| 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 | 39.1 | Very low | 28 | Very low | 239 Ų | 239 | 150.8 Ų | 150.8 | 100% | 1.177 | 84% | 0.837 | S | S | * | * | 0 | 75.2 | 0 | -70.9 | 158.6 | 129 | 0 | 0 | 106.6 | |||||
| 2 | N | 27 | Very low | 28 | Very low | 158 Ų | 158 | 147.3 Ų | 147.3 | 85% | 0.845 | 83% | 0.831 | S | S | * | * | 35.2 | 118.9 | 85.1 | -77.3 | -0.6 | 0 | 0 | 0 | 111.8 | |||||
| 3 | S | 27 | Very low | 28.2 | Very low | 95 Ų | 95 | 143.9 Ų | 143.9 | 66% | 0.664 | 82% | 0.822 | S | S | * | * | cis | -176.2 | 142.5 | 24 | 40.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 4 | R | 27.4 | Very low | 28.1 | Very low | 243 Ų | 243 | 147.6 Ų | 147.6 | 92% | 0.917 | 83% | 0.832 | S | S | * | * | trans | 74.6 | 117 | 132 | -68.4 | 175.9 | -168 | -160.1 | 3.5 | 122.3 | ||||
| 5 | L | 29.1 | Very low | 28.2 | Very low | 164 Ų | 164 | 151.5 Ų | 151.5 | 86% | 0.859 | 84% | 0.837 | S | S | * | * | trans | -53.5 | 165.7 | 144 | -80.9 | 158.7 | 0 | 0 | 0 | 112.3 | ||||
| 6 | P | 34.9 | Very low | 28.4 | Very low | 116 Ų | 116 | 152.4 Ų | 152.4 | 75% | 0.753 | 84% | 0.839 | S | S | * | * | cis | -153.6 | -176.1 | 43.7 | 40.8 | -16.8 | 0 | 0 | 0 | 119.3 | ||||
| 7 | M | 24.6 | Very low | 28.4 | Very low | 183 Ų | 183 | 155.4 Ų | 155.4 | 90% | 0.901 | 84% | 0.841 | S | S | * | * | trans | -18 | 143.1 | 161.4 | -65.2 | -142 | 161.8 | 0 | 0 | 120.5 | ||||
| 8 | A | 25.5 | Very low | 28.4 | Very low | 87 Ų | 87 | 156.8 Ų | 156.8 | 72% | 0.719 | 85% | 0.847 | S | S | * | * | 163.6 | 138.9 | 105.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 9 | S | 24.3 | Very low | 28.4 | Very low | 104 Ų | 104 | 158.5 Ų | 158.5 | 73% | 0.727 | 85% | 0.849 | S | S | * | * | trans | 58.2 | 139.1 | 138 | 61 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 10 | D | 23.9 | Very low | 28.4 | Very low | 147 Ų | 147 | 163.3 Ų | 163.3 | 79% | 0.786 | 85% | 0.854 | S | S | * | * | trans | 85.3 | 96.6 | 144 | -76.3 | -18.9 | 0 | 0 | 0 | 121.3 | ||||
| 11 | S | 25.7 | Very low | 28.2 | Very low | 123 Ų | 123 | 160.7 Ų | 160.7 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | trans | -141.8 | 53.9 | 138.2 | -177.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 12 | S | 28 | Very low | 27.7 | Very low | 109 Ų | 109 | 155.6 Ų | 155.6 | 76% | 0.762 | 83% | 0.833 | S | S | * | * | trans | -107.1 | 57.6 | 159.7 | -169.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 13 | S | 29.6 | Very low | 27.6 | Very low | 103 Ų | 103 | 159.8 Ų | 159.8 | 72% | 0.72 | 84% | 0.837 | S | S | * | * | trans | -140.9 | 58.7 | -179.3 | -171.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 14 | M | 27.5 | Very low | 27.5 | Very low | 195 Ų | 195 | 167 Ų | 167 | 96% | 0.961 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -145.9 | 15.9 | 158.2 | -106.8 | -170.3 | 179.3 | 0 | 0 | 113.7 | ||
| 15 | K | 30 | Very low | 27.4 | Very low | 207 Ų | 207 | 167.3 Ų | 167.3 | 90% | 0.9 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -119.5 | 10.6 | 178 | -90.7 | -176.4 | 175.9 | 178.1 | 0 | 115.3 | ||
| 16 | L | 30.5 | Very low | 27.4 | Very low | 166 Ų | 166 | 166.6 Ų | 166.6 | 87% | 0.869 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -135.5 | 63.6 | -176.6 | -100.5 | 144.5 | 0 | 0 | 0 | 111.3 | ||
| 17 | K | 29.2 | Very low | 27 | Very low | 203 Ų | 203 | 164.3 Ų | 164.3 | 88% | 0.883 | 85% | 0.85 | S | S | * | * | S | Bend | trans | -159 | 52.6 | 165.9 | -118.3 | 176.7 | -169.5 | -179.8 | 0 | 112.8 | ||
| 18 | L | 27.5 | Very low | 27.3 | Very low | 181 Ų | 181 | 162.8 Ų | 162.8 | 95% | 0.948 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -159.4 | 49.6 | 152.8 | -138.3 | 75.1 | 0 | 0 | 0 | 112.4 | ||
| 19 | Q | 29 | Very low | 27.3 | Very low | 189 Ų | 189 | 162 Ų | 162 | 88% | 0.883 | 85% | 0.852 | S | S | * | * | trans | -143 | 65.4 | 168.2 | -154.3 | 172.1 | 6.6 | 0 | 0 | 108.9 | ||||
| 20 | R | 29.1 | Very low | 27.5 | Very low | 253 Ų | 253 | 163.5 Ų | 163.5 | 96% | 0.955 | 86% | 0.857 | S | S | * | * | trans | -165.5 | 68.3 | 168.7 | -111.3 | 173 | -170.1 | -166.3 | 3.6 | 112 | ||||
| 21 | S | 24.3 | Very low | 27.7 | Very low | 109 Ų | 109 | 163.8 Ų | 163.8 | 76% | 0.762 | 86% | 0.858 | S | S | * | * | S | Bend | trans | -177.1 | 111.8 | 153.7 | -161 | 0 | 0 | 0 | 0 | 102.1 | ||
| 22 | T | 27 | Very low | 27.8 | Very low | 133 Ų | 133 | 165.1 Ų | 165.1 | 82% | 0.816 | 85% | 0.85 | S | S | * | * | -169.6 | 118.3 | 52 | -32 | 0 | 0 | 0 | 0 | 105.9 | |||||
| 23 | R | 25.7 | Very low | 28 | Very low | 246 Ų | 246 | 169.2 Ų | 169.2 | 93% | 0.928 | 86% | 0.858 | S | S | * | * | trans | -141.9 | 90.2 | 167.7 | -153.4 | -177.9 | -165.7 | -172 | 4.9 | 108.9 | ||||
| 24 | R | 25.4 | Very low | 28 | Very low | 246 Ų | 246 | 168.8 Ų | 168.8 | 93% | 0.928 | 85% | 0.851 | S | S | * | * | trans | 170.6 | 106.7 | 147.2 | -97.9 | 173.7 | -175.8 | -167 | 2 | 110.5 | ||||
| 25 | R | 24.7 | Very low | 28 | Very low | 249 Ų | 249 | 167 Ų | 167 | 94% | 0.94 | 84% | 0.84 | S | S | * | * | trans | -159.9 | 113.3 | 131.1 | -127.8 | 177.7 | -173.5 | 179.7 | 1.8 | 109.2 | ||||
| 26 | V | 29.4 | Very low | 28.1 | Very low | 150 Ų | 150 | 162.9 Ų | 162.9 | 91% | 0.909 | 83% | 0.832 | S | S | * | * | trans | -73.5 | 127.6 | 160.1 | 172.2 | 0 | 0 | 0 | 0 | 106 | ||||
| 27 | G | 25.5 | Very low | 28 | Very low | 68 Ų | 68 | 157 Ų | 157 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -157.8 | 106.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 28 | T | 31.4 | Very low | 27.9 | Very low | 150 Ų | 150 | 153.4 Ų | 153.4 | 92% | 0.92 | 80% | 0.797 | S | S | * | * | trans | -57.6 | 127.2 | 169 | 43.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 29 | G | 25 | Very low | 28.2 | Very low | 72 Ų | 72 | 149.8 Ų | 149.8 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -175.3 | 101.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 30 | T | 30.2 | Very low | 28.6 | Very low | 135 Ų | 135 | 147.1 Ų | 147.1 | 83% | 0.828 | 77% | 0.773 | S | S | * | * | trans | -51.2 | 132.2 | 161.8 | 34.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 31 | L | 27 | Very low | 28.8 | Very low | 153 Ų | 153 | 144.5 Ų | 144.5 | 80% | 0.801 | 76% | 0.763 | S | S | * | * | trans | 148.9 | 138.3 | 141.5 | -95 | 123.4 | 0 | 0 | 0 | 113.2 | ||||
| 32 | Q | 27.9 | Very low | 29.4 | Very low | 150 Ų | 150 | 149.5 Ų | 149.5 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | trans | 86.2 | 70.6 | 157.5 | -121 | 117.7 | 7.4 | 0 | 0 | 119.7 | T34 | Q32-T34 PolarHBondContact O-N 3.29Š| ||
| 33 | Q | 32.3 | Very low | 30.2 | Very low | 196 Ų | 196 | 148.2 Ų | 148.2 | 92% | 0.916 | 75% | 0.748 | S | S | * | * | trans | -61.8 | 101.9 | 140.1 | -89.8 | 176 | -16.8 | 0 | 0 | 109.6 | ||||
| 34 | T | 29.9 | Very low | 31.1 | Very low | 93 Ų | 93 | 144 Ų | 144 | 57% | 0.571 | 74% | 0.743 | S | S | * | * | trans | -156.7 | -5.8 | 158.9 | 41.5 | 0 | 0 | 0 | 0 | 116.8 | Q32 | Q32-T34 PolarHBondContact O-N 3.29Š| ||
| 35 | H | 27.9 | Very low | 32.3 | Very low | 159 Ų | 159 | 134.9 Ų | 134.9 | 74% | 0.736 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -105.4 | -11.6 | -168.9 | -110.6 | -69.1 | 0 | 0 | 0 | 118.1 | ||
| 36 | T | 31.9 | Very low | 33.9 | Very low | 119 Ų | 119 | 125.9 Ų | 125.9 | 73% | 0.73 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -90.7 | -17.5 | 178.7 | 33.8 | 0 | 0 | 0 | 0 | 114.1 | ||
| 37 | G | 27.3 | Very low | 35.5 | Very low | 42 Ų | 42 | 120.6 Ų | 120.6 | 43% | 0.433 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -78 | -22.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | R41 | G37-R41 WeakPolarHBondContact O-CB 3.44Å; G37-R41 WeakPolarHBondContact O-CG 3.42Å; G37-R41 PolarHBondContact O-N 3.26Å |
| 38 | H | 27.8 | Very low | 37.2 | Very low | 129 Ų | 129 | 119.8 Ų | 119.8 | 60% | 0.597 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -84.9 | -24.7 | -176.8 | -91.5 | -32.7 | 0 | 0 | 0 | 114.6 | ||
| 39 | V | 33.6 | Very low | 39.5 | Very low | 105 Ų | 105 | 117.2 Ų | 117.2 | 64% | 0.636 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -77.2 | -34.1 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 110.8 | ||
| 40 | I | 38 | Very low | 42.4 | Very low | 132 Ų | 132 | 114.1 Ų | 114.1 | 68% | 0.677 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -75.4 | -31.7 | 176.5 | -61 | 174.2 | 0 | 0 | 0 | 111.3 | R42 | I40-R42 VanDerWaalsContact C-N 3.34Å; I40-R42 PolarHBondContact O-N 3.42Å |
| 41 | R | 33.1 | Very low | 45.2 | Very low | 198 Ų | 198 | 111.4 Ų | 111.4 | 75% | 0.747 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -12.4 | 177.6 | -84.7 | -175.2 | 178.8 | -175.1 | 0.8 | 115.4 | G37 | G37-R41 WeakPolarHBondContact O-CB 3.44Å; G37-R41 WeakPolarHBondContact O-CG 3.42Å; G37-R41 PolarHBondContact O-N 3.26Å |
| 42 | R | 36.3 | Very low | 48.1 | Very low | 215 Ų | 215 | 109.9 Ų | 109.9 | 81% | 0.811 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -6.2 | 176.6 | -91.9 | -171.8 | 177.6 | 169.8 | 0.4 | 114.8 | I40 | I40-R42 VanDerWaalsContact C-N 3.34Å; I40-R42 PolarHBondContact O-N 3.42Å |
