3.21Å; R135-L139 HydrophobicContact CG-CD1 3.86Å; R135-L139 HydrophobicContact CG-CG 4.36Å; R135-L139 WeakPolarHBondContact O-CB 3.46Å; R135-L139 WeakPolarHBondContact O-CG 3.34Å; R135-L139 PolarHBondContact O-N 2.78Å; R135-D165 IonicContact CZ-OD1 3.52Å; R135-D165 IonicContact CZ-OD2 2.84Å; R135-D165 IonicContact NE-OD1 3.66Å; R135-D165 PolarHBondContact NE-OD1 2.93Å; R135-D165 IonicContact NE-OD2 3.09Å; R135-D165 IonicContact NH2-OD1 2.69Å; R135-D165 PolarHBondContact NH2-OD1 3.48Å; R135-D165 IonicContact NH2-OD2 3.5Å; R135-D165 PolarHBondContact NH2-OD2 2.96Å; R135-L287 PolarHBondContact NH2-O 3.06Å; R135-V288 PolarHBondContact NH1-O 3.29Å; R135-S290 PolarHBondContact NH1-OG 2.8Å |
| 136 | A | 94.2 | Very high | 93.6 | Very high | 29 Ų | 29 | 39.1 Ų | 39.1 | 24% | 0.24 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.1 | -46.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A132 A133 T138 L139 F140 V288 | A132-A136 WeakPolarHBondContact O-CB 3.27Å; A132-A136 PolarHBondContact O-N 3.37Å; A133-A136 PolarHBondContact O-N 2.83Å; A136-T138 VanDerWaalsContact C-N 3.32Å; A136-T138 PolarHBondContact O-N 3.42Å; A136-L139 PolarHBondContact O-N 3.47Å; A136-F140 VanDerWaalsContact O-CB 3.29Å; A136-F140 WeakPolarHBondContact O-CB 3.42Å; A136-F140 PolarHBondContact O-N 3.13Å; A136-V288 HydrophobicContact CB-CG1 4.18Å; A136-V288 WeakPolarHBondContact O-CG1 3.39Å |
| 137 | E | 93.9 | Very high | 93.6 | Very high | 101 Ų | 101 | 33.4 Ų | 33.4 | 47% | 0.472 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -59.7 | -43.7 | 176.9 | -170.9 | -168.1 | 159.8 | 0 | 0 | 111.8 | A133 R135 F140 K141 | A133-E137 PolarHBondContact O-N 2.97Å; R135-E137 PolarHBondContact O-N 3.01Å; E137-F140 PolarHBondContact O-N 3.48Å; E137-K141 WeakPolarHBondContact O-CG 3.47Å; E137-K141 PolarHBondContact O-N 2.77Å; E137-K141 VanDerWaalsContact O-N 3.09Å; E137-K141 WeakPolarHBondContact OE1-CE 3.37Å; E137-K141 IonicContact OE1-NZ 2.64Å; E137-K141 PolarHBondContact OE1-NZ 3.28Å |
| 138 | T | 95.8 | Very high | 93.6 | Very high | 5 Ų | 5 | 31.3 Ų | 31.3 | 3% | 0.031 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.7 | -46.7 | -179.9 | -61.5 | 0 | 0 | 0 | 0 | 111.5 | L134 R135 A136 F140 K141 L142 M164 A178 M179 A182 | L134-T138 WeakPolarHBondContact O-CB 3.43Å; L134-T138 PolarHBondContact O-N 3.22Å; L134-T138 PolarHBondContact O-OG1 2.89Å; R135-T138 PolarHBondContact O-N 3.21Å; A136-T138 VanDerWaalsContact C-N 3.32Å; A136-T138 PolarHBondContact O-N 3.42Å; T138-F140 VanDerWaalsContact C-N 3.33Å; T138-K141 PolarHBondContact O-N 3.39Å; T138-L142 PolarHBondContact O-N 2.88Å; T138-M164 HydrophobicContact CG2-CE 3.82Å; T138-M164 HydrophobicContact CG2-SD 4.38Å; T138-A178 HydrophobicContact CG2-CB 4.28Å; T138-M179 HydrophobicContact CG2-CB 4.45Å; T138-M179 HydrophobicContact CG2-SD 3.88Å; T138-A182 HydrophobicContact CG2-CB 3.49Å; T138-A182 VanDerWaalsContact CG2-CB 3.49Å |
| 139 | L | 96.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -67.5 | -34.4 | 178.9 | -72.9 | -180 | 0 | 0 | 0 | 111.8 | R135 A136 L142 W143 V161 M164 V288 | R135-L139 HydrophobicContact CG-CD1 3.86Å; R135-L139 HydrophobicContact CG-CG 4.36Å; R135-L139 WeakPolarHBondContact O-CB 3.46Å; R135-L139 WeakPolarHBondContact O-CG 3.34Å; R135-L139 PolarHBondContact O-N 2.78Å; A136-L139 PolarHBondContact O-N 3.47Å; L139-L142 HydrophobicContact CD2-CD2 4.36Å; L139-L142 PolarHBondContact O-N 3.05Å; L139-W143 WeakPolarHBondContact O-CB 3.16Å; L139-W143 PolarHBondContact O-N 3.27Å; L139-V161 HydrophobicContact CD1-CG1 3.9Å; L139-V161 HydrophobicContact CD1-CG2 4.24Å; L139-V161 HydrophobicContact CD2-CG2 3.94Å; L139-M164 HydrophobicContact CD2-SD 3.53Å; L139-M164 VanDerWaalsContact CD2-SD 3.53Å; L139-M164 HydrophobicContact CG-SD 4.09Å; L139-V288 HydrophobicContact CB-CB 4.47Å; L139-V288 HydrophobicContact CB-CG1 4.15Å; L139-V288 HydrophobicContact CB-CG2 4.2Å |
| 140 | F | 94.6 | Very high | 93.1 | Very high | 37 Ų | 37 | 28.2 Ų | 28.2 | 16% | 0.162 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -63.9 | -43 | 173.8 | -171 | -100.1 | 0 | 0 | 0 | 112.2 | A136 E137 T138 L142 W143 S144 V288 T359 Y363 | A136-F140 VanDerWaalsContact O-CB 3.29Å; A136-F140 WeakPolarHBondContact O-CB 3.42Å; A136-F140 PolarHBondContact O-N 3.13Å; E137-F140 PolarHBondContact O-N 3.48Å; T138-F140 VanDerWaalsContact C-N 3.33Å; F140-L142 VanDerWaalsContact C-N 3.32Å; F140-L142 PolarHBondContact O-N 3.03Å; F140-W143 HydrophobicContact CD2-CE3 4.05Å; F140-W143 HydrophobicContact CD2-CZ3 4.41Å; F140-W143 AromaticContact CE2-CE3 3.76Å; F140-W143 HydrophobicContact CE2-CE3 3.76Å; F140-W143 AromaticContact CE2-CZ3 3.66Å; F140-W143 HydrophobicContact CE2-CZ3 3.66Å; F140-W143 HydrophobicContact CZ-CE3 4.25Å; F140-W143 AromaticContact CZ-CZ3 3.98Å; F140-W143 HydrophobicContact CZ-CZ3 3.98Å; F140-W143 WeakPolarHBondContact O-CB 3.39Å; F140-W143 PolarHBondContact O-N 3.33Å; F140-S144 PolarHBondContact O-N 3.16Å; F140-S144 PolarHBondContact O-OG 3.41Å; F140-S144 VanDerWaalsContact O-OG 3.06Å; F140-V288 HydrophobicContact CB-CG1 4.03Å; F140-T359 HydrophobicContact CE2-CG2 3.98Å; F140-Y363 HydrophobicContact CD1-CE2 4.18Å; F140-Y363 AromaticContact CE1-CD1 3.88Å; F140-Y363 HydrophobicContact CE1-CD1 3.88Å; F140-Y363 AromaticContact CE1-CD2 3.59Å; F140-Y363 HydrophobicContact CE1-CD2 3.59Å; F140-Y363 AromaticContact CE1-CE1 3.89Å; F140-Y363 HydrophobicContact CE1-CE1 3.89Å; F140-Y363 AromaticContact CE1-CE2 3.61Å; F140-Y363 HydrophobicContact CE1-CE2 3.61Å; F140-Y363 AromaticContact CE1-CG 3.73Å; F140-Y363 HydrophobicContact CE1-CG 3.73Å; F140-Y363 AromaticContact CE1-CZ 3.78Å; F140-Y363 AromaticContact CE2-CD2 3.87Å; F140-Y363 HydrophobicContact CE2-CD2 3.87Å; F140-Y363 HydrophobicContact CE2-CE2 4.3Å; F140-Y363 HydrophobicContact CE2-CG 4.41Å; F140-Y363 HydrophobicContact CZ-CD1 4.02Å; F140-Y363 AromaticContact CZ-CD2 3.21Å; F140-Y363 HydrophobicContact CZ-CD2 3.21Å; F140-Y363 HydrophobicContact CZ-CE1 4.42Å; F140-Y363 AromaticContact CZ-CE2 3.69Å; F140-Y363 HydrophobicContact CZ-CE2 3.69Å; F140-Y363 AromaticContact CZ-CG 3.4Å; F140-Y363 HydrophobicContact CZ-CG 3.4Å; F140-Y363 VanDerWaalsContact CZ-CG 3.4Å |
| 141 | K | 93.8 | Very high | 92.5 | Very high | 95 Ų | 95 | 29.7 Ų | 29.7 | 41% | 0.413 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.4 | -39.6 | 172.2 | -72.2 | 174.2 | -172.5 | 168.3 | 0 | 112 | E137 T138 S144 L145 M179 | E137-K141 WeakPolarHBondContact O-CG 3.47Å; E137-K141 PolarHBondContact O-N 2.77Å; E137-K141 VanDerWaalsContact O-N 3.09Å; E137-K141 WeakPolarHBondContact OE1-CE 3.37Å; E137-K141 IonicContact OE1-NZ 2.64Å; E137-K141 PolarHBondContact OE1-NZ 3.28Å; T138-K141 PolarHBondContact O-N 3.39Å; K141-S144 WeakPolarHBondContact CA-OG 3.26Å; K141-S144 PolarHBondContact O-OG 3.36Å; K141-L145 WeakPolarHBondContact O-CB 3.44Å; K141-L145 PolarHBondContact O-N 3.03Å; K141-M179 HydrophobicContact CB-CE 3.9Å; K141-M179 HydrophobicContact CB-SD 3.83Å; K141-M179 HydrophobicContact CD-SD 4.35Å |
| 142 | L | 95.8 | Very high | 92.3 | Very high | 1 Ų | 1 | 29.3 Ų | 29.3 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.4 | -41.7 | 175.8 | -176.5 | 67.7 | 0 | 0 | 0 | 111.7 | T138 L139 F140 L145 H146 F157 A160 M179 A182 Y186 | T138-L142 PolarHBondContact O-N 2.88Å; L139-L142 HydrophobicContact CD2-CD2 4.36Å; L139-L142 PolarHBondContact O-N 3.05Å; F140-L142 VanDerWaalsContact C-N 3.32Å; F140-L142 PolarHBondContact O-N 3.03Å; L142-L145 HydrophobicContact CD1-CD2 4.26Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 3.29Å; L142-H146 WeakPolarHBondContact O-CB 3.36Å; L142-H146 PolarHBondContact O-N 2.83Å; L142-F157 HydrophobicContact CB-CE2 4.44Å; L142-F157 HydrophobicContact CD2-CE2 4.21Å; L142-F157 HydrophobicContact CG-CE2 4.2Å; L142-A160 HydrophobicContact CD2-CB 4.38Å; L142-M179 HydrophobicContact CB-CE 4.33Å; L142-A182 HydrophobicContact CD2-CB 4.21Å; L142-Y186 HydrophobicContact CD1-CD1 4.22Å; L142-Y186 HydrophobicContact CD1-CD2 4.38Å; L142-Y186 HydrophobicContact CD1-CG 3.86Å |
| 143 | W | 94.6 | Very high | 92.3 | Very high | 14 Ų | 14 | 30.7 Ų | 30.7 | 5% | 0.053 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.1 | -44.1 | 179.7 | 173.1 | 81 | 0 | 0 | 0 | 112.9 | L139 F140 L145 H146 S147 F157 R281 E284 I285 | L139-W143 WeakPolarHBondContact O-CB 3.16Å; L139-W143 PolarHBondContact O-N 3.27Å; F140-W143 HydrophobicContact CD2-CE3 4.05Å; F140-W143 HydrophobicContact CD2-CZ3 4.41Å; F140-W143 AromaticContact CE2-CE3 3.76Å; F140-W143 HydrophobicContact CE2-CE3 3.76Å; F140-W143 AromaticContact CE2-CZ3 3.66Å; F140-W143 HydrophobicContact CE2-CZ3 3.66Å; F140-W143 HydrophobicContact CZ-CE3 4.25Å; F140-W143 AromaticContact CZ-CZ3 3.98Å; F140-W143 HydrophobicContact CZ-CZ3 3.98Å; F140-W143 WeakPolarHBondContact O-CB 3.39Å; F140-W143 PolarHBondContact O-N 3.33Å; W143-L145 VanDerWaalsContact C-N 3.32Å; W143-H146 WeakPolarHBondContact O-CB 3.49Å; W143-H146 PolarHBondContact O-N 3.16Å; W143-S147 PolarHBondContact O-N 3.31Å; W143-S147 PolarHBondContact O-OG 3.14Å; W143-S147 VanDerWaalsContact O-OG 3.04Å; W143-F157 HydrophobicContact CB-CE2 3.65Å; W143-F157 HydrophobicContact CB-CZ 3.66Å; W143-F157 AromaticContact CD1-CZ 3.97Å; W143-F157 HydrophobicContact CG-CE2 4.43Å; W143-F157 HydrophobicContact CG-CZ 4.23Å; W143-R281 VanDerWaalsContact CD1-NH1 3.31Å; W143-R281 VanDerWaalsContact CE2-NE 3.27Å; W143-R281 VanDerWaalsContact CE2-NH1 3.29Å; W143-R281 HydrophobicContact CZ2-CG 4.14Å; W143-E284 PolarHBondContact NE1-OE2 2.94Å; W143-E284 VanDerWaalsContact NE1-OE2 3.14Å; W143-I285 VanDerWaalsContact CE2-CG1 3.46Å; W143-I285 HydrophobicContact CH2-CD1 4.04Å; W143-I285 HydrophobicContact CH2-CG1 3.9Å; W143-I285 HydrophobicContact CZ2-CD1 3.47Å; W143-I285 VanDerWaalsContact CZ2-CD1 3.47Å; W143-I285 HydrophobicContact CZ2-CG1 3.08Å |
| 144 | S | 91.9 | Very high | 92.3 | Very high | 45 Ų | 45 | 27.9 Ų | 27.9 | 32% | 0.315 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -62.4 | -41.5 | 174.4 | 53.3 | 0 | 0 | 0 | 0 | 111.3 | F140 K141 S147 A148 | F140-S144 PolarHBondContact O-N 3.16Å; F140-S144 PolarHBondContact O-OG 3.41Å; F140-S144 VanDerWaalsContact O-OG 3.06Å; K141-S144 WeakPolarHBondContact CA-OG 3.26Å; K141-S144 PolarHBondContact O-OG 3.36Å; S144-S147 PolarHBondContact O-OG 2.96Å; S144-A148 WeakPolarHBondContact O-CB 3.36Å; S144-A148 PolarHBondContact O-N 3.29Å |
| 145 | L | 91.9 | Very high | 92.4 | Very high | 6 Ų | 6 | 28.3 Ų | 28.3 | 3% | 0.031 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.5 | -43.6 | 172.7 | 170.6 | 151.4 | 0 | 0 | 0 | 112 | K141 L142 W143 Y149 Y150 Y186 L206 L209 | K141-L145 WeakPolarHBondContact O-CB 3.44Å; K141-L145 PolarHBondContact O-N 3.03Å; L142-L145 HydrophobicContact CD1-CD2 4.26Å; L142-L145 WeakPolarHBondContact O-CB 3.47Å; L142-L145 PolarHBondContact O-N 3.29Å; W143-L145 VanDerWaalsContact C-N 3.32Å; L145-Y149 PolarHBondContact O-N 3.07Å; L145-Y150 HydrophobicContact CD1-CE2 4.26Å; L145-Y150 HydrophobicContact CD2-CD2 3.48Å; L145-Y150 VanDerWaalsContact CD2-CD2 3.48Å; L145-Y150 HydrophobicContact CD2-CE2 3.33Å; L145-Y150 HydrophobicContact CG-CD2 4.05Å; L145-Y150 HydrophobicContact CG-CE2 3.7Å; L145-Y150 WeakPolarHBondContact O-CD2 3.27Å; L145-Y186 HydrophobicContact CD2-CD1 4.28Å; L145-Y186 HydrophobicContact CD2-CE1 3.97Å; L145-L206 HydrophobicContact CD1-CD2 4.38Å; L145-L206 HydrophobicContact CD2-CD2 4.02Å; L145-L209 HydrophobicContact CD1-CB 3.84Å |
| 146 | H | 92.8 | Very high | 92.4 | Very high | 5 Ų | 5 | 28.4 Ų | 28.4 | 2% | 0.023 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -56.6 | -58.7 | 176.6 | 172.2 | 64.3 | 0 | 0 | 0 | 110.1 | L142 W143 A148 Y150 L152 F157 Y186 E284 | L142-H146 WeakPolarHBondContact O-CB 3.36Å; L142-H146 PolarHBondContact O-N 2.83Å; W143-H146 WeakPolarHBondContact O-CB 3.49Å; W143-H146 PolarHBondContact O-N 3.16Å; H146-A148 PolarHBondContact O-N 3.24Å; H146-Y150 CarbonylContact O-C 3.57Å; H146-Y150 PolarHBondContact O-N 3.47Å; H146-Y150 VanDerWaalsContact O-N 3.11Å; H146-L152 PolarHBondContact CE1-O 2.81Å; H146-L152 VanDerWaalsContact CE1-O 3.29Å; H146-F157 HydrophobicContact CB-CD2 4.18Å; H146-Y186 HydrophobicContact CB-CE2 4.15Å; H146-Y186 AromaticContact ND1-CE2 3.52Å; H146-Y186 AromaticContact ND1-CZ 3.57Å; H146-Y186 PolarHBondContact ND1-OH 2.97Å; H146-E284 IonicContact CD2-OE1 3.55Å; H146-E284 IonicContact CD2-OE2 3.64Å; H146-E284 IonicContact NE2-OE1 2.76Å; H146-E284 PolarHBondContact NE2-OE1 3.31Å |
| 147 | S | 89.9 | Confident | 92.5 | Very high | 23 Ų | 23 | 27 Ų | 27 | 16% | 0.161 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60.7 | -45.3 | -180 | 36.4 | 0 | 0 | 0 | 0 | 115.3 | W143 S144 R281 | W143-S147 PolarHBondContact O-N 3.31Å; W143-S147 PolarHBondContact O-OG 3.14Å; W143-S147 VanDerWaalsContact O-OG 3.04Å; S144-S147 PolarHBondContact O-OG 2.96Å; S147-R281 VanDerWaalsContact CB-NH1 3.26Å; S147-R281 PolarHBondContact OG-NH2 3.4Å |
| 148 | A | 88.2 | Confident | 92.6 | Very high | 17 Ų | 17 | 22.7 Ų | 22.7 | 14% | 0.14 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -79.3 | -36 | -163.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | S144 H146 S371 | S144-A148 WeakPolarHBondContact O-CB 3.36Å; S144-A148 PolarHBondContact O-N 3.29Å; H146-A148 PolarHBondContact O-N 3.24Å; A148-S371 WeakPolarHBondContact O-CB 3.45Å; A148-S371 PolarHBondContact O-N 2.94Å; A148-S371 PolarHBondContact O-OG 3.04Å |
| 149 | Y | 88 | Confident | 92.7 | Very high | 69 Ų | 69 | 22.7 Ų | 22.7 | 27% | 0.271 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -113.7 | -31.2 | -169.1 | -62 | -87.4 | 0 | 0 | 0 | 113.7 | L145 L209 L374 P379 | L145-Y149 PolarHBondContact O-N 3.07Å; Y149-L209 HydrophobicContact CD1-CD1 3.87Å; Y149-L209 HydrophobicContact CD1-CD2 3.91Å; Y149-L209 HydrophobicContact CE1-CD1 4.48Å; Y149-L209 HydrophobicContact CE1-CD2 3.68Å; Y149-L209 HydrophobicContact CG-CD1 3.94Å; Y149-L209 HydrophobicContact CG-CD2 4.49Å; Y149-L374 WeakPolarHBondContact O-CD1 3.15Å; Y149-P379 HydrophobicContact CE1-CG 3.75Å |
| 150 | Y | 87.8 | Confident | 92.8 | Very high | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.016 | 12% | 0.123 | C | C | . | . | trans | -116.6 | 119.2 | -171 | -61.9 | -72 | 0 | 0 | 0 | 110.4 | L145 H146 L152 Y186 P201 S205 L206 L209 L374 | L145-Y150 HydrophobicContact CD1-CE2 4.26Å; L145-Y150 HydrophobicContact CD2-CD2 3.48Å; L145-Y150 VanDerWaalsContact CD2-CD2 3.48Å; L145-Y150 HydrophobicContact CD2-CE2 3.33Å; L145-Y150 HydrophobicContact CG-CD2 4.05Å; L145-Y150 HydrophobicContact CG-CE2 3.7Å; L145-Y150 WeakPolarHBondContact O-CD2 3.27Å; H146-Y150 CarbonylContact O-C 3.57Å; H146-Y150 PolarHBondContact O-N 3.47Å; H146-Y150 VanDerWaalsContact O-N 3.11Å; Y150-L152 PolarHBondContact O-N 3.46Å; Y150-Y186 VanDerWaalsContact CB-OH 3.31Å; Y150-Y186 WeakPolarHBondContact CB-OH 3.46Å; Y150-Y186 AromaticContact CD2-CE1 3.96Å; Y150-Y186 HydrophobicContact CD2-CE1 3.96Å; Y150-Y186 HydrophobicContact CE2-CE1 4.39Å; Y150-Y186 HydrophobicContact CG-CE1 4.3Å; Y150-P201 HydrophobicContact CD1-CB 4.08Å; Y150-P201 VanDerWaalsContact CE1-CA 3.5Å; Y150-P201 HydrophobicContact CE1-CB 3.57Å; Y150-P201 HydrophobicContact CE2-CB 4.48Å; Y150-S205 WeakPolarHBondContact OH-CB 3.24Å; Y150-S205 PolarHBondContact OH-OG 3.01Å; Y150-L206 HydrophobicContact CE2-CD2 3.92Å; Y150-L209 HydrophobicContact CE2-CD1 4.25Å; Y150-L374 HydrophobicContact CD1-CD1 4.17Å; Y150-L374 HydrophobicContact CE1-CD1 3.98Å | ||
| 151 | S | 81.9 | Confident | 92.9 | Very high | 35 Ų | 35 | 21.1 Ų | 21.1 | 25% | 0.245 | 12% | 0.117 | C | C | . | . | trans | -78.4 | 32.3 | 178 | 66.5 | 0 | 0 | 0 | 0 | 112.9 | H198 V199 | S151-H198 WeakPolarHBondContact O-CB 3.35Å; S151-H198 PolarHBondContact O-CD2 3.38Å; S151-H198 VanDerWaalsContact O-CD2 3.32Å; S151-H198 PolarHBondContact O-CE1 2.99Å; S151-H198 VanDerWaalsContact O-CE1 3.27Å; S151-H198 PolarHBondContact O-ND1 3.25Å; S151-H198 VanDerWaalsContact OG-CA 3.31Å; S151-H198 WeakPolarHBondContact OG-CA 3.34Å; S151-H198 WeakPolarHBondContact OG-CB 3.49Å; S151-H198 PolarHBondContact OG-ND1 3.42Å; S151-V199 PolarHBondContact OG-N 2.99Å | ||
| 152 | L | 91.8 | Very high | 93 | Very high | 12 Ų | 12 | 16.9 Ų | 16.9 | 6% | 0.063 | 10% | 0.099 | C | C | . | . | trans | -74.1 | 159.2 | 180 | -58.9 | -176.2 | 0 | 0 | 0 | 110.6 | H146 Y150 I156 Y186 E193 H198 P201 | H146-L152 PolarHBondContact CE1-O 2.81Å; H146-L152 VanDerWaalsContact CE1-O 3.29Å; Y150-L152 PolarHBondContact O-N 3.46Å; L152-I156 HydrophobicContact CB-CB 4.38Å; L152-I156 HydrophobicContact CB-CG1 4.39Å; L152-I156 HydrophobicContact CD1-CG2 3.96Å; L152-Y186 HydrophobicContact CD1-CE1 4.25Å; L152-Y186 HydrophobicContact CD1-CE2 4.22Å; L152-Y186 WeakPolarHBondContact CD1-OH 3.28Å; L152-E193 HydrophobicContact CD2-CB 4.21Å; L152-E193 HydrophobicContact CD2-CG 3.94Å; L152-H198 HydrophobicContact CD2-CB 3.94Å; L152-P201 HydrophobicContact CD1-CG 4.37Å | ||
| 153 | S | 92.3 | Very high | 93.1 | Very high | 43 Ų | 43 | 16.9 Ų | 16.9 | 30% | 0.301 | 10% | 0.099 | S | C | . | . | trans | -64.3 | 144.4 | 174.3 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | I155 I156 E193 | S153-I155 PolarHBondContact O-N 3.24Å; S153-I155 VanDerWaalsContact O-N 3.09Å; S153-I155 PolarHBondContact OG-N 3.4Å; S153-I156 VanDerWaalsContact O-CB 3.24Å; S153-I156 WeakPolarHBondContact O-CB 3.18Å; S153-I156 PolarHBondContact O-N 3.04Å; S153-E193 VanDerWaalsContact CB-OE2 3.26Å; S153-E193 WeakPolarHBondContact CB-OE2 3.44Å; S153-E193 PolarHBondContact N-OE2 3.46Å | ||
| 154 | S | 93.8 | Very high | 93.2 | Very high | 12 Ų | 12 | 16.3 Ų | 16.3 | 8% | 0.084 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -54.5 | -26.4 | 171.6 | -58.1 | 0 | 0 | 0 | 0 | 114.1 | I156 F157 C158 C280 E284 | S154-I156 PolarHBondContact O-N 3.14Å; S154-F157 PolarHBondContact O-N 2.72Å; S154-C158 PolarHBondContact O-N 2.88Å; S154-C158 PolarHBondContact O-SG 2.85Å; S154-C280 WeakPolarHBondContact OG-CB 3.49Å; S154-E284 WeakPolarHBondContact CA-OE1 3.49Å; S154-E284 WeakPolarHBondContact CB-OE1 3.48Å; S154-E284 PolarHBondContact OG-OE1 3Å |
| 155 | I | 95.2 | Very high | 93.4 | Very high | 39 Ų | 39 | 14.5 Ų | 14.5 | 20% | 0.2 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -61.6 | -35.6 | 173.8 | -65.5 | 172.4 | 0 | 0 | 0 | 110.7 | S153 C158 K159 T244 I246 | S153-I155 PolarHBondContact O-N 3.24Å; S153-I155 VanDerWaalsContact O-N 3.09Å; S153-I155 PolarHBondContact OG-N 3.4Å; I155-C158 PolarHBondContact O-N 3.27Å; I155-K159 HydrophobicContact CG2-CD 4.18Å; I155-K159 WeakPolarHBondContact O-CG 3.47Å; I155-K159 PolarHBondContact O-N 2.65Å; I155-T244 HydrophobicContact CG2-CG2 4.16Å; I155-I246 HydrophobicContact CD1-CG2 4.44Å; I155-I246 HydrophobicContact CG1-CB 4.18Å; I155-I246 HydrophobicContact CG1-CD1 4.48Å; I155-I246 HydrophobicContact CG1-CG2 4.06Å |
| 156 | I | 95.9 | Very high | 93.6 | Very high | 5 Ų | 5 | 16.3 Ų | 16.3 | 3% | 0.026 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -66 | -42.7 | 177.3 | -57.7 | -55.4 | 0 | 0 | 0 | 110.5 | L152 S153 S154 K159 A160 Y186 E193 | L152-I156 HydrophobicContact CB-CB 4.38Å; L152-I156 HydrophobicContact CB-CG1 4.39Å; L152-I156 HydrophobicContact CD1-CG2 3.96Å; S153-I156 VanDerWaalsContact O-CB 3.24Å; S153-I156 WeakPolarHBondContact O-CB 3.18Å; S153-I156 PolarHBondContact O-N 3.04Å; S154-I156 PolarHBondContact O-N 3.14Å; I156-K159 PolarHBondContact O-N 2.87Å; I156-A160 WeakPolarHBondContact O-CB 3.45Å; I156-A160 PolarHBondContact O-N 3.03Å; I156-Y186 HydrophobicContact CG2-CE2 4.29Å; I156-E193 HydrophobicContact CD1-CB 4.17Å; I156-E193 HydrophobicContact CG1-CB 4.26Å; I156-E193 VanDerWaalsContact CG1-OE2 3.24Å; I156-E193 WeakPolarHBondContact CG1-OE2 3.39Å |
| 157 | F | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 174.6 | 180 | -95.5 | 0 | 0 | 0 | 111.6 | L142 W143 H146 S154 K159 A160 V161 E284 V288 | L142-F157 HydrophobicContact CB-CE2 4.44Å; L142-F157 HydrophobicContact CD2-CE2 4.21Å; L142-F157 HydrophobicContact CG-CE2 4.2Å; W143-F157 HydrophobicContact CB-CE2 3.65Å; W143-F157 HydrophobicContact CB-CZ 3.66Å; W143-F157 AromaticContact CD1-CZ 3.97Å; W143-F157 HydrophobicContact CG-CE2 4.43Å; W143-F157 HydrophobicContact CG-CZ 4.23Å; H146-F157 HydrophobicContact CB-CD2 4.18Å; S154-F157 PolarHBondContact O-N 2.72Å; F157-K159 VanDerWaalsContact C-N 3.28Å; F157-K159 PolarHBondContact O-N 3.02Å; F157-A160 WeakPolarHBondContact O-CA 3.44Å; F157-A160 WeakPolarHBondContact O-CB 3.33Å; F157-A160 PolarHBondContact O-N 3.34Å; F157-V161 HydrophobicContact CD1-CG2 4.06Å; F157-V161 HydrophobicContact CE1-CG2 3.56Å; F157-V161 HydrophobicContact CE2-CG2 4.34Å; F157-V161 HydrophobicContact CZ-CG2 3.71Å; F157-V161 WeakPolarHBondContact O-CG2 3.36Å; F157-V161 PolarHBondContact O-N 3.17Å; F157-E284 HydrophobicContact CB-CG 4.41Å; F157-E284 HydrophobicContact CD1-CB 3.74Å; F157-E284 HydrophobicContact CD1-CG 3.71Å; F157-E284 HydrophobicContact CE1-CB 3.92Å; F157-E284 HydrophobicContact CE1-CG 4.41Å; F157-E284 WeakPolarHBondContact CE1-O 3.49Å; F157-E284 HydrophobicContact CG-CG 4.31Å; F157-V288 HydrophobicContact CZ-CG2 4.38Å |
| 158 | C | 96.6 | Very high | 94 | Very high | 9 Ų | 9 | 16 Ų | 16 | 6% | 0.061 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -56.1 | -43 | 176.7 | -63 | 0 | 0 | 0 | 0 | 112 | S154 I155 A160 V161 C162 T244 L287 | S154-C158 PolarHBondContact O-N 2.88Å; S154-C158 PolarHBondContact O-SG 2.85Å; I155-C158 PolarHBondContact O-N 3.27Å; C158-A160 VanDerWaalsContact C-N 3.35Å; C158-V161 PolarHBondContact O-N 3.48Å; C158-C162 PolarHBondContact O-N 3.01Å; C158-C162 VanDerWaalsContact O-N 3.09Å; C158-T244 HydrophobicContact CB-CG2 3.99Å; C158-L287 HydrophobicContact CB-CD1 4.04Å |
| 159 | K | 97.2 | Very high | 94.2 | Very high | 5 Ų | 5 | 17.7 Ų | 17.7 | 2% | 0.022 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -67.4 | -34.7 | 176 | -72.3 | 174.5 | 175.6 | 179.2 | 0 | 112.3 | I155 I156 F157 C162 L163 T189 I238 G239 C241 T244 | I155-K159 HydrophobicContact CG2-CD 4.18Å; I155-K159 WeakPolarHBondContact O-CG 3.47Å; I155-K159 PolarHBondContact O-N 2.65Å; I156-K159 PolarHBondContact O-N 2.87Å; F157-K159 VanDerWaalsContact C-N 3.28Å; F157-K159 PolarHBondContact O-N 3.02Å; K159-C162 PolarHBondContact O-N 2.91Å; K159-L163 PolarHBondContact O-N 3.17Å; K159-T189 HydrophobicContact CB-CG2 3.72Å; K159-I238 HydrophobicContact CB-CG2 4.46Å; K159-I238 VanDerWaalsContact CE-O 3.27Å; K159-I238 WeakPolarHBondContact CE-O 3.27Å; K159-I238 HydrophobicContact CG-CG2 4.49Å; K159-G239 PolarHBondContact NZ-O 3.24Å; K159-C241 WeakPolarHBondContact CE-O 3.49Å; K159-C241 PolarHBondContact NZ-O 3.29Å; K159-T244 HydrophobicContact CG-CG2 4.33Å |
| 160 | A | 97.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65.8 | -43 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L142 I156 F157 C158 L163 M164 Y186 T189 | L142-A160 HydrophobicContact CD2-CB 4.38Å; I156-A160 WeakPolarHBondContact O-CB 3.45Å; I156-A160 PolarHBondContact O-N 3.03Å; F157-A160 WeakPolarHBondContact O-CA 3.44Å; F157-A160 WeakPolarHBondContact O-CB 3.33Å; F157-A160 PolarHBondContact O-N 3.34Å; C158-A160 VanDerWaalsContact C-N 3.35Å; A160-L163 PolarHBondContact O-N 2.95Å; A160-M164 WeakPolarHBondContact O-CB 3.36Å; A160-M164 PolarHBondContact O-N 3.3Å; A160-Y186 HydrophobicContact CB-CD2 4Å; A160-T189 HydrophobicContact CB-CG2 4.47Å; A160-T189 WeakPolarHBondContact CB-OG1 2.9Å |
| 161 | V | 97.1 | Very high | 94.8 | Very high | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.024 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -57.7 | -51.3 | 172.9 | 175.9 | 0 | 0 | 0 | 0 | 109.8 | L139 F157 C158 L163 M164 D165 L287 | L139-V161 HydrophobicContact CD1-CG1 3.9Å; L139-V161 HydrophobicContact CD1-CG2 4.24Å; L139-V161 HydrophobicContact CD2-CG2 3.94Å; F157-V161 HydrophobicContact CD1-CG2 4.06Å; F157-V161 HydrophobicContact CE1-CG2 3.56Å; F157-V161 HydrophobicContact CE2-CG2 4.34Å; F157-V161 HydrophobicContact CZ-CG2 3.71Å; F157-V161 WeakPolarHBondContact O-CG2 3.36Å; F157-V161 PolarHBondContact O-N 3.17Å; C158-V161 PolarHBondContact O-N 3.48Å; V161-L163 PolarHBondContact O-N 2.82Å; V161-M164 WeakPolarHBondContact O-CB 3.46Å; V161-M164 PolarHBondContact O-N 3.06Å; V161-M164 VanDerWaalsContact O-N 3.12Å; V161-D165 VanDerWaalsContact O-CG 3.28Å; V161-D165 PolarHBondContact O-N 3.46Å; V161-L287 HydrophobicContact CG1-CB 4.44Å |