| 43 | F | 44.3 | Very low | 51.1 | Low | 105 Ų | 105 | 104.9 Ų | 104.9 | 46% | 0.461 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -102.4 | -0.5 | -178.4 | -91.2 | -82.5 | 0 | 0 | 0 | 115 | V45 I72 | F43-V45 PolarHBondContact O-N 3.07Å; F43-I72 HydrophobicContact CD1-CD1 4.05Å; F43-I72 HydrophobicContact CE1-CD1 3.93Å |
| 44 | L | 43.8 | Very low | 53.9 | Low | 158 Ų | 158 | 95.5 Ų | 95.5 | 83% | 0.827 | 50% | 0.499 | S | S | * | . | trans | -82.5 | 58.2 | 163.4 | -89.9 | 152.4 | 0 | 0 | 0 | 109.2 | A46 | L44-A46 PolarHBondContact O-N 3.39Š| ||
| 45 | V | 51.8 | Low | 56.6 | Low | 55 Ų | 55 | 94.4 Ų | 94.4 | 33% | 0.333 | 49% | 0.49 | S | S | . | . | trans | -64.8 | 122.1 | 165.1 | 178 | 0 | 0 | 0 | 0 | 105.5 | F43 M47 D49 I50 | F43-V45 PolarHBondContact O-N 3.07Å; V45-M47 PolarHBondContact O-N 3.26Å; V45-D49 HydrophobicContact CG1-CB 3.39Å; V45-I50 HydrophobicContact CB-CG1 4.31Å; V45-I50 HydrophobicContact CG1-CD1 4.46Å; V45-I50 HydrophobicContact CG1-CG1 3.73Å | ||
| 46 | A | 58.3 | Low | 59.6 | Low | 59 Ų | 59 | 92 Ų | 92 | 49% | 0.488 | 49% | 0.488 | S | S | . | . | trans | -60.3 | 141.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | L44 G48 D49 I50 | L44-A46 PolarHBondContact O-N 3.39Å; A46-G48 PolarHBondContact O-N 3.37Å; A46-D49 PolarHBondContact N-OD2 3.5Å; A46-D49 WeakPolarHBondContact O-CA 3.25Å; A46-D49 WeakPolarHBondContact O-CB 3.48Å; A46-D49 PolarHBondContact O-N 2.98Å; A46-I50 PolarHBondContact O-N 3.42Å | ||
| 47 | M | 62.1 | Low | 62.4 | Low | 40 Ų | 40 | 90.7 Ų | 90.7 | 20% | 0.197 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -55.8 | -24.3 | -176.4 | -69.4 | -50.6 | -41.9 | 0 | 0 | 113.9 | V45 I50 R51 L94 | V45-M47 PolarHBondContact O-N 3.26Å; M47-I50 HydrophobicContact CE-CB 4.01Å; M47-I50 HydrophobicContact CE-CD1 3.39Å; M47-I50 HydrophobicContact CE-CG1 4.23Å; M47-I50 HydrophobicContact CE-CG2 4.18Å; M47-I50 PolarHBondContact O-N 3.49Å; M47-I50 HydrophobicContact SD-CD1 3.57Å; M47-I50 VanDerWaalsContact SD-CD1 3.57Å; M47-R51 PolarHBondContact O-N 2.97Å; M47-L94 HydrophobicContact CE-CD1 3.33Å |
| 48 | G | 61.2 | Low | 65.4 | Low | 51 Ų | 51 | 92.7 Ų | 92.7 | 53% | 0.526 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.7 | -32.7 | 172 | 0 | 0 | 0 | 0 | 0 | 114.2 | A46 | A46-G48 PolarHBondContact O-N 3.37Å |
| 49 | D | 78.9 | Confident | 68.4 | Low | 96 Ų | 96 | 87.3 Ų | 87.3 | 51% | 0.513 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -75 | -32.9 | 176.8 | -59 | -32.6 | 0 | 0 | 0 | 110.9 | V45 A46 Q52 S53 | V45-D49 HydrophobicContact CG1-CB 3.39Å; A46-D49 PolarHBondContact N-OD2 3.5Å; A46-D49 WeakPolarHBondContact O-CA 3.25Å; A46-D49 WeakPolarHBondContact O-CB 3.48Å; A46-D49 PolarHBondContact O-N 2.98Å; D49-Q52 PolarHBondContact O-N 3.37Å; D49-S53 PolarHBondContact O-N 3.45Å |
| 50 | I | 86.9 | Confident | 71.3 | Confident | 7 Ų | 7 | 83.4 Ų | 83.4 | 4% | 0.036 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -61.4 | -47.9 | 176.1 | -70.3 | 168.5 | 0 | 0 | 0 | 109.8 | V45 A46 M47 Q52 S53 L54 H69 L94 | V45-I50 HydrophobicContact CB-CG1 4.31Å; V45-I50 HydrophobicContact CG1-CD1 4.46Å; V45-I50 HydrophobicContact CG1-CG1 3.73Å; A46-I50 PolarHBondContact O-N 3.42Å; M47-I50 HydrophobicContact CE-CB 4.01Å; M47-I50 HydrophobicContact CE-CD1 3.39Å; M47-I50 HydrophobicContact CE-CG1 4.23Å; M47-I50 HydrophobicContact CE-CG2 4.18Å; M47-I50 PolarHBondContact O-N 3.49Å; M47-I50 HydrophobicContact SD-CD1 3.57Å; M47-I50 VanDerWaalsContact SD-CD1 3.57Å; I50-Q52 VanDerWaalsContact C-N 3.28Å; I50-Q52 PolarHBondContact O-N 2.7Å; I50-S53 WeakPolarHBondContact O-CB 3.25Å; I50-S53 PolarHBondContact O-N 3.49Å; I50-S53 PolarHBondContact O-OG 3.02Å; I50-L54 HydrophobicContact CG2-CD1 3.76Å; I50-L54 HydrophobicContact CG2-CG 4.11Å; I50-L54 VanDerWaalsContact O-CG 3.31Å; I50-L54 WeakPolarHBondContact O-CG 3.46Å; I50-L54 PolarHBondContact O-N 3.39Å; I50-H69 HydrophobicContact CD1-CB 4.24Å; I50-L94 HydrophobicContact CG2-CD1 4.19Å |
| 51 | R | 88.9 | Confident | 74 | Confident | 78 Ų | 78 | 79.4 Ų | 79.4 | 29% | 0.294 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -53.8 | -46.1 | 177.8 | -169.9 | 171.8 | 177.5 | -86.9 | -6 | 112.5 | M47 S53 L54 L55 L94 E97 F98 | M47-R51 PolarHBondContact O-N 2.97Å; R51-S53 VanDerWaalsContact C-N 3.29Å; R51-S53 PolarHBondContact O-N 3.04Å; R51-L54 PolarHBondContact O-N 3.33Å; R51-L55 WeakPolarHBondContact O-CG 3.32Å; R51-L55 PolarHBondContact O-N 3.17Å; R51-L55 VanDerWaalsContact O-N 3.12Å; R51-L94 HydrophobicContact CB-CD2 3.74Å; R51-L94 HydrophobicContact CG-CD2 3.82Å; R51-E97 IonicContact CZ-OE1 3.4Å; R51-E97 IonicContact CZ-OE2 3.65Å; R51-E97 IonicContact NE-OE1 3.81Å; R51-E97 PolarHBondContact NE-OE1 2.94Å; R51-E97 IonicContact NE-OE2 2.62Å; R51-E97 PolarHBondContact NE-OE2 2.89Å; R51-E97 IonicContact NH2-OE1 3.82Å; R51-E97 PolarHBondContact NH2-OE1 3.18Å; R51-E97 IonicContact NH2-OE2 3.77Å; R51-F98 HydrophobicContact CG-CE2 4.18Å; R51-F98 HydrophobicContact CG-CZ 4.38Å |
| 52 | Q | 88.6 | Confident | 76.9 | Confident | 121 Ų | 121 | 70 Ų | 70 | 57% | 0.565 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -65.6 | -32.6 | 179.4 | -64.2 | -60.6 | -22.4 | 0 | 0 | 112.4 | D49 I50 L54 P56 | D49-Q52 PolarHBondContact O-N 3.37Å; I50-Q52 VanDerWaalsContact C-N 3.28Å; I50-Q52 PolarHBondContact O-N 2.7Å; Q52-L54 VanDerWaalsContact C-N 3.34Å; Q52-P56 WeakPolarHBondContact O-CD 3.27Å |
| 53 | S | 90.5 | Very high | 79.7 | Confident | 44 Ų | 44 | 59.9 Ų | 59.9 | 31% | 0.308 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -72.6 | -24.1 | 174.9 | 80.4 | 0 | 0 | 0 | 0 | 114.2 | D49 I50 R51 R57 | D49-S53 PolarHBondContact O-N 3.45Å; I50-S53 WeakPolarHBondContact O-CB 3.25Å; I50-S53 PolarHBondContact O-N 3.49Å; I50-S53 PolarHBondContact O-OG 3.02Å; R51-S53 VanDerWaalsContact C-N 3.29Å; R51-S53 PolarHBondContact O-N 3.04Å; S53-R57 PolarHBondContact O-NE 3.11Å |
| 54 | L | 90.1 | Very high | 82.2 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -88 | -35.6 | -178.5 | -65.2 | 177.9 | 0 | 0 | 0 | 112.8 | I50 R51 Q52 P56 R57 A62 E65 L66 F98 | I50-L54 HydrophobicContact CG2-CD1 3.76Å; I50-L54 HydrophobicContact CG2-CG 4.11Å; I50-L54 VanDerWaalsContact O-CG 3.31Å; I50-L54 WeakPolarHBondContact O-CG 3.46Å; I50-L54 PolarHBondContact O-N 3.39Å; R51-L54 PolarHBondContact O-N 3.33Å; Q52-L54 VanDerWaalsContact C-N 3.34Å; L54-P56 VanDerWaalsContact C-CD 3.45Å; L54-R57 WeakPolarHBondContact O-CB 3.46Å; L54-R57 PolarHBondContact O-N 3.47Å; L54-R57 VanDerWaalsContact O-N 3.07Å; L54-A62 HydrophobicContact CB-CB 4.48Å; L54-A62 HydrophobicContact CD2-CB 4.41Å; L54-A62 WeakPolarHBondContact CD2-O 3.49Å; L54-E65 HydrophobicContact CD2-CB 3.78Å; L54-E65 HydrophobicContact CD2-CG 3.96Å; L54-L66 HydrophobicContact CD1-CB 4Å; L54-L66 HydrophobicContact CD1-CD1 4.12Å; L54-L66 HydrophobicContact CD1-CD2 4.49Å; L54-L66 HydrophobicContact CD1-CG 4.43Å; L54-F98 HydrophobicContact CB-CD1 4.09Å; L54-F98 HydrophobicContact CB-CD2 4.44Å; L54-F98 HydrophobicContact CB-CE1 3.64Å; L54-F98 HydrophobicContact CB-CE2 4.04Å; L54-F98 HydrophobicContact CB-CG 4.47Å; L54-F98 HydrophobicContact CB-CZ 3.61Å; L54-F98 HydrophobicContact CD1-CD2 3.83Å; L54-F98 HydrophobicContact CD1-CE2 3.97Å; L54-F98 HydrophobicContact CD1-CG 4.17Å; L54-F98 HydrophobicContact CD1-CZ 4.41Å |
| 55 | L | 87.7 | Confident | 84.7 | Confident | 70 Ų | 70 | 56 Ų | 56 | 37% | 0.366 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.2 | -45.2 | -179.9 | -81.2 | 168.6 | 0 | 0 | 0 | 115.7 | R51 R57 F98 | R51-L55 WeakPolarHBondContact O-CG 3.32Å; R51-L55 PolarHBondContact O-N 3.17Å; R51-L55 VanDerWaalsContact O-N 3.12Å; L55-R57 PolarHBondContact O-N 3.4Å; L55-F98 HydrophobicContact CD2-CZ 4.37Å; L55-F98 HydrophobicContact CG-CZ 4.37Å |
| 56 | P | 90.9 | Very high | 86.7 | Confident | 108 Ų | 108 | 53.5 Ų | 53.5 | 70% | 0.701 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | -7.1 | -177.4 | 30.5 | -35.9 | 0 | 0 | 0 | 113.8 | Q52 L54 | Q52-P56 WeakPolarHBondContact O-CD 3.27Å; L54-P56 VanDerWaalsContact C-CD 3.45Å |
| 57 | R | 90.1 | Very high | 88.6 | Confident | 91 Ų | 91 | 50.8 Ų | 50.8 | 34% | 0.343 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -84.1 | 158.1 | -174.7 | -62.8 | 179.1 | 177.2 | -127.6 | 8.1 | 111.6 | S53 L54 L55 A62 E65 | S53-R57 PolarHBondContact O-NE 3.11Å; L54-R57 WeakPolarHBondContact O-CB 3.46Å; L54-R57 PolarHBondContact O-N 3.47Å; L54-R57 VanDerWaalsContact O-N 3.07Å; L55-R57 PolarHBondContact O-N 3.4Å; R57-A62 HydrophobicContact CB-CB 4.08Å; R57-E65 IonicContact CZ-OE2 3.35Å; R57-E65 VanDerWaalsContact CZ-OE2 3.26Å; R57-E65 IonicContact NH1-OE2 2.74Å; R57-E65 PolarHBondContact NH1-OE2 3.14Å; R57-E65 IonicContact NH2-OE2 3.98Å; R57-E65 PolarHBondContact NH2-OE2 3.43Å; R57-E65 VanDerWaalsContact NH2-OE2 3.1Å |