| 162 | C | 96.2 | Very high | 95.4 | Very high | 7 Ų | 7 | 26.9 Ų | 26.9 | 5% | 0.047 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -56.3 | -46.4 | 177.9 | 176 | 0 | 0 | 0 | 0 | 112.8 | L112 I114 C158 K159 M164 D165 L166 | L112-C162 HydrophobicContact CD2-CB 4.05Å; L112-C162 VanDerWaalsContact CD2-SG 3.53Å; I114-C162 HydrophobicContact CD1-CB 4.33Å; I114-C162 WeakPolarHBondContact CD1-O 3.5Å; I114-C162 WeakPolarHBondContact CD1-SG 3.33Å; C158-C162 PolarHBondContact O-N 3.01Å; C158-C162 VanDerWaalsContact O-N 3.09Å; K159-C162 PolarHBondContact O-N 2.91Å; C162-M164 VanDerWaalsContact C-N 3.34Å; C162-M164 PolarHBondContact O-N 3.07Å; C162-D165 PolarHBondContact O-N 3.07Å; C162-L166 WeakPolarHBondContact O-CB 3.5Å; C162-L166 PolarHBondContact O-N 3.18Å |
| 163 | L | 97.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.1 | -38.1 | 177.1 | -76.8 | -172.6 | 0 | 0 | 0 | 113.1 | K159 A160 V161 L167 C185 I188 T189 L230 V235 I238 | K159-L163 PolarHBondContact O-N 3.17Å; A160-L163 PolarHBondContact O-N 2.95Å; V161-L163 PolarHBondContact O-N 2.82Å; L163-L167 WeakPolarHBondContact O-CB 3.27Å; L163-L167 PolarHBondContact O-N 3.38Å; L163-L167 VanDerWaalsContact O-N 3.1Å; L163-C185 HydrophobicContact CB-CB 4.02Å; L163-I188 HydrophobicContact CD1-CB 4.26Å; L163-I188 HydrophobicContact CD1-CG2 3.77Å; L163-T189 HydrophobicContact CD1-CG2 3.49Å; L163-T189 VanDerWaalsContact CD1-CG2 3.49Å; L163-T189 HydrophobicContact CG-CG2 4.15Å; L163-L230 HydrophobicContact CD2-CD1 3.98Å; L163-V235 HydrophobicContact CD1-CG1 4.26Å; L163-V235 HydrophobicContact CD2-CG1 4.5Å; L163-V235 HydrophobicContact CD2-CG2 4.15Å; L163-I238 HydrophobicContact CD2-CB 4.24Å; L163-I238 HydrophobicContact CD2-CD1 3.59Å; L163-I238 HydrophobicContact CD2-CG2 4.03Å; L163-I238 HydrophobicContact CG-CG2 4.18Å |
| 164 | M | 97.2 | Very high | 95.7 | Very high | 2 Ų | 2 | 28.8 Ų | 28.8 | 1% | 0.01 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63.4 | -48.8 | 176.5 | 178.5 | 171.4 | 170.9 | 0 | 0 | 110.6 | T138 L139 A160 V161 C162 L166 L167 V168 V181 A182 C185 | T138-M164 HydrophobicContact CG2-CE 3.82Å; T138-M164 HydrophobicContact CG2-SD 4.38Å; L139-M164 HydrophobicContact CD2-SD 3.53Å; L139-M164 VanDerWaalsContact CD2-SD 3.53Å; L139-M164 HydrophobicContact CG-SD 4.09Å; A160-M164 WeakPolarHBondContact O-CB 3.36Å; A160-M164 PolarHBondContact O-N 3.3Å; V161-M164 WeakPolarHBondContact O-CB 3.46Å; V161-M164 PolarHBondContact O-N 3.06Å; V161-M164 VanDerWaalsContact O-N 3.12Å; C162-M164 VanDerWaalsContact C-N 3.34Å; C162-M164 PolarHBondContact O-N 3.07Å; M164-L166 VanDerWaalsContact C-N 3.34Å; M164-L166 PolarHBondContact O-N 3.47Å; M164-L167 WeakPolarHBondContact O-CB 3.4Å; M164-L167 PolarHBondContact O-N 3.25Å; M164-V168 HydrophobicContact CG-CG2 4.49Å; M164-V168 WeakPolarHBondContact O-CG2 3.24Å; M164-V168 PolarHBondContact O-N 3.3Å; M164-V181 HydrophobicContact CG-CG1 4.32Å; M164-A182 HydrophobicContact CE-CB 4.41Å; M164-A182 HydrophobicContact SD-CB 3.61Å; M164-C185 HydrophobicContact CB-CB 4.47Å |
| 165 | D | 96.3 | Very high | 95.7 | Very high | 7 Ų | 7 | 30 Ų | 30 | 4% | 0.037 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61 | -43.9 | 179.8 | -69.4 | -7.8 | 0 | 0 | 0 | 111.5 | I114 N116 R135 V161 C162 L167 V168 A169 | I114-D165 HydrophobicContact CB-CB 4.36Å; I114-D165 HydrophobicContact CD1-CB 3.94Å; I114-D165 HydrophobicContact CG2-CB 4.13Å; N116-D165 VanDerWaalsContact ND2-CG 3.27Å; N116-D165 PolarHBondContact ND2-OD2 3.5Å; N116-D165 WeakPolarHBondContact OD1-CB 3.43Å; R135-D165 IonicContact CZ-OD1 3.52Å; R135-D165 IonicContact CZ-OD2 2.84Å; R135-D165 IonicContact NE-OD1 3.66Å; R135-D165 PolarHBondContact NE-OD1 2.93Å; R135-D165 IonicContact NE-OD2 3.09Å; R135-D165 IonicContact NH2-OD1 2.69Å; R135-D165 PolarHBondContact NH2-OD1 3.48Å; R135-D165 IonicContact NH2-OD2 3.5Å; R135-D165 PolarHBondContact NH2-OD2 2.96Å; V161-D165 VanDerWaalsContact O-CG 3.28Å; V161-D165 PolarHBondContact O-N 3.46Å; C162-D165 PolarHBondContact O-N 3.07Å; D165-L167 VanDerWaalsContact C-N 3.28Å; D165-L167 PolarHBondContact O-N 3.16Å; D165-V168 PolarHBondContact O-N 3.2Å; D165-A169 WeakPolarHBondContact O-CB 3.45Å; D165-A169 PolarHBondContact O-N 3.49Å |
| 166 | L | 95.5 | Very high | 95.7 | Very high | 44 Ų | 44 | 34.7 Ų | 34.7 | 23% | 0.23 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63 | -37.8 | 178.2 | -171.7 | 62.3 | 0 | 0 | 0 | 111.6 | I114 C162 M164 K170 L230 I238 | I114-L166 HydrophobicContact CD1-CB 3.68Å; I114-L166 HydrophobicContact CD1-CD1 4.42Å; I114-L166 HydrophobicContact CG1-CB 4.47Å; I114-L166 HydrophobicContact CG1-CD1 4.35Å; C162-L166 WeakPolarHBondContact O-CB 3.5Å; C162-L166 PolarHBondContact O-N 3.18Å; M164-L166 VanDerWaalsContact C-N 3.34Å; M164-L166 PolarHBondContact O-N 3.47Å; L166-K170 VanDerWaalsContact O-CB 3.3Å; L166-K170 WeakPolarHBondContact O-CB 3.49Å; L166-K170 PolarHBondContact O-N 3.42Å; L166-L230 HydrophobicContact CB-CD2 4.33Å; L166-L230 HydrophobicContact CD2-CD1 4.25Å; L166-L230 HydrophobicContact CD2-CD2 3.99Å; L166-L230 HydrophobicContact CG-CD2 3.76Å; L166-I238 HydrophobicContact CD2-CD1 3.69Å |
| 167 | L | 96.3 | Very high | 95.7 | Very high | 6 Ų | 6 | 39.3 Ų | 39.3 | 3% | 0.031 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -68.3 | -44.6 | 177.2 | -172.1 | 77.2 | 0 | 0 | 0 | 111.4 | L163 M164 D165 A169 K170 V171 V173 V181 I226 K229 L230 | L163-L167 WeakPolarHBondContact O-CB 3.27Å; L163-L167 PolarHBondContact O-N 3.38Å; L163-L167 VanDerWaalsContact O-N 3.1Å; M164-L167 WeakPolarHBondContact O-CB 3.4Å; M164-L167 PolarHBondContact O-N 3.25Å; D165-L167 VanDerWaalsContact C-N 3.28Å; D165-L167 PolarHBondContact O-N 3.16Å; L167-A169 VanDerWaalsContact C-N 3.35Å; L167-K170 PolarHBondContact O-N 3.11Å; L167-V171 HydrophobicContact CD1-CG2 4.29Å; L167-V171 WeakPolarHBondContact O-CB 3.44Å; L167-V171 PolarHBondContact O-N 3.15Å; L167-V173 HydrophobicContact CD2-CG2 4.31Å; L167-V173 HydrophobicContact CG-CG2 4.48Å; L167-V181 HydrophobicContact CD2-CB 4.43Å; L167-V181 HydrophobicContact CD2-CG1 3.45Å; L167-V181 VanDerWaalsContact CD2-CG1 3.45Å; L167-V181 HydrophobicContact CD2-CG2 4.1Å; L167-I226 HydrophobicContact CD1-CG1 4.18Å; L167-I226 HydrophobicContact CD1-CG2 4.5Å; L167-I226 HydrophobicContact CD2-CD1 4.22Å; L167-I226 HydrophobicContact CD2-CG1 3.74Å; L167-K229 HydrophobicContact CD1-CB 4.11Å; L167-L230 HydrophobicContact CB-CD1 4.46Å; L167-L230 HydrophobicContact CB-CD2 4.43Å; L167-L230 HydrophobicContact CD1-CD2 4.16Å; L167-L230 HydrophobicContact CD1-CG 4.09Å |
| 168 | V | 95.2 | Very high | 95.6 | Very high | 17 Ų | 17 | 39.4 Ų | 39.4 | 10% | 0.103 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.6 | -39.8 | -179.8 | 177.3 | 0 | 0 | 0 | 0 | 110.8 | L119 V130 M164 D165 K170 V171 V173 | L119-V168 HydrophobicContact CD2-CG1 3.57Å; V130-V168 HydrophobicContact CB-CG1 4.15Å; V130-V168 HydrophobicContact CG1-CG1 4.48Å; M164-V168 HydrophobicContact CG-CG2 4.49Å; M164-V168 WeakPolarHBondContact O-CG2 3.24Å; M164-V168 PolarHBondContact O-N 3.3Å; D165-V168 PolarHBondContact O-N 3.2Å; V168-K170 VanDerWaalsContact C-N 3.26Å; V168-K170 PolarHBondContact O-N 3.45Å; V168-V171 VanDerWaalsContact O-O 3.08Å; V168-V173 HydrophobicContact CG2-CB 4.44Å; V168-V173 HydrophobicContact CG2-CG2 4.13Å |
| 169 | A | 93.4 | Very high | 95.7 | Very high | 52 Ų | 52 | 40.1 Ų | 40.1 | 43% | 0.43 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -63.3 | -31.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I114 D165 L167 | I114-A169 HydrophobicContact CG2-CB 4.37Å; D165-A169 WeakPolarHBondContact O-CB 3.45Å; D165-A169 PolarHBondContact O-N 3.49Å; L167-A169 VanDerWaalsContact C-N 3.35Å |
| 170 | K | 93.7 | Very high | 95.6 | Very high | 132 Ų | 132 | 40.4 Ų | 40.4 | 57% | 0.574 | 20% | 0.199 | S | C | * | . | H | α-helix | trans | -94.6 | -25.6 | -175.3 | -165 | 174.8 | -172.2 | 175.1 | 0 | 114.2 | L166 L167 V168 K229 L230 | L166-K170 VanDerWaalsContact O-CB 3.3Å; L166-K170 WeakPolarHBondContact O-CB 3.49Å; L166-K170 PolarHBondContact O-N 3.42Å; L167-K170 PolarHBondContact O-N 3.11Å; V168-K170 VanDerWaalsContact C-N 3.26Å; V168-K170 PolarHBondContact O-N 3.45Å; K170-K229 WeakPolarHBondContact CD-O 3.39Å; K170-K229 VanDerWaalsContact CE-O 3.27Å; K170-K229 WeakPolarHBondContact CE-O 3.16Å; K170-K229 PolarHBondContact NZ-O 2.86Å; K170-L230 HydrophobicContact CD-CD2 4.11Å |
| 171 | V | 93.9 | Very high | 95.6 | Very high | 45 Ų | 45 | 40.5 Ų | 40.5 | 27% | 0.273 | 20% | 0.2 | S | C | . | . | S | Bend | trans | -137.2 | 138.1 | -170.5 | -175.2 | 0 | 0 | 0 | 0 | 110.2 | L167 V168 V173 K229 | L167-V171 HydrophobicContact CD1-CG2 4.29Å; L167-V171 WeakPolarHBondContact O-CB 3.44Å; L167-V171 PolarHBondContact O-N 3.15Å; V168-V171 VanDerWaalsContact O-O 3.08Å; V171-V173 PolarHBondContact O-N 2.99Å; V171-K229 HydrophobicContact CG2-CB 4.07Å; V171-K229 HydrophobicContact CG2-CD 4.08Å; V171-K229 HydrophobicContact CG2-CG 4.08Å |
| 172 | K | 94.3 | Very high | 95.7 | Very high | 123 Ų | 123 | 40.3 Ų | 40.3 | 54% | 0.535 | 20% | 0.198 | S | C | . | . | trans | -63.9 | 96.9 | 169.4 | -166.5 | -177.9 | 174.4 | 166.5 | 0 | 110.4 | D127 D128 K129 | D127-K172 WeakPolarHBondContact O-CE 3.44Å; D127-K172 PolarHBondContact O-NZ 3.11Å; D128-K172 WeakPolarHBondContact O-CE 3.35Å; K129-K172 HydrophobicContact CD-CG 4.15Å; K129-K172 HydrophobicContact CG-CD 4.12Å; K129-K172 VanDerWaalsContact CG-CE 3.45Å; K129-K172 HydrophobicContact CG-CG 3.7Å | ||
| 173 | V | 96.1 | Very high | 95.8 | Very high | 13 Ų | 13 | 40 Ų | 40 | 8% | 0.079 | 20% | 0.196 | C | C | . | . | trans | -89.3 | 123.9 | 174.2 | -179.2 | 0 | 0 | 0 | 0 | 109.2 | K129 V130 L167 V168 V171 V181 | K129-V173 CarbonylContact C-O 3.26Å; K129-V173 WeakPolarHBondContact CA-O 3.36Å; V130-V173 HydrophobicContact CG2-CB 3.92Å; V130-V173 HydrophobicContact CG2-CG1 3.75Å; V130-V173 PolarHBondContact N-O 2.96Å; V130-V173 VanDerWaalsContact N-O 3.1Å; L167-V173 HydrophobicContact CD2-CG2 4.31Å; L167-V173 HydrophobicContact CG-CG2 4.48Å; V168-V173 HydrophobicContact CG2-CB 4.44Å; V168-V173 HydrophobicContact CG2-CG2 4.13Å; V171-V173 PolarHBondContact O-N 2.99Å; V173-V181 HydrophobicContact CG1-CG2 4Å | ||
| 174 | K | 95.1 | Very high | 95.8 | Very high | 83 Ų | 83 | 40 Ų | 40 | 36% | 0.361 | 20% | 0.196 | S | C | . | . | trans | -75.8 | 144.8 | 175.1 | -61.3 | -170 | 176.2 | -131 | 0 | 111 | D128 K176 Y177 | D128-K174 VanDerWaalsContact OD2-CD 3.28Å; D128-K174 WeakPolarHBondContact OD2-CD 3.31Å; D128-K174 WeakPolarHBondContact OD2-CE 3.41Å; D128-K174 IonicContact OD2-NZ 3.92Å; D128-K174 PolarHBondContact OD2-NZ 3.33Å; K174-K176 VanDerWaalsContact C-N 3.27Å; K174-K176 HydrophobicContact CB-CG 4.1Å; K174-K176 PolarHBondContact O-N 3.28Å; K174-K176 VanDerWaalsContact O-N 3.14Å; K174-Y177 HydrophobicContact CB-CD2 4.01Å; K174-Y177 HydrophobicContact CB-CE2 4.46Å; K174-Y177 HydrophobicContact CD-CE2 4.47Å; K174-Y177 PolarHBondContact O-N 3.47Å | ||
| 175 | P | 94.4 | Very high | 95.9 | Very high | 36 Ų | 36 | 39.9 Ų | 39.9 | 23% | 0.234 | 20% | 0.196 | C | C | . | . | G | 310 helix | trans | -48.8 | -43.5 | 179.3 | -34.2 | 38.4 | 0 | 0 | 0 | 114.8 | D128 L134 Y177 A178 | D128-P175 WeakPolarHBondContact OD1-CD 3.46Å; L134-P175 VanDerWaalsContact CD2-CA 3.48Å; L134-P175 HydrophobicContact CD2-CB 3.46Å; L134-P175 VanDerWaalsContact CD2-CB 3.46Å; L134-P175 HydrophobicContact CD2-CG 3.98Å; P175-Y177 PolarHBondContact O-N 2.85Å; P175-A178 VanDerWaalsContact O-CB 3.3Å; P175-A178 WeakPolarHBondContact O-CB 3.14Å; P175-A178 PolarHBondContact O-N 3.23Å |
| 176 | K | 93.5 | Very high | 96 | Very high | 138 Ų | 138 | 39.6 Ų | 39.6 | 60% | 0.6 | 19% | 0.194 | S | C | * | . | G | 310 helix | trans | -58.9 | -17.1 | 179.1 | 62.1 | 164 | 165.1 | 166.9 | 0 | 115.5 | K174 | K174-K176 VanDerWaalsContact C-N 3.27Å; K174-K176 HydrophobicContact CB-CG 4.1Å; K174-K176 PolarHBondContact O-N 3.28Å; K174-K176 VanDerWaalsContact O-N 3.14Å |
| 177 | Y | 95.5 | Very high | 96.1 | Very high | 103 Ų | 103 | 39.8 Ų | 39.8 | 40% | 0.404 | 19% | 0.192 | S | C | . | . | G | 310 helix | trans | -106.5 | -2.7 | 179.8 | -59.9 | -54.7 | 0 | 0 | 0 | 113 | K174 P175 M179 C180 V181 | K174-Y177 HydrophobicContact CB-CD2 4.01Å; K174-Y177 HydrophobicContact CB-CE2 4.46Å; K174-Y177 HydrophobicContact CD-CE2 4.47Å; K174-Y177 PolarHBondContact O-N 3.47Å; P175-Y177 PolarHBondContact O-N 2.85Å; Y177-M179 PolarHBondContact O-N 3.45Å; Y177-C180 PolarHBondContact O-N 3.08Å; Y177-C180 VanDerWaalsContact O-N 3.1Å; Y177-V181 WeakPolarHBondContact O-CG2 3.48Å; Y177-V181 PolarHBondContact O-N 3.3Å |
| 178 | A | 96.2 | Very high | 96.2 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.008 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -54.4 | -51.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V130 L134 T138 P175 C180 V181 A182 | V130-A178 HydrophobicContact CG2-CB 4.13Å; L134-A178 HydrophobicContact CD2-CB 4.12Å; L134-A178 HydrophobicContact CG-CB 4.24Å; T138-A178 HydrophobicContact CG2-CB 4.28Å; P175-A178 VanDerWaalsContact O-CB 3.3Å; P175-A178 WeakPolarHBondContact O-CB 3.14Å; P175-A178 PolarHBondContact O-N 3.23Å; A178-C180 VanDerWaalsContact C-N 3.35Å; A178-C180 PolarHBondContact O-N 3.27Å; A178-V181 WeakPolarHBondContact O-CB 3.47Å; A178-V181 PolarHBondContact O-N 2.91Å; A178-A182 PolarHBondContact O-N 3.3Å |
| 179 | M | 96.9 | Very high | 96.3 | Very high | 24 Ų | 24 | 39.2 Ų | 39.2 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66 | -34.7 | 179.1 | -165.7 | 65.3 | -157 | 0 | 0 | 113.4 | T138 K141 L142 Y177 A182 A183 C212 | T138-M179 HydrophobicContact CG2-CB 4.45Å; T138-M179 HydrophobicContact CG2-SD 3.88Å; K141-M179 HydrophobicContact CB-CE 3.9Å; K141-M179 HydrophobicContact CB-SD 3.83Å; K141-M179 HydrophobicContact CD-SD 4.35Å; L142-M179 HydrophobicContact CB-CE 4.33Å; Y177-M179 PolarHBondContact O-N 3.45Å; M179-A182 PolarHBondContact O-N 3.32Å; M179-A183 WeakPolarHBondContact O-CB 3.26Å; M179-A183 PolarHBondContact O-N 2.86Å; M179-C212 HydrophobicContact CB-CB 4.01Å; M179-C212 HydrophobicContact CG-CB 3.79Å |
| 180 | C | 96.8 | Very high | 96.4 | Very high | 11 Ų | 11 | 36.9 Ų | 36.9 | 7% | 0.074 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -69.6 | -38.5 | 177.4 | -175.1 | 0 | 0 | 0 | 0 | 111.2 | Y177 A178 A184 C212 | Y177-C180 PolarHBondContact O-N 3.08Å; Y177-C180 VanDerWaalsContact O-N 3.1Å; A178-C180 VanDerWaalsContact C-N 3.35Å; A178-C180 PolarHBondContact O-N 3.27Å; C180-A184 VanDerWaalsContact O-CB 3.27Å; C180-A184 WeakPolarHBondContact O-CB 3.44Å; C180-A184 PolarHBondContact O-N 3.3Å; C180-C212 HydrophobicContact CB-CB 4.05Å |
| 181 | V | 98 | Very high | 96.5 | Very high | 3 Ų | 3 | 36.1 Ų | 36.1 | 2% | 0.018 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.1 | -50 | 171.2 | 165.1 | 0 | 0 | 0 | 0 | 110.6 | M164 L167 V173 Y177 A178 A183 A184 C185 M222 | M164-V181 HydrophobicContact CG-CG1 4.32Å; L167-V181 HydrophobicContact CD2-CB 4.43Å; L167-V181 HydrophobicContact CD2-CG1 3.45Å; L167-V181 VanDerWaalsContact CD2-CG1 3.45Å; L167-V181 HydrophobicContact CD2-CG2 4.1Å; V173-V181 HydrophobicContact CG1-CG2 4Å; Y177-V181 WeakPolarHBondContact O-CG2 3.48Å; Y177-V181 PolarHBondContact O-N 3.3Å; A178-V181 WeakPolarHBondContact O-CB 3.47Å; A178-V181 PolarHBondContact O-N 2.91Å; V181-A183 PolarHBondContact O-N 3.49Å; V181-A184 PolarHBondContact O-N 3.15Å; V181-A184 VanDerWaalsContact O-N 3.15Å; V181-C185 PolarHBondContact O-N 3.47Å; V181-C185 PolarHBondContact O-SG 3.27Å; V181-C185 VanDerWaalsContact O-SG 3.4Å; V181-M222 HydrophobicContact CG2-CE 4.28Å; V181-M222 HydrophobicContact CG2-CG 4.35Å; V181-M222 HydrophobicContact CG2-SD 3.9Å |
| 182 | A | 98.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.3 | -46.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | T138 L142 M164 A178 M179 A184 C185 Y186 | T138-A182 HydrophobicContact CG2-CB 3.49Å; T138-A182 VanDerWaalsContact CG2-CB 3.49Å; L142-A182 HydrophobicContact CD2-CB 4.21Å; M164-A182 HydrophobicContact CE-CB 4.41Å; M164-A182 HydrophobicContact SD-CB 3.61Å; A178-A182 PolarHBondContact O-N 3.3Å; M179-A182 PolarHBondContact O-N 3.32Å; A182-A184 VanDerWaalsContact C-N 3.33Å; A182-A184 PolarHBondContact O-N 3.47Å; A182-C185 PolarHBondContact O-N 3.25Å; A182-Y186 WeakPolarHBondContact O-CB 3.43Å; A182-Y186 PolarHBondContact O-N 2.9Å |
| 183 | A | 98 | Very high | 96.4 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.6 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | M179 V181 Y186 Y187 L219 | M179-A183 WeakPolarHBondContact O-CB 3.26Å; M179-A183 PolarHBondContact O-N 2.86Å; V181-A183 PolarHBondContact O-N 3.49Å; A183-Y186 PolarHBondContact O-N 3.27Å; A183-Y187 WeakPolarHBondContact O-CB 3.46Å; A183-Y187 PolarHBondContact O-N 2.92Å; A183-L219 HydrophobicContact CB-CD1 3.97Å |
| 184 | A | 98.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -69.1 | -42.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | C180 V181 A182 Y186 Y187 I188 L219 M222 V223 I226 | C180-A184 VanDerWaalsContact O-CB 3.27Å; C180-A184 WeakPolarHBondContact O-CB 3.44Å; C180-A184 PolarHBondContact O-N 3.3Å; V181-A184 PolarHBondContact O-N 3.15Å; V181-A184 VanDerWaalsContact O-N 3.15Å; A182-A184 VanDerWaalsContact C-N 3.33Å; A182-A184 PolarHBondContact O-N 3.47Å; A184-Y186 VanDerWaalsContact C-N 3.31Å; A184-Y186 PolarHBondContact O-N 2.95Å; A184-Y187 WeakPolarHBondContact O-CB 3.31Å; A184-Y187 PolarHBondContact O-N 3.37Å; A184-I188 VanDerWaalsContact O-CG1 3.27Å; A184-I188 WeakPolarHBondContact O-CG1 3.49Å; A184-I188 PolarHBondContact O-N 3.29Å; A184-L219 HydrophobicContact CB-CD1 3.92Å; A184-M222 HydrophobicContact CB-CB 4.08Å; A184-M222 HydrophobicContact CB-CG 3.82Å; A184-V223 HydrophobicContact CB-CG2 3.84Å; A184-I226 HydrophobicContact CB-CD1 3.57Å |
| 185 | C | 98.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.5 | -42.2 | 172.7 | -71.1 | 0 | 0 | 0 | 0 | 111.6 | L163 M164 V181 A182 I188 T189 | L163-C185 HydrophobicContact CB-CB 4.02Å; M164-C185 HydrophobicContact CB-CB 4.47Å; V181-C185 PolarHBondContact O-N 3.47Å; V181-C185 PolarHBondContact O-SG 3.27Å; V181-C185 VanDerWaalsContact O-SG 3.4Å; A182-C185 PolarHBondContact O-N 3.25Å; C185-I188 PolarHBondContact O-N 3.19Å; C185-T189 WeakPolarHBondContact O-CG2 3.12Å; C185-T189 PolarHBondContact O-N 3.37Å; C185-T189 PolarHBondContact O-OG1 3.01Å |
| 186 | Y | 98 | Very high | 94.4 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.8 | -40.9 | 175.1 | -173.1 | -109.6 | 0 | 0 | 0 | 112.6 | L142 L145 H146 Y150 L152 I156 A160 A182 A183 A184 I188 T189 S190 P201 L206 | L142-Y186 HydrophobicContact CD1-CD1 4.22Å; L142-Y186 HydrophobicContact CD1-CD2 4.38Å; L142-Y186 HydrophobicContact CD1-CG 3.86Å; L145-Y186 HydrophobicContact CD2-CD1 4.28Å; L145-Y186 HydrophobicContact CD2-CE1 3.97Å; H146-Y186 HydrophobicContact CB-CE2 4.15Å; H146-Y186 AromaticContact ND1-CE2 3.52Å; H146-Y186 AromaticContact ND1-CZ 3.57Å; H146-Y186 PolarHBondContact ND1-OH 2.97Å; Y150-Y186 VanDerWaalsContact CB-OH 3.31Å; Y150-Y186 WeakPolarHBondContact CB-OH 3.46Å; Y150-Y186 AromaticContact CD2-CE1 3.96Å; Y150-Y186 HydrophobicContact CD2-CE1 3.96Å; Y150-Y186 HydrophobicContact CE2-CE1 4.39Å; Y150-Y186 HydrophobicContact CG-CE1 4.3Å; L152-Y186 HydrophobicContact CD1-CE1 4.25Å; L152-Y186 HydrophobicContact CD1-CE2 4.22Å; L152-Y186 WeakPolarHBondContact CD1-OH 3.28Å; I156-Y186 HydrophobicContact CG2-CE2 4.29Å; A160-Y186 HydrophobicContact CB-CD2 4Å; A182-Y186 WeakPolarHBondContact O-CB 3.43Å; A182-Y186 PolarHBondContact O-N 2.9Å; A183-Y186 PolarHBondContact O-N 3.27Å; A184-Y186 VanDerWaalsContact C-N 3.31Å; A184-Y186 PolarHBondContact O-N 2.95Å; Y186-I188 PolarHBondContact O-N 3.04Å; Y186-T189 WeakPolarHBondContact CA-OG1 3.12Å; Y186-T189 PolarHBondContact O-N 3.44Å; Y186-T189 PolarHBondContact O-OG1 3.16Å; Y186-T189 VanDerWaalsContact O-OG1 3.09Å; Y186-S190 WeakPolarHBondContact O-CB 3.37Å; Y186-S190 PolarHBondContact O-N 3.09Å; Y186-P201 HydrophobicContact CD1-CG 4.37Å; Y186-P201 HydrophobicContact CE1-CB 4.46Å; Y186-P201 HydrophobicContact CE1-CG 4.1Å; Y186-L206 HydrophobicContact CD1-CD2 3.89Å; Y186-L206 HydrophobicContact CE1-CD2 4.27Å |
| 187 | Y | 97.8 | Very high | 93.7 | Very high | 48 Ų | 48 | 43 Ų | 43 | 19% | 0.188 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.5 | -46 | 173.6 | -177.7 | -104.9 | 0 | 0 | 0 | 112.1 | A183 A184 T189 S190 K191 P201 P203 L206 V223 | A183-Y187 WeakPolarHBondContact O-CB 3.46Å; A183-Y187 PolarHBondContact O-N 2.92Å; A184-Y187 WeakPolarHBondContact O-CB 3.31Å; A184-Y187 PolarHBondContact O-N 3.37Å; Y187-T189 PolarHBondContact O-N 2.87Å; Y187-S190 PolarHBondContact O-N 3.22Å; Y187-S190 PolarHBondContact O-OG 3.11Å; Y187-K191 VanDerWaalsContact CZ-CE 3.42Å; Y187-K191 WeakPolarHBondContact OH-CE 3.49Å; Y187-K191 PolarHBondContact OH-NZ 3.28Å; Y187-P201 VanDerWaalsContact CE2-O 3.3Å; Y187-P201 WeakPolarHBondContact CE2-O 3.23Å; Y187-P203 HydrophobicContact CE2-CG 3.92Å; Y187-L206 HydrophobicContact CD2-CD1 3.89Å; Y187-L206 HydrophobicContact CG-CD1 4.18Å; Y187-V223 HydrophobicContact CD1-CG2 3.75Å; Y187-V223 HydrophobicContact CE1-CG2 4.48Å |
| 188 | I | 98.1 | Very high | 93 | Very high | 12 Ų | 12 | 40.8 Ų | 40.8 | 6% | 0.062 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.8 | -49.7 | 176.9 | -69.8 | 164.2 | 0 | 0 | 0 | 110.1 | L163 A184 C185 Y186 S190 K191 F192 V223 I226 L227 V235 | L163-I188 HydrophobicContact CD1-CB 4.26Å; L163-I188 HydrophobicContact CD1-CG2 3.77Å; A184-I188 VanDerWaalsContact O-CG1 3.27Å; A184-I188 WeakPolarHBondContact O-CG1 3.49Å; A184-I188 PolarHBondContact O-N 3.29Å; C185-I188 PolarHBondContact O-N 3.19Å; Y186-I188 PolarHBondContact O-N 3.04Å; I188-S190 VanDerWaalsContact C-N 3.34Å; I188-S190 PolarHBondContact O-N 3.17Å; I188-K191 WeakPolarHBondContact O-CB 3.46Å; I188-K191 PolarHBondContact O-N 3.41Å; I188-F192 HydrophobicContact CG2-CE2 4.36Å; I188-V223 HydrophobicContact CD1-CB 4.5Å; I188-V223 HydrophobicContact CD1-CG1 4.05Å; I188-V223 HydrophobicContact CG1-CB 4.45Å; I188-V223 HydrophobicContact CG1-CG1 3.73Å; I188-V223 HydrophobicContact CG1-CG2 4.24Å; I188-I226 HydrophobicContact CD1-CB 3.96Å; I188-I226 HydrophobicContact CD1-CD1 4.28Å; I188-I226 HydrophobicContact CD1-CG2 3.66Å; I188-L227 HydrophobicContact CD1-CG 4.47Å; I188-V235 HydrophobicContact CG2-CG1 3.46Å; I188-V235 VanDerWaalsContact CG2-CG1 3.46Å |
| 189 | T | 97.2 | Very high | 92.4 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -69.6 | -32.1 | -175.5 | 47.5 | 0 | 0 | 0 | 0 | 113.2 | K159 A160 L163 C185 Y186 Y187 K191 F192 | K159-T189 HydrophobicContact CB-CG2 3.72Å; A160-T189 HydrophobicContact CB-CG2 4.47Å; A160-T189 WeakPolarHBondContact CB-OG1 2.9Å; L163-T189 HydrophobicContact CD1-CG2 3.49Å; L163-T189 VanDerWaalsContact CD1-CG2 3.49Å; L163-T189 HydrophobicContact CG-CG2 4.15Å; C185-T189 WeakPolarHBondContact O-CG2 3.12Å; C185-T189 PolarHBondContact O-N 3.37Å; C185-T189 PolarHBondContact O-OG1 3.01Å; Y186-T189 WeakPolarHBondContact CA-OG1 3.12Å; Y186-T189 PolarHBondContact O-N 3.44Å; Y186-T189 PolarHBondContact O-OG1 3.16Å; Y186-T189 VanDerWaalsContact O-OG1 3.09Å; Y187-T189 PolarHBondContact O-N 2.87Å; T189-K191 PolarHBondContact O-N 2.55Å; T189-K191 VanDerWaalsContact O-N 3.09Å; T189-F192 WeakPolarHBondContact O-CB 3.15Å; T189-F192 PolarHBondContact O-N 3.18Å |