| 58 | D | 91.3 | Very high | 90.1 | Very high | 85 Ų | 85 | 54.6 Ų | 54.6 | 46% | 0.455 | 29% | 0.285 | S | S | . | . | trans | -65.1 | 160.9 | 163.4 | 73.2 | 87.1 | 0 | 0 | 0 | 110.4 | L60 S61 A62 | D58-L60 VanDerWaalsContact C-N 3.33Å; D58-L60 PolarHBondContact O-N 3.33Å; D58-L60 PolarHBondContact OD1-N 2.66Å; D58-S61 PolarHBondContact O-N 3.1Å; D58-S61 PolarHBondContact OD1-N 3.33Å; D58-S61 PolarHBondContact OD1-OG 2.84Å; D58-S61 WeakPolarHBondContact OD2-CB 3.5Å; D58-S61 PolarHBondContact OD2-OG 2.89Å; D58-A62 WeakPolarHBondContact O-CB 3.47Å; D58-A62 PolarHBondContact O-N 3.21Å | ||
| 59 | V | 90.8 | Very high | 91.7 | Very high | 15 Ų | 15 | 53.7 Ų | 53.7 | 9% | 0.091 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.6 | -44 | -172.3 | 169.9 | 0 | 0 | 0 | 0 | 112.6 | A63 H101 R111 M113 | V59-A63 WeakPolarHBondContact O-CB 3.34Å; V59-A63 PolarHBondContact O-N 3.48Å; V59-H101 WeakPolarHBondContact CG1-NE2 3.37Å; V59-R111 HydrophobicContact CG2-CG 4.38Å; V59-M113 HydrophobicContact CG1-CE 3.92Å; V59-M113 HydrophobicContact CG1-CG 3.89Å; V59-M113 HydrophobicContact CG1-SD 3.91Å |
| 60 | L | 94.6 | Very high | 92.4 | Very high | 23 Ų | 23 | 49.2 Ų | 49.2 | 12% | 0.12 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -76.3 | -40.3 | -175.4 | -63.6 | 176.3 | 0 | 0 | 0 | 111.5 | D58 A62 A63 K64 M113 Q117 Q120 L121 I124 | D58-L60 VanDerWaalsContact C-N 3.33Å; D58-L60 PolarHBondContact O-N 3.33Å; D58-L60 PolarHBondContact OD1-N 2.66Å; L60-A62 VanDerWaalsContact C-N 3.31Å; L60-A62 PolarHBondContact O-N 3.29Å; L60-A63 PolarHBondContact O-N 2.77Å; L60-K64 WeakPolarHBondContact O-CB 3.49Å; L60-K64 PolarHBondContact O-N 3.37Å; L60-M113 HydrophobicContact CD2-CE 3.54Å; L60-Q117 HydrophobicContact CD1-CB 4.45Å; L60-Q117 HydrophobicContact CD1-CG 4.27Å; L60-Q117 HydrophobicContact CD2-CB 4.37Å; L60-Q117 WeakPolarHBondContact CD2-O 3.43Å; L60-Q120 HydrophobicContact CD1-CB 3.82Å; L60-Q120 HydrophobicContact CD1-CG 4.49Å; L60-Q120 HydrophobicContact CD2-CB 4.33Å; L60-L121 HydrophobicContact CD2-CB 3.98Å; L60-I124 HydrophobicContact CB-CD1 4.32Å |
| 61 | S | 94.5 | Very high | 92.8 | Very high | 48 Ų | 48 | 50.5 Ų | 50.5 | 34% | 0.336 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.2 | -37.3 | 174.3 | -63.4 | 0 | 0 | 0 | 0 | 112 | D58 E65 | D58-S61 PolarHBondContact O-N 3.1Å; D58-S61 PolarHBondContact OD1-N 3.33Å; D58-S61 PolarHBondContact OD1-OG 2.84Å; D58-S61 WeakPolarHBondContact OD2-CB 3.5Å; D58-S61 PolarHBondContact OD2-OG 2.89Å; S61-E65 VanDerWaalsContact O-CB 3.32Å; S61-E65 WeakPolarHBondContact O-CB 3.43Å; S61-E65 PolarHBondContact O-N 3.23Å |
| 62 | A | 94.2 | Very high | 92.9 | Very high | 2 Ų | 2 | 48.3 Ų | 48.3 | 2% | 0.017 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.4 | -48 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L54 R57 D58 L60 K64 E65 L66 F98 | L54-A62 HydrophobicContact CB-CB 4.48Å; L54-A62 HydrophobicContact CD2-CB 4.41Å; L54-A62 WeakPolarHBondContact CD2-O 3.49Å; R57-A62 HydrophobicContact CB-CB 4.08Å; D58-A62 WeakPolarHBondContact O-CB 3.47Å; D58-A62 PolarHBondContact O-N 3.21Å; L60-A62 VanDerWaalsContact C-N 3.31Å; L60-A62 PolarHBondContact O-N 3.29Å; A62-K64 PolarHBondContact O-N 2.88Å; A62-E65 PolarHBondContact O-N 3.38Å; A62-L66 WeakPolarHBondContact O-CB 3.32Å; A62-L66 PolarHBondContact O-N 3.5Å; A62-F98 HydrophobicContact CB-CD1 3.92Å |
| 63 | A | 95.2 | Very high | 93.1 | Very high | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.008 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.3 | -44.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | V59 L60 L66 L67 I99 L121 | V59-A63 WeakPolarHBondContact O-CB 3.34Å; V59-A63 PolarHBondContact O-N 3.48Å; L60-A63 PolarHBondContact O-N 2.77Å; A63-L66 PolarHBondContact O-N 3.34Å; A63-L67 WeakPolarHBondContact O-CG 3.46Å; A63-L67 PolarHBondContact O-N 3.46Å; A63-I99 HydrophobicContact CB-CG1 4.42Å; A63-L121 HydrophobicContact CB-CD1 3.63Å |
| 64 | K | 96.1 | Very high | 93.1 | Very high | 135 Ų | 135 | 43.8 Ų | 43.8 | 59% | 0.587 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -61 | -46.3 | 177.1 | -174.8 | 176.8 | 179.6 | 177.3 | 0 | 112.2 | L60 A62 L67 Y68 I124 | L60-K64 WeakPolarHBondContact O-CB 3.49Å; L60-K64 PolarHBondContact O-N 3.37Å; A62-K64 PolarHBondContact O-N 2.88Å; K64-L67 PolarHBondContact O-N 3.48Å; K64-Y68 PolarHBondContact O-N 3.23Å; K64-I124 HydrophobicContact CB-CG2 4.07Å; K64-I124 HydrophobicContact CG-CG2 4.12Å |
| 65 | E | 95.1 | Very high | 93.2 | Very high | 48 Ų | 48 | 44.6 Ų | 44.6 | 22% | 0.224 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.3 | -40.6 | 178.2 | -168.4 | 74.5 | -130 | 0 | 0 | 111.3 | L54 R57 S61 A62 Y68 H69 | L54-E65 HydrophobicContact CD2-CB 3.78Å; L54-E65 HydrophobicContact CD2-CG 3.96Å; R57-E65 IonicContact CZ-OE2 3.35Å; R57-E65 VanDerWaalsContact CZ-OE2 3.26Å; R57-E65 IonicContact NH1-OE2 2.74Å; R57-E65 PolarHBondContact NH1-OE2 3.14Å; R57-E65 IonicContact NH2-OE2 3.98Å; R57-E65 PolarHBondContact NH2-OE2 3.43Å; R57-E65 VanDerWaalsContact NH2-OE2 3.1Å; S61-E65 VanDerWaalsContact O-CB 3.32Å; S61-E65 WeakPolarHBondContact O-CB 3.43Å; S61-E65 PolarHBondContact O-N 3.23Å; A62-E65 PolarHBondContact O-N 3.38Å; E65-Y68 WeakPolarHBondContact O-CB 3.3Å; E65-Y68 PolarHBondContact O-N 2.93Å; E65-H69 PolarHBondContact O-CD2 3.46Å; E65-H69 VanDerWaalsContact O-CD2 3.23Å; E65-H69 PolarHBondContact O-N 3.04Å; E65-H69 IonicContact OE1-CD2 3.26Å; E65-H69 IonicContact OE1-NE2 2.77Å; E65-H69 PolarHBondContact OE1-NE2 2.79Å |
| 66 | L | 95.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 45.2 Ų | 45.2 | 1% | 0.01 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.4 | -43.8 | 176.2 | 179.5 | 58.1 | 0 | 0 | 0 | 111.9 | L54 A62 A63 Y68 H69 L70 L94 F98 I99 | L54-L66 HydrophobicContact CD1-CB 4Å; L54-L66 HydrophobicContact CD1-CD1 4.12Å; L54-L66 HydrophobicContact CD1-CD2 4.49Å; L54-L66 HydrophobicContact CD1-CG 4.43Å; A62-L66 WeakPolarHBondContact O-CB 3.32Å; A62-L66 PolarHBondContact O-N 3.5Å; A63-L66 PolarHBondContact O-N 3.34Å; L66-Y68 VanDerWaalsContact C-N 3.3Å; L66-Y68 PolarHBondContact O-N 3.42Å; L66-H69 PolarHBondContact O-N 3.31Å; L66-L70 VanDerWaalsContact O-CB 3.32Å; L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 2.93Å; L66-L94 HydrophobicContact CD1-CB 4.01Å; L66-L94 HydrophobicContact CD1-CD1 4.29Å; L66-L94 HydrophobicContact CD2-CB 4.03Å; L66-L94 WeakPolarHBondContact CD2-O 3.31Å; L66-F98 HydrophobicContact CD2-CB 3.84Å; L66-F98 HydrophobicContact CD2-CD2 4.5Å; L66-I99 HydrophobicContact CD2-CD1 4.05Å; L66-I99 HydrophobicContact CD2-CG1 4.07Å; L66-I99 HydrophobicContact CG-CD1 4.41Å |
| 67 | L | 96.4 | Very high | 93.1 | Very high | 2 Ų | 2 | 41.4 Ų | 41.4 | 1% | 0.01 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.2 | -39.7 | 175.6 | -73.1 | 170.3 | 0 | 0 | 0 | 111.8 | A63 K64 L70 D71 I99 I124 M125 L145 | A63-L67 WeakPolarHBondContact O-CG 3.46Å; A63-L67 PolarHBondContact O-N 3.46Å; K64-L67 PolarHBondContact O-N 3.48Å; L67-L70 PolarHBondContact O-N 3.47Å; L67-D71 PolarHBondContact O-N 3.04Å; L67-I99 HydrophobicContact CD2-CD1 3.81Å; L67-I99 HydrophobicContact CG-CD1 4.07Å; L67-I124 HydrophobicContact CD1-CG2 4.06Å; L67-M125 HydrophobicContact CD1-CG 3.92Å; L67-L145 HydrophobicContact CD2-CD1 4.21Å; L67-L145 HydrophobicContact CD2-CD2 4.21Å |
| 68 | Y | 95.2 | Very high | 93 | Very high | 119 Ų | 119 | 38.8 Ų | 38.8 | 47% | 0.467 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -63.8 | -45.5 | 175.1 | 177.5 | -106 | 0 | 0 | 0 | 112.3 | K64 E65 L66 L70 D71 I72 | K64-Y68 PolarHBondContact O-N 3.23Å; E65-Y68 WeakPolarHBondContact O-CB 3.3Å; E65-Y68 PolarHBondContact O-N 2.93Å; L66-Y68 VanDerWaalsContact C-N 3.3Å; L66-Y68 PolarHBondContact O-N 3.42Å; Y68-L70 VanDerWaalsContact C-N 3.35Å; Y68-L70 PolarHBondContact O-N 3.4Å; Y68-D71 WeakPolarHBondContact O-CB 3.48Å; Y68-D71 PolarHBondContact O-N 2.68Å; Y68-I72 HydrophobicContact CD1-CD1 3.97Å; Y68-I72 HydrophobicContact CE1-CD1 3.4Å; Y68-I72 VanDerWaalsContact CE1-CD1 3.4Å; Y68-I72 HydrophobicContact CE2-CD1 4.17Å; Y68-I72 WeakPolarHBondContact O-CG1 3.35Å; Y68-I72 PolarHBondContact O-N 3.26Å; Y68-I72 VanDerWaalsContact O-N 3.14Å |
| 69 | H | 93.9 | Very high | 92.8 | Very high | 32 Ų | 32 | 41.1 Ų | 41.1 | 15% | 0.148 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65 | -38.4 | 175.2 | -77.8 | -58.9 | 0 | 0 | 0 | 112.8 | I50 E65 L66 D71 I72 Y73 | I50-H69 HydrophobicContact CD1-CB 4.24Å; E65-H69 PolarHBondContact O-CD2 3.46Å; E65-H69 VanDerWaalsContact O-CD2 3.23Å; E65-H69 PolarHBondContact O-N 3.04Å; E65-H69 IonicContact OE1-CD2 3.26Å; E65-H69 IonicContact OE1-NE2 2.77Å; E65-H69 PolarHBondContact OE1-NE2 2.79Å; L66-H69 PolarHBondContact O-N 3.31Å; H69-D71 VanDerWaalsContact C-N 3.32Å; H69-I72 PolarHBondContact O-N 3.46Å; H69-Y73 VanDerWaalsContact O-CB 3.27Å; H69-Y73 WeakPolarHBondContact O-CB 3.48Å; H69-Y73 PolarHBondContact O-N 3.29Å |