| 190 | S | 95.8 | Very high | 92 | Very high | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.014 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.2 | -24.6 | 174 | 76.6 | 0 | 0 | 0 | 0 | 113.7 | Y186 Y187 I188 F192 E193 P201 | Y186-S190 WeakPolarHBondContact O-CB 3.37Å; Y186-S190 PolarHBondContact O-N 3.09Å; Y187-S190 PolarHBondContact O-N 3.22Å; Y187-S190 PolarHBondContact O-OG 3.11Å; I188-S190 VanDerWaalsContact C-N 3.34Å; I188-S190 PolarHBondContact O-N 3.17Å; S190-F192 PolarHBondContact O-N 2.89Å; S190-E193 VanDerWaalsContact O-CB 3.32Å; S190-E193 WeakPolarHBondContact O-CB 3.01Å; S190-E193 PolarHBondContact O-N 3.5Å; S190-P201 VanDerWaalsContact CB-CG 3.46Å; S190-P201 WeakPolarHBondContact OG-CG 3.21Å |
| 191 | K | 95.1 | Very high | 91.8 | Very high | 116 Ų | 116 | 44.9 Ų | 44.9 | 50% | 0.504 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -12.8 | 175.9 | -56.7 | -52.6 | -177.2 | -170.9 | 0 | 113.6 | Y187 I188 T189 | Y187-K191 VanDerWaalsContact CZ-CE 3.42Å; Y187-K191 WeakPolarHBondContact OH-CE 3.49Å; Y187-K191 PolarHBondContact OH-NZ 3.28Å; I188-K191 WeakPolarHBondContact O-CB 3.46Å; I188-K191 PolarHBondContact O-N 3.41Å; T189-K191 PolarHBondContact O-N 2.55Å; T189-K191 VanDerWaalsContact O-N 3.09Å |
| 192 | F | 94.3 | Very high | 91.7 | Very high | 55 Ų | 55 | 47.8 Ų | 47.8 | 24% | 0.241 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 0.9 | 173 | -56.8 | -70 | 0 | 0 | 0 | 112.8 | I188 T189 S190 R194 V235 G239 | I188-F192 HydrophobicContact CG2-CE2 4.36Å; T189-F192 WeakPolarHBondContact O-CB 3.15Å; T189-F192 PolarHBondContact O-N 3.18Å; S190-F192 PolarHBondContact O-N 2.89Å; F192-R194 PolarHBondContact O-N 3.01Å; F192-V235 HydrophobicContact CE2-CG1 4.39Å; F192-V235 HydrophobicContact CZ-CG1 4.47Å; F192-G239 VanDerWaalsContact CD2-CA 3.43Å |
| 193 | E | 92.8 | Very high | 91.5 | Very high | 40 Ų | 40 | 48.5 Ų | 48.5 | 19% | 0.187 | 25% | 0.252 | C | S | . | . | trans | -62.3 | 128.9 | 170.1 | -176.4 | 55.7 | -99 | 0 | 0 | 109.4 | L152 S153 I156 S190 S195 | L152-E193 HydrophobicContact CD2-CB 4.21Å; L152-E193 HydrophobicContact CD2-CG 3.94Å; S153-E193 VanDerWaalsContact CB-OE2 3.26Å; S153-E193 WeakPolarHBondContact CB-OE2 3.44Å; S153-E193 PolarHBondContact N-OE2 3.46Å; I156-E193 HydrophobicContact CD1-CB 4.17Å; I156-E193 HydrophobicContact CG1-CB 4.26Å; I156-E193 VanDerWaalsContact CG1-OE2 3.24Å; I156-E193 WeakPolarHBondContact CG1-OE2 3.39Å; S190-E193 VanDerWaalsContact O-CB 3.32Å; S190-E193 WeakPolarHBondContact O-CB 3.01Å; S190-E193 PolarHBondContact O-N 3.5Å; E193-S195 PolarHBondContact OE1-N 3.36Å | ||
| 194 | R | 86 | Confident | 91.4 | Very high | 194 Ų | 194 | 53.9 Ų | 53.9 | 73% | 0.732 | 28% | 0.278 | S | S | * | . | trans | -94 | -26.8 | -175.2 | -64.2 | -172.1 | -177.3 | 97.8 | -4.3 | 112 | F192 | F192-R194 PolarHBondContact O-N 3.01Š| ||
| 195 | S | 82.3 | Confident | 91.3 | Very high | 42 Ų | 42 | 55 Ų | 55 | 29% | 0.294 | 29% | 0.286 | S | S | . | . | trans | -77.7 | 124.5 | 179.1 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | E193 D197 H198 | E193-S195 PolarHBondContact OE1-N 3.36Å; S195-D197 VanDerWaalsContact C-N 3.27Å; S195-D197 PolarHBondContact OG-N 3.37Å; S195-H198 WeakPolarHBondContact CB-CD2 3.46Å; S195-H198 VanDerWaalsContact CB-NE2 3.35Å; S195-H198 WeakPolarHBondContact CB-NE2 3.39Å; S195-H198 PolarHBondContact OG-CD2 3.36Å; S195-H198 VanDerWaalsContact OG-CD2 3.3Å; S195-H198 PolarHBondContact OG-NE2 3.23Å; S195-H198 VanDerWaalsContact OG-NE2 3.08Å | ||
| 196 | S | 74.7 | Confident | 91.1 | Very high | 112 Ų | 112 | 55 Ų | 55 | 78% | 0.783 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | -11.7 | 176.7 | 52.4 | 0 | 0 | 0 | 0 | 113.7 | H198 | S196-H198 PolarHBondContact O-N 2.95Š|
| 197 | D | 78.7 | Confident | 91 | Very high | 139 Ų | 139 | 55.9 Ų | 55.9 | 74% | 0.743 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | 0.2 | -172.7 | -59.9 | -18 | 0 | 0 | 0 | 112.3 | S195 | S195-D197 VanDerWaalsContact C-N 3.27Å; S195-D197 PolarHBondContact OG-N 3.37Å |
| 198 | H | 81.7 | Confident | 90.8 | Very high | 57 Ų | 57 | 57.3 Ų | 57.3 | 26% | 0.264 | 31% | 0.305 | S | S | . | . | S | Bend | trans | -105.4 | 141.4 | -173.8 | -56 | -36.2 | 0 | 0 | 0 | 112.6 | S151 L152 S195 S196 S200 | S151-H198 WeakPolarHBondContact O-CB 3.35Å; S151-H198 PolarHBondContact O-CD2 3.38Å; S151-H198 VanDerWaalsContact O-CD2 3.32Å; S151-H198 PolarHBondContact O-CE1 2.99Å; S151-H198 VanDerWaalsContact O-CE1 3.27Å; S151-H198 PolarHBondContact O-ND1 3.25Å; S151-H198 VanDerWaalsContact OG-CA 3.31Å; S151-H198 WeakPolarHBondContact OG-CA 3.34Å; S151-H198 WeakPolarHBondContact OG-CB 3.49Å; S151-H198 PolarHBondContact OG-ND1 3.42Å; L152-H198 HydrophobicContact CD2-CB 3.94Å; S195-H198 WeakPolarHBondContact CB-CD2 3.46Å; S195-H198 VanDerWaalsContact CB-NE2 3.35Å; S195-H198 WeakPolarHBondContact CB-NE2 3.39Å; S195-H198 PolarHBondContact OG-CD2 3.36Å; S195-H198 VanDerWaalsContact OG-CD2 3.3Å; S195-H198 PolarHBondContact OG-NE2 3.23Å; S195-H198 VanDerWaalsContact OG-NE2 3.08Å; S196-H198 PolarHBondContact O-N 2.95Å; H198-S200 PolarHBondContact O-N 2.93Å |
| 199 | V | 83.2 | Confident | 90.6 | Very high | 58 Ų | 58 | 59.2 Ų | 59.2 | 35% | 0.352 | 32% | 0.315 | S | S | . | . | trans | -69.4 | 109.4 | 174.6 | -178.5 | 0 | 0 | 0 | 0 | 109 | S151 L374 | S151-V199 PolarHBondContact OG-N 2.99Å; V199-L374 HydrophobicContact CB-CD1 4.47Å; V199-L374 HydrophobicContact CG1-CB 3.91Å; V199-L374 HydrophobicContact CG1-CD1 3.75Å; V199-L374 HydrophobicContact CG1-CG 4.47Å; V199-L374 HydrophobicContact CG2-CB 4.24Å | ||
| 200 | S | 88.2 | Confident | 90.3 | Very high | 63 Ų | 63 | 59.9 Ų | 59.9 | 44% | 0.441 | 32% | 0.319 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 134.4 | 176.2 | -72.4 | 0 | 0 | 0 | 0 | 111.1 | H198 | H198-S200 PolarHBondContact O-N 2.93Š|
| 201 | P | 93.3 | Very high | 90.1 | Very high | 1 Ų | 1 | 67.6 Ų | 67.6 | 1% | 0.006 | 35% | 0.348 | C | S | . | . | P | Polyproline II helix | trans | -64.6 | 138.4 | 176.2 | 25.3 | -32.5 | 0 | 0 | 0 | 111.6 | Y150 L152 Y186 Y187 S190 L206 | Y150-P201 HydrophobicContact CD1-CB 4.08Å; Y150-P201 VanDerWaalsContact CE1-CA 3.5Å; Y150-P201 HydrophobicContact CE1-CB 3.57Å; Y150-P201 HydrophobicContact CE2-CB 4.48Å; L152-P201 HydrophobicContact CD1-CG 4.37Å; Y186-P201 HydrophobicContact CD1-CG 4.37Å; Y186-P201 HydrophobicContact CE1-CB 4.46Å; Y186-P201 HydrophobicContact CE1-CG 4.1Å; Y187-P201 VanDerWaalsContact CE2-O 3.3Å; Y187-P201 WeakPolarHBondContact CE2-O 3.23Å; S190-P201 VanDerWaalsContact CB-CG 3.46Å; S190-P201 WeakPolarHBondContact OG-CG 3.21Å; P201-L206 HydrophobicContact CB-CD1 3.74Å; P201-L206 HydrophobicContact CB-CD2 3.85Å; P201-L206 HydrophobicContact CB-CG 3.65Å; P201-L206 HydrophobicContact CG-CD1 4.39Å |
| 202 | T | 94.5 | Very high | 89.9 | Confident | 64 Ų | 64 | 62.8 Ų | 62.8 | 39% | 0.393 | 33% | 0.329 | S | S | . | . | P | Polyproline II helix | trans | -101.7 | 156 | 169.3 | 62.4 | 0 | 0 | 0 | 0 | 109.5 | E204 S205 L206 | T202-E204 PolarHBondContact O-N 2.95Å; T202-S205 PolarHBondContact N-OG 2.97Å; T202-S205 PolarHBondContact O-N 2.68Å; T202-S205 PolarHBondContact O-OG 3.22Å; T202-S205 VanDerWaalsContact O-OG 3.07Å; T202-S205 VanDerWaalsContact OG1-CB 3.26Å; T202-S205 WeakPolarHBondContact OG1-CB 3.2Å; T202-S205 PolarHBondContact OG1-N 3.04Å; T202-S205 VanDerWaalsContact OG1-N 3.08Å; T202-S205 PolarHBondContact OG1-OG 3.45Å; T202-L206 WeakPolarHBondContact O-CB 3.33Å; T202-L206 WeakPolarHBondContact O-CG 3.45Å; T202-L206 PolarHBondContact O-N 2.69Å |
| 203 | P | 96.1 | Very high | 89.6 | Confident | 15 Ų | 15 | 62.2 Ų | 62.2 | 10% | 0.097 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56.2 | -38.7 | 175.5 | -27.3 | 37.3 | 0 | 0 | 0 | 113 | Y187 V207 A216 L219 | Y187-P203 HydrophobicContact CE2-CG 3.92Å; P203-V207 VanDerWaalsContact O-CG2 3.31Å; P203-V207 WeakPolarHBondContact O-CG2 3.49Å; P203-V207 PolarHBondContact O-N 3.21Å; P203-A216 HydrophobicContact CB-CB 3.99Å; P203-L219 HydrophobicContact CB-CD2 4.07Å |
| 204 | E | 95.9 | Very high | 89.5 | Confident | 113 Ų | 113 | 62.9 Ų | 62.9 | 53% | 0.528 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.1 | -46.5 | 178.1 | -65.8 | 70.7 | -157 | 0 | 0 | 111.9 | T202 T208 A216 | T202-E204 PolarHBondContact O-N 2.95Å; E204-T208 WeakPolarHBondContact O-CB 3.48Å; E204-T208 PolarHBondContact O-N 3.14Å; E204-T208 VanDerWaalsContact O-N 3.1Å; E204-T208 PolarHBondContact O-OG1 3.04Å; E204-A216 HydrophobicContact CG-CB 3.89Å; E204-A216 WeakPolarHBondContact OE1-CB 3.21Å |
| 205 | S | 94.7 | Very high | 89.9 | Confident | 24 Ų | 24 | 57.3 Ų | 57.3 | 17% | 0.168 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66 | -40.6 | 178.9 | 70.3 | 0 | 0 | 0 | 0 | 111.3 | Y150 T202 T208 L209 | Y150-S205 WeakPolarHBondContact OH-CB 3.24Å; Y150-S205 PolarHBondContact OH-OG 3.01Å; T202-S205 PolarHBondContact N-OG 2.97Å; T202-S205 PolarHBondContact O-N 2.68Å; T202-S205 PolarHBondContact O-OG 3.22Å; T202-S205 VanDerWaalsContact O-OG 3.07Å; T202-S205 VanDerWaalsContact OG1-CB 3.26Å; T202-S205 WeakPolarHBondContact OG1-CB 3.2Å; T202-S205 PolarHBondContact OG1-N 3.04Å; T202-S205 VanDerWaalsContact OG1-N 3.08Å; T202-S205 PolarHBondContact OG1-OG 3.45Å; S205-T208 PolarHBondContact O-N 2.98Å; S205-L209 VanDerWaalsContact O-CB 3.3Å; S205-L209 WeakPolarHBondContact O-CB 3.02Å; S205-L209 VanDerWaalsContact O-CG 3.3Å; S205-L209 WeakPolarHBondContact O-CG 3.5Å; S205-L209 PolarHBondContact O-N 3.29Å |
| 206 | L | 95.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.6 | -48.2 | 178.2 | -77.2 | 174.8 | 0 | 0 | 0 | 112.1 | L145 Y150 Y186 Y187 P201 T202 T208 L209 S210 L219 | L145-L206 HydrophobicContact CD1-CD2 4.38Å; L145-L206 HydrophobicContact CD2-CD2 4.02Å; Y150-L206 HydrophobicContact CE2-CD2 3.92Å; Y186-L206 HydrophobicContact CD1-CD2 3.89Å; Y186-L206 HydrophobicContact CE1-CD2 4.27Å; Y187-L206 HydrophobicContact CD2-CD1 3.89Å; Y187-L206 HydrophobicContact CG-CD1 4.18Å; P201-L206 HydrophobicContact CB-CD1 3.74Å; P201-L206 HydrophobicContact CB-CD2 3.85Å; P201-L206 HydrophobicContact CB-CG 3.65Å; P201-L206 HydrophobicContact CG-CD1 4.39Å; T202-L206 WeakPolarHBondContact O-CB 3.33Å; T202-L206 WeakPolarHBondContact O-CG 3.45Å; T202-L206 PolarHBondContact O-N 2.69Å; L206-T208 PolarHBondContact O-N 3.39Å; L206-L209 PolarHBondContact O-N 2.99Å; L206-S210 WeakPolarHBondContact O-CB 3.34Å; L206-S210 PolarHBondContact O-N 3.48Å; L206-S210 PolarHBondContact O-OG 2.98Å; L206-L219 HydrophobicContact CB-CD2 3.89Å; L206-L219 HydrophobicContact CD1-CD2 4.2Å |
| 207 | V | 95.1 | Very high | 91.7 | Very high | 19 Ų | 19 | 54.2 Ų | 54.2 | 12% | 0.115 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.5 | -39.6 | 178 | 171.5 | 0 | 0 | 0 | 0 | 111 | P203 R211 G214 L219 | P203-V207 VanDerWaalsContact O-CG2 3.31Å; P203-V207 WeakPolarHBondContact O-CG2 3.49Å; P203-V207 PolarHBondContact O-N 3.21Å; V207-R211 PolarHBondContact O-N 3.1Å; V207-G214 WeakPolarHBondContact CG1-O 3.17Å; V207-L219 HydrophobicContact CG2-CB 3.83Å; V207-L219 HydrophobicContact CG2-CD2 3.97Å; V207-L219 HydrophobicContact CG2-CG 4.42Å |
| 208 | T | 94.5 | Very high | 92.6 | Very high | 78 Ų | 78 | 51.2 Ų | 51.2 | 48% | 0.479 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -69.3 | -46.6 | -179 | -55.4 | 0 | 0 | 0 | 0 | 112.4 | E204 S205 L206 R211 | E204-T208 WeakPolarHBondContact O-CB 3.48Å; E204-T208 PolarHBondContact O-N 3.14Å; E204-T208 VanDerWaalsContact O-N 3.1Å; E204-T208 PolarHBondContact O-OG1 3.04Å; S205-T208 PolarHBondContact O-N 2.98Å; L206-T208 PolarHBondContact O-N 3.39Å; T208-R211 VanDerWaalsContact O-CD 3.3Å; T208-R211 WeakPolarHBondContact O-CD 3.49Å; T208-R211 PolarHBondContact O-NE 3.4Å |
| 209 | L | 93.2 | Very high | 93.4 | Very high | 52 Ų | 52 | 48.5 Ų | 48.5 | 27% | 0.272 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -81.1 | -41.5 | -175.1 | -67.1 | 173.4 | 0 | 0 | 0 | 112.7 | L145 Y149 Y150 S205 L206 R211 | L145-L209 HydrophobicContact CD1-CB 3.84Å; Y149-L209 HydrophobicContact CD1-CD1 3.87Å; Y149-L209 HydrophobicContact CD1-CD2 3.91Å; Y149-L209 HydrophobicContact CE1-CD1 4.48Å; Y149-L209 HydrophobicContact CE1-CD2 3.68Å; Y149-L209 HydrophobicContact CG-CD1 3.94Å; Y149-L209 HydrophobicContact CG-CD2 4.49Å; Y150-L209 HydrophobicContact CE2-CD1 4.25Å; S205-L209 VanDerWaalsContact O-CB 3.3Å; S205-L209 WeakPolarHBondContact O-CB 3.02Å; S205-L209 VanDerWaalsContact O-CG 3.3Å; S205-L209 WeakPolarHBondContact O-CG 3.5Å; S205-L209 PolarHBondContact O-N 3.29Å; L206-L209 PolarHBondContact O-N 2.99Å; L209-R211 VanDerWaalsContact C-N 3.28Å; L209-R211 PolarHBondContact O-N 2.89Å |
| 210 | S | 91.8 | Very high | 94.1 | Very high | 13 Ų | 13 | 48.5 Ų | 48.5 | 9% | 0.091 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -74.2 | -19.5 | -179.6 | 69.8 | 0 | 0 | 0 | 0 | 113.4 | L206 C212 | L206-S210 WeakPolarHBondContact O-CB 3.34Å; L206-S210 PolarHBondContact O-N 3.48Å; L206-S210 PolarHBondContact O-OG 2.98Å; S210-C212 PolarHBondContact O-N 2.91Å; S210-C212 VanDerWaalsContact O-N 3.16Å; S210-C212 WeakPolarHBondContact OG-CB 3.48Å; S210-C212 PolarHBondContact OG-N 2.86Å; S210-C212 PolarHBondContact OG-SG 3.08Å |
| 211 | R | 91.4 | Very high | 94.5 | Very high | 164 Ų | 164 | 53 Ų | 53 | 62% | 0.619 | 31% | 0.307 | S | S | * | . | trans | 51.7 | 33.3 | -171.5 | -54.3 | -65.5 | -176.3 | 178.6 | -1.7 | 112.5 | V207 T208 L209 G213 | V207-R211 PolarHBondContact O-N 3.1Å; T208-R211 VanDerWaalsContact O-CD 3.3Å; T208-R211 WeakPolarHBondContact O-CD 3.49Å; T208-R211 PolarHBondContact O-NE 3.4Å; L209-R211 VanDerWaalsContact C-N 3.28Å; L209-R211 PolarHBondContact O-N 2.89Å; R211-G213 PolarHBondContact O-N 3.34Å | ||
| 212 | C | 90.6 | Very high | 94.8 | Very high | 15 Ų | 15 | 54.3 Ų | 54.3 | 10% | 0.101 | 31% | 0.313 | C | S | . | . | trans | -64.9 | -5.6 | -178.9 | 66.6 | 0 | 0 | 0 | 0 | 114.8 | M179 C180 S210 | M179-C212 HydrophobicContact CB-CB 4.01Å; M179-C212 HydrophobicContact CG-CB 3.79Å; C180-C212 HydrophobicContact CB-CB 4.05Å; S210-C212 PolarHBondContact O-N 2.91Å; S210-C212 VanDerWaalsContact O-N 3.16Å; S210-C212 WeakPolarHBondContact OG-CB 3.48Å; S210-C212 PolarHBondContact OG-N 2.86Å; S210-C212 PolarHBondContact OG-SG 3.08Å | ||
| 213 | G | 86.7 | Confident | 94.9 | Very high | 44 Ų | 44 | 52 Ų | 52 | 45% | 0.454 | 30% | 0.298 | S | S | . | . | S | Bend | trans | 76.8 | 170.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | R211 | R211-G213 PolarHBondContact O-N 3.34Š|
| 214 | G | 91.7 | Very high | 95 | Very high | 54 Ų | 54 | 56.6 Ų | 56.6 | 56% | 0.557 | 32% | 0.319 | S | S | * | . | S | Bend | trans | 73.9 | -165.8 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | V207 | V207-G214 WeakPolarHBondContact CG1-O 3.17Š|
| 215 | T | 95.2 | Very high | 95.1 | Very high | 77 Ų | 77 | 54.3 Ų | 54.3 | 47% | 0.472 | 31% | 0.309 | S | S | . | . | trans | -112.2 | 166.7 | 179.8 | 64.4 | 0 | 0 | 0 | 0 | 111.2 | A217 D218 L219 | T215-A217 PolarHBondContact O-N 2.81Å; T215-A217 VanDerWaalsContact O-N 3.16Å; T215-A217 PolarHBondContact OG1-N 3.34Å; T215-D218 WeakPolarHBondContact CB-OD2 3.36Å; T215-D218 PolarHBondContact N-OD2 3.44Å; T215-D218 WeakPolarHBondContact O-CA 3.37Å; T215-D218 WeakPolarHBondContact O-CB 3.48Å; T215-D218 PolarHBondContact O-N 3.3Å; T215-D218 PolarHBondContact OG1-N 2.79Å; T215-D218 PolarHBondContact OG1-OD2 2.63Å; T215-L219 PolarHBondContact O-N 3.4Å | ||
| 216 | A | 97.1 | Very high | 95.3 | Very high | 20 Ų | 20 | 53.1 Ų | 53.1 | 17% | 0.165 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -55 | -31.2 | 172 | 0 | 0 | 0 | 0 | 0 | 112.9 | P203 E204 L219 T220 | P203-A216 HydrophobicContact CB-CB 3.99Å; E204-A216 HydrophobicContact CG-CB 3.89Å; E204-A216 WeakPolarHBondContact OE1-CB 3.21Å; A216-L219 PolarHBondContact O-N 3.21Å; A216-T220 PolarHBondContact O-N 3.03Å; A216-T220 PolarHBondContact O-OG1 2.96Å |
| 217 | A | 97.4 | Very high | 95.4 | Very high | 68 Ų | 68 | 55 Ų | 55 | 56% | 0.562 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -68.4 | -37.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T215 T220 R221 | T215-A217 PolarHBondContact O-N 2.81Å; T215-A217 VanDerWaalsContact O-N 3.16Å; T215-A217 PolarHBondContact OG1-N 3.34Å; A217-T220 PolarHBondContact O-N 3.03Å; A217-R221 WeakPolarHBondContact O-CB 3.42Å; A217-R221 PolarHBondContact O-N 3.37Å |
| 218 | D | 96.8 | Very high | 95.6 | Very high | 76 Ų | 76 | 59.4 Ų | 59.4 | 41% | 0.406 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -67.9 | -38.1 | 175.6 | -60.3 | -55.4 | 0 | 0 | 0 | 111.5 | T215 R221 M222 | T215-D218 WeakPolarHBondContact CB-OD2 3.36Å; T215-D218 PolarHBondContact N-OD2 3.44Å; T215-D218 WeakPolarHBondContact O-CA 3.37Å; T215-D218 WeakPolarHBondContact O-CB 3.48Å; T215-D218 PolarHBondContact O-N 3.3Å; T215-D218 PolarHBondContact OG1-N 2.79Å; T215-D218 PolarHBondContact OG1-OD2 2.63Å; D218-R221 WeakPolarHBondContact O-CB 3.39Å; D218-R221 PolarHBondContact O-N 3.21Å; D218-M222 PolarHBondContact O-N 3.17Å |
| 219 | L | 98 | Very high | 95.7 | Very high | 1 Ų | 1 | 60.9 Ų | 60.9 | 1% | 0.005 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.9 | -44.9 | 173.3 | -174.9 | 72.1 | 0 | 0 | 0 | 111.1 | A183 A184 P203 L206 V207 T215 A216 R221 M222 V223 | A183-L219 HydrophobicContact CB-CD1 3.97Å; A184-L219 HydrophobicContact CB-CD1 3.92Å; P203-L219 HydrophobicContact CB-CD2 4.07Å; L206-L219 HydrophobicContact CB-CD2 3.89Å; L206-L219 HydrophobicContact CD1-CD2 4.2Å; V207-L219 HydrophobicContact CG2-CB 3.83Å; V207-L219 HydrophobicContact CG2-CD2 3.97Å; V207-L219 HydrophobicContact CG2-CG 4.42Å; T215-L219 PolarHBondContact O-N 3.4Å; A216-L219 PolarHBondContact O-N 3.21Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.03Å; L219-M222 WeakPolarHBondContact O-CA 3.08Å; L219-M222 WeakPolarHBondContact O-CB 3.27Å; L219-M222 PolarHBondContact O-N 3.22Å; L219-V223 WeakPolarHBondContact O-CG2 3.4Å; L219-V223 PolarHBondContact O-N 3.09Å |
| 220 | T | 98.1 | Very high | 95.9 | Very high | 57 Ų | 57 | 58.9 Ų | 58.9 | 35% | 0.35 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.6 | -41.1 | 176.4 | -54.9 | 0 | 0 | 0 | 0 | 111.2 | A216 A217 M222 V223 E224 | A216-T220 PolarHBondContact O-N 3.03Å; A216-T220 PolarHBondContact O-OG1 2.96Å; A217-T220 PolarHBondContact O-N 3.03Å; T220-M222 VanDerWaalsContact C-N 3.31Å; T220-M222 PolarHBondContact O-N 2.84Å; T220-V223 WeakPolarHBondContact O-CB 3.32Å; T220-V223 PolarHBondContact O-N 2.9Å; T220-E224 PolarHBondContact O-N 2.95Å |
| 221 | R | 98 | Very high | 96 | Very high | 159 Ų | 159 | 59.3 Ų | 59.3 | 60% | 0.6 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -60.6 | -39.8 | 171.8 | -177.6 | -174.7 | 174.9 | 87.2 | 2.3 | 111.6 | A217 D218 L219 V223 E224 I225 | A217-R221 WeakPolarHBondContact O-CB 3.42Å; A217-R221 PolarHBondContact O-N 3.37Å; D218-R221 WeakPolarHBondContact O-CB 3.39Å; D218-R221 PolarHBondContact O-N 3.21Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.03Å; R221-V223 VanDerWaalsContact C-N 3.35Å; R221-E224 PolarHBondContact O-N 2.64Å; R221-I225 HydrophobicContact CG-CD1 4.34Å; R221-I225 VanDerWaalsContact O-CG1 3.3Å; R221-I225 WeakPolarHBondContact O-CG1 3.24Å; R221-I225 PolarHBondContact O-N 2.89Å |
| 222 | M | 98.1 | Very high | 96.2 | Very high | 27 Ų | 27 | 55.9 Ų | 55.9 | 13% | 0.133 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63.9 | -40.7 | 176.1 | -169.9 | 60.1 | 71.8 | 0 | 0 | 111.6 | V181 A184 D218 L219 T220 E224 I225 I226 | V181-M222 HydrophobicContact CG2-CE 4.28Å; V181-M222 HydrophobicContact CG2-CG 4.35Å; V181-M222 HydrophobicContact CG2-SD 3.9Å; A184-M222 HydrophobicContact CB-CB 4.08Å; A184-M222 HydrophobicContact CB-CG 3.82Å; D218-M222 PolarHBondContact O-N 3.17Å; L219-M222 WeakPolarHBondContact O-CA 3.08Å; L219-M222 WeakPolarHBondContact O-CB 3.27Å; L219-M222 PolarHBondContact O-N 3.22Å; T220-M222 VanDerWaalsContact C-N 3.31Å; T220-M222 PolarHBondContact O-N 2.84Å; M222-E224 VanDerWaalsContact C-N 3.34Å; M222-E224 PolarHBondContact O-N 3.26Å; M222-I225 WeakPolarHBondContact O-CB 3.47Å; M222-I225 PolarHBondContact O-N 2.96Å; M222-I225 HydrophobicContact SD-CD1 4.4Å; M222-I226 HydrophobicContact CG-CD1 4.13Å; M222-I226 VanDerWaalsContact O-CG1 3.31Å; M222-I226 WeakPolarHBondContact O-CG1 3.24Å; M222-I226 PolarHBondContact O-N 2.85Å |
| 223 | V | 98.2 | Very high | 96.4 | Very high | 15 Ų | 15 | 60 Ų | 60 | 9% | 0.091 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -57.3 | -46.5 | 173.6 | 169.9 | 0 | 0 | 0 | 0 | 111.1 | A184 Y187 I188 L219 T220 R221 I225 I226 L227 | A184-V223 HydrophobicContact CB-CG2 3.84Å; Y187-V223 HydrophobicContact CD1-CG2 3.75Å; Y187-V223 HydrophobicContact CE1-CG2 4.48Å; I188-V223 HydrophobicContact CD1-CB 4.5Å; I188-V223 HydrophobicContact CD1-CG1 4.05Å; I188-V223 HydrophobicContact CG1-CB 4.45Å; I188-V223 HydrophobicContact CG1-CG1 3.73Å; I188-V223 HydrophobicContact CG1-CG2 4.24Å; L219-V223 WeakPolarHBondContact O-CG2 3.4Å; L219-V223 PolarHBondContact O-N 3.09Å; T220-V223 WeakPolarHBondContact O-CB 3.32Å; T220-V223 PolarHBondContact O-N 2.9Å; R221-V223 VanDerWaalsContact C-N 3.35Å; V223-I225 VanDerWaalsContact C-N 3.34Å; V223-I225 PolarHBondContact O-N 3.07Å; V223-I226 PolarHBondContact O-N 3.26Å; V223-L227 HydrophobicContact CG1-CD1 3.95Å; V223-L227 HydrophobicContact CG1-CG 4.45Å; V223-L227 WeakPolarHBondContact O-CG 3.37Å; V223-L227 PolarHBondContact O-N 3.38Å |
| 224 | E | 98.2 | Very high | 96.8 | Very high | 112 Ų | 112 | 59.9 Ų | 59.9 | 52% | 0.523 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.7 | -41.5 | 176 | -67.8 | 171.9 | 176.9 | 0 | 0 | 112.2 | T220 R221 M222 L227 T228 | T220-E224 PolarHBondContact O-N 2.95Å; R221-E224 PolarHBondContact O-N 2.64Å; M222-E224 VanDerWaalsContact C-N 3.34Å; M222-E224 PolarHBondContact O-N 3.26Å; E224-L227 PolarHBondContact O-N 3.36Å; E224-T228 WeakPolarHBondContact O-CB 3.49Å; E224-T228 PolarHBondContact O-N 3.49Å; E224-T228 PolarHBondContact O-OG1 3.34Å |
| 225 | I | 97.9 | Very high | 97.1 | Very high | 65 Ų | 65 | 57.5 Ų | 57.5 | 33% | 0.333 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 176.3 | -67.6 | 168.6 | 0 | 0 | 0 | 110.4 | R221 M222 V223 T228 K229 | R221-I225 HydrophobicContact CG-CD1 4.34Å; R221-I225 VanDerWaalsContact O-CG1 3.3Å; R221-I225 WeakPolarHBondContact O-CG1 3.24Å; R221-I225 PolarHBondContact O-N 2.89Å; M222-I225 WeakPolarHBondContact O-CB 3.47Å; M222-I225 PolarHBondContact O-N 2.96Å; M222-I225 HydrophobicContact SD-CD1 4.4Å; V223-I225 VanDerWaalsContact C-N 3.34Å; V223-I225 PolarHBondContact O-N 3.07Å; I225-T228 PolarHBondContact O-N 2.89Å; I225-K229 HydrophobicContact CG2-CG 4.11Å; I225-K229 WeakPolarHBondContact O-CB 3.13Å; I225-K229 VanDerWaalsContact O-CG 3.28Å; I225-K229 WeakPolarHBondContact O-CG 3.32Å; I225-K229 PolarHBondContact O-N 3.48Å |
| 226 | I | 98.2 | Very high | 97.1 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.6 | -49.6 | -179.8 | -67.5 | 168.3 | 0 | 0 | 0 | 110.4 | L167 A184 I188 M222 V223 T228 K229 L230 | L167-I226 HydrophobicContact CD1-CG1 4.18Å; L167-I226 HydrophobicContact CD1-CG2 4.5Å; L167-I226 HydrophobicContact CD2-CD1 4.22Å; L167-I226 HydrophobicContact CD2-CG1 3.74Å; A184-I226 HydrophobicContact CB-CD1 3.57Å; I188-I226 HydrophobicContact CD1-CB 3.96Å; I188-I226 HydrophobicContact CD1-CD1 4.28Å; I188-I226 HydrophobicContact CD1-CG2 3.66Å; M222-I226 HydrophobicContact CG-CD1 4.13Å; M222-I226 VanDerWaalsContact O-CG1 3.31Å; M222-I226 WeakPolarHBondContact O-CG1 3.24Å; M222-I226 PolarHBondContact O-N 2.85Å; V223-I226 PolarHBondContact O-N 3.26Å; I226-T228 PolarHBondContact O-N 3.23Å; I226-K229 PolarHBondContact O-N 3.09Å; I226-L230 HydrophobicContact CG2-CD1 3.79Å; I226-L230 HydrophobicContact CG2-CG 4.28Å; I226-L230 WeakPolarHBondContact O-CB 3.38Å; I226-L230 PolarHBondContact O-N 3.38Å |
| 227 | L | 98 | Very high | 97.1 | Very high | 38 Ų | 38 | 56.8 Ų | 56.8 | 20% | 0.199 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.2 | -36.4 | 177.7 | -69.3 | 172.7 | 0 | 0 | 0 | 112 | I188 V223 E224 G231 V235 | I188-L227 HydrophobicContact CD1-CG 4.47Å; V223-L227 HydrophobicContact CG1-CD1 3.95Å; V223-L227 HydrophobicContact CG1-CG 4.45Å; V223-L227 WeakPolarHBondContact O-CG 3.37Å; V223-L227 PolarHBondContact O-N 3.38Å; E224-L227 PolarHBondContact O-N 3.36Å; L227-G231 CarbonylContact O-C 3.37Å; L227-G231 WeakPolarHBondContact O-CA 3.47Å; L227-G231 PolarHBondContact O-N 2.88Å; L227-V235 HydrophobicContact CD2-CB 4.15Å; L227-V235 HydrophobicContact CD2-CG1 3.89Å; L227-V235 HydrophobicContact CD2-CG2 4.13Å |