| 70 | L | 94.2 | Very high | 92.4 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 2% | 0.016 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.1 | -43.1 | 175.5 | -177.6 | 65.1 | 0 | 0 | 0 | 111 | L66 L67 Y68 Y73 I74 T91 I95 M141 A144 | L66-L70 VanDerWaalsContact O-CB 3.32Å; L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 2.93Å; L67-L70 PolarHBondContact O-N 3.47Å; Y68-L70 VanDerWaalsContact C-N 3.35Å; Y68-L70 PolarHBondContact O-N 3.4Å; L70-Y73 PolarHBondContact O-N 2.91Å; L70-I74 HydrophobicContact CD1-CD1 3.79Å; L70-I74 HydrophobicContact CD1-CG1 4.21Å; L70-I74 HydrophobicContact CG-CD1 3.88Å; L70-I74 WeakPolarHBondContact O-CB 3.45Å; L70-I74 WeakPolarHBondContact O-CG1 3.48Å; L70-I74 PolarHBondContact O-N 2.62Å; L70-T91 HydrophobicContact CD1-CG2 3.7Å; L70-I95 HydrophobicContact CD2-CD1 4.13Å; L70-M141 HydrophobicContact CG-CG 4.48Å; L70-A144 HydrophobicContact CD1-CB 4.43Å; L70-A144 HydrophobicContact CD2-CB 4.4Å |
| 71 | D | 94.1 | Very high | 91.3 | Very high | 33 Ų | 33 | 45.9 Ų | 45.9 | 18% | 0.176 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.5 | -49.2 | 176.1 | -174.9 | 64.3 | 0 | 0 | 0 | 112.1 | L67 Y68 H69 Y73 I74 C75 Q132 V137 M141 | L67-D71 PolarHBondContact O-N 3.04Å; Y68-D71 WeakPolarHBondContact O-CB 3.48Å; Y68-D71 PolarHBondContact O-N 2.68Å; H69-D71 VanDerWaalsContact C-N 3.32Å; D71-Y73 PolarHBondContact O-N 3.29Å; D71-I74 PolarHBondContact O-N 2.82Å; D71-C75 VanDerWaalsContact O-CB 3.25Å; D71-C75 WeakPolarHBondContact O-CB 3.33Å; D71-C75 PolarHBondContact O-N 3.44Å; D71-C75 PolarHBondContact O-SG 3.03Å; D71-Q132 PolarHBondContact OD1-NE2 3.39Å; D71-Q132 PolarHBondContact OD2-NE2 2.98Å; D71-V137 WeakPolarHBondContact OD1-CG1 3.32Å; D71-M141 HydrophobicContact CB-CE 3.94Å; D71-M141 HydrophobicContact CB-SD 4.05Å; D71-M141 VanDerWaalsContact OD1-SD 3.35Å |
| 72 | I | 92.6 | Very high | 89.5 | Confident | 33 Ų | 33 | 53.8 Ų | 53.8 | 17% | 0.169 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 176.7 | -67.8 | 171.6 | 0 | 0 | 0 | 110.7 | F43 Y68 H69 I74 C75 N76 | F43-I72 HydrophobicContact CD1-CD1 4.05Å; F43-I72 HydrophobicContact CE1-CD1 3.93Å; Y68-I72 HydrophobicContact CD1-CD1 3.97Å; Y68-I72 HydrophobicContact CE1-CD1 3.4Å; Y68-I72 VanDerWaalsContact CE1-CD1 3.4Å; Y68-I72 HydrophobicContact CE2-CD1 4.17Å; Y68-I72 WeakPolarHBondContact O-CG1 3.35Å; Y68-I72 PolarHBondContact O-N 3.26Å; Y68-I72 VanDerWaalsContact O-N 3.14Å; H69-I72 PolarHBondContact O-N 3.46Å; I72-I74 PolarHBondContact O-N 2.92Å; I72-C75 PolarHBondContact O-N 3.29Å; I72-N76 WeakPolarHBondContact O-CB 3.28Å; I72-N76 VanDerWaalsContact O-CG 3.24Å; I72-N76 PolarHBondContact O-N 3.42Å; I72-N76 PolarHBondContact O-ND2 3.48Å |
| 73 | Y | 90.8 | Very high | 87.8 | Confident | 69 Ų | 69 | 62 Ų | 62 | 27% | 0.271 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -57.8 | -50.1 | -179.6 | 172.2 | -100.4 | 0 | 0 | 0 | 111.1 | H69 L70 D71 N76 M77 V87 D88 | H69-Y73 VanDerWaalsContact O-CB 3.27Å; H69-Y73 WeakPolarHBondContact O-CB 3.48Å; H69-Y73 PolarHBondContact O-N 3.29Å; L70-Y73 PolarHBondContact O-N 2.91Å; D71-Y73 PolarHBondContact O-N 3.29Å; Y73-N76 PolarHBondContact O-N 3.49Å; Y73-M77 WeakPolarHBondContact O-CB 3.32Å; Y73-M77 PolarHBondContact O-N 3.21Å; Y73-V87 HydrophobicContact CE1-CG1 4.27Å; Y73-V87 HydrophobicContact CE1-CG2 4.35Å; Y73-D88 PolarHBondContact OH-OD1 3.19Å |
| 74 | I | 92.1 | Very high | 86.2 | Confident | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -67.9 | -40.2 | 179.6 | -67.2 | 175.6 | 0 | 0 | 0 | 111 | L70 D71 I72 N76 M77 V78 V87 V137 L140 M141 | L70-I74 HydrophobicContact CD1-CD1 3.79Å; L70-I74 HydrophobicContact CD1-CG1 4.21Å; L70-I74 HydrophobicContact CG-CD1 3.88Å; L70-I74 WeakPolarHBondContact O-CB 3.45Å; L70-I74 WeakPolarHBondContact O-CG1 3.48Å; L70-I74 PolarHBondContact O-N 2.62Å; D71-I74 PolarHBondContact O-N 2.82Å; I72-I74 PolarHBondContact O-N 2.92Å; I74-N76 VanDerWaalsContact C-N 3.3Å; I74-N76 PolarHBondContact O-N 3.1Å; I74-M77 HydrophobicContact CB-CE 4.26Å; I74-M77 HydrophobicContact CG1-CE 3.97Å; I74-M77 HydrophobicContact CG2-CE 4.09Å; I74-M77 PolarHBondContact O-N 3.05Å; I74-V78 HydrophobicContact CG2-CG2 4.2Å; I74-V78 WeakPolarHBondContact O-CG2 3.43Å; I74-V78 PolarHBondContact O-N 3.08Å; I74-V87 HydrophobicContact CD1-CG2 4.12Å; I74-V87 HydrophobicContact CG1-CG2 4.23Å; I74-V137 HydrophobicContact CB-CG1 4.29Å; I74-V137 HydrophobicContact CG2-CB 4.3Å; I74-V137 HydrophobicContact CG2-CG1 3.82Å; I74-V137 HydrophobicContact CG2-CG2 4.4Å; I74-L140 HydrophobicContact CD1-CB 4.14Å; I74-L140 HydrophobicContact CG2-CB 3.65Å; I74-L140 HydrophobicContact CG2-CD1 3.78Å; I74-L140 HydrophobicContact CG2-CG 4.39Å; I74-M141 HydrophobicContact CD1-CB 4.25Å; I74-M141 HydrophobicContact CD1-CG 3.59Å |
| 75 | C | 91.9 | Very high | 84.9 | Confident | 18 Ų | 18 | 62.5 Ų | 62.5 | 12% | 0.122 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -55.5 | -47.2 | 175.2 | -83.6 | 0 | 0 | 0 | 0 | 111.9 | D71 I72 V78 Q79 R134 | D71-C75 VanDerWaalsContact O-CB 3.25Å; D71-C75 WeakPolarHBondContact O-CB 3.33Å; D71-C75 PolarHBondContact O-N 3.44Å; D71-C75 PolarHBondContact O-SG 3.03Å; I72-C75 PolarHBondContact O-N 3.29Å; C75-V78 PolarHBondContact O-N 3.05Å; C75-Q79 VanDerWaalsContact O-CG 3.25Å; C75-Q79 WeakPolarHBondContact O-CG 3.31Å; C75-Q79 PolarHBondContact O-N 2.97Å; C75-Q79 VanDerWaalsContact O-N 3.07Å; C75-R134 PolarHBondContact O-NH1 3.38Å |
| 76 | N | 90.1 | Very high | 84 | Confident | 83 Ų | 83 | 68 Ų | 68 | 44% | 0.444 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.3 | -42.9 | 177.6 | -70.2 | -25.6 | 0 | 0 | 0 | 111.6 | I72 Y73 I74 V78 Q79 S80 | I72-N76 WeakPolarHBondContact O-CB 3.28Å; I72-N76 VanDerWaalsContact O-CG 3.24Å; I72-N76 PolarHBondContact O-N 3.42Å; I72-N76 PolarHBondContact O-ND2 3.48Å; Y73-N76 PolarHBondContact O-N 3.49Å; I74-N76 VanDerWaalsContact C-N 3.3Å; I74-N76 PolarHBondContact O-N 3.1Å; N76-V78 PolarHBondContact O-N 2.86Å; N76-Q79 PolarHBondContact O-N 2.92Å; N76-S80 WeakPolarHBondContact O-CB 3.45Å; N76-S80 PolarHBondContact O-N 2.85Å |
| 77 | M | 86.9 | Confident | 83.5 | Confident | 27 Ų | 27 | 69 Ų | 69 | 13% | 0.133 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58.2 | -49.6 | 176.7 | -178.7 | -179.3 | 48.6 | 0 | 0 | 111.1 | Y73 I74 Q79 S80 P85 V87 L140 | Y73-M77 WeakPolarHBondContact O-CB 3.32Å; Y73-M77 PolarHBondContact O-N 3.21Å; I74-M77 HydrophobicContact CB-CE 4.26Å; I74-M77 HydrophobicContact CG1-CE 3.97Å; I74-M77 HydrophobicContact CG2-CE 4.09Å; I74-M77 PolarHBondContact O-N 3.05Å; M77-Q79 VanDerWaalsContact C-N 3.32Å; M77-Q79 PolarHBondContact O-N 3.4Å; M77-S80 PolarHBondContact O-N 3.3Å; M77-S80 VanDerWaalsContact O-N 3.17Å; M77-S80 PolarHBondContact O-OG 2.93Å; M77-P85 HydrophobicContact CE-CB 3.42Å; M77-P85 VanDerWaalsContact CE-CB 3.42Å; M77-P85 HydrophobicContact CG-CB 3.8Å; M77-P85 WeakPolarHBondContact SD-CA 3.46Å; M77-P85 HydrophobicContact SD-CB 3.46Å; M77-P85 WeakPolarHBondContact SD-CB 3.4Å; M77-V87 HydrophobicContact CE-CG2 4.39Å; M77-L140 HydrophobicContact CE-CD1 4.27Å |
| 78 | V | 87.9 | Confident | 83.1 | Confident | 36 Ų | 36 | 71.5 Ų | 71.5 | 22% | 0.218 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.9 | -36.9 | 178.9 | 179.5 | 0 | 0 | 0 | 0 | 111.6 | I74 C75 N76 S80 T136 V137 L140 | I74-V78 HydrophobicContact CG2-CG2 4.2Å; I74-V78 WeakPolarHBondContact O-CG2 3.43Å; I74-V78 PolarHBondContact O-N 3.08Å; C75-V78 PolarHBondContact O-N 3.05Å; N76-V78 PolarHBondContact O-N 2.86Å; V78-S80 VanDerWaalsContact C-N 3.32Å; V78-S80 PolarHBondContact O-N 3.38Å; V78-T136 HydrophobicContact CG1-CG2 4.4Å; V78-T136 HydrophobicContact CG2-CG2 4.37Å; V78-V137 HydrophobicContact CG2-CG2 4.39Å; V78-L140 HydrophobicContact CG2-CD1 3.49Å; V78-L140 VanDerWaalsContact CG2-CD1 3.49Å |
| 79 | Q | 86.5 | Confident | 82.7 | Confident | 135 Ų | 135 | 69.7 Ų | 69.7 | 63% | 0.631 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -68.8 | -29.4 | 176.7 | -72.9 | 171.3 | 22.4 | 0 | 0 | 113 | C75 N76 M77 G81 | C75-Q79 VanDerWaalsContact O-CG 3.25Å; C75-Q79 WeakPolarHBondContact O-CG 3.31Å; C75-Q79 PolarHBondContact O-N 2.97Å; C75-Q79 VanDerWaalsContact O-N 3.07Å; N76-Q79 PolarHBondContact O-N 2.92Å; M77-Q79 VanDerWaalsContact C-N 3.32Å; M77-Q79 PolarHBondContact O-N 3.4Å; Q79-G81 VanDerWaalsContact C-N 3.3Å; Q79-G81 PolarHBondContact O-N 2.93Å |
| 80 | S | 82.9 | Confident | 82.5 | Confident | 70 Ų | 70 | 74.9 Ų | 74.9 | 49% | 0.49 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -73.2 | -18.2 | -177.6 | 75.5 | 0 | 0 | 0 | 0 | 114.2 | N76 M77 V78 R82 | N76-S80 WeakPolarHBondContact O-CB 3.45Å; N76-S80 PolarHBondContact O-N 2.85Å; M77-S80 PolarHBondContact O-N 3.3Å; M77-S80 VanDerWaalsContact O-N 3.17Å; M77-S80 PolarHBondContact O-OG 2.93Å; V78-S80 VanDerWaalsContact C-N 3.32Å; V78-S80 PolarHBondContact O-N 3.38Å; S80-R82 PolarHBondContact O-N 3.35Å |
| 81 | G | 70.8 | Confident | 82.3 | Confident | 68 Ų | 68 | 75 Ų | 75 | 70% | 0.701 | 40% | 0.397 | S | S | * | . | trans | 63.1 | 8.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | Q79 | Q79-G81 VanDerWaalsContact C-N 3.3Å; Q79-G81 PolarHBondContact O-N 2.93Å | ||
| 82 | R | 57 | Low | 82.1 | Confident | 213 Ų | 213 | 74.8 Ų | 74.8 | 80% | 0.804 | 40% | 0.396 | S | S | * | . | trans | -94.8 | 117.1 | -179.4 | -72.6 | -178.1 | 176.8 | 179.2 | -1.4 | 110 | S80 | S80-R82 PolarHBondContact O-N 3.35Š| ||
| 83 | Q | 57.9 | Low | 82 | Confident | 175 Ų | 175 | 76.3 Ų | 76.3 | 82% | 0.818 | 40% | 0.404 | S | S | * | . | S | Bend | trans | 65 | 163.3 | 174.5 | -72.8 | 178 | -23.1 | 0 | 0 | 114.9 | P85 | Q83-P85 WeakPolarHBondContact O-CD 3.19Š|
| 84 | P | 62.3 | Low | 82.1 | Confident | 102 Ų | 102 | 73.4 Ų | 73.4 | 66% | 0.662 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -55.2 | 124.8 | 168.3 | 22 | -32.7 | 0 | 0 | 0 | 108.6 | Q86 | P84-Q86 PolarHBondContact O-N 2.9Š|
| 85 | P | 68.1 | Low | 82.2 | Confident | 45 Ų | 45 | 73.4 Ų | 73.4 | 29% | 0.292 | 39% | 0.393 | S | S | . | . | trans | -64.9 | 104.4 | -176 | 21.3 | -29.8 | 0 | 0 | 0 | 109.8 | M77 Q83 L140 | M77-P85 HydrophobicContact CE-CB 3.42Å; M77-P85 VanDerWaalsContact CE-CB 3.42Å; M77-P85 HydrophobicContact CG-CB 3.8Å; M77-P85 WeakPolarHBondContact SD-CA 3.46Å; M77-P85 HydrophobicContact SD-CB 3.46Å; M77-P85 WeakPolarHBondContact SD-CB 3.4Å; Q83-P85 WeakPolarHBondContact O-CD 3.19Å; P85-L140 HydrophobicContact CB-CD1 3.73Å; P85-L140 HydrophobicContact CB-CD2 4.21Å; P85-L140 HydrophobicContact CG-CD1 3.56Å; P85-L140 HydrophobicContact CG-CD2 3.92Å; P85-L140 HydrophobicContact CG-CG 4.37Å; P85-L140 WeakPolarHBondContact O-CD2 3.24Å | ||
| 86 | Q | 77.2 | Confident | 82.2 | Confident | 162 Ų | 162 | 74.1 Ų | 74.1 | 76% | 0.757 | 40% | 0.395 | S | S | * | . | trans | -113.5 | 132.8 | 172.1 | -72.4 | -166.3 | -22.2 | 0 | 0 | 109.4 | P84 | P84-Q86 PolarHBondContact O-N 2.9Š| ||
| 87 | V | 84.6 | Confident | 82.2 | Confident | 25 Ų | 25 | 72 Ų | 72 | 15% | 0.152 | 38% | 0.382 | C | S | . | . | trans | -74.5 | 134.2 | 175.9 | 178.5 | 0 | 0 | 0 | 0 | 108.8 | Y73 I74 M77 T91 L92 A144 | Y73-V87 HydrophobicContact CE1-CG1 4.27Å; Y73-V87 HydrophobicContact CE1-CG2 4.35Å; I74-V87 HydrophobicContact CD1-CG2 4.12Å; I74-V87 HydrophobicContact CG1-CG2 4.23Å; M77-V87 HydrophobicContact CE-CG2 4.39Å; V87-T91 HydrophobicContact CG1-CG2 3.51Å; V87-L92 HydrophobicContact CG1-CD2 4.17Å; V87-L92 HydrophobicContact CG1-CG 4.45Å; V87-A144 HydrophobicContact CB-CB 4.32Å; V87-A144 HydrophobicContact CG1-CB 4.41Å; V87-A144 HydrophobicContact CG2-CB 3.89Å | ||
| 88 | D | 87.3 | Confident | 82.4 | Confident | 53 Ų | 53 | 71.5 Ų | 71.5 | 28% | 0.283 | 38% | 0.379 | S | S | . | . | trans | -73.2 | 154.1 | -176.8 | 72.1 | -45.9 | 0 | 0 | 0 | 112.5 | Y73 K90 T91 L92 | Y73-D88 PolarHBondContact OH-OD1 3.19Å; D88-K90 PolarHBondContact O-N 3.23Å; D88-K90 VanDerWaalsContact O-N 3.13Å; D88-T91 PolarHBondContact O-N 3.04Å; D88-T91 VanDerWaalsContact OD1-CB 3.24Å; D88-T91 WeakPolarHBondContact OD1-CB 3.24Å; D88-T91 PolarHBondContact OD1-OG1 3.2Å; D88-L92 PolarHBondContact O-N 3.4Å | ||
| 89 | S | 87.8 | Confident | 82.7 | Confident | 81 Ų | 81 | 70 Ų | 70 | 57% | 0.566 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -55 | -35.7 | -177.2 | -168.3 | 0 | 0 | 0 | 0 | 113.1 | T91 L92 D93 | S89-T91 VanDerWaalsContact C-N 3.29Å; S89-T91 PolarHBondContact O-N 3.43Å; S89-L92 WeakPolarHBondContact O-CB 3.33Å; S89-L92 PolarHBondContact O-N 3.25Å; S89-L92 VanDerWaalsContact O-N 3.17Å; S89-D93 PolarHBondContact O-N 2.94Å |
| 90 | K | 88.8 | Confident | 82.9 | Confident | 142 Ų | 142 | 64.2 Ų | 64.2 | 62% | 0.617 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -64.6 | -36.2 | -179.6 | -63.3 | 179.8 | 179.7 | 177.5 | 0 | 111.9 | D88 L94 | D88-K90 PolarHBondContact O-N 3.23Å; D88-K90 VanDerWaalsContact O-N 3.13Å; K90-L94 WeakPolarHBondContact O-CG 3.21Å; K90-L94 PolarHBondContact O-N 2.59Å |
| 91 | T | 90.3 | Very high | 83.1 | Confident | 4 Ų | 4 | 62.3 Ų | 62.3 | 3% | 0.025 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.1 | -38.1 | 175.9 | -60.5 | 0 | 0 | 0 | 0 | 110.7 | L70 V87 D88 S89 D93 L94 I95 | L70-T91 HydrophobicContact CD1-CG2 3.7Å; V87-T91 HydrophobicContact CG1-CG2 3.51Å; D88-T91 PolarHBondContact O-N 3.04Å; D88-T91 VanDerWaalsContact OD1-CB 3.24Å; D88-T91 WeakPolarHBondContact OD1-CB 3.24Å; D88-T91 PolarHBondContact OD1-OG1 3.2Å; S89-T91 VanDerWaalsContact C-N 3.29Å; S89-T91 PolarHBondContact O-N 3.43Å; T91-D93 VanDerWaalsContact C-N 3.35Å; T91-D93 PolarHBondContact O-N 3.01Å; T91-L94 PolarHBondContact O-N 3.12Å; T91-I95 WeakPolarHBondContact O-CG1 3.43Å; T91-I95 PolarHBondContact O-N 2.83Å; T91-I95 VanDerWaalsContact O-N 3.14Å |
| 92 | L | 91.1 | Very high | 83.5 | Confident | 29 Ų | 29 | 60.2 Ų | 60.2 | 15% | 0.152 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62 | -40.8 | 173.4 | -60.4 | 179.4 | 0 | 0 | 0 | 111.8 | V87 D88 S89 L94 I95 E96 A144 | V87-L92 HydrophobicContact CG1-CD2 4.17Å; V87-L92 HydrophobicContact CG1-CG 4.45Å; D88-L92 PolarHBondContact O-N 3.4Å; S89-L92 WeakPolarHBondContact O-CB 3.33Å; S89-L92 PolarHBondContact O-N 3.25Å; S89-L92 VanDerWaalsContact O-N 3.17Å; L92-L94 PolarHBondContact O-N 3.38Å; L92-I95 HydrophobicContact CD2-CD1 4.29Å; L92-I95 WeakPolarHBondContact O-CB 3.3Å; L92-I95 PolarHBondContact O-N 2.85Å; L92-I95 VanDerWaalsContact O-N 3.1Å; L92-E96 WeakPolarHBondContact O-CG 3.47Å; L92-E96 PolarHBondContact O-N 3.44Å; L92-A144 HydrophobicContact CD2-CB 4.41Å; L92-A144 WeakPolarHBondContact CD2-O 3.35Å |
| 93 | D | 90.4 | Very high | 84 | Confident | 66 Ų | 66 | 53 Ų | 53 | 35% | 0.353 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61 | -32.2 | 176.5 | -62.6 | -22.9 | 0 | 0 | 0 | 112.5 | S89 T91 E97 | S89-D93 PolarHBondContact O-N 2.94Å; T91-D93 VanDerWaalsContact C-N 3.35Å; T91-D93 PolarHBondContact O-N 3.01Å; D93-E97 WeakPolarHBondContact O-CB 3.34Å; D93-E97 PolarHBondContact O-N 3.47Å; D93-E97 VanDerWaalsContact O-N 3.09Å |
| 94 | L | 92.2 | Very high | 84.3 | Confident | 8 Ų | 8 | 50 Ų | 50 | 4% | 0.042 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -73.3 | -38.3 | 175.1 | -65 | 175.3 | 0 | 0 | 0 | 111.8 | M47 I50 R51 L66 K90 T91 L92 E96 E97 F98 | M47-L94 HydrophobicContact CE-CD1 3.33Å; I50-L94 HydrophobicContact CG2-CD1 4.19Å; R51-L94 HydrophobicContact CB-CD2 3.74Å; R51-L94 HydrophobicContact CG-CD2 3.82Å; L66-L94 HydrophobicContact CD1-CB 4.01Å; L66-L94 HydrophobicContact CD1-CD1 4.29Å; L66-L94 HydrophobicContact CD2-CB 4.03Å; L66-L94 WeakPolarHBondContact CD2-O 3.31Å; K90-L94 WeakPolarHBondContact O-CG 3.21Å; K90-L94 PolarHBondContact O-N 2.59Å; T91-L94 PolarHBondContact O-N 3.12Å; L92-L94 PolarHBondContact O-N 3.38Å; L94-E96 VanDerWaalsContact C-N 3.3Å; L94-E97 PolarHBondContact O-N 3.03Å; L94-F98 HydrophobicContact CB-CD2 4.43Å; L94-F98 HydrophobicContact CD2-CD2 4.18Å; L94-F98 HydrophobicContact CD2-CE2 3.85Å; L94-F98 WeakPolarHBondContact O-CB 3.25Å; L94-F98 WeakPolarHBondContact O-CD2 3.38Å; L94-F98 PolarHBondContact O-N 3.33Å |
| 95 | I | 93.8 | Very high | 84.4 | Confident | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 173.9 | -68.2 | 169.9 | 0 | 0 | 0 | 109.6 | L70 T91 L92 E97 I99 L100 A144 L145 | L70-I95 HydrophobicContact CD2-CD1 4.13Å; T91-I95 WeakPolarHBondContact O-CG1 3.43Å; T91-I95 PolarHBondContact O-N 2.83Å; T91-I95 VanDerWaalsContact O-N 3.14Å; L92-I95 HydrophobicContact CD2-CD1 4.29Å; L92-I95 WeakPolarHBondContact O-CB 3.3Å; L92-I95 PolarHBondContact O-N 2.85Å; L92-I95 VanDerWaalsContact O-N 3.1Å; I95-E97 VanDerWaalsContact C-N 3.33Å; I95-E97 PolarHBondContact O-N 2.88Å; I95-I99 HydrophobicContact CG1-CD1 4.36Å; I95-I99 HydrophobicContact CG2-CB 4.36Å; I95-I99 HydrophobicContact CG2-CD1 4.37Å; I95-I99 WeakPolarHBondContact O-CA 3.41Å; I95-I99 WeakPolarHBondContact O-CB 3.32Å; I95-I99 PolarHBondContact O-N 3.36Å; I95-L100 HydrophobicContact CG2-CD1 4.18Å; I95-L100 HydrophobicContact CG2-CG 4.32Å; I95-L100 PolarHBondContact O-N 2.92Å; I95-A144 HydrophobicContact CD1-CB 3.98Å; I95-L145 HydrophobicContact CD1-CD2 4.35Å; I95-L145 HydrophobicContact CG1-CD2 4.44Å; I95-L145 HydrophobicContact CG2-CD2 3.88Å |
| 96 | E | 91.6 | Very high | 83.9 | Confident | 33 Ų | 33 | 60.4 Ų | 60.4 | 15% | 0.154 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 176.6 | -69.6 | -172.7 | 178.5 | 0 | 0 | 112.4 | L92 L94 L100 H101 T102 N151 A153 R157 | L92-E96 WeakPolarHBondContact O-CG 3.47Å; L92-E96 PolarHBondContact O-N 3.44Å; L94-E96 VanDerWaalsContact C-N 3.3Å; E96-L100 HydrophobicContact CG-CD1 4.12Å; E96-L100 CarbonylContact O-C 3.54Å; E96-H101 PolarHBondContact O-N 3.34Å; E96-T102 PolarHBondContact O-N 3.16Å; E96-N151 PolarHBondContact OE1-ND2 2.95Å; E96-A153 HydrophobicContact CG-CB 3.99Å; E96-R157 IonicContact OE1-CZ 3.04Å; E96-R157 IonicContact OE1-NH1 2.88Å; E96-R157 PolarHBondContact OE1-NH1 3.44Å; E96-R157 IonicContact OE1-NH2 3.89Å; E96-R157 PolarHBondContact OE1-NH2 2.87Å |