| 228 | T | 97.9 | Very high | 97 | Very high | 113 Ų | 113 | 53.6 Ų | 53.6 | 69% | 0.693 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -72.6 | -40.2 | 177.5 | -56 | 0 | 0 | 0 | 0 | 112.2 | E224 I225 I226 | E224-T228 WeakPolarHBondContact O-CB 3.49Å; E224-T228 PolarHBondContact O-N 3.49Å; E224-T228 PolarHBondContact O-OG1 3.34Å; I225-T228 PolarHBondContact O-N 2.89Å; I226-T228 PolarHBondContact O-N 3.23Å |
| 229 | K | 97.7 | Very high | 96.8 | Very high | 109 Ų | 109 | 50.1 Ų | 50.1 | 47% | 0.474 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -78.7 | -41 | -175.9 | -70.3 | -65.7 | -177.5 | -177.8 | 0 | 113.1 | L167 K170 V171 I225 I226 | L167-K229 HydrophobicContact CD1-CB 4.11Å; K170-K229 WeakPolarHBondContact CD-O 3.39Å; K170-K229 VanDerWaalsContact CE-O 3.27Å; K170-K229 WeakPolarHBondContact CE-O 3.16Å; K170-K229 PolarHBondContact NZ-O 2.86Å; V171-K229 HydrophobicContact CG2-CB 4.07Å; V171-K229 HydrophobicContact CG2-CD 4.08Å; V171-K229 HydrophobicContact CG2-CG 4.08Å; I225-K229 HydrophobicContact CG2-CG 4.11Å; I225-K229 WeakPolarHBondContact O-CB 3.13Å; I225-K229 VanDerWaalsContact O-CG 3.28Å; I225-K229 WeakPolarHBondContact O-CG 3.32Å; I225-K229 PolarHBondContact O-N 3.48Å; I226-K229 PolarHBondContact O-N 3.09Å |
| 230 | L | 96.4 | Very high | 96.6 | Very high | 10 Ų | 10 | 53 Ų | 53 | 5% | 0.052 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -81.7 | -30.1 | 177 | -61.4 | -173.7 | 0 | 0 | 0 | 111.7 | L163 L166 L167 K170 I226 S234 V235 | L163-L230 HydrophobicContact CD2-CD1 3.98Å; L166-L230 HydrophobicContact CB-CD2 4.33Å; L166-L230 HydrophobicContact CD2-CD1 4.25Å; L166-L230 HydrophobicContact CD2-CD2 3.99Å; L166-L230 HydrophobicContact CG-CD2 3.76Å; L167-L230 HydrophobicContact CB-CD1 4.46Å; L167-L230 HydrophobicContact CB-CD2 4.43Å; L167-L230 HydrophobicContact CD1-CD2 4.16Å; L167-L230 HydrophobicContact CD1-CG 4.09Å; K170-L230 HydrophobicContact CD-CD2 4.11Å; I226-L230 HydrophobicContact CG2-CD1 3.79Å; I226-L230 HydrophobicContact CG2-CG 4.28Å; I226-L230 WeakPolarHBondContact O-CB 3.38Å; I226-L230 PolarHBondContact O-N 3.38Å; L230-S234 WeakPolarHBondContact O-CB 3.31Å; L230-V235 HydrophobicContact CB-CG2 3.9Å; L230-V235 HydrophobicContact CD1-CG2 4.24Å |
| 231 | G | 95.4 | Very high | 96.4 | Very high | 21 Ų | 21 | 50.3 Ų | 50.3 | 22% | 0.216 | 29% | 0.294 | C | S | . | . | trans | 88.5 | 135.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | L227 S233 S234 V235 | L227-G231 CarbonylContact O-C 3.37Å; L227-G231 WeakPolarHBondContact O-CA 3.47Å; L227-G231 PolarHBondContact O-N 2.88Å; G231-S233 PolarHBondContact O-N 2.65Å; G231-S234 PolarHBondContact O-N 2.92Å; G231-S234 VanDerWaalsContact O-N 3.14Å; G231-V235 PolarHBondContact O-N 3.3Å | ||
| 232 | P | 94.4 | Very high | 96.1 | Very high | 93 Ų | 93 | 44.6 Ų | 44.6 | 60% | 0.604 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -61.7 | -31.8 | -175.1 | 23.6 | -33.7 | 0 | 0 | 0 | 112.9 | V235 A236 | P232-V235 PolarHBondContact O-N 2.69Å; P232-A236 VanDerWaalsContact O-CB 3.25Å; P232-A236 WeakPolarHBondContact O-CB 3.31Å; P232-A236 PolarHBondContact O-N 2.85Å |
| 233 | S | 95.4 | Very high | 96 | Very high | 100 Ų | 100 | 43.3 Ų | 43.3 | 70% | 0.699 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -65.2 | -40.4 | 177.2 | -49.6 | 0 | 0 | 0 | 0 | 112.6 | G231 A237 | G231-S233 PolarHBondContact O-N 2.65Å; S233-A237 WeakPolarHBondContact O-CB 3.41Å; S233-A237 PolarHBondContact O-N 3.07Å |
| 234 | S | 94.9 | Very high | 95.9 | Very high | 42 Ų | 42 | 42.8 Ų | 42.8 | 29% | 0.294 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -67.8 | -44.7 | 177.5 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | L230 G231 A236 A237 I238 | L230-S234 WeakPolarHBondContact O-CB 3.31Å; G231-S234 PolarHBondContact O-N 2.92Å; G231-S234 VanDerWaalsContact O-N 3.14Å; S234-A236 PolarHBondContact O-N 3.12Å; S234-A237 WeakPolarHBondContact O-CB 3.43Å; S234-A237 PolarHBondContact O-N 3.26Å; S234-I238 WeakPolarHBondContact O-CG1 3.5Å; S234-I238 PolarHBondContact O-N 2.95Å |
| 235 | V | 97.1 | Very high | 95.8 | Very high | 4 Ų | 4 | 37.7 Ų | 37.7 | 2% | 0.024 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.3 | -42.5 | 177.3 | 176.1 | 0 | 0 | 0 | 0 | 111.5 | L163 I188 F192 L227 L230 G231 P232 I238 G239 | L163-V235 HydrophobicContact CD1-CG1 4.26Å; L163-V235 HydrophobicContact CD2-CG1 4.5Å; L163-V235 HydrophobicContact CD2-CG2 4.15Å; I188-V235 HydrophobicContact CG2-CG1 3.46Å; I188-V235 VanDerWaalsContact CG2-CG1 3.46Å; F192-V235 HydrophobicContact CE2-CG1 4.39Å; F192-V235 HydrophobicContact CZ-CG1 4.47Å; L227-V235 HydrophobicContact CD2-CB 4.15Å; L227-V235 HydrophobicContact CD2-CG1 3.89Å; L227-V235 HydrophobicContact CD2-CG2 4.13Å; L230-V235 HydrophobicContact CB-CG2 3.9Å; L230-V235 HydrophobicContact CD1-CG2 4.24Å; G231-V235 PolarHBondContact O-N 3.3Å; P232-V235 PolarHBondContact O-N 2.69Å; V235-I238 PolarHBondContact O-N 3.39Å; V235-G239 PolarHBondContact O-N 3.33Å |
| 236 | A | 96.4 | Very high | 95.6 | Very high | 48 Ų | 48 | 35 Ų | 35 | 40% | 0.397 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.8 | -38.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P232 S234 G239 A240 | P232-A236 VanDerWaalsContact O-CB 3.25Å; P232-A236 WeakPolarHBondContact O-CB 3.31Å; P232-A236 PolarHBondContact O-N 2.85Å; S234-A236 PolarHBondContact O-N 3.12Å; A236-G239 PolarHBondContact O-N 3.39Å; A236-A240 WeakPolarHBondContact O-CB 3.29Å; A236-A240 PolarHBondContact O-N 3.22Å |
| 237 | A | 96 | Very high | 95.5 | Very high | 34 Ų | 34 | 36.1 Ų | 36.1 | 28% | 0.281 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -62.7 | -46.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L111 S233 S234 G239 A240 C241 | L111-A237 HydrophobicContact CD1-CB 4.23Å; S233-A237 WeakPolarHBondContact O-CB 3.41Å; S233-A237 PolarHBondContact O-N 3.07Å; S234-A237 WeakPolarHBondContact O-CB 3.43Å; S234-A237 PolarHBondContact O-N 3.26Å; A237-G239 VanDerWaalsContact C-N 3.34Å; A237-G239 PolarHBondContact O-N 2.82Å; A237-A240 PolarHBondContact O-N 3.39Å; A237-C241 WeakPolarHBondContact O-CB 3.28Å; A237-C241 PolarHBondContact O-N 3.02Å |
| 238 | I | 95.4 | Very high | 95.4 | Very high | 1 Ų | 1 | 34.3 Ų | 34.3 | 1% | 0.005 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.7 | -41.8 | 175.2 | -69 | 167.3 | 0 | 0 | 0 | 110.9 | L112 K159 L163 L166 S234 V235 A240 C241 | L112-I238 HydrophobicContact CD2-CG2 3.88Å; K159-I238 HydrophobicContact CB-CG2 4.46Å; K159-I238 VanDerWaalsContact CE-O 3.27Å; K159-I238 WeakPolarHBondContact CE-O 3.27Å; K159-I238 HydrophobicContact CG-CG2 4.49Å; L163-I238 HydrophobicContact CD2-CB 4.24Å; L163-I238 HydrophobicContact CD2-CD1 3.59Å; L163-I238 HydrophobicContact CD2-CG2 4.03Å; L163-I238 HydrophobicContact CG-CG2 4.18Å; L166-I238 HydrophobicContact CD2-CD1 3.69Å; S234-I238 WeakPolarHBondContact O-CG1 3.5Å; S234-I238 PolarHBondContact O-N 2.95Å; V235-I238 PolarHBondContact O-N 3.39Å; I238-A240 PolarHBondContact O-N 3.04Å; I238-C241 WeakPolarHBondContact O-CB 3.26Å; I238-C241 PolarHBondContact O-N 3.41Å |
| 239 | G | 94.4 | Very high | 95.1 | Very high | 3 Ų | 3 | 29 Ų | 29 | 3% | 0.031 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.1 | -41.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | K159 F192 V235 A236 A237 | K159-G239 PolarHBondContact NZ-O 3.24Å; F192-G239 VanDerWaalsContact CD2-CA 3.43Å; V235-G239 PolarHBondContact O-N 3.33Å; A236-G239 PolarHBondContact O-N 3.39Å; A237-G239 VanDerWaalsContact C-N 3.34Å; A237-G239 PolarHBondContact O-N 2.82Å |
| 240 | A | 93.3 | Very high | 94.8 | Very high | 62 Ų | 62 | 24.7 Ų | 24.7 | 51% | 0.512 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -83.8 | -19.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114 | A236 A237 I238 | A236-A240 WeakPolarHBondContact O-CB 3.29Å; A236-A240 PolarHBondContact O-N 3.22Å; A237-A240 PolarHBondContact O-N 3.39Å; I238-A240 PolarHBondContact O-N 3.04Å |
| 241 | C | 92.8 | Very high | 94.5 | Very high | 1 Ų | 1 | 24.2 Ų | 24.2 | 1% | 0.007 | 18% | 0.177 | C | C | . | . | trans | -58.6 | 138.9 | -177.7 | -176 | 0 | 0 | 0 | 0 | 111.6 | L112 K159 A237 I238 | L112-C241 HydrophobicContact CD1-CB 4.36Å; L112-C241 VanDerWaalsContact CD1-SG 3.54Å; L112-C241 HydrophobicContact CG-CB 4.43Å; K159-C241 WeakPolarHBondContact CE-O 3.49Å; K159-C241 PolarHBondContact NZ-O 3.29Å; A237-C241 WeakPolarHBondContact O-CB 3.28Å; A237-C241 PolarHBondContact O-N 3.02Å; I238-C241 WeakPolarHBondContact O-CB 3.26Å; I238-C241 PolarHBondContact O-N 3.41Å | ||
| 242 | S | 92.5 | Very high | 94.3 | Very high | 39 Ų | 39 | 23.2 Ų | 23.2 | 27% | 0.273 | 17% | 0.167 | S | C | . | . | trans | -123 | 50.2 | 177.2 | -53.5 | 0 | 0 | 0 | 0 | 110.4 | S105 Q108 D247 | S105-S242 WeakPolarHBondContact CB-O 3.39Å; S105-S242 PolarHBondContact OG-O 2.69Å; Q108-S242 VanDerWaalsContact OE1-N 3.11Å; S242-D247 WeakPolarHBondContact CA-OD2 3.44Å; S242-D247 WeakPolarHBondContact O-CB 3.19Å | ||
| 243 | A | 95.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 14% | 0.139 | C | C | . | . | trans | -127.7 | 27 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | S105 Q108 E109 L112 D247 F248 P297 | S105-A243 WeakPolarHBondContact O-CB 3.22Å; Q108-A243 HydrophobicContact CB-CB 4.11Å; E109-A243 HydrophobicContact CB-CB 4.39Å; L112-A243 HydrophobicContact CD1-CB 4.12Å; L112-A243 WeakPolarHBondContact CD1-O 3.43Å; A243-D247 PolarHBondContact N-OD2 3.18Å; A243-F248 HydrophobicContact CB-CE2 3.93Å; A243-F248 HydrophobicContact CB-CZ 4.14Å; A243-F248 VanDerWaalsContact O-CE2 3.26Å; A243-F248 WeakPolarHBondContact O-CE2 3.19Å; A243-P297 VanDerWaalsContact O-CB 3.28Å; A243-P297 WeakPolarHBondContact O-CB 3.43Å | ||
| 244 | T | 95.8 | Very high | 93.4 | Very high | 4 Ų | 4 | 14.1 Ų | 14.1 | 3% | 0.025 | 11% | 0.105 | C | C | . | . | S | Bend | trans | -69.9 | 162.6 | 171.7 | 66.5 | 0 | 0 | 0 | 0 | 109.8 | L112 I155 C158 K159 I246 D247 F248 | L112-T244 HydrophobicContact CD1-CG2 3.73Å; I155-T244 HydrophobicContact CG2-CG2 4.16Å; C158-T244 HydrophobicContact CB-CG2 3.99Å; K159-T244 HydrophobicContact CG-CG2 4.33Å; T244-I246 PolarHBondContact O-N 2.89Å; T244-D247 WeakPolarHBondContact CB-OD2 3.29Å; T244-D247 PolarHBondContact N-OD2 3.32Å; T244-D247 WeakPolarHBondContact O-CB 3.5Å; T244-D247 PolarHBondContact O-N 2.85Å; T244-D247 VanDerWaalsContact OG1-CG 3.23Å; T244-D247 PolarHBondContact OG1-N 2.9Å; T244-D247 PolarHBondContact OG1-OD2 3.23Å; T244-F248 VanDerWaalsContact O-CD2 3.29Å; T244-F248 WeakPolarHBondContact O-CD2 3.47Å; T244-F248 PolarHBondContact O-N 2.8Å |
| 245 | A | 96.2 | Very high | 92.8 | Very high | 5 Ų | 5 | 13.9 Ų | 13.9 | 4% | 0.041 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -58.7 | -30.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | F248 L249 I283 P297 L300 A301 | A245-F248 PolarHBondContact O-N 2.96Å; A245-L249 VanDerWaalsContact O-CB 3.27Å; A245-L249 WeakPolarHBondContact O-CB 3.44Å; A245-L249 PolarHBondContact O-N 2.55Å; A245-I283 HydrophobicContact CB-CD1 3.91Å; A245-I283 HydrophobicContact CB-CG2 4.03Å; A245-P297 WeakPolarHBondContact CA-O 3.41Å; A245-P297 HydrophobicContact CB-CB 4.44Å; A245-P297 WeakPolarHBondContact CB-O 3.47Å; A245-L300 HydrophobicContact CB-CB 4.24Å; A245-L300 HydrophobicContact CB-CD2 3.96Å; A245-L300 HydrophobicContact CB-CG 4.11Å; A245-A301 HydrophobicContact CB-CB 4.43Å; A245-A301 WeakPolarHBondContact O-CB 3.41Å |
| 246 | I | 95.4 | Very high | 91.8 | Very high | 8 Ų | 8 | 14 Ų | 14 | 4% | 0.041 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -70.4 | -38.9 | 175.6 | -58.1 | 178.6 | 0 | 0 | 0 | 111.4 | I155 T244 L249 S250 C280 I283 | I155-I246 HydrophobicContact CD1-CG2 4.44Å; I155-I246 HydrophobicContact CG1-CB 4.18Å; I155-I246 HydrophobicContact CG1-CD1 4.48Å; I155-I246 HydrophobicContact CG1-CG2 4.06Å; T244-I246 PolarHBondContact O-N 2.89Å; I246-L249 PolarHBondContact O-N 3.24Å; I246-S250 PolarHBondContact O-N 2.93Å; I246-S250 PolarHBondContact O-OG 3.23Å; I246-C280 HydrophobicContact CD1-CB 4.07Å; I246-I283 HydrophobicContact CD1-CG2 4.4Å; I246-I283 HydrophobicContact CG1-CB 4.25Å; I246-I283 HydrophobicContact CG1-CG1 4.41Å; I246-I283 HydrophobicContact CG1-CG2 3.98Å |
| 247 | D | 94.7 | Very high | 90.6 | Very high | 24 Ų | 24 | 12 Ų | 12 | 13% | 0.128 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.4 | -47.4 | 173.9 | -63.8 | -56.9 | 0 | 0 | 0 | 110.6 | S242 A243 T244 L249 S250 I251 | S242-D247 WeakPolarHBondContact CA-OD2 3.44Å; S242-D247 WeakPolarHBondContact O-CB 3.19Å; A243-D247 PolarHBondContact N-OD2 3.18Å; T244-D247 WeakPolarHBondContact CB-OD2 3.29Å; T244-D247 PolarHBondContact N-OD2 3.32Å; T244-D247 WeakPolarHBondContact O-CB 3.5Å; T244-D247 PolarHBondContact O-N 2.85Å; T244-D247 VanDerWaalsContact OG1-CG 3.23Å; T244-D247 PolarHBondContact OG1-N 2.9Å; T244-D247 PolarHBondContact OG1-OD2 3.23Å; D247-L249 VanDerWaalsContact C-N 3.33Å; D247-L249 PolarHBondContact O-N 2.73Å; D247-S250 WeakPolarHBondContact O-CB 3.45Å; D247-S250 PolarHBondContact O-N 3.31Å; D247-I251 VanDerWaalsContact O-CG1 3.31Å; D247-I251 WeakPolarHBondContact O-CG1 3.42Å; D247-I251 PolarHBondContact O-N 2.89Å |
| 248 | F | 95.6 | Very high | 89.1 | Confident | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61 | -41.3 | 175.8 | -77.2 | -63.9 | 0 | 0 | 0 | 112.2 | L102 L106 E109 A243 T244 A245 S250 I251 F252 P297 A301 | L102-F248 HydrophobicContact CD1-CD1 4.08Å; L102-F248 HydrophobicContact CD1-CE1 4.14Å; L106-F248 HydrophobicContact CD2-CE1 3.84Å; L106-F248 HydrophobicContact CD2-CZ 4.02Å; L106-F248 HydrophobicContact CG-CE1 4.03Å; L106-F248 HydrophobicContact CG-CZ 4.44Å; E109-F248 HydrophobicContact CB-CE2 4.46Å; E109-F248 HydrophobicContact CB-CZ 4.25Å; E109-F248 HydrophobicContact CG-CE2 4.12Å; E109-F248 HydrophobicContact CG-CZ 4.29Å; A243-F248 HydrophobicContact CB-CE2 3.93Å; A243-F248 HydrophobicContact CB-CZ 4.14Å; A243-F248 VanDerWaalsContact O-CE2 3.26Å; A243-F248 WeakPolarHBondContact O-CE2 3.19Å; T244-F248 VanDerWaalsContact O-CD2 3.29Å; T244-F248 WeakPolarHBondContact O-CD2 3.47Å; T244-F248 PolarHBondContact O-N 2.8Å; A245-F248 PolarHBondContact O-N 2.96Å; F248-S250 VanDerWaalsContact C-N 3.32Å; F248-S250 PolarHBondContact O-N 2.78Å; F248-I251 WeakPolarHBondContact O-CB 3.48Å; F248-I251 PolarHBondContact O-N 2.95Å; F248-I251 VanDerWaalsContact O-N 3.13Å; F248-F252 HydrophobicContact CB-CD2 4.33Å; F248-F252 HydrophobicContact CB-CE2 3.87Å; F248-F252 HydrophobicContact CB-CZ 4.25Å; F248-F252 HydrophobicContact CD1-CZ 4.18Å; F248-F252 WeakPolarHBondContact O-CB 3.4Å; F248-F252 VanDerWaalsContact O-CD2 3.28Å; F248-F252 WeakPolarHBondContact O-CD2 3.36Å; F248-F252 WeakPolarHBondContact O-CG 3.48Å; F248-F252 PolarHBondContact O-N 3.06Å; F248-P297 HydrophobicContact CD2-CB 4.03Å; F248-P297 HydrophobicContact CE2-CB 4.05Å; F248-A301 HydrophobicContact CB-CB 3.7Å |
| 249 | L | 92.8 | Very high | 87.5 | Confident | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -62.6 | -38.5 | 176.5 | -172.9 | 60.5 | 0 | 0 | 0 | 112.5 | A245 I246 D247 I251 F252 S253 V275 I279 A301 L304 I305 W323 | A245-L249 VanDerWaalsContact O-CB 3.27Å; A245-L249 WeakPolarHBondContact O-CB 3.44Å; A245-L249 PolarHBondContact O-N 2.55Å; I246-L249 PolarHBondContact O-N 3.24Å; D247-L249 VanDerWaalsContact C-N 3.33Å; D247-L249 PolarHBondContact O-N 2.73Å; L249-I251 VanDerWaalsContact C-N 3.3Å; L249-I251 PolarHBondContact O-N 2.86Å; L249-F252 PolarHBondContact O-N 3.34Å; L249-S253 WeakPolarHBondContact O-CB 3.26Å; L249-S253 PolarHBondContact O-N 3.09Å; L249-S253 PolarHBondContact O-OG 3.48Å; L249-V275 HydrophobicContact CB-CG2 4.21Å; L249-V275 HydrophobicContact CD2-CB 4.49Å; L249-V275 HydrophobicContact CD2-CG1 3.48Å; L249-V275 VanDerWaalsContact CD2-CG1 3.48Å; L249-V275 HydrophobicContact CD2-CG2 4.15Å; L249-V275 HydrophobicContact CG-CG1 4.15Å; L249-V275 HydrophobicContact CG-CG2 3.94Å; L249-I279 HydrophobicContact CD2-CG2 3.47Å; L249-I279 VanDerWaalsContact CD2-CG2 3.47Å; L249-A301 HydrophobicContact CB-CB 4.4Å; L249-L304 HydrophobicContact CD2-CD2 4.32Å; L249-I305 HydrophobicContact CD1-CD1 3.62Å; L249-I305 HydrophobicContact CD1-CG1 3.38Å; L249-W323 HydrophobicContact CD1-CH2 3.91Å; L249-W323 HydrophobicContact CD2-CH2 4.21Å; L249-W323 HydrophobicContact CG-CH2 4.08Å |
| 250 | S | 90.8 | Very high | 85.9 | Confident | 20 Ų | 20 | 20.1 Ų | 20.1 | 14% | 0.14 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -65.4 | -34.8 | 174.5 | -53.5 | 0 | 0 | 0 | 0 | 112 | I246 D247 F248 S253 S254 V275 | I246-S250 PolarHBondContact O-N 2.93Å; I246-S250 PolarHBondContact O-OG 3.23Å; D247-S250 WeakPolarHBondContact O-CB 3.45Å; D247-S250 PolarHBondContact O-N 3.31Å; F248-S250 VanDerWaalsContact C-N 3.32Å; F248-S250 PolarHBondContact O-N 2.78Å; S250-S253 WeakPolarHBondContact CA-OG 3.3Å; S250-S253 PolarHBondContact O-OG 3.25Å; S250-S254 PolarHBondContact O-OG 3.41Å; S250-V275 VanDerWaalsContact OG-CG2 3.26Å; S250-V275 WeakPolarHBondContact OG-CG2 3.37Å |
| 251 | I | 91.2 | Very high | 84.5 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -72.7 | -49 | 175.7 | -64.5 | 163.5 | 0 | 0 | 0 | 110.1 | I98 K101 L102 S105 D247 F248 L249 S254 F255 | I98-I251 HydrophobicContact CG2-CG2 3.85Å; K101-I251 HydrophobicContact CD-CD1 4.35Å; K101-I251 HydrophobicContact CD-CG1 4.01Å; K101-I251 HydrophobicContact CG-CD1 3.95Å; K101-I251 HydrophobicContact CG-CG1 4.11Å; L102-I251 HydrophobicContact CB-CG2 3.89Å; L102-I251 HydrophobicContact CD1-CG2 4Å; L102-I251 HydrophobicContact CG-CG2 4.46Å; S105-I251 WeakPolarHBondContact OG-CD1 3.48Å; D247-I251 VanDerWaalsContact O-CG1 3.31Å; D247-I251 WeakPolarHBondContact O-CG1 3.42Å; D247-I251 PolarHBondContact O-N 2.89Å; F248-I251 WeakPolarHBondContact O-CB 3.48Å; F248-I251 PolarHBondContact O-N 2.95Å; F248-I251 VanDerWaalsContact O-N 3.13Å; L249-I251 VanDerWaalsContact C-N 3.3Å; L249-I251 PolarHBondContact O-N 2.86Å; I251-S254 WeakPolarHBondContact O-CB 3.35Å; I251-S254 PolarHBondContact O-N 3.19Å; I251-S254 VanDerWaalsContact O-N 3.17Å; I251-F255 HydrophobicContact CG2-CE2 4.14Å |
| 252 | F | 90.7 | Very high | 83.1 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.1 | -48 | -179.8 | -63.4 | -29.2 | 0 | 0 | 0 | 111.7 | L102 F248 L249 S254 F255 G256 A301 L302 I305 F326 L334 | L102-F252 HydrophobicContact CD1-CE1 3.71Å; L102-F252 HydrophobicContact CD1-CZ 4.38Å; F248-F252 HydrophobicContact CB-CD2 4.33Å; F248-F252 HydrophobicContact CB-CE2 3.87Å; F248-F252 HydrophobicContact CB-CZ 4.25Å; F248-F252 HydrophobicContact CD1-CZ 4.18Å; F248-F252 WeakPolarHBondContact O-CB 3.4Å; F248-F252 VanDerWaalsContact O-CD2 3.28Å; F248-F252 WeakPolarHBondContact O-CD2 3.36Å; F248-F252 WeakPolarHBondContact O-CG 3.48Å; F248-F252 PolarHBondContact O-N 3.06Å; L249-F252 PolarHBondContact O-N 3.34Å; F252-S254 PolarHBondContact O-N 3.25Å; F252-F255 WeakPolarHBondContact O-CA 3.36Å; F252-F255 WeakPolarHBondContact O-CB 3.16Å; F252-F255 PolarHBondContact O-N 3.05Å; F252-G256 PolarHBondContact O-N 3.21Å; F252-A301 HydrophobicContact CD2-CB 4Å; F252-A301 HydrophobicContact CE2-CB 3.83Å; F252-L302 HydrophobicContact CD2-CD2 3.78Å; F252-L302 HydrophobicContact CD2-CG 4.19Å; F252-L302 HydrophobicContact CE1-CD2 4.47Å; F252-L302 HydrophobicContact CE2-CD1 4.49Å; F252-L302 HydrophobicContact CE2-CD2 3.61Å; F252-L302 HydrophobicContact CE2-CG 3.59Å; F252-L302 HydrophobicContact CG-CD2 4.31Å; F252-L302 HydrophobicContact CZ-CD1 4.46Å; F252-L302 HydrophobicContact CZ-CD2 3.99Å; F252-L302 HydrophobicContact CZ-CG 4Å; F252-I305 HydrophobicContact CB-CD1 3.61Å; F252-I305 HydrophobicContact CD2-CD1 3.91Å; F252-I305 HydrophobicContact CG-CD1 4.21Å; F252-F326 HydrophobicContact CB-CZ 4.34Å; F252-F326 WeakPolarHBondContact O-CZ 3.35Å; F252-L334 HydrophobicContact CB-CD1 4.42Å; F252-L334 HydrophobicContact CD1-CD1 4.01Å; F252-L334 HydrophobicContact CD1-CD2 4.17Å; F252-L334 HydrophobicContact CE1-CD2 4.38Å; F252-L334 HydrophobicContact CG-CD1 4.32Å |
| 253 | S | 85.7 | Confident | 81.6 | Confident | 2 Ų | 2 | 21.9 Ų | 21.9 | 1% | 0.014 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -53.1 | -28.9 | 176.8 | 53.4 | 0 | 0 | 0 | 0 | 113.7 | L249 S250 F255 G256 I257 L324 | L249-S253 WeakPolarHBondContact O-CB 3.26Å; L249-S253 PolarHBondContact O-N 3.09Å; L249-S253 PolarHBondContact O-OG 3.48Å; S250-S253 WeakPolarHBondContact CA-OG 3.3Å; S250-S253 PolarHBondContact O-OG 3.25Å; S253-F255 VanDerWaalsContact C-N 3.3Å; S253-F255 PolarHBondContact O-N 3.47Å; S253-G256 PolarHBondContact O-N 2.87Å; S253-I257 VanDerWaalsContact O-CD1 3.32Å; S253-I257 WeakPolarHBondContact O-CD1 3.47Å; S253-I257 VanDerWaalsContact O-CG1 3.31Å; S253-I257 WeakPolarHBondContact O-CG1 3.38Å; S253-L324 VanDerWaalsContact CB-CD1 3.49Å |
| 254 | S | 84.1 | Confident | 79.8 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -71.8 | -20.2 | 175.7 | -58.3 | 0 | 0 | 0 | 0 | 113.9 | S250 I251 F252 Y262 | S250-S254 PolarHBondContact O-OG 3.41Å; I251-S254 WeakPolarHBondContact O-CB 3.35Å; I251-S254 PolarHBondContact O-N 3.19Å; I251-S254 VanDerWaalsContact O-N 3.17Å; F252-S254 PolarHBondContact O-N 3.25Å; S254-Y262 PolarHBondContact OG-OH 3.42Å |
| 255 | F | 82.5 | Confident | 77.9 | Confident | 37 Ų | 37 | 34.3 Ų | 34.3 | 16% | 0.162 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -80.9 | -32.6 | 170.8 | -71.6 | -77.8 | 0 | 0 | 0 | 112.9 | L73 Y95 I98 L102 I251 F252 S253 I257 F326 L334 | L73-F255 HydrophobicContact CD1-CD1 4.01Å; L73-F255 HydrophobicContact CD1-CE1 4.01Å; Y95-F255 HydrophobicContact CD1-CD1 4.35Å; Y95-F255 HydrophobicContact CD1-CE1 4.41Å; Y95-F255 HydrophobicContact CE1-CD1 4.45Å; I98-F255 HydrophobicContact CB-CE2 4.39Å; I98-F255 HydrophobicContact CB-CZ 4.09Å; I98-F255 HydrophobicContact CG2-CD2 3.84Å; I98-F255 HydrophobicContact CG2-CE1 4.11Å; I98-F255 HydrophobicContact CG2-CE2 3.25Å; I98-F255 HydrophobicContact CG2-CG 4.5Å; I98-F255 HydrophobicContact CG2-CZ 3.4Å; I98-F255 VanDerWaalsContact CG2-CZ 3.4Å; L102-F255 HydrophobicContact CD2-CE2 4.27Å; L102-F255 HydrophobicContact CD2-CZ 4.45Å; I251-F255 HydrophobicContact CG2-CE2 4.14Å; F252-F255 WeakPolarHBondContact O-CA 3.36Å; F252-F255 WeakPolarHBondContact O-CB 3.16Å; F252-F255 PolarHBondContact O-N 3.05Å; S253-F255 VanDerWaalsContact C-N 3.3Å; S253-F255 PolarHBondContact O-N 3.47Å; F255-I257 PolarHBondContact O-N 3.22Å; F255-F326 HydrophobicContact CB-CE1 4.28Å; F255-F326 HydrophobicContact CB-CZ 4.39Å; F255-L334 HydrophobicContact CD2-CD2 3.92Å; F255-L334 HydrophobicContact CE2-CD2 4.09Å; F255-L334 HydrophobicContact CG-CD2 4.25Å |
| 256 | G | 76.4 | Confident | 75.7 | Confident | 6 Ų | 6 | 35.4 Ų | 35.4 | 6% | 0.062 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -83.1 | 10.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | F252 S253 Q325 | F252-G256 PolarHBondContact O-N 3.21Å; S253-G256 PolarHBondContact O-N 2.87Å; G256-Q325 WeakPolarHBondContact CA-O 3.27Å; G256-Q325 PolarHBondContact O-N 3.13Å; G256-Q325 VanDerWaalsContact O-N 3.12Å; G256-Q325 VanDerWaalsContact O-O 3.11Å |
| 257 | I | 70.9 | Confident | 73.6 | Confident | 7 Ų | 7 | 39.2 Ų | 39.2 | 4% | 0.036 | 23% | 0.232 | C | C | . | . | S | Bend | trans | -125.6 | 126 | -173.8 | -68.1 | 173.3 | 0 | 0 | 0 | 109.5 | S253 F255 F259 S261 Y262 L273 W323 | S253-I257 VanDerWaalsContact O-CD1 3.32Å; S253-I257 WeakPolarHBondContact O-CD1 3.47Å; S253-I257 VanDerWaalsContact O-CG1 3.31Å; S253-I257 WeakPolarHBondContact O-CG1 3.38Å; F255-I257 PolarHBondContact O-N 3.22Å; I257-F259 PolarHBondContact O-N 3.2Å; I257-S261 WeakPolarHBondContact CG2-OG 3.36Å; I257-Y262 HydrophobicContact CG2-CD2 4.17Å; I257-L273 HydrophobicContact CD1-CD1 3.08Å; I257-L273 HydrophobicContact CG1-CD1 4.43Å; I257-L273 HydrophobicContact CG2-CD1 4.45Å; I257-W323 WeakPolarHBondContact CD1-O 3.22Å |
| 258 | P | 64.3 | Low | 71.3 | Confident | 70 Ų | 70 | 42 Ų | 42 | 46% | 0.455 | 25% | 0.253 | S | S | . | . | trans | -59.3 | 128.6 | 178 | -23.3 | 32.6 | 0 | 0 | 0 | 111.4 | V260 S261 | P258-V260 PolarHBondContact O-N 3.48Å; P258-S261 WeakPolarHBondContact O-CB 3.3Å; P258-S261 PolarHBondContact O-N 3.14Å; P258-S261 PolarHBondContact O-OG 2.91Å | ||
| 259 | F | 63.2 | Low | 68.9 | Low | 35 Ų | 35 | 49.6 Ų | 49.6 | 15% | 0.154 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -48.4 | -35 | -177 | 176.6 | -102.1 | 0 | 0 | 0 | 114.4 | R90 C91 F94 I257 S261 Y262 Q263 | R90-F259 HydrophobicContact CB-CZ 4.16Å; R90-F259 HydrophobicContact CG-CZ 3.8Å; C91-F259 HydrophobicContact CB-CD1 4.02Å; C91-F259 HydrophobicContact CB-CD2 4.49Å; C91-F259 HydrophobicContact CB-CE1 4.04Å; C91-F259 HydrophobicContact CB-CG 4.25Å; C91-F259 HydrophobicContact CB-CZ 4.29Å; F94-F259 HydrophobicContact CB-CD2 4.03Å; F94-F259 HydrophobicContact CB-CE2 3.66Å; F94-F259 AromaticContact CD1-CD2 3.62Å; F94-F259 HydrophobicContact CD1-CD2 3.62Å; F94-F259 HydrophobicContact CD1-CE2 4.11Å; F94-F259 HydrophobicContact CD2-CE2 4.39Å; F94-F259 HydrophobicContact CE1-CD2 4.15Å; F94-F259 AromaticContact CG-CD2 3.83Å; F94-F259 HydrophobicContact CG-CD2 3.83Å; F94-F259 AromaticContact CG-CE2 3.82Å; F94-F259 HydrophobicContact CG-CE2 3.82Å; I257-F259 PolarHBondContact O-N 3.2Å; F259-S261 VanDerWaalsContact C-N 3.3Å; F259-S261 PolarHBondContact O-N 3.42Å; F259-Y262 VanDerWaalsContact O-CB 3.3Å; F259-Y262 WeakPolarHBondContact O-CB 3.5Å; F259-Y262 PolarHBondContact O-N 3.05Å; F259-Y262 VanDerWaalsContact O-N 3.11Å; F259-Q263 PolarHBondContact O-N 3.37Å; F259-Q263 VanDerWaalsContact O-N 3.12Å |
| 260 | V | 59.8 | Low | 66.7 | Low | 103 Ų | 103 | 55.1 Ų | 55.1 | 62% | 0.624 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -57.9 | -41.4 | 176.8 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | P258 Y262 Q263 N264 | P258-V260 PolarHBondContact O-N 3.48Å; V260-Y262 VanDerWaalsContact C-N 3.3Å; V260-Y262 PolarHBondContact O-N 3.17Å; V260-Q263 PolarHBondContact O-N 3.1Å; V260-N264 PolarHBondContact O-N 3.29Å |
| 261 | S | 64.1 | Low | 64.8 | Low | 33 Ų | 33 | 58.3 Ų | 58.3 | 23% | 0.231 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -69.3 | -29.8 | 178 | 70.8 | 0 | 0 | 0 | 0 | 112.5 | I257 P258 F259 K265 | I257-S261 WeakPolarHBondContact CG2-OG 3.36Å; P258-S261 WeakPolarHBondContact O-CB 3.3Å; P258-S261 PolarHBondContact O-N 3.14Å; P258-S261 PolarHBondContact O-OG 2.91Å; F259-S261 VanDerWaalsContact C-N 3.3Å; F259-S261 PolarHBondContact O-N 3.42Å; S261-K265 PolarHBondContact O-N 3.41Å |
| 262 | Y | 62.6 | Low | 63.5 | Low | 14 Ų | 14 | 62 Ų | 62 | 6% | 0.055 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 174.1 | -131.3 | -82.1 | 0 | 0 | 0 | 111.5 | F94 S254 I257 F259 V260 N264 K265 S266 W272 L273 | F94-Y262 AromaticContact CE2-CD1 3.83Å; F94-Y262 HydrophobicContact CE2-CD1 3.83Å; F94-Y262 HydrophobicContact CE2-CD2 4.28Å; F94-Y262 AromaticContact CE2-CE1 3.77Å; F94-Y262 HydrophobicContact CE2-CE1 3.77Å; F94-Y262 HydrophobicContact CE2-CE2 4.21Å; F94-Y262 HydrophobicContact CE2-CG 4.06Å; F94-Y262 AromaticContact CE2-CZ 3.95Å; F94-Y262 HydrophobicContact CZ-CD1 4.08Å; F94-Y262 AromaticContact CZ-CD2 3.69Å; F94-Y262 HydrophobicContact CZ-CD2 3.69Å; F94-Y262 HydrophobicContact CZ-CE1 4.12Å; F94-Y262 AromaticContact CZ-CE2 3.71Å; F94-Y262 HydrophobicContact CZ-CE2 3.71Å; F94-Y262 AromaticContact CZ-CG 3.85Å; F94-Y262 HydrophobicContact CZ-CG 3.85Å; F94-Y262 AromaticContact CZ-CZ 3.91Å; S254-Y262 PolarHBondContact OG-OH 3.42Å; I257-Y262 HydrophobicContact CG2-CD2 4.17Å; F259-Y262 VanDerWaalsContact O-CB 3.3Å; F259-Y262 WeakPolarHBondContact O-CB 3.5Å; F259-Y262 PolarHBondContact O-N 3.05Å; F259-Y262 VanDerWaalsContact O-N 3.11Å; V260-Y262 VanDerWaalsContact C-N 3.3Å; V260-Y262 PolarHBondContact O-N 3.17Å; Y262-N264 VanDerWaalsContact C-N 3.34Å; Y262-N264 PolarHBondContact O-N 2.58Å; Y262-K265 PolarHBondContact O-N 3.47Å; Y262-S266 VanDerWaalsContact O-CB 3.29Å; Y262-S266 WeakPolarHBondContact O-CB 3.3Å; Y262-S266 PolarHBondContact O-N 3.19Å; Y262-W272 VanDerWaalsContact OH-CA 3.28Å; Y262-W272 WeakPolarHBondContact OH-CA 3.5Å; Y262-L273 HydrophobicContact CD2-CD1 4.08Å; Y262-L273 HydrophobicContact CE2-CD1 3.59Å; Y262-L273 HydrophobicContact CE2-CG 3.94Å; Y262-L273 PolarHBondContact OH-N 2.99Å |
| 263 | Q | 61.1 | Low | 62.3 | Low | 92 Ų | 92 | 63.9 Ų | 63.9 | 43% | 0.43 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.8 | -37.8 | 178.9 | -172.4 | 167.7 | 110.5 | 0 | 0 | 112.3 | F259 V260 K265 | F259-Q263 PolarHBondContact O-N 3.37Å; F259-Q263 VanDerWaalsContact O-N 3.12Å; V260-Q263 PolarHBondContact O-N 3.1Å; Q263-K265 VanDerWaalsContact C-N 3.35Å |
| 264 | N | 58.3 | Low | 61.9 | Low | 131 Ų | 131 | 69.1 Ų | 69.1 | 70% | 0.701 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -70.2 | -30.6 | 178.9 | -69.7 | -13.3 | 0 | 0 | 0 | 112.7 | V260 Y262 | V260-N264 PolarHBondContact O-N 3.29Å; Y262-N264 VanDerWaalsContact C-N 3.34Å; Y262-N264 PolarHBondContact O-N 2.58Å |
| 265 | K | 56.2 | Low | 61.9 | Low | 133 Ų | 133 | 69.9 Ų | 69.9 | 58% | 0.578 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -85.3 | -32 | 177.6 | -69.1 | 179.1 | -179.2 | 174.5 | 0 | 112.8 | S261 Y262 Q263 L273 | S261-K265 PolarHBondContact O-N 3.41Å; Y262-K265 PolarHBondContact O-N 3.47Å; Q263-K265 VanDerWaalsContact C-N 3.35Å; K265-L273 HydrophobicContact CD-CD2 4.27Å |
| 266 | S | 50.4 | Low | 62.1 | Low | 29 Ų | 29 | 69.9 Ų | 69.9 | 20% | 0.203 | 40% | 0.403 | C | S | . | . | trans | -102.6 | 73 | -176.6 | -175.2 | 0 | 0 | 0 | 0 | 111.3 | Y262 S268 | Y262-S266 VanDerWaalsContact O-CB 3.29Å; Y262-S266 WeakPolarHBondContact O-CB 3.3Å; Y262-S266 PolarHBondContact O-N 3.19Å; S266-S268 PolarHBondContact O-N 3.34Å; S266-S268 PolarHBondContact OG-O 2.92Å | ||
| 267 | G | 49.3 | Very low | 62.6 | Low | 87 Ų | 87 | 76 Ų | 76 | 90% | 0.897 | 43% | 0.433 | S | S | * | . | S | Bend | trans | -63.6 | -14.6 | 156.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 268 | S | 47.3 | Very low | 63.3 | Low | 83 Ų | 83 | 77.7 Ų | 77.7 | 58% | 0.58 | 45% | 0.446 | S | S | * | . | S | Bend | trans | -120.1 | 103.4 | 178.8 | 179.2 | 0 | 0 | 0 | 0 | 110 | S266 T271 | S266-S268 PolarHBondContact O-N 3.34Å; S266-S268 PolarHBondContact OG-O 2.92Å; S268-T271 PolarHBondContact O-OG1 2.75Å |
| 269 | Q | 45.3 | Very low | 64.5 | Low | 159 Ų | 159 | 74.5 Ų | 74.5 | 74% | 0.743 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 11.4 | 112.7 | 160.7 | -57.1 | -76.2 | 28.1 | 0 | 0 | 116.6 | T271 | Q269-T271 PolarHBondContact O-N 2.88Š|
| 270 | N | 47.5 | Very low | 65.9 | Low | 116 Ų | 116 | 73.4 Ų | 73.4 | 62% | 0.62 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.9 | 29 | 155.7 | -59.8 | -11.7 | 0 | 0 | 0 | 117.4 | W272 | N270-W272 PolarHBondContact O-N 3.31Š|
| 271 | T | 50.9 | Low | 67.4 | Low | 88 Ų | 88 | 70.2 Ų | 70.2 | 54% | 0.54 | 40% | 0.398 | S | S | . | . | trans | -77.6 | 101.6 | 176.5 | -0.5 | 0 | 0 | 0 | 0 | 108.7 | S268 Q269 L273 | S268-T271 PolarHBondContact O-OG1 2.75Å; Q269-T271 PolarHBondContact O-N 2.88Å; T271-L273 PolarHBondContact O-N 3.47Å | ||
| 272 | W | 62.8 | Low | 68.8 | Low | 78 Ų | 78 | 69.8 Ų | 69.8 | 30% | 0.295 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -49.5 | 132.6 | 170.2 | -57.6 | 92.6 | 0 | 0 | 0 | 109.8 | I98 K101 Y262 N270 P274 | I98-W272 HydrophobicContact CB-CH2 4.24Å; I98-W272 HydrophobicContact CB-CZ3 4.26Å; I98-W272 HydrophobicContact CG1-CH2 3.78Å; I98-W272 HydrophobicContact CG1-CZ3 3.68Å; I98-W272 HydrophobicContact CG2-CZ3 4.26Å; K101-W272 HydrophobicContact CD-CD2 4.38Å; K101-W272 HydrophobicContact CD-CH2 4.05Å; K101-W272 HydrophobicContact CD-CZ2 3.85Å; K101-W272 HydrophobicContact CD-CZ3 4.35Å; Y262-W272 VanDerWaalsContact OH-CA 3.28Å; Y262-W272 WeakPolarHBondContact OH-CA 3.5Å; N270-W272 PolarHBondContact O-N 3.31Å; W272-P274 WeakPolarHBondContact O-CD 3.44Å |
| 273 | L | 66.1 | Low | 70.3 | Confident | 38 Ų | 38 | 69.1 Ų | 69.1 | 20% | 0.199 | 39% | 0.39 | C | S | . | . | P | Polyproline II helix | trans | -61.9 | 124.8 | -178.5 | -76.4 | 164.8 | 0 | 0 | 0 | 110 | I257 Y262 K265 T271 V275 | I257-L273 HydrophobicContact CD1-CD1 3.08Å; I257-L273 HydrophobicContact CG1-CD1 4.43Å; I257-L273 HydrophobicContact CG2-CD1 4.45Å; Y262-L273 HydrophobicContact CD2-CD1 4.08Å; Y262-L273 HydrophobicContact CE2-CD1 3.59Å; Y262-L273 HydrophobicContact CE2-CG 3.94Å; Y262-L273 PolarHBondContact OH-N 2.99Å; K265-L273 HydrophobicContact CD-CD2 4.27Å; T271-L273 PolarHBondContact O-N 3.47Å; L273-V275 PolarHBondContact O-N 3.07Å |
| 274 | P | 76.2 | Confident | 71.9 | Confident | 112 Ų | 112 | 64.9 Ų | 64.9 | 73% | 0.727 | 37% | 0.37 | S | S | * | . | P | Polyproline II helix | trans | -66.3 | 130.5 | 178.3 | 26.8 | -32.2 | 0 | 0 | 0 | 108.9 | W272 | W272-P274 WeakPolarHBondContact O-CD 3.44Š|
| 275 | V | 85.2 | Confident | 73.6 | Confident | 17 Ų | 17 | 59.3 Ų | 59.3 | 10% | 0.103 | 34% | 0.34 | C | S | . | . | P | Polyproline II helix | trans | -63.6 | 131.4 | 172.6 | 175.1 | 0 | 0 | 0 | 0 | 108.7 | L249 S250 L273 I277 I279 C280 W323 | L249-V275 HydrophobicContact CB-CG2 4.21Å; L249-V275 HydrophobicContact CD2-CB 4.49Å; L249-V275 HydrophobicContact CD2-CG1 3.48Å; L249-V275 VanDerWaalsContact CD2-CG1 3.48Å; L249-V275 HydrophobicContact CD2-CG2 4.15Å; L249-V275 HydrophobicContact CG-CG1 4.15Å; L249-V275 HydrophobicContact CG-CG2 3.94Å; S250-V275 VanDerWaalsContact OG-CG2 3.26Å; S250-V275 WeakPolarHBondContact OG-CG2 3.37Å; L273-V275 PolarHBondContact O-N 3.07Å; V275-I277 PolarHBondContact O-N 2.86Å; V275-I279 HydrophobicContact CG1-CB 4.02Å; V275-I279 HydrophobicContact CG1-CG2 4.21Å; V275-C280 VanDerWaalsContact CG1-SG 3.58Å; V275-W323 HydrophobicContact CG1-CZ3 4.43Å |
| 276 | P | 86.5 | Confident | 75.4 | Confident | 36 Ų | 36 | 53 Ų | 53 | 23% | 0.234 | 31% | 0.312 | C | S | . | . | P | Polyproline II helix | trans | -54.5 | 138.5 | 175.9 | -25.6 | 33 | 0 | 0 | 0 | 112.2 | S278 I279 C280 V320 W323 | P276-S278 PolarHBondContact O-N 3.21Å; P276-I279 HydrophobicContact CB-CD1 4.1Å; P276-I279 HydrophobicContact CB-CG1 4.17Å; P276-I279 HydrophobicContact CG-CD1 3.94Å; P276-I279 WeakPolarHBondContact O-CB 3.49Å; P276-I279 PolarHBondContact O-N 3.03Å; P276-C280 PolarHBondContact O-N 3.47Å; P276-C280 VanDerWaalsContact O-N 3.16Å; P276-V320 HydrophobicContact CG-CG1 4.36Å; P276-W323 HydrophobicContact CG-CD2 4.05Å; P276-W323 HydrophobicContact CG-CE3 4.07Å; P276-W323 HydrophobicContact CG-CG 4.4Å |
| 277 | I | 86.2 | Confident | 77.5 | Confident | 134 Ų | 134 | 52.8 Ų | 52.8 | 69% | 0.687 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -62.3 | -31.3 | -173.9 | -163.2 | 147.6 | 0 | 0 | 0 | 113.3 | V275 I279 C280 R281 | V275-I277 PolarHBondContact O-N 2.86Å; I277-I279 PolarHBondContact O-N 3.08Å; I277-C280 WeakPolarHBondContact O-CB 3.42Å; I277-C280 PolarHBondContact O-N 2.66Å; I277-R281 WeakPolarHBondContact O-CB 3.48Å; I277-R281 PolarHBondContact O-N 3.09Å |
| 278 | S | 86.7 | Confident | 79.7 | Confident | 44 Ų | 44 | 49.2 Ų | 49.2 | 31% | 0.308 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.7 | -30.5 | 174.9 | 56.5 | 0 | 0 | 0 | 0 | 112.5 | P276 Q282 | P276-S278 PolarHBondContact O-N 3.21Å; S278-Q282 WeakPolarHBondContact O-CG 3.36Å; S278-Q282 PolarHBondContact O-N 3.27Å |
| 279 | I | 89.7 | Confident | 81.8 | Confident | 3 Ų | 3 | 46.2 Ų | 46.2 | 2% | 0.015 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -85.4 | -40.3 | -179.3 | -54.2 | -178.4 | 0 | 0 | 0 | 110.1 | L249 V275 P276 I277 R281 Q282 I283 L304 L308 W323 | L249-I279 HydrophobicContact CD2-CG2 3.47Å; L249-I279 VanDerWaalsContact CD2-CG2 3.47Å; V275-I279 HydrophobicContact CG1-CB 4.02Å; V275-I279 HydrophobicContact CG1-CG2 4.21Å; P276-I279 HydrophobicContact CB-CD1 4.1Å; P276-I279 HydrophobicContact CB-CG1 4.17Å; P276-I279 HydrophobicContact CG-CD1 3.94Å; P276-I279 WeakPolarHBondContact O-CB 3.49Å; P276-I279 PolarHBondContact O-N 3.03Å; I277-I279 PolarHBondContact O-N 3.08Å; I279-R281 PolarHBondContact O-N 2.89Å; I279-Q282 WeakPolarHBondContact O-CB 3.26Å; I279-Q282 PolarHBondContact O-N 2.68Å; I279-Q282 VanDerWaalsContact O-N 3.16Å; I279-I283 PolarHBondContact O-N 3.45Å; I279-I283 VanDerWaalsContact O-N 3.14Å; I279-L304 HydrophobicContact CG2-CD2 3.55Å; I279-L304 HydrophobicContact CG2-CG 4.29Å; I279-L308 HydrophobicContact CD1-CD1 3.96Å; I279-L308 HydrophobicContact CG1-CD1 4.35Å; I279-L308 HydrophobicContact CG2-CD1 4Å; I279-W323 HydrophobicContact CD1-CD2 4.15Å; I279-W323 HydrophobicContact CD1-CH2 3.55Å; I279-W323 HydrophobicContact CD1-CZ2 3.03Å; I279-W323 HydrophobicContact CD1-CZ3 4.27Å; I279-W323 HydrophobicContact CG1-CZ2 4.45Å; I279-W323 HydrophobicContact CG2-CH2 4.42Å |
| 280 | C | 92.6 | Very high | 84 | Confident | 11 Ų | 11 | 38.8 Ų | 38.8 | 7% | 0.074 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -53.8 | -42.5 | 167.8 | -64.8 | 0 | 0 | 0 | 0 | 110.9 | S154 I246 V275 P276 I277 Q282 I283 E284 | S154-C280 WeakPolarHBondContact OG-CB 3.49Å; I246-C280 HydrophobicContact CD1-CB 4.07Å; V275-C280 VanDerWaalsContact CG1-SG 3.58Å; P276-C280 PolarHBondContact O-N 3.47Å; P276-C280 VanDerWaalsContact O-N 3.16Å; I277-C280 WeakPolarHBondContact O-CB 3.42Å; I277-C280 PolarHBondContact O-N 2.66Å; C280-Q282 PolarHBondContact O-N 3.37Å; C280-I283 WeakPolarHBondContact O-CB 3.37Å; C280-I283 PolarHBondContact O-N 3.39Å; C280-E284 WeakPolarHBondContact O-CG 3.48Å; C280-E284 PolarHBondContact O-N 2.91Å |
| 281 | R | 91.2 | Very high | 86.1 | Confident | 36 Ų | 36 | 37.4 Ų | 37.4 | 14% | 0.136 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.4 | -38 | 178.4 | -165.6 | 57.7 | 165.6 | 170.6 | 11.5 | 113.3 | W143 S147 I277 I279 E284 I285 | W143-R281 VanDerWaalsContact CD1-NH1 3.31Å; W143-R281 VanDerWaalsContact CE2-NE 3.27Å; W143-R281 VanDerWaalsContact CE2-NH1 3.29Å; W143-R281 HydrophobicContact CZ2-CG 4.14Å; S147-R281 VanDerWaalsContact CB-NH1 3.26Å; S147-R281 PolarHBondContact OG-NH2 3.4Å; I277-R281 WeakPolarHBondContact O-CB 3.48Å; I277-R281 PolarHBondContact O-N 3.09Å; I279-R281 PolarHBondContact O-N 2.89Å; R281-E284 WeakPolarHBondContact CD-OE2 3.42Å; R281-E284 IonicContact CZ-OE2 3.56Å; R281-E284 IonicContact NE-OE2 3.42Å; R281-E284 IonicContact NH1-OE2 3.86Å; R281-E284 PolarHBondContact NH1-OE2 2.82Å; R281-E284 PolarHBondContact O-N 2.81Å; R281-I285 HydrophobicContact CG-CD1 4.43Å; R281-I285 WeakPolarHBondContact O-CG1 3.44Å; R281-I285 PolarHBondContact O-N 3.37Å |
| 282 | Q | 92.5 | Very high | 88.1 | Confident | 24 Ų | 24 | 33.2 Ų | 33.2 | 11% | 0.112 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.1 | -42.3 | 173.5 | -74.4 | 176.2 | 62.3 | 0 | 0 | 111.7 | S278 I279 C280 I285 A286 L304 L317 L356 | S278-Q282 WeakPolarHBondContact O-CG 3.36Å; S278-Q282 PolarHBondContact O-N 3.27Å; I279-Q282 WeakPolarHBondContact O-CB 3.26Å; I279-Q282 PolarHBondContact O-N 2.68Å; I279-Q282 VanDerWaalsContact O-N 3.16Å; C280-Q282 PolarHBondContact O-N 3.37Å; Q282-I285 PolarHBondContact O-N 3.41Å; Q282-A286 WeakPolarHBondContact O-CB 3.43Å; Q282-A286 PolarHBondContact O-N 3.47Å; Q282-L304 HydrophobicContact CB-CD1 4.26Å; Q282-L317 VanDerWaalsContact NE2-CD2 3.29Å; Q282-L356 HydrophobicContact CB-CD1 4.32Å; Q282-L356 HydrophobicContact CB-CD2 4.05Å; Q282-L356 HydrophobicContact CG-CD1 4.28Å; Q282-L356 HydrophobicContact CG-CD2 4.18Å |
| 283 | I | 94.6 | Very high | 89.4 | Confident | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61 | -45.8 | 173.7 | -69.3 | -66.7 | 0 | 0 | 0 | 111.1 | A245 I246 I279 C280 I285 A286 L287 L300 L304 | A245-I283 HydrophobicContact CB-CD1 3.91Å; A245-I283 HydrophobicContact CB-CG2 4.03Å; I246-I283 HydrophobicContact CD1-CG2 4.4Å; I246-I283 HydrophobicContact CG1-CB 4.25Å; I246-I283 HydrophobicContact CG1-CG1 4.41Å; I246-I283 HydrophobicContact CG1-CG2 3.98Å; I279-I283 PolarHBondContact O-N 3.45Å; I279-I283 VanDerWaalsContact O-N 3.14Å; C280-I283 WeakPolarHBondContact O-CB 3.37Å; C280-I283 PolarHBondContact O-N 3.39Å; I283-I285 PolarHBondContact O-N 2.88Å; I283-A286 WeakPolarHBondContact O-CB 3.3Å; I283-A286 PolarHBondContact O-N 3.09Å; I283-L287 HydrophobicContact CG2-CD1 3.97Å; I283-L287 HydrophobicContact CG2-CG 4.34Å; I283-L287 WeakPolarHBondContact O-CG 3.13Å; I283-L287 PolarHBondContact O-N 2.86Å; I283-L300 HydrophobicContact CD1-CD1 4.37Å; I283-L300 HydrophobicContact CD1-CD2 4.1Å; I283-L300 HydrophobicContact CD1-CG 3.8Å; I283-L304 HydrophobicContact CD1-CB 4.33Å; I283-L304 HydrophobicContact CD1-CD2 3.44Å; I283-L304 VanDerWaalsContact CD1-CD2 3.44Å; I283-L304 HydrophobicContact CG1-CD2 3.52Å |
| 284 | E | 94.5 | Very high | 90.6 | Very high | 4 Ų | 4 | 30 Ų | 30 | 2% | 0.019 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.4 | -46.6 | 179.5 | -66.9 | 172.3 | 179.6 | 0 | 0 | 112.1 | W143 H146 S154 F157 C280 R281 A286 L287 | W143-E284 PolarHBondContact NE1-OE2 2.94Å; W143-E284 VanDerWaalsContact NE1-OE2 3.14Å; H146-E284 IonicContact CD2-OE1 3.55Å; H146-E284 IonicContact CD2-OE2 3.64Å; H146-E284 IonicContact NE2-OE1 2.76Å; H146-E284 PolarHBondContact NE2-OE1 3.31Å; S154-E284 WeakPolarHBondContact CA-OE1 3.49Å; S154-E284 WeakPolarHBondContact CB-OE1 3.48Å; S154-E284 PolarHBondContact OG-OE1 3Å; F157-E284 HydrophobicContact CB-CG 4.41Å; F157-E284 HydrophobicContact CD1-CB 3.74Å; F157-E284 HydrophobicContact CD1-CG 3.71Å; F157-E284 HydrophobicContact CE1-CB 3.92Å; F157-E284 HydrophobicContact CE1-CG 4.41Å; F157-E284 WeakPolarHBondContact CE1-O 3.49Å; F157-E284 HydrophobicContact CG-CG 4.31Å; C280-E284 WeakPolarHBondContact O-CG 3.48Å; C280-E284 PolarHBondContact O-N 2.91Å; R281-E284 WeakPolarHBondContact CD-OE2 3.42Å; R281-E284 IonicContact CZ-OE2 3.56Å; R281-E284 IonicContact NE-OE2 3.42Å; R281-E284 IonicContact NH1-OE2 3.86Å; R281-E284 PolarHBondContact NH1-OE2 2.82Å; R281-E284 PolarHBondContact O-N 2.81Å; E284-A286 VanDerWaalsContact C-N 3.33Å; E284-L287 PolarHBondContact O-N 2.93Å |
| 285 | I | 93 | Very high | 91.4 | Very high | 13 Ų | 13 | 27 Ų | 27 | 7% | 0.067 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.7 | -46.1 | 175.6 | -67.5 | 167.3 | 0 | 0 | 0 | 110.2 | W143 R281 Q282 I283 L287 V288 L356 T359 V365 | W143-I285 VanDerWaalsContact CE2-CG1 3.46Å; W143-I285 HydrophobicContact CH2-CD1 4.04Å; W143-I285 HydrophobicContact CH2-CG1 3.9Å; W143-I285 HydrophobicContact CZ2-CD1 3.47Å; W143-I285 VanDerWaalsContact CZ2-CD1 3.47Å; W143-I285 HydrophobicContact CZ2-CG1 3.08Å; R281-I285 HydrophobicContact CG-CD1 4.43Å; R281-I285 WeakPolarHBondContact O-CG1 3.44Å; R281-I285 PolarHBondContact O-N 3.37Å; Q282-I285 PolarHBondContact O-N 3.41Å; I283-I285 PolarHBondContact O-N 2.88Å; I285-L287 VanDerWaalsContact C-N 3.28Å; I285-L287 PolarHBondContact O-N 3.29Å; I285-V288 VanDerWaalsContact O-CB 3.24Å; I285-V288 WeakPolarHBondContact O-CB 3.19Å; I285-V288 PolarHBondContact O-N 3.09Å; I285-V288 VanDerWaalsContact O-N 3.08Å; I285-L356 HydrophobicContact CB-CD2 4.06Å; I285-L356 HydrophobicContact CG2-CD2 3.93Å; I285-T359 HydrophobicContact CD1-CG2 4.35Å; I285-T359 HydrophobicContact CG1-CG2 4.47Å; I285-T359 HydrophobicContact CG2-CG2 3.71Å; I285-T359 WeakPolarHBondContact CG2-OG1 3.41Å; I285-V365 HydrophobicContact CD1-CG2 4.44Å |
| 286 | A | 94.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.9 | -41.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q282 I283 E284 V288 S289 V292 L352 | Q282-A286 WeakPolarHBondContact O-CB 3.43Å; Q282-A286 PolarHBondContact O-N 3.47Å; I283-A286 WeakPolarHBondContact O-CB 3.3Å; I283-A286 PolarHBondContact O-N 3.09Å; E284-A286 VanDerWaalsContact C-N 3.33Å; A286-V288 PolarHBondContact O-N 3.07Å; A286-S289 WeakPolarHBondContact O-CB 3.42Å; A286-S289 PolarHBondContact O-N 2.97Å; A286-V292 HydrophobicContact CB-CG1 4.04Å; A286-V292 WeakPolarHBondContact O-CB 3.45Å; A286-L352 HydrophobicContact CB-CD1 3.29Å |
| 287 | L | 95.2 | Very high | 92.3 | Very high | 25 Ų | 25 | 28.3 Ų | 28.3 | 13% | 0.131 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -66.7 | -15.6 | 178.9 | -71.5 | 175.6 | 0 | 0 | 0 | 114.4 | R135 C158 V161 I283 E284 I285 S289 L300 | R135-L287 PolarHBondContact NH2-O 3.06Å; C158-L287 HydrophobicContact CB-CD1 4.04Å; V161-L287 HydrophobicContact CG1-CB 4.44Å; I283-L287 HydrophobicContact CG2-CD1 3.97Å; I283-L287 HydrophobicContact CG2-CG 4.34Å; I283-L287 WeakPolarHBondContact O-CG 3.13Å; I283-L287 PolarHBondContact O-N 2.86Å; E284-L287 PolarHBondContact O-N 2.93Å; I285-L287 VanDerWaalsContact C-N 3.28Å; I285-L287 PolarHBondContact O-N 3.29Å; L287-S289 VanDerWaalsContact C-N 3.31Å; L287-L300 HydrophobicContact CD2-CD2 3.71Å; L287-L300 HydrophobicContact CG-CD2 4.19Å |
| 288 | V | 94.3 | Very high | 92.8 | Very high | 13 Ų | 13 | 22 Ų | 22 | 8% | 0.079 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -67.3 | -34.8 | 171.2 | 179.1 | 0 | 0 | 0 | 0 | 110.8 | R135 A136 L139 F140 F157 I285 A286 | R135-V288 PolarHBondContact NH1-O 3.29Å; A136-V288 HydrophobicContact CB-CG1 4.18Å; A136-V288 WeakPolarHBondContact O-CG1 3.39Å; L139-V288 HydrophobicContact CB-CB 4.47Å; L139-V288 HydrophobicContact CB-CG1 4.15Å; L139-V288 HydrophobicContact CB-CG2 4.2Å; F140-V288 HydrophobicContact CB-CG1 4.03Å; F157-V288 HydrophobicContact CZ-CG2 4.38Å; I285-V288 VanDerWaalsContact O-CB 3.24Å; I285-V288 WeakPolarHBondContact O-CB 3.19Å; I285-V288 PolarHBondContact O-N 3.09Å; I285-V288 VanDerWaalsContact O-N 3.08Å; A286-V288 PolarHBondContact O-N 3.07Å |
| 289 | S | 91.9 | Very high | 93.3 | Very high | 20 Ų | 20 | 20 Ų | 20 | 14% | 0.14 | 10% | 0.1 | C | C | . | . | S | Bend | trans | -70.8 | 131.4 | 173.8 | 155.7 | 0 | 0 | 0 | 0 | 110.1 | A286 L287 E291 V292 S293 | A286-S289 WeakPolarHBondContact O-CB 3.42Å; A286-S289 PolarHBondContact O-N 2.97Å; L287-S289 VanDerWaalsContact C-N 3.31Å; S289-E291 VanDerWaalsContact C-N 3.34Å; S289-E291 PolarHBondContact OG-N 3.25Å; S289-E291 PolarHBondContact OG-OE2 2.95Å; S289-V292 PolarHBondContact OG-N 3.18Å; S289-S293 WeakPolarHBondContact O-CB 3.32Å; S289-S293 PolarHBondContact O-N 3.2Å; S289-S293 VanDerWaalsContact O-N 3.13Å |
| 290 | S | 91.6 | Very high | 93.6 | Very high | 2 Ų | 2 | 20 Ų | 20 | 1% | 0.014 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -70.5 | -35.4 | 179.3 | -61.2 | 0 | 0 | 0 | 0 | 111 | R135 V292 S293 C294 | R135-S290 PolarHBondContact NH1-OG 2.8Å; S290-V292 PolarHBondContact O-N 3.43Å; S290-S293 WeakPolarHBondContact CA-OG 3.47Å; S290-S293 PolarHBondContact O-N 2.85Å; S290-S293 PolarHBondContact O-OG 3.12Å; S290-C294 PolarHBondContact O-N 3Å; S290-C294 PolarHBondContact O-SG 3.21Å |
| 291 | E | 91.1 | Very high | 93.7 | Very high | 88 Ų | 88 | 19.5 Ų | 19.5 | 41% | 0.411 | 10% | 0.097 | S | C | . | . | H | α-helix | trans | -61 | -44 | 177.4 | -55.2 | 82.4 | 177.1 | 0 | 0 | 111.7 | S289 F295 | S289-E291 VanDerWaalsContact C-N 3.34Å; S289-E291 PolarHBondContact OG-N 3.25Å; S289-E291 PolarHBondContact OG-OE2 2.95Å; E291-F295 WeakPolarHBondContact O-CD2 3.37Å; E291-F295 WeakPolarHBondContact O-CE2 3.43Å |
| 292 | V | 92.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -73 | -33.9 | 177.5 | -177.9 | 0 | 0 | 0 | 0 | 111.4 | A286 S289 S290 C294 F295 L300 A355 | A286-V292 HydrophobicContact CB-CG1 4.04Å; A286-V292 WeakPolarHBondContact O-CB 3.45Å; S289-V292 PolarHBondContact OG-N 3.18Å; S290-V292 PolarHBondContact O-N 3.43Å; V292-C294 PolarHBondContact O-N 3.3Å; V292-F295 WeakPolarHBondContact O-CD2 3.42Å; V292-F295 PolarHBondContact O-N 3.45Å; V292-L300 HydrophobicContact CG1-CD1 3.42Å; V292-L300 VanDerWaalsContact CG1-CD1 3.42Å; V292-L300 HydrophobicContact CG1-CD2 4.23Å; V292-L300 HydrophobicContact CG1-CG 4.44Å; V292-A355 HydrophobicContact CG2-CB 3.97Å |
| 293 | S | 91.8 | Very high | 94 | Very high | 12 Ų | 12 | 16.7 Ų | 16.7 | 8% | 0.084 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -65.1 | -20.2 | 179.9 | 77.4 | 0 | 0 | 0 | 0 | 114.3 | N116 S289 S290 F295 | N116-S293 PolarHBondContact ND2-OG 2.91Å; S289-S293 WeakPolarHBondContact O-CB 3.32Å; S289-S293 PolarHBondContact O-N 3.2Å; S289-S293 VanDerWaalsContact O-N 3.13Å; S290-S293 WeakPolarHBondContact CA-OG 3.47Å; S290-S293 PolarHBondContact O-N 2.85Å; S290-S293 PolarHBondContact O-OG 3.12Å; S293-F295 VanDerWaalsContact C-N 3.25Å; S293-F295 PolarHBondContact O-N 3.16Å |