| 97 | E | 90.1 | Very high | 83 | Confident | 39 Ų | 39 | 60.2 Ų | 60.2 | 18% | 0.182 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -73.4 | -47.7 | -178.4 | -173.6 | 171.8 | -171.9 | 0 | 0 | 113.1 | R51 D93 L94 I95 K104 | R51-E97 IonicContact CZ-OE1 3.4Å; R51-E97 IonicContact CZ-OE2 3.65Å; R51-E97 IonicContact NE-OE1 3.81Å; R51-E97 PolarHBondContact NE-OE1 2.94Å; R51-E97 IonicContact NE-OE2 2.62Å; R51-E97 PolarHBondContact NE-OE2 2.89Å; R51-E97 IonicContact NH2-OE1 3.82Å; R51-E97 PolarHBondContact NH2-OE1 3.18Å; R51-E97 IonicContact NH2-OE2 3.77Å; D93-E97 WeakPolarHBondContact O-CB 3.34Å; D93-E97 PolarHBondContact O-N 3.47Å; D93-E97 VanDerWaalsContact O-N 3.09Å; L94-E97 PolarHBondContact O-N 3.03Å; I95-E97 VanDerWaalsContact C-N 3.33Å; I95-E97 PolarHBondContact O-N 2.88Å; E97-K104 WeakPolarHBondContact OE2-CE 3.49Å; E97-K104 IonicContact OE2-NZ 2.62Å; E97-K104 PolarHBondContact OE2-NZ 3.28Å |
| 98 | F | 92 | Very high | 81.9 | Confident | 15 Ų | 15 | 61 Ų | 61 | 7% | 0.066 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -105.5 | -16.4 | -166.9 | -66.8 | -79.2 | 0 | 0 | 0 | 115.2 | R51 L54 L55 A62 L66 L94 H101 | R51-F98 HydrophobicContact CG-CE2 4.18Å; R51-F98 HydrophobicContact CG-CZ 4.38Å; L54-F98 HydrophobicContact CB-CD1 4.09Å; L54-F98 HydrophobicContact CB-CD2 4.44Å; L54-F98 HydrophobicContact CB-CE1 3.64Å; L54-F98 HydrophobicContact CB-CE2 4.04Å; L54-F98 HydrophobicContact CB-CG 4.47Å; L54-F98 HydrophobicContact CB-CZ 3.61Å; L54-F98 HydrophobicContact CD1-CD2 3.83Å; L54-F98 HydrophobicContact CD1-CE2 3.97Å; L54-F98 HydrophobicContact CD1-CG 4.17Å; L54-F98 HydrophobicContact CD1-CZ 4.41Å; L55-F98 HydrophobicContact CD2-CZ 4.37Å; L55-F98 HydrophobicContact CG-CZ 4.37Å; A62-F98 HydrophobicContact CB-CD1 3.92Å; L66-F98 HydrophobicContact CD2-CB 3.84Å; L66-F98 HydrophobicContact CD2-CD2 4.5Å; L94-F98 HydrophobicContact CB-CD2 4.43Å; L94-F98 HydrophobicContact CD2-CD2 4.18Å; L94-F98 HydrophobicContact CD2-CE2 3.85Å; L94-F98 WeakPolarHBondContact O-CB 3.25Å; L94-F98 WeakPolarHBondContact O-CD2 3.38Å; L94-F98 PolarHBondContact O-N 3.33Å; F98-H101 PolarHBondContact O-CE1 3.31Å |
| 99 | I | 93.8 | Very high | 80.5 | Confident | 4 Ų | 4 | 64.4 Ų | 64.4 | 2% | 0.021 | 33% | 0.33 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.8 | -50.1 | 176.9 | -62.3 | 175.9 | 0 | 0 | 0 | 109.9 | A63 L66 L67 I95 H101 L145 L160 | A63-I99 HydrophobicContact CB-CG1 4.42Å; L66-I99 HydrophobicContact CD2-CD1 4.05Å; L66-I99 HydrophobicContact CD2-CG1 4.07Å; L66-I99 HydrophobicContact CG-CD1 4.41Å; L67-I99 HydrophobicContact CD2-CD1 3.81Å; L67-I99 HydrophobicContact CG-CD1 4.07Å; I95-I99 HydrophobicContact CG1-CD1 4.36Å; I95-I99 HydrophobicContact CG2-CB 4.36Å; I95-I99 HydrophobicContact CG2-CD1 4.37Å; I95-I99 WeakPolarHBondContact O-CA 3.41Å; I95-I99 WeakPolarHBondContact O-CB 3.32Å; I95-I99 PolarHBondContact O-N 3.36Å; I99-H101 PolarHBondContact O-CE1 2.89Å; I99-H101 PolarHBondContact O-ND1 3.3Å; I99-L145 HydrophobicContact CD1-CD2 3.58Å; I99-L145 HydrophobicContact CG2-CD2 4.35Å; I99-L160 HydrophobicContact CG2-CD2 3.66Å |
| 100 | L | 90.4 | Very high | 79.4 | Confident | 14 Ų | 14 | 64.1 Ų | 64.1 | 7% | 0.073 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -86.9 | -12.4 | -176.7 | -56.7 | 171.9 | 0 | 0 | 0 | 113.2 | I95 E96 T102 R157 L160 | I95-L100 HydrophobicContact CG2-CD1 4.18Å; I95-L100 HydrophobicContact CG2-CG 4.32Å; I95-L100 PolarHBondContact O-N 2.92Å; E96-L100 HydrophobicContact CG-CD1 4.12Å; E96-L100 CarbonylContact O-C 3.54Å; L100-T102 PolarHBondContact O-N 3.4Å; L100-T102 VanDerWaalsContact O-N 3.12Å; L100-R157 HydrophobicContact CD1-CG 3.41Å; L100-R157 VanDerWaalsContact CD1-CG 3.41Å; L100-R157 HydrophobicContact CD2-CG 3.96Å; L100-R157 HydrophobicContact CG-CG 4.35Å; L100-L160 HydrophobicContact CD2-CB 4.33Å; L100-L160 HydrophobicContact CD2-CD2 3.76Å |
| 101 | H | 87.2 | Confident | 78.4 | Confident | 31 Ų | 31 | 64.5 Ų | 64.5 | 14% | 0.144 | 32% | 0.322 | C | S | . | . | trans | 53.4 | 33.1 | 179.2 | -59.3 | 82 | 0 | 0 | 0 | 113.1 | V59 E96 F98 I99 M113 | V59-H101 WeakPolarHBondContact CG1-NE2 3.37Å; E96-H101 PolarHBondContact O-N 3.34Å; F98-H101 PolarHBondContact O-CE1 3.31Å; I99-H101 PolarHBondContact O-CE1 2.89Å; I99-H101 PolarHBondContact O-ND1 3.3Å; H101-M113 PolarHBondContact CE1-SD 3.37Å | ||
| 102 | T | 79.7 | Confident | 77.4 | Confident | 24 Ų | 24 | 74.6 Ų | 74.6 | 15% | 0.147 | 36% | 0.36 | C | S | . | . | trans | -74.4 | 124.3 | 179.3 | -56.5 | 0 | 0 | 0 | 0 | 108.8 | E96 L100 K104 A153 | E96-T102 PolarHBondContact O-N 3.16Å; L100-T102 PolarHBondContact O-N 3.4Å; L100-T102 VanDerWaalsContact O-N 3.12Å; T102-K104 PolarHBondContact O-N 2.98Å; T102-A153 HydrophobicContact CG2-CB 3.94Å | ||
| 103 | P | 67 | Low | 77 | Confident | 61 Ų | 61 | 74.4 Ų | 74.4 | 40% | 0.396 | 36% | 0.358 | S | S | . | . | trans | -65 | 127.1 | -179.5 | 24.8 | -32.3 | 0 | 0 | 0 | 110.5 | D105 S108 V110 | P103-D105 VanDerWaalsContact C-N 3.35Å; P103-S108 WeakPolarHBondContact CB-OG 3.48Å; P103-V110 HydrophobicContact CB-CG2 4.3Å; P103-V110 HydrophobicContact CG-CG2 4.08Å | ||
| 104 | K | 64.8 | Low | 77.1 | Confident | 113 Ų | 113 | 74 Ų | 74 | 49% | 0.491 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -70.3 | -32.6 | 176.6 | -76.5 | -175.5 | 167.5 | 177.9 | 0 | 112.5 | E97 T102 | E97-K104 WeakPolarHBondContact OE2-CE 3.49Å; E97-K104 IonicContact OE2-NZ 2.62Å; E97-K104 PolarHBondContact OE2-NZ 3.28Å; T102-K104 PolarHBondContact O-N 2.98Å |
| 105 | D | 64.1 | Low | 77 | Confident | 114 Ų | 114 | 77.4 Ų | 77.4 | 61% | 0.61 | 39% | 0.39 | S | S | * | . | S | Bend | trans | -123.8 | 143.3 | 178 | -75.1 | -46.4 | 0 | 0 | 0 | 111.4 | P103 N107 S108 | P103-D105 VanDerWaalsContact C-N 3.35Å; D105-N107 PolarHBondContact O-N 3.43Å; D105-S108 PolarHBondContact N-OG 3.06Å; D105-S108 PolarHBondContact O-N 3.13Å; D105-S108 PolarHBondContact O-OG 3.27Å |
| 106 | R | 58.7 | Low | 77 | Confident | 251 Ų | 251 | 82.8 Ų | 82.8 | 95% | 0.947 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -20.8 | 177.8 | -157.7 | 172.3 | 169.9 | -175.8 | -3.9 | 113.4 | ||
| 107 | N | 57 | Low | 77.2 | Confident | 158 Ų | 158 | 84.3 Ų | 84.3 | 85% | 0.845 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.5 | -0.8 | 179.5 | -66.9 | -3.8 | 0 | 0 | 0 | 113.6 | D105 | D105-N107 PolarHBondContact O-N 3.43Š|
| 108 | S | 61.4 | Low | 77.4 | Confident | 41 Ų | 41 | 85.8 Ų | 85.8 | 29% | 0.287 | 43% | 0.432 | S | S | . | . | S | Bend | trans | -77.8 | 136.9 | 177 | 63.5 | 0 | 0 | 0 | 0 | 110.5 | P103 D105 V110 | P103-S108 WeakPolarHBondContact CB-OG 3.48Å; D105-S108 PolarHBondContact N-OG 3.06Å; D105-S108 PolarHBondContact O-N 3.13Å; D105-S108 PolarHBondContact O-OG 3.27Å; S108-V110 PolarHBondContact O-N 3.17Å |
| 109 | P | 59.1 | Low | 77.6 | Confident | 124 Ų | 124 | 88.9 Ų | 88.9 | 81% | 0.805 | 45% | 0.449 | S | S | * | . | trans | -63.3 | 122.3 | 177.7 | 24.7 | -31.8 | 0 | 0 | 0 | 109.5 | R111 | P109-R111 PolarHBondContact O-N 2.91Š| ||
| 110 | V | 63.1 | Low | 77.7 | Confident | 76 Ų | 76 | 92.3 Ų | 92.3 | 46% | 0.461 | 47% | 0.465 | S | S | . | . | trans | -65 | 110.7 | 175.8 | -175.2 | 0 | 0 | 0 | 0 | 108.1 | P103 S108 R112 | P103-V110 HydrophobicContact CB-CG2 4.3Å; P103-V110 HydrophobicContact CG-CG2 4.08Å; S108-V110 PolarHBondContact O-N 3.17Å; V110-R112 HydrophobicContact CG1-CG 3.78Å; V110-R112 PolarHBondContact O-N 3.48Å | ||
| 111 | R | 68.3 | Low | 78 | Confident | 149 Ų | 149 | 91.8 Ų | 91.8 | 56% | 0.562 | 46% | 0.462 | S | S | * | . | trans | -75.2 | 79.1 | 175.1 | -155.1 | 177.7 | -162.5 | -173.3 | 3.6 | 108.2 | V59 P109 | V59-R111 HydrophobicContact CG2-CG 4.38Å; P109-R111 PolarHBondContact O-N 2.91Å | ||
| 112 | R | 69.4 | Low | 78.5 | Confident | 216 Ų | 216 | 90.9 Ų | 90.9 | 82% | 0.815 | 46% | 0.459 | S | S | * | . | P | Polyproline II helix | trans | -72.5 | 132.7 | 177 | -73.1 | -168.9 | -162.3 | 166.3 | 6.2 | 110.2 | V110 | V110-R112 HydrophobicContact CG1-CG 3.78Å; V110-R112 PolarHBondContact O-N 3.48Å |
| 113 | M | 83.7 | Confident | 79.4 | Confident | 25 Ų | 25 | 94.8 Ų | 94.8 | 12% | 0.123 | 48% | 0.475 | C | S | . | . | P | Polyproline II helix | trans | -73.2 | 147.1 | 169.6 | -63.7 | -179.9 | 69.8 | 0 | 0 | 109.9 | V59 L60 H101 Q117 E118 L121 | V59-M113 HydrophobicContact CG1-CE 3.92Å; V59-M113 HydrophobicContact CG1-CG 3.89Å; V59-M113 HydrophobicContact CG1-SD 3.91Å; L60-M113 HydrophobicContact CD2-CE 3.54Å; H101-M113 PolarHBondContact CE1-SD 3.37Å; M113-Q117 HydrophobicContact CB-CB 4.11Å; M113-Q117 VanDerWaalsContact CE-C 3.46Å; M113-Q117 HydrophobicContact CE-CB 3.7Å; M113-Q117 VanDerWaalsContact CE-O 3.26Å; M113-Q117 WeakPolarHBondContact CE-O 3.33Å; M113-E118 HydrophobicContact CB-CG 3.75Å; M113-L121 HydrophobicContact CE-CB 3.85Å; M113-L121 HydrophobicContact CE-CD2 3.96Å; M113-L121 HydrophobicContact SD-CD2 3.87Å |