| 294 | C | 90.6 | Very high | 94 | Very high | 37 Ų | 37 | 16.7 Ų | 16.7 | 25% | 0.25 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -19.6 | 177.1 | -65.7 | 0 | 0 | 0 | 0 | 113.2 | H113 S290 V292 | H113-C294 PolarHBondContact NE2-O 3.46Å; S290-C294 PolarHBondContact O-N 3Å; S290-C294 PolarHBondContact O-SG 3.21Å; V292-C294 PolarHBondContact O-N 3.3Å |
| 295 | F | 93.8 | Very high | 93.8 | Very high | 47 Ų | 47 | 16.5 Ų | 16.5 | 21% | 0.206 | 9% | 0.085 | C | C | . | . | S | Bend | trans | -79.6 | 152.4 | 179.2 | -64.8 | -83.2 | 0 | 0 | 0 | 112.1 | E291 V292 S293 A347 C348 T351 | E291-F295 WeakPolarHBondContact O-CD2 3.37Å; E291-F295 WeakPolarHBondContact O-CE2 3.43Å; V292-F295 WeakPolarHBondContact O-CD2 3.42Å; V292-F295 PolarHBondContact O-N 3.45Å; S293-F295 VanDerWaalsContact C-N 3.25Å; S293-F295 PolarHBondContact O-N 3.16Å; F295-A347 HydrophobicContact CE1-CB 4.41Å; F295-A347 HydrophobicContact CZ-CB 4.35Å; F295-C348 HydrophobicContact CB-CB 4.48Å; F295-C348 HydrophobicContact CD1-CB 3.73Å; F295-C348 HydrophobicContact CD2-CB 4.03Å; F295-C348 HydrophobicContact CE1-CB 3.87Å; F295-C348 HydrophobicContact CE2-CB 4.16Å; F295-C348 HydrophobicContact CG-CB 3.82Å; F295-C348 HydrophobicContact CZ-CB 4.08Å; F295-T351 HydrophobicContact CE2-CG2 4.43Å; F295-T351 WeakPolarHBondContact CE2-OG1 3.47Å |
| 296 | R | 94.6 | Very high | 93.7 | Very high | 67 Ų | 67 | 16.6 Ų | 16.6 | 25% | 0.253 | 9% | 0.085 | S | C | . | . | trans | -58.2 | 140.3 | 171.8 | -79.9 | 175.3 | 63.4 | -163.4 | -1.7 | 111 | E109 S298 C299 L300 C338 N339 | E109-R296 WeakPolarHBondContact OE1-CB 3.38Å; E109-R296 IonicContact OE1-NE 2.66Å; E109-R296 IonicContact OE2-CZ 3.28Å; E109-R296 VanDerWaalsContact OE2-CZ 3.23Å; E109-R296 IonicContact OE2-NE 2.61Å; E109-R296 PolarHBondContact OE2-NE 2.89Å; E109-R296 IonicContact OE2-NH2 2.71Å; E109-R296 PolarHBondContact OE2-NH2 3.31Å; R296-S298 VanDerWaalsContact C-N 3.27Å; R296-S298 PolarHBondContact O-N 2.97Å; R296-C299 HydrophobicContact CB-CB 3.99Å; R296-C299 WeakPolarHBondContact O-CA 3.5Å; R296-C299 WeakPolarHBondContact O-CB 3.49Å; R296-C299 PolarHBondContact O-N 2.86Å; R296-L300 PolarHBondContact O-N 3.39Å; R296-C338 PolarHBondContact NH1-O 2.93Å; R296-C338 PolarHBondContact NH2-O 3.44Å; R296-N339 PolarHBondContact NH1-O 2.92Å | ||
| 297 | P | 96.1 | Very high | 93.5 | Very high | 15 Ų | 15 | 17.8 Ų | 17.8 | 10% | 0.097 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -55 | -37.5 | 176.8 | -26.8 | 33 | 0 | 0 | 0 | 114.4 | E109 L112 A243 A245 F248 L300 A301 | E109-P297 HydrophobicContact CG-CG 4.21Å; E109-P297 WeakPolarHBondContact OE1-CD 3.43Å; L112-P297 HydrophobicContact CB-CG 4.22Å; A243-P297 VanDerWaalsContact O-CB 3.28Å; A243-P297 WeakPolarHBondContact O-CB 3.43Å; A245-P297 WeakPolarHBondContact CA-O 3.41Å; A245-P297 HydrophobicContact CB-CB 4.44Å; A245-P297 WeakPolarHBondContact CB-O 3.47Å; F248-P297 HydrophobicContact CD2-CB 4.03Å; F248-P297 HydrophobicContact CE2-CB 4.05Å; P297-L300 PolarHBondContact O-N 3.48Å; P297-A301 PolarHBondContact O-N 2.76Å |
| 298 | S | 96.1 | Very high | 93 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -68.1 | -37.1 | 174.8 | 56.7 | 0 | 0 | 0 | 0 | 112.5 | E109 R296 A301 L302 I340 | E109-S298 VanDerWaalsContact OE1-CB 3.22Å; E109-S298 WeakPolarHBondContact OE1-CB 3.48Å; E109-S298 PolarHBondContact OE1-N 2.88Å; E109-S298 PolarHBondContact OE1-OG 3.2Å; E109-S298 PolarHBondContact OE2-OG 3.15Å; R296-S298 VanDerWaalsContact C-N 3.27Å; R296-S298 PolarHBondContact O-N 2.97Å; S298-A301 PolarHBondContact O-N 2.84Å; S298-L302 WeakPolarHBondContact O-CG 3.49Å; S298-L302 PolarHBondContact O-N 3.25Å; S298-I340 WeakPolarHBondContact OG-CD1 3.39Å |
| 299 | C | 96.4 | Very high | 92.4 | Very high | 3 Ų | 3 | 20.5 Ų | 20.5 | 2% | 0.02 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -64.9 | -45.2 | 174.4 | -175.2 | 0 | 0 | 0 | 0 | 110.8 | R296 A301 L302 A303 I340 | R296-C299 HydrophobicContact CB-CB 3.99Å; R296-C299 WeakPolarHBondContact O-CA 3.5Å; R296-C299 WeakPolarHBondContact O-CB 3.49Å; R296-C299 PolarHBondContact O-N 2.86Å; C299-A301 VanDerWaalsContact C-N 3.31Å; C299-A301 PolarHBondContact O-N 3.28Å; C299-L302 PolarHBondContact O-N 2.71Å; C299-A303 VanDerWaalsContact O-CB 3.23Å; C299-A303 WeakPolarHBondContact O-CB 3.32Å; C299-A303 PolarHBondContact O-N 3.01Å; C299-I340 HydrophobicContact CB-CD1 3.86Å; C299-I340 HydrophobicContact CB-CG2 4.12Å |
| 300 | L | 96.1 | Very high | 91.9 | Very high | 4 Ų | 4 | 23.8 Ų | 23.8 | 2% | 0.021 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.3 | -41.5 | 175.9 | 179.8 | 57.7 | 0 | 0 | 0 | 112.2 | A245 I283 L287 V292 R296 P297 A303 L304 L352 | A245-L300 HydrophobicContact CB-CB 4.24Å; A245-L300 HydrophobicContact CB-CD2 3.96Å; A245-L300 HydrophobicContact CB-CG 4.11Å; I283-L300 HydrophobicContact CD1-CD1 4.37Å; I283-L300 HydrophobicContact CD1-CD2 4.1Å; I283-L300 HydrophobicContact CD1-CG 3.8Å; L287-L300 HydrophobicContact CD2-CD2 3.71Å; L287-L300 HydrophobicContact CG-CD2 4.19Å; V292-L300 HydrophobicContact CG1-CD1 3.42Å; V292-L300 VanDerWaalsContact CG1-CD1 3.42Å; V292-L300 HydrophobicContact CG1-CD2 4.23Å; V292-L300 HydrophobicContact CG1-CG 4.44Å; R296-L300 PolarHBondContact O-N 3.39Å; P297-L300 PolarHBondContact O-N 3.48Å; L300-A303 PolarHBondContact O-N 2.71Å; L300-L304 WeakPolarHBondContact O-CB 3.44Å; L300-L304 PolarHBondContact O-N 3.25Å; L300-L352 HydrophobicContact CD1-CD1 4.2Å |
| 301 | A | 95.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -63.7 | -46.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A245 F248 L249 F252 P297 S298 C299 L304 I305 | A245-A301 HydrophobicContact CB-CB 4.43Å; A245-A301 WeakPolarHBondContact O-CB 3.41Å; F248-A301 HydrophobicContact CB-CB 3.7Å; L249-A301 HydrophobicContact CB-CB 4.4Å; F252-A301 HydrophobicContact CD2-CB 4Å; F252-A301 HydrophobicContact CE2-CB 3.83Å; P297-A301 PolarHBondContact O-N 2.76Å; S298-A301 PolarHBondContact O-N 2.84Å; C299-A301 VanDerWaalsContact C-N 3.31Å; C299-A301 PolarHBondContact O-N 3.28Å; A301-L304 PolarHBondContact O-N 3.21Å; A301-I305 WeakPolarHBondContact O-CG1 3.41Å; A301-I305 PolarHBondContact O-N 2.83Å; A301-I305 VanDerWaalsContact O-N 3.07Å |
| 302 | L | 95.1 | Very high | 89.5 | Confident | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.8 | -40.7 | 175.9 | -70.9 | 175 | 0 | 0 | 0 | 112.3 | F252 S298 C299 L304 I305 N306 L331 L334 I340 V345 | F252-L302 HydrophobicContact CD2-CD2 3.78Å; F252-L302 HydrophobicContact CD2-CG 4.19Å; F252-L302 HydrophobicContact CE1-CD2 4.47Å; F252-L302 HydrophobicContact CE2-CD1 4.49Å; F252-L302 HydrophobicContact CE2-CD2 3.61Å; F252-L302 HydrophobicContact CE2-CG 3.59Å; F252-L302 HydrophobicContact CG-CD2 4.31Å; F252-L302 HydrophobicContact CZ-CD1 4.46Å; F252-L302 HydrophobicContact CZ-CD2 3.99Å; F252-L302 HydrophobicContact CZ-CG 4Å; S298-L302 WeakPolarHBondContact O-CG 3.49Å; S298-L302 PolarHBondContact O-N 3.25Å; C299-L302 PolarHBondContact O-N 2.71Å; L302-L304 VanDerWaalsContact C-N 3.32Å; L302-L304 PolarHBondContact O-N 3.32Å; L302-I305 PolarHBondContact O-N 3Å; L302-N306 WeakPolarHBondContact O-CB 3.31Å; L302-N306 PolarHBondContact O-N 2.93Å; L302-L331 HydrophobicContact CD2-CD2 4.42Å; L302-L334 HydrophobicContact CD2-CB 3.92Å; L302-L334 HydrophobicContact CD2-CD1 4.3Å; L302-I340 HydrophobicContact CD1-CD1 4.12Å; L302-V345 HydrophobicContact CB-CG1 4.15Å; L302-V345 HydrophobicContact CB-CG2 4.38Å; L302-V345 HydrophobicContact CD1-CG2 4.41Å |
| 303 | A | 95.1 | Very high | 87.3 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64 | -37.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | C299 L300 H307 V345 C348 S349 | C299-A303 VanDerWaalsContact O-CB 3.23Å; C299-A303 WeakPolarHBondContact O-CB 3.32Å; C299-A303 PolarHBondContact O-N 3.01Å; L300-A303 PolarHBondContact O-N 2.71Å; A303-H307 WeakPolarHBondContact O-CB 3.37Å; A303-H307 PolarHBondContact O-N 3.03Å; A303-V345 HydrophobicContact CB-CG1 4.43Å; A303-C348 HydrophobicContact CB-CB 3.66Å; A303-C348 VanDerWaalsContact CB-SG 3.6Å; A303-S349 PolarHBondContact O-OG 2.89Å |
| 304 | L | 93.3 | Very high | 85.1 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -68.5 | -44 | 173.7 | -178.3 | 62.1 | 0 | 0 | 0 | 111.4 | L249 I279 Q282 I283 L300 A301 L302 N306 H307 L308 L352 | L249-L304 HydrophobicContact CD2-CD2 4.32Å; I279-L304 HydrophobicContact CG2-CD2 3.55Å; I279-L304 HydrophobicContact CG2-CG 4.29Å; Q282-L304 HydrophobicContact CB-CD1 4.26Å; I283-L304 HydrophobicContact CD1-CB 4.33Å; I283-L304 HydrophobicContact CD1-CD2 3.44Å; I283-L304 VanDerWaalsContact CD1-CD2 3.44Å; I283-L304 HydrophobicContact CG1-CD2 3.52Å; L300-L304 WeakPolarHBondContact O-CB 3.44Å; L300-L304 PolarHBondContact O-N 3.25Å; A301-L304 PolarHBondContact O-N 3.21Å; L302-L304 VanDerWaalsContact C-N 3.32Å; L302-L304 PolarHBondContact O-N 3.32Å; L304-N306 VanDerWaalsContact C-N 3.32Å; L304-N306 PolarHBondContact O-N 3.5Å; L304-H307 WeakPolarHBondContact O-CB 3.45Å; L304-H307 PolarHBondContact O-N 3.28Å; L304-H307 VanDerWaalsContact O-N 3.16Å; L304-L308 HydrophobicContact CD1-CD1 4.28Å; L304-L308 HydrophobicContact CD1-CG 4.22Å; L304-L308 HydrophobicContact CG-CD1 4.06Å; L304-L308 HydrophobicContact CG-CG 4.43Å; L304-L308 VanDerWaalsContact O-CG 3.27Å; L304-L308 WeakPolarHBondContact O-CG 3.34Å; L304-L308 PolarHBondContact O-N 2.88Å; L304-L352 HydrophobicContact CB-CD2 3.87Å; L304-L352 HydrophobicContact CD1-CD2 3.83Å; L304-L352 HydrophobicContact CG-CD2 4.45Å |
| 305 | I | 90.7 | Very high | 82.5 | Confident | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59 | -46.6 | 174.4 | -65.2 | 169.9 | 0 | 0 | 0 | 110.6 | L249 F252 A301 L302 H307 L308 C309 L324 F326 L331 | L249-I305 HydrophobicContact CD1-CD1 3.62Å; L249-I305 HydrophobicContact CD1-CG1 3.38Å; F252-I305 HydrophobicContact CB-CD1 3.61Å; F252-I305 HydrophobicContact CD2-CD1 3.91Å; F252-I305 HydrophobicContact CG-CD1 4.21Å; A301-I305 WeakPolarHBondContact O-CG1 3.41Å; A301-I305 PolarHBondContact O-N 2.83Å; A301-I305 VanDerWaalsContact O-N 3.07Å; L302-I305 PolarHBondContact O-N 3Å; I305-H307 VanDerWaalsContact C-N 3.28Å; I305-H307 PolarHBondContact O-N 2.61Å; I305-L308 PolarHBondContact O-N 2.93Å; I305-C309 WeakPolarHBondContact O-CB 3.45Å; I305-C309 PolarHBondContact O-N 3.38Å; I305-C309 PolarHBondContact O-SG 3.33Å; I305-C309 VanDerWaalsContact O-SG 3.42Å; I305-L324 HydrophobicContact CB-CD2 4.15Å; I305-L324 HydrophobicContact CD1-CD2 4.41Å; I305-L324 HydrophobicContact CG1-CD2 3.85Å; I305-L324 HydrophobicContact CG2-CD2 3.47Å; I305-L324 VanDerWaalsContact CG2-CD2 3.47Å; I305-F326 HydrophobicContact CD1-CE2 4.12Å; I305-F326 HydrophobicContact CG2-CD2 3.65Å; I305-F326 HydrophobicContact CG2-CE2 4.1Å; I305-F326 HydrophobicContact CG2-CG 4.31Å; I305-L331 HydrophobicContact CB-CD2 4.28Å; I305-L331 HydrophobicContact CG2-CD1 3.92Å; I305-L331 HydrophobicContact CG2-CD2 3.51Å; I305-L331 HydrophobicContact CG2-CG 4.34Å |
| 306 | N | 91.1 | Very high | 79.8 | Confident | 14 Ų | 14 | 40.6 Ų | 40.6 | 8% | 0.075 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.8 | -40.6 | 176.6 | -175.8 | 66.2 | 0 | 0 | 0 | 111.7 | L302 L304 F310 L331 S349 | L302-N306 WeakPolarHBondContact O-CB 3.31Å; L302-N306 PolarHBondContact O-N 2.93Å; L304-N306 VanDerWaalsContact C-N 3.32Å; L304-N306 PolarHBondContact O-N 3.5Å; N306-F310 PolarHBondContact O-N 3.3Å; N306-F310 WeakPolarHBondContact OD1-CD2 3.48Å; N306-L331 HydrophobicContact CB-CD1 4.03Å; N306-S349 PolarHBondContact ND2-OG 3.24Å |
| 307 | H | 88.9 | Confident | 77.4 | Confident | 25 Ų | 25 | 42.3 Ų | 42.3 | 12% | 0.116 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.9 | -47.1 | 176.2 | -177.4 | 69.2 | 0 | 0 | 0 | 112 | A303 L304 I305 N311 S312 L352 | A303-H307 WeakPolarHBondContact O-CB 3.37Å; A303-H307 PolarHBondContact O-N 3.03Å; L304-H307 WeakPolarHBondContact O-CB 3.45Å; L304-H307 PolarHBondContact O-N 3.28Å; L304-H307 VanDerWaalsContact O-N 3.16Å; I305-H307 VanDerWaalsContact C-N 3.28Å; I305-H307 PolarHBondContact O-N 2.61Å; H307-N311 PolarHBondContact O-N 3.47Å; H307-N311 VanDerWaalsContact O-N 3.11Å; H307-S312 PolarHBondContact O-N 3.27Å; H307-L352 HydrophobicContact CB-CD2 4.34Å |
| 308 | L | 85.6 | Confident | 74.7 | Confident | 47 Ų | 47 | 44.1 Ų | 44.1 | 25% | 0.246 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.1 | -41.5 | -178.6 | -67.4 | 171.6 | 0 | 0 | 0 | 112.6 | I279 L304 I305 W323 | I279-L308 HydrophobicContact CD1-CD1 3.96Å; I279-L308 HydrophobicContact CG1-CD1 4.35Å; I279-L308 HydrophobicContact CG2-CD1 4Å; L304-L308 HydrophobicContact CD1-CD1 4.28Å; L304-L308 HydrophobicContact CD1-CG 4.22Å; L304-L308 HydrophobicContact CG-CD1 4.06Å; L304-L308 HydrophobicContact CG-CG 4.43Å; L304-L308 VanDerWaalsContact O-CG 3.27Å; L304-L308 WeakPolarHBondContact O-CG 3.34Å; L304-L308 PolarHBondContact O-N 2.88Å; I305-L308 PolarHBondContact O-N 2.93Å; L308-W323 HydrophobicContact CD1-CZ2 4.08Å |
| 309 | C | 82.7 | Confident | 72.1 | Confident | 48 Ų | 48 | 48.7 Ų | 48.7 | 32% | 0.324 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -79.9 | -34.3 | -176.3 | -66.5 | 0 | 0 | 0 | 0 | 113.7 | I305 | I305-C309 WeakPolarHBondContact O-CB 3.45Å; I305-C309 PolarHBondContact O-N 3.38Å; I305-C309 PolarHBondContact O-SG 3.33Å; I305-C309 VanDerWaalsContact O-SG 3.42Å |
| 310 | F | 80.3 | Confident | 69.9 | Low | 89 Ų | 89 | 51.5 Ų | 51.5 | 39% | 0.39 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -124.3 | -23.1 | -166.6 | -58 | -71 | 0 | 0 | 0 | 115.2 | N306 F326 T328 L331 | N306-F310 PolarHBondContact O-N 3.3Å; N306-F310 WeakPolarHBondContact OD1-CD2 3.48Å; F310-F326 WeakPolarHBondContact CZ-O 3.3Å; F310-T328 WeakPolarHBondContact CE1-OG1 3.36Å; F310-T328 WeakPolarHBondContact CZ-OG1 3.44Å; F310-L331 HydrophobicContact CD2-CD1 4.36Å; F310-L331 HydrophobicContact CE2-CD1 3.76Å |
| 311 | N | 71.3 | Confident | 67.7 | Low | 68 Ų | 68 | 57.3 Ų | 57.3 | 36% | 0.364 | 38% | 0.375 | S | S | . | . | trans | -109.2 | 0.5 | -171.1 | -68.9 | -35.6 | 0 | 0 | 0 | 114.4 | H307 A313 S349 | H307-N311 PolarHBondContact O-N 3.47Å; H307-N311 VanDerWaalsContact O-N 3.11Å; N311-A313 VanDerWaalsContact C-N 3.28Å; N311-A313 PolarHBondContact O-N 3.03Å; N311-S349 PolarHBondContact ND2-OG 3.39Å | ||
| 312 | S | 61 | Low | 66 | Low | 77 Ų | 77 | 62.4 Ų | 62.4 | 54% | 0.538 | 40% | 0.402 | S | S | . | . | trans | -74.3 | 81.5 | 179.7 | -158.7 | 0 | 0 | 0 | 0 | 111.1 | H307 V314 | H307-S312 PolarHBondContact O-N 3.27Å; S312-V314 VanDerWaalsContact C-N 3.26Å; S312-V314 PolarHBondContact OG-O 2.8Å | ||
| 313 | A | 47.9 | Very low | 64.7 | Low | 97 Ų | 97 | 64.2 Ų | 64.2 | 80% | 0.802 | 41% | 0.408 | S | S | * | . | trans | -83.8 | -1.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | N311 | N311-A313 VanDerWaalsContact C-N 3.28Å; N311-A313 PolarHBondContact O-N 3.03Å | ||
| 314 | V | 44.1 | Very low | 63.5 | Low | 112 Ų | 112 | 65.3 Ų | 65.3 | 68% | 0.679 | 41% | 0.414 | S | S | * | . | S | Bend | trans | -104.8 | 109.5 | -177.8 | -179.3 | 0 | 0 | 0 | 0 | 107.7 | S312 | S312-V314 VanDerWaalsContact C-N 3.26Å; S312-V314 PolarHBondContact OG-O 2.8Å |
| 315 | G | 37.4 | Very low | 62.6 | Low | 68 Ų | 68 | 70.3 Ų | 70.3 | 70% | 0.701 | 44% | 0.438 | S | S | * | . | trans | -51.9 | 144.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 316 | S | 36.8 | Very low | 62.1 | Low | 117 Ų | 117 | 71.1 Ų | 71.1 | 82% | 0.818 | 44% | 0.441 | S | S | * | . | trans | 73.8 | 72.4 | 167.1 | -167.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 317 | L | 44 | Very low | 61.7 | Low | 104 Ų | 104 | 77 Ų | 77 | 55% | 0.545 | 47% | 0.468 | S | S | . | . | S | Bend | -120.2 | 101.5 | 129 | -165.5 | 65.7 | 0 | 0 | 0 | 105.6 | Q282 | Q282-L317 VanDerWaalsContact NE2-CD2 3.29Š| |
| 318 | G | 40.1 | Very low | 61.5 | Low | 52 Ų | 52 | 79.2 Ų | 79.2 | 54% | 0.536 | 48% | 0.483 | S | S | . | . | trans | -51.6 | 141.4 | -151.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | V320 | G318-V320 VanDerWaalsContact O-CG2 3.3Å; G318-V320 WeakPolarHBondContact O-CG2 3.38Å; G318-V320 PolarHBondContact O-N 3.35Å | ||
| 319 | S | 40.5 | Very low | 61.5 | Low | 96 Ų | 96 | 80.4 Ų | 80.4 | 67% | 0.671 | 50% | 0.495 | S | S | * | . | trans | 28.7 | 59.1 | 144.3 | -113.8 | 0 | 0 | 0 | 0 | 112.9 | D321 | S319-D321 VanDerWaalsContact CB-OD2 3.3Å; S319-D321 WeakPolarHBondContact CB-OD2 3Å; S319-D321 PolarHBondContact O-N 3.31Å; S319-D321 VanDerWaalsContact OG-CG 3.27Å; S319-D321 PolarHBondContact OG-OD1 2.95Å; S319-D321 PolarHBondContact OG-OD2 3.27Å | ||
| 320 | V | 49.7 | Very low | 61.8 | Low | 63 Ų | 63 | 80.6 Ų | 80.6 | 38% | 0.382 | 49% | 0.493 | S | S | . | . | trans | -81.4 | 56.7 | 165.2 | -145.7 | 0 | 0 | 0 | 0 | 105.9 | P276 G318 D322 W323 | P276-V320 HydrophobicContact CG-CG1 4.36Å; G318-V320 VanDerWaalsContact O-CG2 3.3Å; G318-V320 WeakPolarHBondContact O-CG2 3.38Å; G318-V320 PolarHBondContact O-N 3.35Å; V320-D322 PolarHBondContact O-N 3.5Å; V320-W323 VanDerWaalsContact CB-CD1 3.41Å; V320-W323 HydrophobicContact CB-CG 4.33Å; V320-W323 HydrophobicContact CG1-CB 3.88Å; V320-W323 HydrophobicContact CG1-CD2 4.3Å; V320-W323 HydrophobicContact CG1-CG 3.42Å; V320-W323 VanDerWaalsContact CG1-CG 3.42Å | ||
| 321 | D | 51.3 | Low | 62.3 | Low | 126 Ų | 126 | 76.4 Ų | 76.4 | 67% | 0.674 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | 121.4 | 176.5 | -68 | -34.8 | 0 | 0 | 0 | 105.2 | S319 W323 | S319-D321 VanDerWaalsContact CB-OD2 3.3Å; S319-D321 WeakPolarHBondContact CB-OD2 3Å; S319-D321 PolarHBondContact O-N 3.31Å; S319-D321 VanDerWaalsContact OG-CG 3.27Å; S319-D321 PolarHBondContact OG-OD1 2.95Å; S319-D321 PolarHBondContact OG-OD2 3.27Å; D321-W323 PolarHBondContact O-N 3.28Å |
| 322 | D | 60.2 | Low | 63.3 | Low | 106 Ų | 106 | 78.4 Ų | 78.4 | 57% | 0.567 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76 | -3.2 | 170.1 | -110.7 | 12.6 | 0 | 0 | 0 | 119.9 | V320 Q325 | V320-D322 PolarHBondContact O-N 3.5Å; D322-Q325 PolarHBondContact OD1-NE2 2.97Å |
| 323 | W | 67.6 | Low | 64.8 | Low | 39 Ų | 39 | 77.1 Ų | 77.1 | 15% | 0.148 | 47% | 0.465 | C | S | . | . | S | Bend | trans | -77.8 | -21.5 | 179.9 | 97.1 | -66.4 | 0 | 0 | 0 | 114 | L249 I257 V275 P276 I279 L308 V320 D321 | L249-W323 HydrophobicContact CD1-CH2 3.91Å; L249-W323 HydrophobicContact CD2-CH2 4.21Å; L249-W323 HydrophobicContact CG-CH2 4.08Å; I257-W323 WeakPolarHBondContact CD1-O 3.22Å; V275-W323 HydrophobicContact CG1-CZ3 4.43Å; P276-W323 HydrophobicContact CG-CD2 4.05Å; P276-W323 HydrophobicContact CG-CE3 4.07Å; P276-W323 HydrophobicContact CG-CG 4.4Å; I279-W323 HydrophobicContact CD1-CD2 4.15Å; I279-W323 HydrophobicContact CD1-CH2 3.55Å; I279-W323 HydrophobicContact CD1-CZ2 3.03Å; I279-W323 HydrophobicContact CD1-CZ3 4.27Å; I279-W323 HydrophobicContact CG1-CZ2 4.45Å; I279-W323 HydrophobicContact CG2-CH2 4.42Å; L308-W323 HydrophobicContact CD1-CZ2 4.08Å; V320-W323 VanDerWaalsContact CB-CD1 3.41Å; V320-W323 HydrophobicContact CB-CG 4.33Å; V320-W323 HydrophobicContact CG1-CB 3.88Å; V320-W323 HydrophobicContact CG1-CD2 4.3Å; V320-W323 HydrophobicContact CG1-CG 3.42Å; V320-W323 VanDerWaalsContact CG1-CG 3.42Å; D321-W323 PolarHBondContact O-N 3.28Å |
| 324 | L | 69.7 | Low | 67 | Low | 23 Ų | 23 | 72.6 Ų | 72.6 | 12% | 0.12 | 43% | 0.428 | C | S | . | . | trans | -150 | 109 | -175.2 | -128.4 | 77.9 | 0 | 0 | 0 | 111.6 | S253 I305 F326 | S253-L324 VanDerWaalsContact CB-CD1 3.49Å; I305-L324 HydrophobicContact CB-CD2 4.15Å; I305-L324 HydrophobicContact CD1-CD2 4.41Å; I305-L324 HydrophobicContact CG1-CD2 3.85Å; I305-L324 HydrophobicContact CG2-CD2 3.47Å; I305-L324 VanDerWaalsContact CG2-CD2 3.47Å; L324-F326 HydrophobicContact CD1-CD2 4.44Å; L324-F326 HydrophobicContact CD1-CE2 4.06Å; L324-F326 HydrophobicContact CD2-CD2 3.6Å; L324-F326 HydrophobicContact CD2-CE2 3.82Å; L324-F326 HydrophobicContact CG-CD2 3.54Å; L324-F326 HydrophobicContact CG-CE2 3.64Å | ||
| 325 | Q | 73.2 | Confident | 69.4 | Low | 106 Ų | 106 | 67.3 Ų | 67.3 | 50% | 0.495 | 40% | 0.395 | S | S | . | . | trans | -112.7 | 94.5 | 169.8 | -61.5 | -178.6 | 16.4 | 0 | 0 | 108.2 | G256 D322 | G256-Q325 WeakPolarHBondContact CA-O 3.27Å; G256-Q325 PolarHBondContact O-N 3.13Å; G256-Q325 VanDerWaalsContact O-N 3.12Å; G256-Q325 VanDerWaalsContact O-O 3.11Å; D322-Q325 PolarHBondContact OD1-NE2 2.97Å | ||
| 326 | F | 80.2 | Confident | 72.1 | Confident | 16 Ų | 16 | 68 Ų | 68 | 7% | 0.07 | 38% | 0.383 | C | S | . | . | trans | -118.6 | 132 | 174.5 | -80.8 | -70 | 0 | 0 | 0 | 110.6 | F252 F255 I305 F310 L324 D330 L331 L334 | F252-F326 HydrophobicContact CB-CZ 4.34Å; F252-F326 WeakPolarHBondContact O-CZ 3.35Å; F255-F326 HydrophobicContact CB-CE1 4.28Å; F255-F326 HydrophobicContact CB-CZ 4.39Å; I305-F326 HydrophobicContact CD1-CE2 4.12Å; I305-F326 HydrophobicContact CG2-CD2 3.65Å; I305-F326 HydrophobicContact CG2-CE2 4.1Å; I305-F326 HydrophobicContact CG2-CG 4.31Å; F310-F326 WeakPolarHBondContact CZ-O 3.3Å; L324-F326 HydrophobicContact CD1-CD2 4.44Å; L324-F326 HydrophobicContact CD1-CE2 4.06Å; L324-F326 HydrophobicContact CD2-CD2 3.6Å; L324-F326 HydrophobicContact CD2-CE2 3.82Å; L324-F326 HydrophobicContact CG-CD2 3.54Å; L324-F326 HydrophobicContact CG-CE2 3.64Å; F326-D330 HydrophobicContact CD1-CB 3.71Å; F326-D330 HydrophobicContact CE1-CB 4.35Å; F326-L331 HydrophobicContact CB-CD2 3.95Å; F326-L331 HydrophobicContact CB-CG 4.13Å; F326-L331 HydrophobicContact CD1-CD2 3.77Å; F326-L331 HydrophobicContact CD2-CD2 4.07Å; F326-L331 HydrophobicContact CE1-CD2 4.16Å; F326-L331 HydrophobicContact CE2-CD2 4.45Å; F326-L331 HydrophobicContact CG-CD2 3.68Å; F326-L331 HydrophobicContact CG-CG 4.38Å; F326-L331 HydrophobicContact CZ-CD2 4.44Å; F326-L334 HydrophobicContact CE1-CD1 3.66Å; F326-L334 HydrophobicContact CZ-CD1 3.96Å | ||
| 327 | H | 82.4 | Confident | 74.8 | Confident | 139 Ų | 139 | 63.9 Ų | 63.9 | 64% | 0.644 | 35% | 0.351 | S | S | * | . | trans | -85.1 | 158.3 | 161.2 | -61.5 | -72.9 | 0 | 0 | 0 | 110 | S329 D330 L331 | H327-S329 PolarHBondContact O-N 3.41Å; H327-D330 WeakPolarHBondContact CB-OD2 3.48Å; H327-D330 IonicContact CD2-OD2 3.53Å; H327-D330 IonicContact CG-OD2 3.55Å; H327-D330 PolarHBondContact N-OD2 3.22Å; H327-D330 WeakPolarHBondContact O-CB 3.12Å; H327-D330 PolarHBondContact O-N 2.89Å; H327-L331 PolarHBondContact O-N 2.93Å | ||
| 328 | T | 85.3 | Confident | 77.2 | Confident | 70 Ų | 70 | 59.1 Ų | 59.1 | 43% | 0.429 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -56.6 | -34.7 | 176.6 | -46.5 | 0 | 0 | 0 | 0 | 111.5 | F310 D330 L331 Y332 W342 | F310-T328 WeakPolarHBondContact CE1-OG1 3.36Å; F310-T328 WeakPolarHBondContact CZ-OG1 3.44Å; T328-D330 VanDerWaalsContact C-N 3.33Å; T328-D330 PolarHBondContact O-N 3.48Å; T328-L331 PolarHBondContact O-N 2.75Å; T328-Y332 WeakPolarHBondContact O-CB 3.4Å; T328-Y332 PolarHBondContact O-N 3.37Å; T328-W342 HydrophobicContact CG2-CZ2 4.23Å |
| 329 | S | 86.9 | Confident | 79.8 | Confident | 72 Ų | 72 | 63.1 Ų | 63.1 | 50% | 0.503 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.5 | -35.8 | 175.9 | -169.6 | 0 | 0 | 0 | 0 | 113 | H327 Y332 N333 | H327-S329 PolarHBondContact O-N 3.41Å; S329-Y332 PolarHBondContact O-N 2.91Å; S329-N333 WeakPolarHBondContact O-CB 3.09Å; S329-N333 PolarHBondContact O-N 3.5Å; S329-N333 PolarHBondContact O-ND2 2.87Å; S329-N333 VanDerWaalsContact O-ND2 3.15Å |
| 330 | D | 88.5 | Confident | 82.4 | Confident | 53 Ų | 53 | 59 Ų | 59 | 28% | 0.283 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -70.4 | -42.5 | -178.9 | -57.6 | -39.4 | 0 | 0 | 0 | 110.6 | F326 H327 T328 Y332 N333 L334 | F326-D330 HydrophobicContact CD1-CB 3.71Å; F326-D330 HydrophobicContact CE1-CB 4.35Å; H327-D330 WeakPolarHBondContact CB-OD2 3.48Å; H327-D330 IonicContact CD2-OD2 3.53Å; H327-D330 IonicContact CG-OD2 3.55Å; H327-D330 PolarHBondContact N-OD2 3.22Å; H327-D330 WeakPolarHBondContact O-CB 3.12Å; H327-D330 PolarHBondContact O-N 2.89Å; T328-D330 VanDerWaalsContact C-N 3.33Å; T328-D330 PolarHBondContact O-N 3.48Å; D330-Y332 VanDerWaalsContact C-N 3.33Å; D330-N333 PolarHBondContact O-N 3.44Å; D330-L334 WeakPolarHBondContact O-CG 3.33Å; D330-L334 PolarHBondContact O-N 2.96Å |
| 331 | L | 90.5 | Very high | 84.5 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64.6 | -39.1 | 174.5 | -60.1 | -174.3 | 0 | 0 | 0 | 111.8 | L302 I305 N306 F310 F326 H327 T328 L334 S335 W342 | L302-L331 HydrophobicContact CD2-CD2 4.42Å; I305-L331 HydrophobicContact CB-CD2 4.28Å; I305-L331 HydrophobicContact CG2-CD1 3.92Å; I305-L331 HydrophobicContact CG2-CD2 3.51Å; I305-L331 HydrophobicContact CG2-CG 4.34Å; N306-L331 HydrophobicContact CB-CD1 4.03Å; F310-L331 HydrophobicContact CD2-CD1 4.36Å; F310-L331 HydrophobicContact CE2-CD1 3.76Å; F326-L331 HydrophobicContact CB-CD2 3.95Å; F326-L331 HydrophobicContact CB-CG 4.13Å; F326-L331 HydrophobicContact CD1-CD2 3.77Å; F326-L331 HydrophobicContact CD2-CD2 4.07Å; F326-L331 HydrophobicContact CE1-CD2 4.16Å; F326-L331 HydrophobicContact CE2-CD2 4.45Å; F326-L331 HydrophobicContact CG-CD2 3.68Å; F326-L331 HydrophobicContact CG-CG 4.38Å; F326-L331 HydrophobicContact CZ-CD2 4.44Å; H327-L331 PolarHBondContact O-N 2.93Å; T328-L331 PolarHBondContact O-N 2.75Å; L331-L334 PolarHBondContact O-N 3.45Å; L331-S335 WeakPolarHBondContact O-CB 3.32Å; L331-S335 PolarHBondContact O-N 3.15Å; L331-W342 HydrophobicContact CB-CH2 3.65Å; L331-W342 HydrophobicContact CB-CZ3 3.84Å; L331-W342 HydrophobicContact CD1-CH2 4.41Å |
| 332 | Y | 92.6 | Very high | 86.6 | Confident | 111 Ų | 111 | 54.8 Ų | 54.8 | 44% | 0.435 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.2 | -47.8 | 174.2 | -177.9 | -102.5 | 0 | 0 | 0 | 110.9 | T328 S329 D330 L334 S335 L336 W342 | T328-Y332 WeakPolarHBondContact O-CB 3.4Å; T328-Y332 PolarHBondContact O-N 3.37Å; S329-Y332 PolarHBondContact O-N 2.91Å; D330-Y332 VanDerWaalsContact C-N 3.33Å; Y332-L334 VanDerWaalsContact C-N 3.35Å; Y332-L334 PolarHBondContact O-N 2.94Å; Y332-S335 PolarHBondContact O-N 3.46Å; Y332-S335 VanDerWaalsContact O-N 3.14Å; Y332-S335 PolarHBondContact O-OG 3.35Å; Y332-L336 HydrophobicContact CD1-CD1 4Å; Y332-L336 HydrophobicContact CD1-CG 4.48Å; Y332-L336 HydrophobicContact CE1-CD1 3.54Å; Y332-L336 HydrophobicContact CE1-CG 4.14Å; Y332-L336 WeakPolarHBondContact O-CG 3.19Å; Y332-L336 PolarHBondContact O-N 3.06Å; Y332-W342 HydrophobicContact CD2-CB 4.08Å; Y332-W342 HydrophobicContact CD2-CD2 4.09Å; Y332-W342 HydrophobicContact CD2-CE3 4.21Å; Y332-W342 HydrophobicContact CD2-CG 4.03Å; Y332-W342 HydrophobicContact CE2-CB 4.08Å; Y332-W342 HydrophobicContact CE2-CG 4.44Å |
| 333 | N | 92.7 | Very high | 88.3 | Confident | 49 Ų | 49 | 54.5 Ų | 54.5 | 26% | 0.262 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.9 | -41 | 176.1 | -70.3 | -29.1 | 0 | 0 | 0 | 112.5 | L73 S329 D330 S335 L336 I337 | L73-N333 HydrophobicContact CD2-CB 3.74Å; S329-N333 WeakPolarHBondContact O-CB 3.09Å; S329-N333 PolarHBondContact O-N 3.5Å; S329-N333 PolarHBondContact O-ND2 2.87Å; S329-N333 VanDerWaalsContact O-ND2 3.15Å; D330-N333 PolarHBondContact O-N 3.44Å; N333-S335 VanDerWaalsContact C-N 3.35Å; N333-L336 WeakPolarHBondContact O-CB 3.22Å; N333-L336 PolarHBondContact O-N 3.1Å; N333-I337 WeakPolarHBondContact O-CG1 3.41Å; N333-I337 PolarHBondContact O-N 3.25Å |
| 334 | L | 92.9 | Very high | 89.6 | Confident | 3 Ų | 3 | 56.1 Ų | 56.1 | 2% | 0.016 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 174.3 | -74.4 | 174.6 | 0 | 0 | 0 | 111.9 | F252 F255 L302 F326 D330 L331 Y332 L336 I337 C338 | F252-L334 HydrophobicContact CB-CD1 4.42Å; F252-L334 HydrophobicContact CD1-CD1 4.01Å; F252-L334 HydrophobicContact CD1-CD2 4.17Å; F252-L334 HydrophobicContact CE1-CD2 4.38Å; F252-L334 HydrophobicContact CG-CD1 4.32Å; F255-L334 HydrophobicContact CD2-CD2 3.92Å; F255-L334 HydrophobicContact CE2-CD2 4.09Å; F255-L334 HydrophobicContact CG-CD2 4.25Å; L302-L334 HydrophobicContact CD2-CB 3.92Å; L302-L334 HydrophobicContact CD2-CD1 4.3Å; F326-L334 HydrophobicContact CE1-CD1 3.66Å; F326-L334 HydrophobicContact CZ-CD1 3.96Å; D330-L334 WeakPolarHBondContact O-CG 3.33Å; D330-L334 PolarHBondContact O-N 2.96Å; L331-L334 PolarHBondContact O-N 3.45Å; Y332-L334 VanDerWaalsContact C-N 3.35Å; Y332-L334 PolarHBondContact O-N 2.94Å; L334-L336 VanDerWaalsContact C-N 3.3Å; L334-L336 PolarHBondContact O-N 3.43Å; L334-I337 PolarHBondContact O-N 3.38Å; L334-C338 WeakPolarHBondContact O-CB 3.25Å; L334-C338 PolarHBondContact O-N 3.49Å; L334-C338 PolarHBondContact O-SG 3.44Å; L334-C338 VanDerWaalsContact O-SG 3.36Å |
| 335 | S | 94.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.2 | -39.2 | 175.8 | 76.2 | 0 | 0 | 0 | 0 | 112 | L331 Y332 N333 C338 N339 I340 | L331-S335 WeakPolarHBondContact O-CB 3.32Å; L331-S335 PolarHBondContact O-N 3.15Å; Y332-S335 PolarHBondContact O-N 3.46Å; Y332-S335 VanDerWaalsContact O-N 3.14Å; Y332-S335 PolarHBondContact O-OG 3.35Å; N333-S335 VanDerWaalsContact C-N 3.35Å; S335-C338 CarbonylContact O-C 3.56Å; S335-C338 PolarHBondContact O-N 2.59Å; S335-N339 PolarHBondContact O-N 2.95Å; S335-N339 VanDerWaalsContact O-N 3.1Å; S335-I340 PolarHBondContact O-N 2.87Å |
| 336 | L | 94.8 | Very high | 91.8 | Very high | 84 Ų | 84 | 54.1 Ų | 54.1 | 44% | 0.44 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.9 | -45.5 | 174.2 | -68.1 | 177.2 | 0 | 0 | 0 | 112 | Y332 N333 L334 C338 N339 | Y332-L336 HydrophobicContact CD1-CD1 4Å; Y332-L336 HydrophobicContact CD1-CG 4.48Å; Y332-L336 HydrophobicContact CE1-CD1 3.54Å; Y332-L336 HydrophobicContact CE1-CG 4.14Å; Y332-L336 WeakPolarHBondContact O-CG 3.19Å; Y332-L336 PolarHBondContact O-N 3.06Å; N333-L336 WeakPolarHBondContact O-CB 3.22Å; N333-L336 PolarHBondContact O-N 3.1Å; L334-L336 VanDerWaalsContact C-N 3.3Å; L334-L336 PolarHBondContact O-N 3.43Å; L336-C338 VanDerWaalsContact C-N 3.28Å; L336-C338 PolarHBondContact O-N 3.23Å; L336-N339 PolarHBondContact O-N 3.36Å |
| 337 | I | 92.7 | Very high | 92.6 | Very high | 30 Ų | 30 | 55.2 Ų | 55.2 | 15% | 0.154 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.2 | -39.3 | 177.4 | -66.8 | 165.1 | 0 | 0 | 0 | 111 | L73 L102 F103 N333 L334 N339 | L73-I337 HydrophobicContact CD1-CD1 4.5Å; L73-I337 HydrophobicContact CD2-CD1 3.99Å; L73-I337 HydrophobicContact CG-CD1 4.18Å; L102-I337 HydrophobicContact CD2-CG2 3.77Å; F103-I337 HydrophobicContact CE1-CG2 4.42Å; N333-I337 WeakPolarHBondContact O-CG1 3.41Å; N333-I337 PolarHBondContact O-N 3.25Å; L334-I337 PolarHBondContact O-N 3.38Å; I337-N339 PolarHBondContact O-N 3.34Å |
| 338 | C | 94.2 | Very high | 93.2 | Very high | 3 Ų | 3 | 48.6 Ų | 48.6 | 2% | 0.02 | 27% | 0.268 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | -0.9 | 176.7 | -64.2 | 0 | 0 | 0 | 0 | 113.7 | L106 R296 L334 S335 L336 I340 | L106-C338 HydrophobicContact CD2-CB 4.06Å; R296-C338 PolarHBondContact NH1-O 2.93Å; R296-C338 PolarHBondContact NH2-O 3.44Å; L334-C338 WeakPolarHBondContact O-CB 3.25Å; L334-C338 PolarHBondContact O-N 3.49Å; L334-C338 PolarHBondContact O-SG 3.44Å; L334-C338 VanDerWaalsContact O-SG 3.36Å; S335-C338 CarbonylContact O-C 3.56Å; S335-C338 PolarHBondContact O-N 2.59Å; L336-C338 VanDerWaalsContact C-N 3.28Å; L336-C338 PolarHBondContact O-N 3.23Å; C338-I340 HydrophobicContact CB-CD1 3.73Å; C338-I340 HydrophobicContact CB-CG1 4.04Å |
| 339 | N | 95 | Very high | 93.6 | Very high | 136 Ų | 136 | 45.4 Ų | 45.4 | 73% | 0.727 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 52.2 | -174.5 | -169.2 | 32.1 | 0 | 0 | 0 | 111.9 | R296 S335 L336 I337 | R296-N339 PolarHBondContact NH1-O 2.92Å; S335-N339 PolarHBondContact O-N 2.95Å; S335-N339 VanDerWaalsContact O-N 3.1Å; L336-N339 PolarHBondContact O-N 3.36Å; I337-N339 PolarHBondContact O-N 3.34Å |
| 340 | I | 94.8 | Very high | 93.9 | Very high | 10 Ų | 10 | 45.2 Ų | 45.2 | 5% | 0.051 | 25% | 0.247 | C | C | . | . | trans | -118.2 | 137.8 | 176.7 | -60.7 | 166.2 | 0 | 0 | 0 | 108.2 | S298 C299 L302 S335 C338 D344 V345 | S298-I340 WeakPolarHBondContact OG-CD1 3.39Å; C299-I340 HydrophobicContact CB-CD1 3.86Å; C299-I340 HydrophobicContact CB-CG2 4.12Å; L302-I340 HydrophobicContact CD1-CD1 4.12Å; S335-I340 PolarHBondContact O-N 2.87Å; C338-I340 HydrophobicContact CB-CD1 3.73Å; C338-I340 HydrophobicContact CB-CG1 4.04Å; I340-D344 HydrophobicContact CG2-CB 4.13Å; I340-V345 HydrophobicContact CG2-CG2 3.84Å | ||
| 341 | S | 95.1 | Very high | 94.1 | Very high | 47 Ų | 47 | 44.3 Ų | 44.3 | 33% | 0.329 | 24% | 0.243 | S | C | . | . | trans | -73.3 | 140.2 | 173.5 | 81.3 | 0 | 0 | 0 | 0 | 110.6 | T343 D344 V345 | S341-T343 WeakPolarHBondContact CB-OG1 3.32Å; S341-T343 PolarHBondContact O-N 3.4Å; S341-T343 PolarHBondContact OG-OG1 2.94Å; S341-D344 WeakPolarHBondContact O-CB 3.27Å; S341-D344 PolarHBondContact O-N 3.44Å; S341-D344 PolarHBondContact OG-N 3.39Å; S341-D344 PolarHBondContact OG-OD1 3.17Å; S341-D344 PolarHBondContact OG-OD2 2.96Å; S341-V345 PolarHBondContact O-N 3.4Å | ||
| 342 | W | 94.5 | Very high | 94.3 | Very high | 54 Ų | 54 | 44.3 Ų | 44.3 | 21% | 0.205 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.7 | -27 | 177.1 | -168.7 | -112.5 | 0 | 0 | 0 | 112.4 | T328 L331 Y332 D344 V345 I346 | T328-W342 HydrophobicContact CG2-CZ2 4.23Å; L331-W342 HydrophobicContact CB-CH2 3.65Å; L331-W342 HydrophobicContact CB-CZ3 3.84Å; L331-W342 HydrophobicContact CD1-CH2 4.41Å; Y332-W342 HydrophobicContact CD2-CB 4.08Å; Y332-W342 HydrophobicContact CD2-CD2 4.09Å; Y332-W342 HydrophobicContact CD2-CE3 4.21Å; Y332-W342 HydrophobicContact CD2-CG 4.03Å; Y332-W342 HydrophobicContact CE2-CB 4.08Å; Y332-W342 HydrophobicContact CE2-CG 4.44Å; W342-D344 VanDerWaalsContact C-N 3.33Å; W342-D344 PolarHBondContact O-N 3.44Å; W342-V345 HydrophobicContact CE3-CB 4.06Å; W342-V345 HydrophobicContact CE3-CG1 4.22Å; W342-V345 HydrophobicContact CE3-CG2 4.14Å; W342-V345 HydrophobicContact CH2-CG1 4.22Å; W342-V345 HydrophobicContact CZ3-CB 4.26Å; W342-V345 HydrophobicContact CZ3-CG1 3.9Å; W342-V345 HydrophobicContact CZ3-CG2 4.4Å; W342-V345 PolarHBondContact O-N 3.1Å; W342-I346 HydrophobicContact CG-CD1 4.45Å; W342-I346 WeakPolarHBondContact O-CG1 3.45Å; W342-I346 PolarHBondContact O-N 3.33Å |
| 343 | T | 95.5 | Very high | 94.2 | Very high | 99 Ų | 99 | 43.4 Ų | 43.4 | 61% | 0.607 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -61.2 | -39.5 | 172.4 | 41.9 | 0 | 0 | 0 | 0 | 112.3 | S341 I346 A347 | S341-T343 WeakPolarHBondContact CB-OG1 3.32Å; S341-T343 PolarHBondContact O-N 3.4Å; S341-T343 PolarHBondContact OG-OG1 2.94Å; T343-I346 PolarHBondContact O-N 3.36Å; T343-A347 WeakPolarHBondContact O-CB 3.49Å; T343-A347 PolarHBondContact O-N 3.18Å |
| 344 | D | 95.2 | Very high | 94.1 | Very high | 74 Ų | 74 | 45.9 Ų | 45.9 | 40% | 0.396 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -68.1 | -38 | 176.3 | -60 | -33.1 | 0 | 0 | 0 | 111.3 | I340 S341 W342 A347 C348 | I340-D344 HydrophobicContact CG2-CB 4.13Å; S341-D344 WeakPolarHBondContact O-CB 3.27Å; S341-D344 PolarHBondContact O-N 3.44Å; S341-D344 PolarHBondContact OG-N 3.39Å; S341-D344 PolarHBondContact OG-OD1 3.17Å; S341-D344 PolarHBondContact OG-OD2 2.96Å; W342-D344 VanDerWaalsContact C-N 3.33Å; W342-D344 PolarHBondContact O-N 3.44Å; D344-A347 PolarHBondContact O-N 3.47Å; D344-C348 WeakPolarHBondContact O-CB 3.42Å; D344-C348 PolarHBondContact O-N 2.97Å |
| 345 | V | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 176.8 | -179.9 | 0 | 0 | 0 | 0 | 110.7 | L302 A303 I340 S341 W342 S349 | L302-V345 HydrophobicContact CB-CG1 4.15Å; L302-V345 HydrophobicContact CB-CG2 4.38Å; L302-V345 HydrophobicContact CD1-CG2 4.41Å; A303-V345 HydrophobicContact CB-CG1 4.43Å; I340-V345 HydrophobicContact CG2-CG2 3.84Å; S341-V345 PolarHBondContact O-N 3.4Å; W342-V345 HydrophobicContact CE3-CB 4.06Å; W342-V345 HydrophobicContact CE3-CG1 4.22Å; W342-V345 HydrophobicContact CE3-CG2 4.14Å; W342-V345 HydrophobicContact CH2-CG1 4.22Å; W342-V345 HydrophobicContact CZ3-CB 4.26Å; W342-V345 HydrophobicContact CZ3-CG1 3.9Å; W342-V345 HydrophobicContact CZ3-CG2 4.4Å; W342-V345 PolarHBondContact O-N 3.1Å; V345-S349 VanDerWaalsContact O-CB 3.27Å; V345-S349 WeakPolarHBondContact O-CB 3.43Å; V345-S349 PolarHBondContact O-N 3.1Å |
| 346 | I | 94.4 | Very high | 93.7 | Very high | 87 Ų | 87 | 47.1 Ų | 47.1 | 45% | 0.446 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65 | -46 | 176.8 | -66.9 | 168.3 | 0 | 0 | 0 | 110.7 | W342 T343 S349 S350 | W342-I346 HydrophobicContact CG-CD1 4.45Å; W342-I346 WeakPolarHBondContact O-CG1 3.45Å; W342-I346 PolarHBondContact O-N 3.33Å; T343-I346 PolarHBondContact O-N 3.36Å; I346-S349 WeakPolarHBondContact O-CB 3.49Å; I346-S349 PolarHBondContact O-N 3.23Å; I346-S350 PolarHBondContact O-N 3.05Å; I346-S350 PolarHBondContact O-OG 2.9Å |
| 347 | A | 95.1 | Very high | 93.3 | Very high | 39 Ų | 39 | 46.9 Ų | 46.9 | 32% | 0.322 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | F295 T343 D344 S349 S350 T351 | F295-A347 HydrophobicContact CE1-CB 4.41Å; F295-A347 HydrophobicContact CZ-CB 4.35Å; T343-A347 WeakPolarHBondContact O-CB 3.49Å; T343-A347 PolarHBondContact O-N 3.18Å; D344-A347 PolarHBondContact O-N 3.47Å; A347-S349 VanDerWaalsContact C-N 3.34Å; A347-S350 PolarHBondContact O-N 3.32Å; A347-S350 PolarHBondContact O-OG 3.24Å; A347-T351 WeakPolarHBondContact O-CG2 3.39Å; A347-T351 PolarHBondContact O-N 2.96Å; A347-T351 VanDerWaalsContact O-N 3.09Å; A347-T351 PolarHBondContact O-OG1 3.4Å |
| 348 | C | 95.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66 | -38.8 | 173.2 | -171.7 | 0 | 0 | 0 | 0 | 110.8 | F295 A303 D344 S350 T351 L352 | F295-C348 HydrophobicContact CB-CB 4.48Å; F295-C348 HydrophobicContact CD1-CB 3.73Å; F295-C348 HydrophobicContact CD2-CB 4.03Å; F295-C348 HydrophobicContact CE1-CB 3.87Å; F295-C348 HydrophobicContact CE2-CB 4.16Å; F295-C348 HydrophobicContact CG-CB 3.82Å; F295-C348 HydrophobicContact CZ-CB 4.08Å; A303-C348 HydrophobicContact CB-CB 3.66Å; A303-C348 VanDerWaalsContact CB-SG 3.6Å; D344-C348 WeakPolarHBondContact O-CB 3.42Å; D344-C348 PolarHBondContact O-N 2.97Å; C348-S350 PolarHBondContact O-N 2.7Å; C348-T351 WeakPolarHBondContact CA-OG1 3.35Å; C348-T351 PolarHBondContact O-OG1 3.4Å; C348-L352 WeakPolarHBondContact O-CB 3.27Å; C348-L352 PolarHBondContact O-N 2.95Å |
| 349 | S | 94.4 | Very high | 92 | Very high | 3 Ų | 3 | 51.8 Ų | 51.8 | 2% | 0.021 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -66.9 | -37.1 | 178.6 | -163.8 | 0 | 0 | 0 | 0 | 112.5 | A303 N306 N311 V345 I346 A347 K353 | A303-S349 PolarHBondContact O-OG 2.89Å; N306-S349 PolarHBondContact ND2-OG 3.24Å; N311-S349 PolarHBondContact ND2-OG 3.39Å; V345-S349 VanDerWaalsContact O-CB 3.27Å; V345-S349 WeakPolarHBondContact O-CB 3.43Å; V345-S349 PolarHBondContact O-N 3.1Å; I346-S349 WeakPolarHBondContact O-CB 3.49Å; I346-S349 PolarHBondContact O-N 3.23Å; A347-S349 VanDerWaalsContact C-N 3.34Å; S349-K353 WeakPolarHBondContact O-CB 3.31Å; S349-K353 PolarHBondContact O-N 3.15Å |
| 350 | S | 93.4 | Very high | 90.5 | Very high | 68 Ų | 68 | 49 Ų | 49 | 48% | 0.476 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -70.6 | -46 | 176.3 | 61.9 | 0 | 0 | 0 | 0 | 112.2 | I346 A347 C348 K353 E354 | I346-S350 PolarHBondContact O-N 3.05Å; I346-S350 PolarHBondContact O-OG 2.9Å; A347-S350 PolarHBondContact O-N 3.32Å; A347-S350 PolarHBondContact O-OG 3.24Å; C348-S350 PolarHBondContact O-N 2.7Å; S350-K353 PolarHBondContact O-N 2.96Å; S350-E354 PolarHBondContact O-N 2.77Å |
| 351 | T | 93.1 | Very high | 88.4 | Confident | 33 Ų | 33 | 52 Ų | 52 | 20% | 0.202 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64 | -40 | 176 | 50.6 | 0 | 0 | 0 | 0 | 112 | F295 A347 C348 E354 A355 | F295-T351 HydrophobicContact CE2-CG2 4.43Å; F295-T351 WeakPolarHBondContact CE2-OG1 3.47Å; A347-T351 WeakPolarHBondContact O-CG2 3.39Å; A347-T351 PolarHBondContact O-N 2.96Å; A347-T351 VanDerWaalsContact O-N 3.09Å; A347-T351 PolarHBondContact O-OG1 3.4Å; C348-T351 WeakPolarHBondContact CA-OG1 3.35Å; C348-T351 PolarHBondContact O-OG1 3.4Å; T351-E354 WeakPolarHBondContact O-CB 3.45Å; T351-E354 PolarHBondContact O-N 2.66Å; T351-A355 WeakPolarHBondContact O-CB 3.47Å; T351-A355 PolarHBondContact O-N 3.02Å |
| 352 | L | 93.7 | Very high | 86.2 | Confident | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58 | -48.6 | 172.8 | 175.2 | 67.3 | 0 | 0 | 0 | 111.7 | A286 L300 L304 H307 C348 E354 A355 L356 | A286-L352 HydrophobicContact CB-CD1 3.29Å; L300-L352 HydrophobicContact CD1-CD1 4.2Å; L304-L352 HydrophobicContact CB-CD2 3.87Å; L304-L352 HydrophobicContact CD1-CD2 3.83Å; L304-L352 HydrophobicContact CG-CD2 4.45Å; H307-L352 HydrophobicContact CB-CD2 4.34Å; C348-L352 WeakPolarHBondContact O-CB 3.27Å; C348-L352 PolarHBondContact O-N 2.95Å; L352-E354 VanDerWaalsContact C-N 3.28Å; L352-E354 PolarHBondContact O-N 3.07Å; L352-A355 PolarHBondContact O-N 3.1Å; L352-L356 HydrophobicContact CD1-CD1 3.96Å; L352-L356 HydrophobicContact CD1-CG 4.12Å; L352-L356 HydrophobicContact CG-CD1 4.01Å; L352-L356 HydrophobicContact CG-CG 4.48Å; L352-L356 WeakPolarHBondContact O-CG 3.3Å; L352-L356 PolarHBondContact O-N 3.41Å |
| 353 | K | 91.4 | Very high | 83.9 | Confident | 93 Ų | 93 | 56.8 Ų | 56.8 | 40% | 0.404 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -58.1 | -42.8 | 176.9 | 179.5 | 177.9 | 178.7 | 178.3 | 0 | 111.3 | S349 S350 T357 | S349-K353 WeakPolarHBondContact O-CB 3.31Å; S349-K353 PolarHBondContact O-N 3.15Å; S350-K353 PolarHBondContact O-N 2.96Å; K353-T357 WeakPolarHBondContact O-CB 3.44Å; K353-T357 VanDerWaalsContact O-CG2 3.24Å; K353-T357 WeakPolarHBondContact O-CG2 3.41Å; K353-T357 PolarHBondContact O-N 3.06Å; K353-T357 PolarHBondContact O-OG1 3.13Å |
| 354 | E | 91.1 | Very high | 81 | Confident | 101 Ų | 101 | 57.8 Ų | 57.8 | 47% | 0.472 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 176.7 | -168.7 | -177.5 | 162.6 | 0 | 0 | 112 | S350 T351 L352 T357 K358 | S350-E354 PolarHBondContact O-N 2.77Å; T351-E354 WeakPolarHBondContact O-CB 3.45Å; T351-E354 PolarHBondContact O-N 2.66Å; L352-E354 VanDerWaalsContact C-N 3.28Å; L352-E354 PolarHBondContact O-N 3.07Å; E354-T357 WeakPolarHBondContact CA-OG1 3.49Å; E354-T357 PolarHBondContact O-N 3.44Å; E354-T357 PolarHBondContact O-OG1 2.99Å; E354-K358 HydrophobicContact CG-CD 4.24Å; E354-K358 WeakPolarHBondContact O-CB 3.48Å; E354-K358 VanDerWaalsContact O-CG 3.27Å; E354-K358 WeakPolarHBondContact O-CG 3.34Å; E354-K358 PolarHBondContact O-N 3.2Å; E354-K358 WeakPolarHBondContact OE1-CE 3.14Å; E354-K358 IonicContact OE1-NZ 3.28Å; E354-K358 PolarHBondContact OE1-NZ 3.14Å |
| 355 | A | 89.4 | Confident | 78.5 | Confident | 9 Ų | 9 | 57 Ų | 57 | 7% | 0.074 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.9 | -42.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | V292 T351 L352 T359 | V292-A355 HydrophobicContact CG2-CB 3.97Å; T351-A355 WeakPolarHBondContact O-CB 3.47Å; T351-A355 PolarHBondContact O-N 3.02Å; L352-A355 PolarHBondContact O-N 3.1Å; A355-T359 PolarHBondContact O-N 2.98Å; A355-T359 PolarHBondContact O-OG1 3.48Å |
| 356 | L | 89.1 | Confident | 75.7 | Confident | 20 Ų | 20 | 63.1 Ų | 63.1 | 11% | 0.105 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -68.8 | -38.3 | 179 | -67.2 | 176.6 | 0 | 0 | 0 | 112.3 | Q282 I285 L352 S360 | Q282-L356 HydrophobicContact CB-CD1 4.32Å; Q282-L356 HydrophobicContact CB-CD2 4.05Å; Q282-L356 HydrophobicContact CG-CD1 4.28Å; Q282-L356 HydrophobicContact CG-CD2 4.18Å; I285-L356 HydrophobicContact CB-CD2 4.06Å; I285-L356 HydrophobicContact CG2-CD2 3.93Å; L352-L356 HydrophobicContact CD1-CD1 3.96Å; L352-L356 HydrophobicContact CD1-CG 4.12Å; L352-L356 HydrophobicContact CG-CD1 4.01Å; L352-L356 HydrophobicContact CG-CG 4.48Å; L352-L356 WeakPolarHBondContact O-CG 3.3Å; L352-L356 PolarHBondContact O-N 3.41Å; L356-S360 PolarHBondContact O-N 3.48Å; L356-S360 VanDerWaalsContact O-N 3.17Å; L356-S360 PolarHBondContact O-OG 3.14Å |
| 357 | T | 87.1 | Confident | 73.1 | Confident | 79 Ų | 79 | 65.6 Ų | 65.6 | 49% | 0.485 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -70.7 | -41.5 | 177.5 | 51.2 | 0 | 0 | 0 | 0 | 112.4 | K353 E354 T359 S360 G361 | K353-T357 WeakPolarHBondContact O-CB 3.44Å; K353-T357 VanDerWaalsContact O-CG2 3.24Å; K353-T357 WeakPolarHBondContact O-CG2 3.41Å; K353-T357 PolarHBondContact O-N 3.06Å; K353-T357 PolarHBondContact O-OG1 3.13Å; E354-T357 WeakPolarHBondContact CA-OG1 3.49Å; E354-T357 PolarHBondContact O-N 3.44Å; E354-T357 PolarHBondContact O-OG1 2.99Å; T357-T359 VanDerWaalsContact C-N 3.29Å; T357-T359 PolarHBondContact O-N 2.99Å; T357-S360 PolarHBondContact O-N 3.21Å; T357-G361 PolarHBondContact O-N 3.22Å; T357-G361 VanDerWaalsContact O-N 3.15Å |
| 358 | K | 83 | Confident | 70.6 | Confident | 115 Ų | 115 | 70.6 Ų | 70.6 | 50% | 0.5 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -56 | -43.8 | 173.2 | -78 | 173.4 | -179.9 | 169.2 | 0 | 112 | E354 G361 S362 | E354-K358 HydrophobicContact CG-CD 4.24Å; E354-K358 WeakPolarHBondContact O-CB 3.48Å; E354-K358 VanDerWaalsContact O-CG 3.27Å; E354-K358 WeakPolarHBondContact O-CG 3.34Å; E354-K358 PolarHBondContact O-N 3.2Å; E354-K358 WeakPolarHBondContact OE1-CE 3.14Å; E354-K358 IonicContact OE1-NZ 3.28Å; E354-K358 PolarHBondContact OE1-NZ 3.14Å; K358-G361 PolarHBondContact O-N 3.16Å; K358-S362 WeakPolarHBondContact O-CB 3.25Å; K358-S362 PolarHBondContact O-N 3.5Å; K358-S362 VanDerWaalsContact O-N 3.11Å |
| 359 | T | 75.2 | Confident | 67.9 | Low | 21 Ų | 21 | 75.8 Ų | 75.8 | 13% | 0.129 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -66.2 | -43.7 | -179.5 | -56.6 | 0 | 0 | 0 | 0 | 111.6 | F140 I285 A355 T357 G361 S362 Y363 V365 | F140-T359 HydrophobicContact CE2-CG2 3.98Å; I285-T359 HydrophobicContact CD1-CG2 4.35Å; I285-T359 HydrophobicContact CG1-CG2 4.47Å; I285-T359 HydrophobicContact CG2-CG2 3.71Å; I285-T359 WeakPolarHBondContact CG2-OG1 3.41Å; A355-T359 PolarHBondContact O-N 2.98Å; A355-T359 PolarHBondContact O-OG1 3.48Å; T357-T359 VanDerWaalsContact C-N 3.29Å; T357-T359 PolarHBondContact O-N 2.99Å; T359-G361 VanDerWaalsContact C-N 3.28Å; T359-G361 PolarHBondContact O-N 2.86Å; T359-S362 PolarHBondContact O-N 2.88Å; T359-Y363 PolarHBondContact O-N 2.93Å; T359-V365 HydrophobicContact CG2-CG2 4.26Å |
| 360 | S | 63.5 | Low | 65.4 | Low | 78 Ų | 78 | 78.6 Ų | 78.6 | 55% | 0.545 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.6 | -33.7 | 179.7 | -57.1 | 0 | 0 | 0 | 0 | 113 | L356 T357 | L356-S360 PolarHBondContact O-N 3.48Å; L356-S360 VanDerWaalsContact O-N 3.17Å; L356-S360 PolarHBondContact O-OG 3.14Å; T357-S360 PolarHBondContact O-N 3.21Å |
| 361 | G | 51.2 | Low | 63 | Low | 73 Ų | 73 | 77.3 Ų | 77.3 | 75% | 0.753 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -80 | -32.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | T357 K358 T359 | T357-G361 PolarHBondContact O-N 3.22Å; T357-G361 VanDerWaalsContact O-N 3.15Å; K358-G361 PolarHBondContact O-N 3.16Å; T359-G361 VanDerWaalsContact C-N 3.28Å; T359-G361 PolarHBondContact O-N 2.86Å |
| 362 | S | 49.1 | Very low | 60.5 | Low | 73 Ų | 73 | 86.2 Ų | 86.2 | 51% | 0.51 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -86.5 | -25.8 | -176.9 | -170.6 | 0 | 0 | 0 | 0 | 113.3 | K358 T359 | K358-S362 WeakPolarHBondContact O-CB 3.25Å; K358-S362 PolarHBondContact O-N 3.5Å; K358-S362 VanDerWaalsContact O-N 3.11Å; T359-S362 PolarHBondContact O-N 2.88Å |