| 114 | S | 90.6 | Very high | 80.8 | Confident | 58 Ų | 58 | 93.7 Ų | 93.7 | 41% | 0.406 | 47% | 0.466 | S | S | . | . | P | Polyproline II helix | trans | -72.4 | 159.8 | 166.2 | 74.8 | 0 | 0 | 0 | 0 | 110.5 | L116 Q117 E118 | S114-L116 PolarHBondContact O-N 3.4Å; S114-Q117 WeakPolarHBondContact O-CB 3.35Å; S114-Q117 PolarHBondContact O-N 2.59Å; S114-Q117 WeakPolarHBondContact OG-CG 3.06Å; S114-Q117 PolarHBondContact OG-N 2.97Å; S114-E118 PolarHBondContact O-N 3.37Å |
| 115 | A | 91.5 | Very high | 82.4 | Confident | 80 Ų | 80 | 88.3 Ų | 88.3 | 66% | 0.661 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -56.1 | -36.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | E118 L119 | A115-E118 PolarHBondContact O-N 3.48Å; A115-L119 PolarHBondContact O-N 3.07Å |
| 116 | L | 94.1 | Very high | 84 | Confident | 112 Ų | 112 | 83 Ų | 83 | 59% | 0.586 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -64.8 | -44 | 174.8 | 179.5 | 63.5 | 0 | 0 | 0 | 111.6 | S114 E118 L119 Q120 | S114-L116 PolarHBondContact O-N 3.4Å; L116-E118 VanDerWaalsContact C-N 3.35Å; L116-L119 PolarHBondContact O-N 3.45Å; L116-Q120 VanDerWaalsContact O-CG 3.3Å; L116-Q120 WeakPolarHBondContact O-CG 3.34Å; L116-Q120 PolarHBondContact O-N 3.37Å |
| 117 | Q | 94.4 | Very high | 85.8 | Confident | 65 Ų | 65 | 73.6 Ų | 73.6 | 30% | 0.304 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 177.2 | -71.1 | 174.1 | -38 | 0 | 0 | 111.2 | L60 M113 S114 L119 Q120 L121 | L60-Q117 HydrophobicContact CD1-CB 4.45Å; L60-Q117 HydrophobicContact CD1-CG 4.27Å; L60-Q117 HydrophobicContact CD2-CB 4.37Å; L60-Q117 WeakPolarHBondContact CD2-O 3.43Å; M113-Q117 HydrophobicContact CB-CB 4.11Å; M113-Q117 VanDerWaalsContact CE-C 3.46Å; M113-Q117 HydrophobicContact CE-CB 3.7Å; M113-Q117 VanDerWaalsContact CE-O 3.26Å; M113-Q117 WeakPolarHBondContact CE-O 3.33Å; S114-Q117 WeakPolarHBondContact O-CB 3.35Å; S114-Q117 PolarHBondContact O-N 2.59Å; S114-Q117 WeakPolarHBondContact OG-CG 3.06Å; S114-Q117 PolarHBondContact OG-N 2.97Å; Q117-L119 VanDerWaalsContact C-N 3.34Å; Q117-L119 PolarHBondContact O-N 3.39Å; Q117-Q120 PolarHBondContact O-N 2.88Å; Q117-L121 WeakPolarHBondContact O-CB 3.29Å; Q117-L121 PolarHBondContact O-N 3.49Å |
| 118 | E | 94.3 | Very high | 87.7 | Confident | 71 Ų | 71 | 67.2 Ų | 67.2 | 33% | 0.332 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -59.6 | -46.3 | 175.1 | -70 | -172.1 | 157.3 | 0 | 0 | 110.9 | M113 S114 A115 L116 Q120 L121 L122 K163 | M113-E118 HydrophobicContact CB-CG 3.75Å; S114-E118 PolarHBondContact O-N 3.37Å; A115-E118 PolarHBondContact O-N 3.48Å; L116-E118 VanDerWaalsContact C-N 3.35Å; E118-Q120 PolarHBondContact O-N 3.45Å; E118-L121 WeakPolarHBondContact O-CB 3.37Å; E118-L121 PolarHBondContact O-N 2.86Å; E118-L122 WeakPolarHBondContact O-CG 3.49Å; E118-L122 PolarHBondContact O-N 2.86Å; E118-K163 VanDerWaalsContact CD-NZ 3.28Å; E118-K163 IonicContact OE1-NZ 3.71Å; E118-K163 PolarHBondContact OE1-NZ 2.92Å; E118-K163 IonicContact OE2-NZ 2.67Å; E118-K163 PolarHBondContact OE2-NZ 3.29Å |
| 119 | L | 96.2 | Very high | 89.4 | Confident | 80 Ų | 80 | 65.3 Ų | 65.3 | 42% | 0.419 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -58.9 | -46 | 175.4 | -178.5 | 63.4 | 0 | 0 | 0 | 111.8 | A115 L116 Q117 L121 L122 E123 M167 | A115-L119 PolarHBondContact O-N 3.07Å; L116-L119 PolarHBondContact O-N 3.45Å; Q117-L119 VanDerWaalsContact C-N 3.34Å; Q117-L119 PolarHBondContact O-N 3.39Å; L119-L121 VanDerWaalsContact C-N 3.31Å; L119-L121 PolarHBondContact O-N 3.29Å; L119-L122 WeakPolarHBondContact O-CB 3.42Å; L119-L122 PolarHBondContact O-N 3.38Å; L119-L122 VanDerWaalsContact O-N 3.16Å; L119-E123 PolarHBondContact O-N 3.04Å; L119-M167 HydrophobicContact CD1-SD 3.93Å |
| 120 | Q | 97 | Very high | 91.2 | Very high | 75 Ų | 75 | 63.7 Ų | 63.7 | 35% | 0.35 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.1 | -37.3 | 177 | -72 | 175.5 | -44 | 0 | 0 | 112.4 | L60 L116 Q117 E118 E123 I124 | L60-Q120 HydrophobicContact CD1-CB 3.82Å; L60-Q120 HydrophobicContact CD1-CG 4.49Å; L60-Q120 HydrophobicContact CD2-CB 4.33Å; L116-Q120 VanDerWaalsContact O-CG 3.3Å; L116-Q120 WeakPolarHBondContact O-CG 3.34Å; L116-Q120 PolarHBondContact O-N 3.37Å; Q117-Q120 PolarHBondContact O-N 2.88Å; E118-Q120 PolarHBondContact O-N 3.45Å; Q120-E123 PolarHBondContact O-N 3.18Å; Q120-I124 VanDerWaalsContact O-CG1 3.25Å; Q120-I124 WeakPolarHBondContact O-CG1 3.5Å; Q120-I124 PolarHBondContact O-N 3.07Å |
| 121 | L | 97.1 | Very high | 92.7 | Very high | 3 Ų | 3 | 67.6 Ų | 67.6 | 2% | 0.016 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 173.7 | 174.7 | 62.9 | 0 | 0 | 0 | 111.3 | L60 A63 M113 Q117 E118 L119 E123 I124 M125 L160 | L60-L121 HydrophobicContact CD2-CB 3.98Å; A63-L121 HydrophobicContact CB-CD1 3.63Å; M113-L121 HydrophobicContact CE-CB 3.85Å; M113-L121 HydrophobicContact CE-CD2 3.96Å; M113-L121 HydrophobicContact SD-CD2 3.87Å; Q117-L121 WeakPolarHBondContact O-CB 3.29Å; Q117-L121 PolarHBondContact O-N 3.49Å; E118-L121 WeakPolarHBondContact O-CB 3.37Å; E118-L121 PolarHBondContact O-N 2.86Å; L119-L121 VanDerWaalsContact C-N 3.31Å; L119-L121 PolarHBondContact O-N 3.29Å; L121-E123 VanDerWaalsContact C-N 3.29Å; L121-E123 PolarHBondContact O-N 3.04Å; L121-I124 WeakPolarHBondContact O-CB 3.42Å; L121-I124 PolarHBondContact O-N 3.35Å; L121-M125 HydrophobicContact CD1-CG 4.3Å; L121-M125 HydrophobicContact CD1-SD 4.45Å; L121-M125 HydrophobicContact CG-SD 4.25Å; L121-M125 VanDerWaalsContact O-CG 3.3Å; L121-M125 WeakPolarHBondContact O-CG 3.46Å; L121-M125 PolarHBondContact O-N 3.45Å; L121-L160 HydrophobicContact CD2-CD1 4.44Å |
| 122 | L | 97.8 | Very high | 94 | Very high | 13 Ų | 13 | 61.4 Ų | 61.4 | 7% | 0.068 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.6 | -41.2 | 175.4 | -63.1 | 172.6 | 0 | 0 | 0 | 111.2 | E118 L119 M125 C126 L160 K163 L164 M167 | E118-L122 WeakPolarHBondContact O-CG 3.49Å; E118-L122 PolarHBondContact O-N 2.86Å; L119-L122 WeakPolarHBondContact O-CB 3.42Å; L119-L122 PolarHBondContact O-N 3.38Å; L119-L122 VanDerWaalsContact O-N 3.16Å; L122-M125 PolarHBondContact O-N 3.3Å; L122-C126 WeakPolarHBondContact O-CB 3.43Å; L122-C126 PolarHBondContact O-N 3.14Å; L122-L160 HydrophobicContact CD2-CD1 3.75Å; L122-K163 HydrophobicContact CD1-CB 3.86Å; L122-K163 HydrophobicContact CD2-CB 4.1Å; L122-L164 HydrophobicContact CD2-CB 3.88Å; L122-L164 HydrophobicContact CD2-CD1 4.09Å; L122-M167 HydrophobicContact CB-CE 3.52Å; L122-M167 HydrophobicContact CB-SD 3.65Å; L122-M167 HydrophobicContact CD1-SD 4.24Å; L122-M167 WeakPolarHBondContact O-CE 3.11Å |
| 123 | E | 97.5 | Very high | 95.1 | Very high | 105 Ų | 105 | 55.8 Ų | 55.8 | 49% | 0.491 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 175.9 | -71.9 | -179.1 | 162.8 | 0 | 0 | 112.4 | L119 Q120 L121 C126 S127 M167 | L119-E123 PolarHBondContact O-N 3.04Å; Q120-E123 PolarHBondContact O-N 3.18Å; L121-E123 VanDerWaalsContact C-N 3.29Å; L121-E123 PolarHBondContact O-N 3.04Å; E123-C126 PolarHBondContact O-N 2.89Å; E123-S127 WeakPolarHBondContact O-CB 3.03Å; E123-S127 PolarHBondContact O-N 3.1Å; E123-S127 PolarHBondContact O-OG 2.86Å; E123-M167 HydrophobicContact CG-CE 4.46Å |
| 124 | I | 97.8 | Very high | 95.6 | Very high | 39 Ų | 39 | 58.6 Ų | 58.6 | 20% | 0.2 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.4 | -46.4 | 174.4 | -70.2 | 163.8 | 0 | 0 | 0 | 110.1 | L60 K64 L67 Q120 L121 S127 C128 | L60-I124 HydrophobicContact CB-CD1 4.32Å; K64-I124 HydrophobicContact CB-CG2 4.07Å; K64-I124 HydrophobicContact CG-CG2 4.12Å; L67-I124 HydrophobicContact CD1-CG2 4.06Å; Q120-I124 VanDerWaalsContact O-CG1 3.25Å; Q120-I124 WeakPolarHBondContact O-CG1 3.5Å; Q120-I124 PolarHBondContact O-N 3.07Å; L121-I124 WeakPolarHBondContact O-CB 3.42Å; L121-I124 PolarHBondContact O-N 3.35Å; I124-S127 PolarHBondContact O-N 3.22Å; I124-C128 WeakPolarHBondContact O-CB 3.45Å; I124-C128 PolarHBondContact O-N 3.32Å |
| 125 | M | 98 | Very high | 95.7 | Very high | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 177.9 | -68.3 | 179.2 | 83.7 | 0 | 0 | 111.2 | L67 L121 L122 S127 C128 F129 L145 F146 L160 L164 | L67-M125 HydrophobicContact CD1-CG 3.92Å; L121-M125 HydrophobicContact CD1-CG 4.3Å; L121-M125 HydrophobicContact CD1-SD 4.45Å; L121-M125 HydrophobicContact CG-SD 4.25Å; L121-M125 VanDerWaalsContact O-CG 3.3Å; L121-M125 WeakPolarHBondContact O-CG 3.46Å; L121-M125 PolarHBondContact O-N 3.45Å; L122-M125 PolarHBondContact O-N 3.3Å; M125-S127 VanDerWaalsContact C-N 3.3Å; M125-S127 PolarHBondContact O-N 3.49Å; M125-C128 WeakPolarHBondContact O-CB 3.33Å; M125-C128 PolarHBondContact O-N 3.13Å; M125-F129 VanDerWaalsContact O-CD2 3.3Å; M125-F129 WeakPolarHBondContact O-CD2 3.47Å; M125-F129 PolarHBondContact O-N 3.36Å; M125-L145 HydrophobicContact CE-CD1 3.77Å; M125-L145 HydrophobicContact CE-CD2 4.46Å; M125-F146 HydrophobicContact CE-CE2 4.26Å; M125-F146 HydrophobicContact CE-CZ 3.69Å; M125-L160 HydrophobicContact CE-CD2 4.22Å; M125-L160 HydrophobicContact SD-CD1 4.25Å; M125-L160 HydrophobicContact SD-CD2 4.1Å; M125-L160 HydrophobicContact SD-CG 4.39Å; M125-L164 HydrophobicContact CB-CD1 3.9Å; M125-L164 HydrophobicContact CE-CD2 3.97Å |