| 363 | Y | 45.4 | Very low | 58.1 | Low | 128 Ų | 128 | 90 Ų | 90 | 50% | 0.502 | 48% | 0.483 | S | S | . | . | S | Bend | trans | -147.6 | 116.5 | -179.5 | -52.8 | -82.2 | 0 | 0 | 0 | 106.9 | F140 T359 V365 | F140-Y363 HydrophobicContact CD1-CE2 4.18Å; F140-Y363 AromaticContact CE1-CD1 3.88Å; F140-Y363 HydrophobicContact CE1-CD1 3.88Å; F140-Y363 AromaticContact CE1-CD2 3.59Å; F140-Y363 HydrophobicContact CE1-CD2 3.59Å; F140-Y363 AromaticContact CE1-CE1 3.89Å; F140-Y363 HydrophobicContact CE1-CE1 3.89Å; F140-Y363 AromaticContact CE1-CE2 3.61Å; F140-Y363 HydrophobicContact CE1-CE2 3.61Å; F140-Y363 AromaticContact CE1-CG 3.73Å; F140-Y363 HydrophobicContact CE1-CG 3.73Å; F140-Y363 AromaticContact CE1-CZ 3.78Å; F140-Y363 AromaticContact CE2-CD2 3.87Å; F140-Y363 HydrophobicContact CE2-CD2 3.87Å; F140-Y363 HydrophobicContact CE2-CE2 4.3Å; F140-Y363 HydrophobicContact CE2-CG 4.41Å; F140-Y363 HydrophobicContact CZ-CD1 4.02Å; F140-Y363 AromaticContact CZ-CD2 3.21Å; F140-Y363 HydrophobicContact CZ-CD2 3.21Å; F140-Y363 HydrophobicContact CZ-CE1 4.42Å; F140-Y363 AromaticContact CZ-CE2 3.69Å; F140-Y363 HydrophobicContact CZ-CE2 3.69Å; F140-Y363 AromaticContact CZ-CG 3.4Å; F140-Y363 HydrophobicContact CZ-CG 3.4Å; F140-Y363 VanDerWaalsContact CZ-CG 3.4Å; T359-Y363 PolarHBondContact O-N 2.93Å; Y363-V365 PolarHBondContact O-N 3.06Å |
| 364 | T | 36 | Very low | 56.1 | Low | 119 Ų | 119 | 88.6 Ų | 88.6 | 73% | 0.73 | 48% | 0.48 | S | S | * | . | trans | -55.5 | 109.8 | 169.9 | 53.6 | 0 | 0 | 0 | 0 | 107 | Q366 | T364-Q366 PolarHBondContact O-N 2.98Š| ||
| 365 | V | 42.1 | Very low | 53.9 | Low | 58 Ų | 58 | 87.1 Ų | 87.1 | 35% | 0.352 | 49% | 0.491 | S | S | . | . | trans | -66.5 | 79.6 | 174 | 179.5 | 0 | 0 | 0 | 0 | 105.8 | I285 T359 Y363 | I285-V365 HydrophobicContact CD1-CG2 4.44Å; T359-V365 HydrophobicContact CG2-CG2 4.26Å; Y363-V365 PolarHBondContact O-N 3.06Å | ||
| 366 | Q | 37.5 | Very low | 51.5 | Low | 128 Ų | 128 | 90.4 Ų | 90.4 | 60% | 0.598 | 51% | 0.514 | S | S | * | . | trans | -78.4 | 120.9 | 167.3 | -76.9 | -160.1 | -12.9 | 0 | 0 | 106.4 | T364 Y368 | T364-Q366 PolarHBondContact O-N 2.98Å; Q366-Y368 HydrophobicContact CB-CE2 4.33Å; Q366-Y368 VanDerWaalsContact O-CD2 3.27Å; Q366-Y368 WeakPolarHBondContact O-CD2 3.49Å; Q366-Y368 PolarHBondContact O-N 3.39Å | ||
| 367 | D | 39.2 | Very low | 48.8 | Very low | 139 Ų | 139 | 93.9 Ų | 93.9 | 74% | 0.743 | 54% | 0.54 | S | S | * | . | trans | -61.7 | 90.3 | 168 | -69.4 | -38.1 | 0 | 0 | 0 | 107.7 | P369 | D367-P369 WeakPolarHBondContact O-CD 3.34Š| ||
| 368 | Y | 41.5 | Very low | 46.7 | Very low | 145 Ų | 145 | 94.5 Ų | 94.5 | 57% | 0.569 | 55% | 0.545 | S | S | * | . | trans | -67.2 | 116.1 | 163.1 | -64.2 | -80.6 | 0 | 0 | 0 | 105.7 | Q366 S370 | Q366-Y368 HydrophobicContact CB-CE2 4.33Å; Q366-Y368 VanDerWaalsContact O-CD2 3.27Å; Q366-Y368 WeakPolarHBondContact O-CD2 3.49Å; Q366-Y368 PolarHBondContact O-N 3.39Å; Y368-S370 PolarHBondContact O-N 3.48Å | ||
| 369 | P | 39 | Very low | 45.1 | Very low | 108 Ų | 108 | 91.5 Ų | 91.5 | 70% | 0.701 | 54% | 0.538 | S | S | * | . | trans | -53.9 | 136.1 | 168.8 | 23.7 | -31.9 | 0 | 0 | 0 | 106.9 | D367 S371 | D367-P369 WeakPolarHBondContact O-CD 3.34Å; P369-S371 WeakPolarHBondContact O-CA 3.39Å; P369-S371 PolarHBondContact O-N 3.22Å | ||
| 370 | S | 41.8 | Very low | 43.8 | Very low | 63 Ų | 63 | 97.5 Ų | 97.5 | 44% | 0.441 | 57% | 0.568 | S | S | . | * | trans | -44 | 107.1 | 180 | -59.9 | 0 | 0 | 0 | 0 | 108.2 | Y368 R372 | Y368-S370 PolarHBondContact O-N 3.48Å; S370-R372 PolarHBondContact O-N 3.43Å | ||
| 371 | S | 42.6 | Very low | 43.2 | Very low | 40 Ų | 40 | 98.3 Ų | 98.3 | 28% | 0.28 | 57% | 0.569 | S | S | . | * | trans | -66.7 | 105.1 | -170.1 | -72 | 0 | 0 | 0 | 0 | 106.7 | A148 P369 L373 | A148-S371 WeakPolarHBondContact O-CB 3.45Å; A148-S371 PolarHBondContact O-N 2.94Å; A148-S371 PolarHBondContact O-OG 3.04Å; P369-S371 WeakPolarHBondContact O-CA 3.39Å; P369-S371 PolarHBondContact O-N 3.22Å; S371-L373 PolarHBondContact O-N 2.79Å | ||
| 372 | R | 41.2 | Very low | 42.9 | Very low | 221 Ų | 221 | 104 Ų | 104 | 83% | 0.834 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -64.1 | 2.3 | 166.7 | -60.4 | -171.2 | -158.1 | -134.7 | 5.8 | 111.7 | S370 L374 G375 | S370-R372 PolarHBondContact O-N 3.43Å; R372-L374 PolarHBondContact O-N 3.29Å; R372-L374 VanDerWaalsContact O-N 3.16Å; R372-G375 PolarHBondContact O-N 3.33Å |
| 373 | L | 44.2 | Very low | 43.1 | Very low | 80 Ų | 80 | 106.3 Ų | 106.3 | 42% | 0.419 | 58% | 0.579 | S | S | . | * | G | 310 helix | trans | -62.8 | -16.7 | -177.9 | -65.4 | 178 | 0 | 0 | 0 | 114.2 | S371 G375 S376 S377 | S371-L373 PolarHBondContact O-N 2.79Å; L373-G375 PolarHBondContact O-N 2.87Å; L373-S376 WeakPolarHBondContact CD2-O 3.47Å; L373-S376 CarbonylContact O-C 3.47Å; L373-S376 VanDerWaalsContact O-C 3.24Å; L373-S376 PolarHBondContact O-N 3.21Å; L373-S377 CarbonylContact O-C 3.24Å; L373-S377 VanDerWaalsContact O-C 3.26Å; L373-S377 PolarHBondContact O-N 3.02Å |
| 374 | L | 48.5 | Very low | 43.4 | Very low | 63 Ų | 63 | 103.5 Ų | 103.5 | 33% | 0.33 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -69.6 | -11.8 | 168.1 | -76.7 | 172.1 | 0 | 0 | 0 | 113.5 | Y149 Y150 V199 R372 | Y149-L374 WeakPolarHBondContact O-CD1 3.15Å; Y150-L374 HydrophobicContact CD1-CD1 4.17Å; Y150-L374 HydrophobicContact CE1-CD1 3.98Å; V199-L374 HydrophobicContact CB-CD1 4.47Å; V199-L374 HydrophobicContact CG1-CB 3.91Å; V199-L374 HydrophobicContact CG1-CD1 3.75Å; V199-L374 HydrophobicContact CG1-CG 4.47Å; V199-L374 HydrophobicContact CG2-CB 4.24Å; R372-L374 PolarHBondContact O-N 3.29Å; R372-L374 VanDerWaalsContact O-N 3.16Å |
| 375 | G | 44.4 | Very low | 44.8 | Very low | 70 Ų | 70 | 101.4 Ų | 101.4 | 72% | 0.722 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -19.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | R372 L373 | R372-G375 PolarHBondContact O-N 3.33Å; L373-G375 PolarHBondContact O-N 2.87Å |
| 376 | S | 39.2 | Very low | 46.1 | Very low | 78 Ų | 78 | 108.4 Ų | 108.4 | 55% | 0.545 | 58% | 0.583 | S | S | . | * | S | Bend | trans | -148.3 | 94.4 | -179.8 | 50.8 | 0 | 0 | 0 | 0 | 109.4 | L373 | L373-S376 WeakPolarHBondContact CD2-O 3.47Å; L373-S376 CarbonylContact O-C 3.47Å; L373-S376 VanDerWaalsContact O-C 3.24Å; L373-S376 PolarHBondContact O-N 3.21Å |
| 377 | S | 33.7 | Very low | 47.6 | Very low | 93 Ų | 93 | 112.6 Ų | 112.6 | 65% | 0.65 | 59% | 0.593 | S | S | * | * | trans | 64.1 | 115.9 | 177.3 | -68.9 | 0 | 0 | 0 | 0 | 117.1 | L373 | L373-S377 CarbonylContact O-C 3.24Å; L373-S377 VanDerWaalsContact O-C 3.26Å; L373-S377 PolarHBondContact O-N 3.02Å | ||
| 378 | P | 42.7 | Very low | 49.1 | Very low | 91 Ų | 91 | 109 Ų | 109 | 59% | 0.591 | 58% | 0.576 | S | S | * | * | trans | -57.9 | 149.1 | 170.2 | 27 | -33.4 | 0 | 0 | 0 | 109.7 | L380 | P378-L380 PolarHBondContact O-N 2.99Å; P378-L380 VanDerWaalsContact O-N 3.09Å | ||
| 379 | P | 49.3 | Very low | 50.1 | Low | 53 Ų | 53 | 107.7 Ų | 107.7 | 34% | 0.344 | 58% | 0.575 | S | S | . | * | trans | -53.9 | 125.8 | 173.3 | 19.8 | -28.2 | 0 | 0 | 0 | 108.6 | Y149 V381 | Y149-P379 HydrophobicContact CE1-CG 3.75Å; P379-V381 PolarHBondContact O-N 3.34Å | ||
| 380 | L | 47.6 | Very low | 51.3 | Low | 146 Ų | 146 | 112 Ų | 112 | 76% | 0.764 | 58% | 0.578 | S | S | * | * | trans | -65.4 | 79.6 | -179.5 | -73.9 | 163.4 | 0 | 0 | 0 | 109.2 | P378 W382 | P378-L380 PolarHBondContact O-N 2.99Å; P378-L380 VanDerWaalsContact O-N 3.09Å; L380-W382 VanDerWaalsContact O-CD1 3.3Å; L380-W382 PolarHBondContact O-N 2.95Å | ||
| 381 | V | 51.2 | Low | 52.4 | Low | 95 Ų | 95 | 112.7 Ų | 112.7 | 58% | 0.576 | 58% | 0.582 | S | S | * | * | trans | -81.3 | 97.2 | 166.9 | -179.7 | 0 | 0 | 0 | 0 | 106.4 | P379 T383 | P379-V381 PolarHBondContact O-N 3.34Å; V381-T383 PolarHBondContact O-N 2.84Å | ||
| 382 | W | 44.8 | Very low | 53.2 | Low | 194 Ų | 194 | 114.8 Ų | 114.8 | 74% | 0.735 | 59% | 0.589 | S | S | * | * | trans | -64.5 | 95.6 | 175.1 | -64.4 | 81.1 | 0 | 0 | 0 | 109.5 | L380 L384 | L380-W382 VanDerWaalsContact O-CD1 3.3Å; L380-W382 PolarHBondContact O-N 2.95Å; W382-L384 HydrophobicContact CB-CD2 4.18Å; W382-L384 HydrophobicContact CB-CG 4.06Å; W382-L384 HydrophobicContact CE3-CD2 4.24Å; W382-L384 PolarHBondContact O-N 3.2Å | ||
| 383 | T | 53.3 | Low | 54.1 | Low | 120 Ų | 120 | 108.9 Ų | 108.9 | 74% | 0.736 | 58% | 0.582 | S | S | * | * | trans | -73.6 | 86.3 | 162.5 | 50.9 | 0 | 0 | 0 | 0 | 108 | V381 S385 | V381-T383 PolarHBondContact O-N 2.84Å; T383-S385 PolarHBondContact O-N 3.14Å | ||
| 384 | L | 51.5 | Low | 54.7 | Low | 70 Ų | 70 | 110.5 Ų | 110.5 | 37% | 0.366 | 60% | 0.595 | S | S | . | * | trans | -71.5 | 127.5 | 177.7 | -63.2 | 168.5 | 0 | 0 | 0 | 109.1 | W382 T388 Q389 I392 | W382-L384 HydrophobicContact CB-CD2 4.18Å; W382-L384 HydrophobicContact CB-CG 4.06Å; W382-L384 HydrophobicContact CE3-CD2 4.24Å; W382-L384 PolarHBondContact O-N 3.2Å; L384-T388 HydrophobicContact CD2-CG2 3.65Å; L384-Q389 HydrophobicContact CB-CB 4.43Å; L384-I392 HydrophobicContact CD1-CD1 3.49Å; L384-I392 VanDerWaalsContact CD1-CD1 3.49Å; L384-I392 HydrophobicContact CD2-CD1 3.75Å; L384-I392 HydrophobicContact CG-CD1 4.24Å | ||
| 385 | S | 66.6 | Low | 54.9 | Low | 74 Ų | 74 | 111.1 Ų | 111.1 | 52% | 0.517 | 61% | 0.605 | S | S | . | * | trans | -56.3 | 149.3 | 165.9 | 170.2 | 0 | 0 | 0 | 0 | 109.4 | T383 R387 T388 Q389 | T383-S385 PolarHBondContact O-N 3.14Å; S385-R387 PolarHBondContact O-N 3.21Å; S385-R387 PolarHBondContact OG-N 3.1Å; S385-T388 WeakPolarHBondContact O-CA 3.3Å; S385-T388 WeakPolarHBondContact O-CB 3.48Å; S385-T388 PolarHBondContact O-N 2.86Å; S385-Q389 PolarHBondContact O-N 3.25Å | ||
| 386 | R | 67.6 | Low | 55.7 | Low | 206 Ų | 206 | 112.5 Ų | 112.5 | 78% | 0.777 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -49.2 | -33.9 | 174.8 | -98.5 | -172.7 | -76.4 | -157.2 | -4 | 112.6 | R390 | R386-R390 WeakPolarHBondContact O-CG 3.4Å; R386-R390 PolarHBondContact O-N 3.49Å |
| 387 | R | 70.3 | Confident | 56.7 | Low | 216 Ų | 216 | 114.3 Ų | 114.3 | 82% | 0.815 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.3 | -45.2 | 175.5 | -170.2 | 176.6 | -176.4 | 169.6 | 1 | 111.7 | S385 R390 S391 | S385-R387 PolarHBondContact O-N 3.21Å; S385-R387 PolarHBondContact OG-N 3.1Å; R387-R390 PolarHBondContact O-N 3.07Å; R387-S391 PolarHBondContact O-N 3.35Å; R387-S391 VanDerWaalsContact O-N 3.14Å |
| 388 | T | 71.1 | Confident | 57.8 | Low | 62 Ų | 62 | 115 Ų | 115 | 38% | 0.38 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69 | -41.1 | 179.7 | -39.4 | 0 | 0 | 0 | 0 | 111.6 | L384 S385 R390 S391 I392 | L384-T388 HydrophobicContact CD2-CG2 3.65Å; S385-T388 WeakPolarHBondContact O-CA 3.3Å; S385-T388 WeakPolarHBondContact O-CB 3.48Å; S385-T388 PolarHBondContact O-N 2.86Å; T388-R390 VanDerWaalsContact C-N 3.31Å; T388-R390 PolarHBondContact O-N 3.22Å; T388-S391 WeakPolarHBondContact O-CB 3.28Å; T388-S391 PolarHBondContact O-N 3.17Å; T388-S391 VanDerWaalsContact O-N 3.1Å; T388-I392 HydrophobicContact CG2-CD1 4.07Å; T388-I392 WeakPolarHBondContact O-CG1 3.41Å; T388-I392 PolarHBondContact O-N 3.33Å |
| 389 | Q | 61.8 | Low | 58.7 | Low | 119 Ų | 119 | 116 Ų | 116 | 56% | 0.556 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -57.7 | -43.9 | 176.2 | -172 | -177.4 | 4.3 | 0 | 0 | 111.6 | L384 S385 S393 | L384-Q389 HydrophobicContact CB-CB 4.43Å; S385-Q389 PolarHBondContact O-N 3.25Å; Q389-S393 PolarHBondContact O-N 3.15Å; Q389-S393 PolarHBondContact O-OG 3.47Å |
| 390 | R | 63.9 | Low | 58.8 | Low | 199 Ų | 199 | 120.2 Ų | 120.2 | 75% | 0.751 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -67.9 | -32.2 | 176.1 | -73.1 | -179.5 | 171.7 | -170.4 | -4.1 | 113.4 | R386 R387 T388 | R386-R390 WeakPolarHBondContact O-CG 3.4Å; R386-R390 PolarHBondContact O-N 3.49Å; R387-R390 PolarHBondContact O-N 3.07Å; T388-R390 VanDerWaalsContact C-N 3.31Å; T388-R390 PolarHBondContact O-N 3.22Å |
| 391 | S | 64.4 | Low | 59.2 | Low | 76 Ų | 76 | 118.5 Ų | 118.5 | 53% | 0.531 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -72.5 | -33.2 | 178.9 | -175.7 | 0 | 0 | 0 | 0 | 113 | R387 T388 S393 T394 | R387-S391 PolarHBondContact O-N 3.35Å; R387-S391 VanDerWaalsContact O-N 3.14Å; T388-S391 WeakPolarHBondContact O-CB 3.28Å; T388-S391 PolarHBondContact O-N 3.17Å; T388-S391 VanDerWaalsContact O-N 3.1Å; S391-S393 VanDerWaalsContact C-N 3.34Å; S391-T394 PolarHBondContact O-N 2.97Å; S391-T394 PolarHBondContact O-OG1 2.74Å |
| 392 | I | 60.6 | Low | 59.4 | Low | 85 Ų | 85 | 120 Ų | 120 | 44% | 0.436 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -74.7 | -29.3 | 178.9 | -65.8 | 160.5 | 0 | 0 | 0 | 110.6 | L384 T388 T394 S395 | L384-I392 HydrophobicContact CD1-CD1 3.49Å; L384-I392 VanDerWaalsContact CD1-CD1 3.49Å; L384-I392 HydrophobicContact CD2-CD1 3.75Å; L384-I392 HydrophobicContact CG-CD1 4.24Å; T388-I392 HydrophobicContact CG2-CD1 4.07Å; T388-I392 WeakPolarHBondContact O-CG1 3.41Å; T388-I392 PolarHBondContact O-N 3.33Å; I392-T394 PolarHBondContact O-N 3.38Å; I392-S395 PolarHBondContact O-N 2.9Å; I392-S395 PolarHBondContact O-OG 2.89Å |
| 393 | S | 60.2 | Low | 59.6 | Low | 97 Ų | 97 | 118.2 Ų | 118.2 | 68% | 0.678 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | -20.3 | 175.8 | -38.4 | 0 | 0 | 0 | 0 | 113.2 | Q389 S391 | Q389-S393 PolarHBondContact O-N 3.15Å; Q389-S393 PolarHBondContact O-OG 3.47Å; S391-S393 VanDerWaalsContact C-N 3.34Å |
| 394 | T | 56.3 | Low | 59.6 | Low | 113 Ų | 113 | 116.7 Ų | 116.7 | 69% | 0.693 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.6 | 3.4 | -177.1 | 58 | 0 | 0 | 0 | 0 | 113.7 | S391 I392 S396 | S391-T394 PolarHBondContact O-N 2.97Å; S391-T394 PolarHBondContact O-OG1 2.74Å; I392-T394 PolarHBondContact O-N 3.38Å; T394-S396 PolarHBondContact O-N 3.44Å; T394-S396 VanDerWaalsContact O-N 3.16Å |
| 395 | S | 53 | Low | 59.7 | Low | 77 Ų | 77 | 123 Ų | 123 | 54% | 0.538 | 68% | 0.681 | S | S | . | * | trans | -77.9 | 103.4 | 170.7 | 54.9 | 0 | 0 | 0 | 0 | 108.2 | I392 | I392-S395 PolarHBondContact O-N 2.9Å; I392-S395 PolarHBondContact O-OG 2.89Å | ||
| 396 | S | 60.5 | Low | 58.7 | Low | 99 Ų | 99 | 125.5 Ų | 125.5 | 69% | 0.692 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 140.7 | 160.9 | 39.8 | 0 | 0 | 0 | 0 | 109.3 | T394 | T394-S396 PolarHBondContact O-N 3.44Å; T394-S396 VanDerWaalsContact O-N 3.16Å |
| 397 | P | 60.4 | Low | 57.8 | Low | 115 Ų | 115 | 119.7 Ų | 119.7 | 75% | 0.747 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 136.1 | -177.6 | 20 | -30.5 | 0 | 0 | 0 | 109.4 | A399 | P397-A399 PolarHBondContact O-N 3.33Š|
| 398 | P | 56.9 | Low | 56.9 | Low | 107 Ų | 107 | 118 Ų | 118 | 70% | 0.695 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 132.5 | -178.6 | 22 | -30.9 | 0 | 0 | 0 | 109 | L400 | P398-L400 PolarHBondContact O-N 3.07Š|
| 399 | A | 61.2 | Low | 56 | Low | 112 Ų | 112 | 123.2 Ų | 123.2 | 93% | 0.926 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -69.1 | 8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | P397 | P397-A399 PolarHBondContact O-N 3.33Š|
| 400 | L | 52.3 | Low | 55.5 | Low | 143 Ų | 143 | 121.6 Ų | 121.6 | 75% | 0.749 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -85.9 | 127.2 | 172.1 | -63.3 | 177.5 | 0 | 0 | 0 | 107.3 | P398 T402 | P398-L400 PolarHBondContact O-N 3.07Å; L400-T402 PolarHBondContact O-N 2.93Å; L400-T402 VanDerWaalsContact O-N 3.12Å |
| 401 | S | 56.3 | Low | 55 | Low | 110 Ų | 110 | 116 Ų | 116 | 77% | 0.769 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -47.3 | 120.2 | 171.9 | 47 | 0 | 0 | 0 | 0 | 109.4 | I403 | S401-I403 PolarHBondContact O-N 3.43Å; S401-I403 VanDerWaalsContact O-N 3.08Å |
| 402 | T | 55.3 | Low | 54.6 | Low | 127 Ų | 127 | 118.8 Ų | 118.8 | 78% | 0.779 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 118.9 | 166.6 | -51.8 | 0 | 0 | 0 | 0 | 107 | L400 T404 | L400-T402 PolarHBondContact O-N 2.93Å; L400-T402 VanDerWaalsContact O-N 3.12Å; T402-T404 PolarHBondContact O-N 3.17Å |
| 403 | I | 49.1 | Very low | 54.2 | Low | 156 Ų | 156 | 119 Ų | 119 | 80% | 0.8 | 68% | 0.682 | S | S | * | * | trans | -61.6 | 109.5 | 169.4 | -60.2 | 169.1 | 0 | 0 | 0 | 104.9 | S401 E405 | S401-I403 PolarHBondContact O-N 3.43Å; S401-I403 VanDerWaalsContact O-N 3.08Å; I403-E405 PolarHBondContact O-N 3.24Å | ||
| 404 | T | 51.4 | Low | 53.8 | Low | 88 Ų | 88 | 118.6 Ų | 118.6 | 54% | 0.54 | 67% | 0.672 | S | S | . | * | trans | -63.5 | 123.5 | 169.1 | 39 | 0 | 0 | 0 | 0 | 106.4 | T402 I406 | T402-T404 PolarHBondContact O-N 3.17Å; T404-I406 PolarHBondContact O-N 3.02Å | ||
| 405 | E | 54.8 | Low | 53.8 | Low | 201 Ų | 201 | 117.8 Ų | 117.8 | 94% | 0.939 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -66.9 | 16.3 | 173.8 | -80.5 | -175.5 | 161.3 | 0 | 0 | 113 | I403 | I403-E405 PolarHBondContact O-N 3.24Š|
| 406 | I | 45.1 | Very low | 54 | Low | 128 Ų | 128 | 118.5 Ų | 118.5 | 66% | 0.656 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -135.3 | 88.8 | 179.3 | -50.9 | 167 | 0 | 0 | 0 | 103.7 | T404 | T404-I406 PolarHBondContact O-N 3.02Š|
| 407 | D | 48.7 | Very low | 53.6 | Low | 83 Ų | 83 | 119.4 Ų | 119.4 | 44% | 0.444 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -174.8 | -12.8 | 155 | -89.2 | -27.6 | 0 | 0 | 0 | 113 | E409 L410 V411 | D407-E409 PolarHBondContact O-N 2.95Å; D407-L410 PolarHBondContact O-N 3.28Å; D407-V411 WeakPolarHBondContact O-CB 3.33Å; D407-V411 VanDerWaalsContact O-CG2 3.22Å; D407-V411 WeakPolarHBondContact O-CG2 3.27Å; D407-V411 PolarHBondContact O-N 2.97Å |
| 408 | E | 51.4 | Low | 53.4 | Low | 182 Ų | 182 | 117.8 Ų | 117.8 | 85% | 0.85 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66.7 | -34.2 | 172.5 | -75.3 | -165.7 | 172 | 0 | 0 | 112.8 | ||
| 409 | E | 52.3 | Low | 53.3 | Low | 171 Ų | 171 | 119.2 Ų | 119.2 | 80% | 0.799 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -77.2 | -28.4 | 173.2 | -88.7 | -171.6 | 153.8 | 0 | 0 | 113.3 | D407 L413 | D407-E409 PolarHBondContact O-N 2.95Å; E409-L413 PolarHBondContact O-N 2.86Å |
| 410 | L | 50.8 | Low | 52.9 | Low | 84 Ų | 84 | 119.9 Ų | 119.9 | 44% | 0.44 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -87.2 | -31.8 | -174.1 | -127.7 | 139.6 | 0 | 0 | 0 | 112.6 | D407 H412 L413 N414 | D407-L410 PolarHBondContact O-N 3.28Å; L410-H412 VanDerWaalsContact C-N 3.3Å; L410-L413 PolarHBondContact O-N 3.5Å; L410-N414 PolarHBondContact O-N 2.89Å |
| 411 | V | 54.8 | Low | 52.6 | Low | 81 Ų | 81 | 120.1 Ų | 120.1 | 49% | 0.491 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -63.6 | -40.4 | 168.8 | 174 | 0 | 0 | 0 | 0 | 110.2 | D407 L413 N414 D415 | D407-V411 WeakPolarHBondContact O-CB 3.33Å; D407-V411 VanDerWaalsContact O-CG2 3.22Å; D407-V411 WeakPolarHBondContact O-CG2 3.27Å; D407-V411 PolarHBondContact O-N 2.97Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.27Å; V411-N414 PolarHBondContact O-N 2.86Å; V411-D415 PolarHBondContact O-N 3.18Å |
| 412 | H | 54.2 | Low | 51.8 | Low | 136 Ų | 136 | 123.1 Ų | 123.1 | 63% | 0.63 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -65.7 | -32.9 | 178.1 | -128.5 | -54.4 | 0 | 0 | 0 | 112.9 | L410 I416 | L410-H412 VanDerWaalsContact C-N 3.3Å; H412-I416 VanDerWaalsContact O-CD1 3.28Å; H412-I416 WeakPolarHBondContact O-CD1 3.48Å; H412-I416 VanDerWaalsContact O-CG1 3.22Å; H412-I416 WeakPolarHBondContact O-CG1 3.21Å; H412-I416 PolarHBondContact O-N 2.9Å |
| 413 | L | 53.1 | Low | 51.1 | Low | 90 Ų | 90 | 120.3 Ų | 120.3 | 47% | 0.471 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -76.4 | -40.9 | 174.9 | -76.2 | 172.6 | 0 | 0 | 0 | 112.3 | E409 L410 V411 D415 I416 F417 | E409-L413 PolarHBondContact O-N 2.86Å; L410-L413 PolarHBondContact O-N 3.5Å; V411-L413 VanDerWaalsContact C-N 3.3Å; V411-L413 PolarHBondContact O-N 3.27Å; L413-D415 VanDerWaalsContact C-N 3.34Å; L413-D415 PolarHBondContact O-N 3.44Å; L413-I416 WeakPolarHBondContact O-CB 3.28Å; L413-I416 PolarHBondContact O-N 3.42Å; L413-I416 VanDerWaalsContact O-N 3.12Å; L413-F417 HydrophobicContact CD2-CE2 4.44Å; L413-F417 WeakPolarHBondContact O-CD2 3.18Å; L413-F417 PolarHBondContact O-N 2.75Å |
| 414 | N | 52.7 | Low | 50.7 | Low | 87 Ų | 87 | 124.9 Ų | 124.9 | 47% | 0.465 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -68.3 | -31.4 | 178.9 | -82.8 | -14.1 | 0 | 0 | 0 | 113.1 | L410 V411 I416 F417 S418 | L410-N414 PolarHBondContact O-N 2.89Å; V411-N414 PolarHBondContact O-N 2.86Å; N414-I416 VanDerWaalsContact C-N 3.3Å; N414-F417 PolarHBondContact O-N 3.43Å; N414-S418 VanDerWaalsContact O-CB 3.32Å; N414-S418 WeakPolarHBondContact O-CB 3.14Å; N414-S418 PolarHBondContact O-N 3.49Å; N414-S418 PolarHBondContact O-OG 3.32Å |
| 415 | D | 55.7 | Low | 50.6 | Low | 96 Ų | 96 | 126.7 Ų | 126.7 | 51% | 0.513 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -68.7 | -30.4 | 171.5 | -79.4 | -15 | 0 | 0 | 0 | 112.1 | V411 L413 N419 | V411-D415 PolarHBondContact O-N 3.18Å; L413-D415 VanDerWaalsContact C-N 3.34Å; L413-D415 PolarHBondContact O-N 3.44Å; D415-N419 WeakPolarHBondContact O-CB 3.37Å; D415-N419 PolarHBondContact O-N 2.72Å; D415-N419 PolarHBondContact O-ND2 2.66Å |
| 416 | I | 57.1 | Low | 50.4 | Low | 93 Ų | 93 | 122.8 Ų | 122.8 | 48% | 0.477 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -71.2 | -41.8 | 173.2 | -68 | 166 | 0 | 0 | 0 | 110.4 | H412 L413 N414 | H412-I416 VanDerWaalsContact O-CD1 3.28Å; H412-I416 WeakPolarHBondContact O-CD1 3.48Å; H412-I416 VanDerWaalsContact O-CG1 3.22Å; H412-I416 WeakPolarHBondContact O-CG1 3.21Å; H412-I416 PolarHBondContact O-N 2.9Å; L413-I416 WeakPolarHBondContact O-CB 3.28Å; L413-I416 PolarHBondContact O-N 3.42Å; L413-I416 VanDerWaalsContact O-N 3.12Å; N414-I416 VanDerWaalsContact C-N 3.3Å |
| 417 | F | 52.2 | Low | 50.7 | Low | 117 Ų | 117 | 122.5 Ų | 122.5 | 51% | 0.513 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -74.1 | -38.9 | -179.5 | -76.1 | -68.3 | 0 | 0 | 0 | 113.2 | L413 N414 N419 M420 | L413-F417 HydrophobicContact CD2-CE2 4.44Å; L413-F417 WeakPolarHBondContact O-CD2 3.18Å; L413-F417 PolarHBondContact O-N 2.75Å; N414-F417 PolarHBondContact O-N 3.43Å; F417-N419 VanDerWaalsContact C-N 3.29Å; F417-N419 PolarHBondContact O-N 3.38Å; F417-M420 HydrophobicContact CD1-CE 3.99Å; F417-M420 HydrophobicContact CE1-CE 4.25Å; F417-M420 PolarHBondContact O-N 3.5Å; F417-M420 VanDerWaalsContact O-N 3.08Å |
| 418 | S | 56.3 | Low | 50.8 | Low | 82 Ų | 82 | 124.8 Ų | 124.8 | 57% | 0.573 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.1 | -28.4 | -179.8 | -53.5 | 0 | 0 | 0 | 0 | 112.6 | N414 M420 | N414-S418 VanDerWaalsContact O-CB 3.32Å; N414-S418 WeakPolarHBondContact O-CB 3.14Å; N414-S418 PolarHBondContact O-N 3.49Å; N414-S418 PolarHBondContact O-OG 3.32Å; S418-M420 PolarHBondContact O-N 3.09Å |
| 419 | N | 53.9 | Low | 50.8 | Low | 136 Ų | 136 | 121.3 Ų | 121.3 | 73% | 0.727 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -7.5 | 174 | -78.1 | -43.5 | 0 | 0 | 0 | 113.7 | D415 F417 | D415-N419 WeakPolarHBondContact O-CB 3.37Å; D415-N419 PolarHBondContact O-N 2.72Å; D415-N419 PolarHBondContact O-ND2 2.66Å; F417-N419 VanDerWaalsContact C-N 3.29Å; F417-N419 PolarHBondContact O-N 3.38Å |
| 420 | M | 53.8 | Low | 50.7 | Low | 126 Ų | 126 | 117.9 Ų | 117.9 | 62% | 0.621 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | -10.6 | 175.3 | -74.6 | -161.5 | -48.3 | 0 | 0 | 114.5 | F417 S418 L422 | F417-M420 HydrophobicContact CD1-CE 3.99Å; F417-M420 HydrophobicContact CE1-CE 4.25Å; F417-M420 PolarHBondContact O-N 3.5Å; F417-M420 VanDerWaalsContact O-N 3.08Å; S418-M420 PolarHBondContact O-N 3.09Å; M420-L422 VanDerWaalsContact C-N 3.35Å; M420-L422 PolarHBondContact O-N 2.69Å |
| 421 | D | 46.4 | Very low | 50.7 | Low | 148 Ų | 148 | 120.4 Ų | 120.4 | 79% | 0.791 | 66% | 0.657 | S | S | * | * | trans | -96.1 | 41 | -178 | -84.8 | -14.6 | 0 | 0 | 0 | 114.2 | ||||
| 422 | L | 38.6 | Very low | 50.4 | Low | 173 Ų | 173 | 123.4 Ų | 123.4 | 91% | 0.906 | 67% | 0.67 | S | S | * | * | trans | -124.5 | 76.5 | 162.9 | -78 | 168.8 | 0 | 0 | 0 | 109.3 | M420 | M420-L422 VanDerWaalsContact C-N 3.35Å; M420-L422 PolarHBondContact O-N 2.69Å | ||
| 423 | G | 41.6 | Very low | 50 | Low | 68 Ų | 68 | 122.3 Ų | 122.3 | 70% | 0.701 | 67% | 0.673 | S | S | * | * | trans | -179.2 | 37.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 424 | L | 39.2 | Very low | 49.8 | Very low | 252 Ų | 252 | 125.3 Ų | 125.3 | 100% | 1.319 | 69% | 0.692 | S | S | * | * | trans | -130.6 | 0 | 156.3 | -81.4 | 168.3 | 0 | 0 | 0 | 107.2 |
Retrieved 424 of 424 residues in 157 ms
(Link to these results)