| 126 | C | 97.4 | Very high | 95.8 | Very high | 3 Ų | 3 | 60.7 Ų | 60.7 | 2% | 0.02 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.2 | -45.1 | 174.2 | -81.9 | 0 | 0 | 0 | 0 | 112.6 | L122 E123 Q130 M167 R173 I176 | L122-C126 WeakPolarHBondContact O-CB 3.43Å; L122-C126 PolarHBondContact O-N 3.14Å; E123-C126 PolarHBondContact O-N 2.89Å; C126-Q130 WeakPolarHBondContact O-CB 3.46Å; C126-Q130 PolarHBondContact O-N 2.91Å; C126-M167 HydrophobicContact CB-CE 4.08Å; C126-M167 WeakPolarHBondContact SG-CE 3.4Å; C126-R173 HydrophobicContact CB-CG 4.32Å; C126-I176 HydrophobicContact CB-CD1 4.2Å; C126-I176 WeakPolarHBondContact SG-CD1 3.5Å |
| 127 | S | 96.9 | Very high | 95.8 | Very high | 53 Ų | 53 | 55.3 Ų | 55.3 | 37% | 0.371 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 177.7 | -54.4 | 0 | 0 | 0 | 0 | 111.1 | E123 I124 M125 F129 Q130 E131 | E123-S127 WeakPolarHBondContact O-CB 3.03Å; E123-S127 PolarHBondContact O-N 3.1Å; E123-S127 PolarHBondContact O-OG 2.86Å; I124-S127 PolarHBondContact O-N 3.22Å; M125-S127 VanDerWaalsContact C-N 3.3Å; M125-S127 PolarHBondContact O-N 3.49Å; S127-F129 PolarHBondContact O-N 3.27Å; S127-Q130 PolarHBondContact O-N 3.17Å; S127-Q130 VanDerWaalsContact O-N 3.16Å; S127-E131 WeakPolarHBondContact O-CB 3.46Å; S127-E131 VanDerWaalsContact O-CG 3.32Å; S127-E131 WeakPolarHBondContact O-CG 3.46Å; S127-E131 PolarHBondContact O-N 2.67Å |
| 128 | C | 96.8 | Very high | 95.9 | Very high | 23 Ų | 23 | 53.7 Ų | 53.7 | 16% | 0.155 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58.3 | -48.7 | 177.8 | -179.7 | 0 | 0 | 0 | 0 | 112.4 | I124 M125 Q130 E131 Q132 M141 | I124-C128 WeakPolarHBondContact O-CB 3.45Å; I124-C128 PolarHBondContact O-N 3.32Å; M125-C128 WeakPolarHBondContact O-CB 3.33Å; M125-C128 PolarHBondContact O-N 3.13Å; C128-Q130 VanDerWaalsContact C-N 3.34Å; C128-Q130 PolarHBondContact O-N 3.21Å; C128-E131 PolarHBondContact O-N 2.9Å; C128-Q132 PolarHBondContact O-N 2.75Å; C128-M141 VanDerWaalsContact SG-CE 3.56Å |
| 129 | F | 97.2 | Very high | 95.9 | Very high | 1 Ų | 1 | 52.6 Ų | 52.6 | 0% | 0.004 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -67.9 | -33 | 176.1 | -81.6 | -81.6 | 0 | 0 | 0 | 112.7 | M125 S127 R138 M141 F142 L145 I176 | M125-F129 VanDerWaalsContact O-CD2 3.3Å; M125-F129 WeakPolarHBondContact O-CD2 3.47Å; M125-F129 PolarHBondContact O-N 3.36Å; S127-F129 PolarHBondContact O-N 3.27Å; F129-R138 HydrophobicContact CD1-CB 4.1Å; F129-R138 HydrophobicContact CD1-CG 4.08Å; F129-R138 HydrophobicContact CE1-CB 4.32Å; F129-R138 WeakPolarHBondContact CE1-O 3.3Å; F129-R138 VanDerWaalsContact O-CD 3.31Å; F129-R138 WeakPolarHBondContact O-CD 3.43Å; F129-M141 HydrophobicContact CE1-CB 4.19Å; F129-M141 HydrophobicContact CZ-CB 4.16Å; F129-F142 HydrophobicContact CE1-CB 3.91Å; F129-F142 HydrophobicContact CE1-CD2 4.01Å; F129-F142 HydrophobicContact CE1-CG 4.5Å; F129-F142 HydrophobicContact CE2-CD2 4.48Å; F129-F142 HydrophobicContact CZ-CB 3.97Å; F129-F142 AromaticContact CZ-CD2 3.81Å; F129-F142 HydrophobicContact CZ-CD2 3.81Å; F129-F142 HydrophobicContact CZ-CG 4.39Å; F129-L145 HydrophobicContact CE2-CD1 3.96Å; F129-L145 HydrophobicContact CZ-CD1 3.95Å; F129-I176 HydrophobicContact CB-CD1 4.18Å; F129-I176 HydrophobicContact CB-CG1 3.7Å; F129-I176 HydrophobicContact CD2-CD1 4.31Å; F129-I176 HydrophobicContact CD2-CG1 4.03Å; F129-I176 HydrophobicContact CG-CD1 4.46Å; F129-I176 HydrophobicContact CG-CG1 3.84Å |
| 130 | Q | 95.3 | Very high | 95.8 | Very high | 91 Ų | 91 | 50.1 Ų | 50.1 | 43% | 0.425 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -69.6 | -36.3 | 178.2 | -173.7 | 65.5 | 51 | 0 | 0 | 112.6 | C126 S127 C128 | C126-Q130 WeakPolarHBondContact O-CB 3.46Å; C126-Q130 PolarHBondContact O-N 2.91Å; S127-Q130 PolarHBondContact O-N 3.17Å; S127-Q130 VanDerWaalsContact O-N 3.16Å; C128-Q130 VanDerWaalsContact C-N 3.34Å; C128-Q130 PolarHBondContact O-N 3.21Å |
| 131 | E | 95.4 | Very high | 95.7 | Very high | 158 Ų | 158 | 46.6 Ų | 46.6 | 74% | 0.738 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -76.7 | -28.1 | -179.2 | -72.5 | 172.7 | -172.3 | 0 | 0 | 112.7 | S127 C128 S133 | S127-E131 WeakPolarHBondContact O-CB 3.46Å; S127-E131 VanDerWaalsContact O-CG 3.32Å; S127-E131 WeakPolarHBondContact O-CG 3.46Å; S127-E131 PolarHBondContact O-N 2.67Å; C128-E131 PolarHBondContact O-N 2.9Å; E131-S133 PolarHBondContact O-N 2.83Å; E131-S133 VanDerWaalsContact O-N 3.11Å |
| 132 | Q | 95.4 | Very high | 95.7 | Very high | 18 Ų | 18 | 46.5 Ų | 46.5 | 8% | 0.084 | 24% | 0.243 | C | C | . | . | trans | -73.9 | 104.4 | 179.7 | -178.7 | 47.4 | -91.7 | 0 | 0 | 112.4 | D71 C128 R134 V137 R138 | D71-Q132 PolarHBondContact OD1-NE2 3.39Å; D71-Q132 PolarHBondContact OD2-NE2 2.98Å; C128-Q132 PolarHBondContact O-N 2.75Å; Q132-R134 PolarHBondContact O-N 3.1Å; Q132-V137 HydrophobicContact CG-CB 4Å; Q132-V137 HydrophobicContact CG-CG1 3.89Å; Q132-R138 HydrophobicContact CB-CG 3.86Å; Q132-R138 HydrophobicContact CG-CG 3.77Å; Q132-R138 PolarHBondContact O-NE 3.28Å | ||
| 133 | S | 93.3 | Very high | 95.6 | Very high | 99 Ų | 99 | 48.4 Ų | 48.4 | 69% | 0.692 | 26% | 0.257 | S | S | * | . | trans | -64.2 | -29.1 | 178.9 | 63.3 | 0 | 0 | 0 | 0 | 115.5 | E131 | E131-S133 PolarHBondContact O-N 2.83Å; E131-S133 VanDerWaalsContact O-N 3.11Å | ||
| 134 | R | 94.3 | Very high | 95.4 | Very high | 83 Ų | 83 | 43.7 Ų | 43.7 | 31% | 0.313 | 24% | 0.236 | S | C | . | . | trans | -90.4 | 112.4 | -173 | -61.4 | 174.9 | 70.8 | -161.9 | 5.3 | 111.3 | C75 Q132 T136 V137 R138 | C75-R134 PolarHBondContact O-NH1 3.38Å; Q132-R134 PolarHBondContact O-N 3.1Å; R134-T136 VanDerWaalsContact C-N 3.32Å; R134-T136 PolarHBondContact O-N 2.76Å; R134-V137 HydrophobicContact CB-CB 4.05Å; R134-V137 HydrophobicContact CB-CG2 3.74Å; R134-V137 PolarHBondContact O-N 2.85Å; R134-R138 PolarHBondContact O-N 3.22Å; R134-R138 VanDerWaalsContact O-N 3.08Å | ||
| 135 | D | 92.9 | Very high | 95.3 | Very high | 99 Ų | 99 | 41.9 Ų | 41.9 | 53% | 0.529 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -54 | -45.8 | 179.3 | -70.7 | -41.3 | 0 | 0 | 0 | 112.6 | V137 R138 Q139 | D135-V137 VanDerWaalsContact C-N 3.27Å; D135-V137 PolarHBondContact O-N 3.11Å; D135-R138 WeakPolarHBondContact O-CB 3.28Å; D135-R138 PolarHBondContact O-N 3.31Å; D135-R138 IonicContact OD1-CZ 3.1Å; D135-R138 IonicContact OD1-NH1 2.69Å; D135-R138 PolarHBondContact OD1-NH1 2.93Å; D135-R138 IonicContact OD1-NH2 3.46Å; D135-R138 PolarHBondContact OD1-NH2 3.5Å; D135-Q139 VanDerWaalsContact O-CG 3.3Å; D135-Q139 WeakPolarHBondContact O-CG 3.42Å; D135-Q139 PolarHBondContact O-N 3.45Å |
| 136 | T | 92.8 | Very high | 95.2 | Very high | 83 Ų | 83 | 41.9 Ų | 41.9 | 51% | 0.509 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -59.3 | -38.4 | 179.2 | -47.9 | 0 | 0 | 0 | 0 | 112.3 | V78 R134 Q139 L140 | V78-T136 HydrophobicContact CG1-CG2 4.4Å; V78-T136 HydrophobicContact CG2-CG2 4.37Å; R134-T136 VanDerWaalsContact C-N 3.32Å; R134-T136 PolarHBondContact O-N 2.76Å; T136-Q139 PolarHBondContact O-N 3.28Å; T136-L140 HydrophobicContact CG2-CD1 4.16Å; T136-L140 VanDerWaalsContact O-CG 3.28Å; T136-L140 WeakPolarHBondContact O-CG 3.39Å; T136-L140 PolarHBondContact O-N 2.63Å; T136-L140 VanDerWaalsContact O-N 3.1Å |
| 137 | V | 94.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.8 | -45.5 | 178.3 | 177.8 | 0 | 0 | 0 | 0 | 109.8 | D71 I74 V78 Q132 R134 D135 Q139 L140 M141 | D71-V137 WeakPolarHBondContact OD1-CG1 3.32Å; I74-V137 HydrophobicContact CB-CG1 4.29Å; I74-V137 HydrophobicContact CG2-CB 4.3Å; I74-V137 HydrophobicContact CG2-CG1 3.82Å; I74-V137 HydrophobicContact CG2-CG2 4.4Å; V78-V137 HydrophobicContact CG2-CG2 4.39Å; Q132-V137 HydrophobicContact CG-CB 4Å; Q132-V137 HydrophobicContact CG-CG1 3.89Å; R134-V137 HydrophobicContact CB-CB 4.05Å; R134-V137 HydrophobicContact CB-CG2 3.74Å; R134-V137 PolarHBondContact O-N 2.85Å; D135-V137 VanDerWaalsContact C-N 3.27Å; D135-V137 PolarHBondContact O-N 3.11Å; V137-Q139 VanDerWaalsContact C-N 3.33Å; V137-Q139 PolarHBondContact O-N 2.97Å; V137-L140 PolarHBondContact O-N 3.44Å; V137-M141 HydrophobicContact CG1-CG 4.28Å; V137-M141 HydrophobicContact CG1-SD 4.06Å; V137-M141 WeakPolarHBondContact O-CG 3.25Å; V137-M141 PolarHBondContact O-N 2.83Å |
| 138 | R | 95.8 | Very high | 94.5 | Very high | 30 Ų | 30 | 44.2 Ų | 44.2 | 11% | 0.113 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -55.1 | -48 | 174 | -73 | -167.5 | -111.8 | 129.9 | 6.2 | 112 | F129 Q132 R134 D135 L140 M141 F142 | F129-R138 HydrophobicContact CD1-CB 4.1Å; F129-R138 HydrophobicContact CD1-CG 4.08Å; F129-R138 HydrophobicContact CE1-CB 4.32Å; F129-R138 WeakPolarHBondContact CE1-O 3.3Å; F129-R138 VanDerWaalsContact O-CD 3.31Å; F129-R138 WeakPolarHBondContact O-CD 3.43Å; Q132-R138 HydrophobicContact CB-CG 3.86Å; Q132-R138 HydrophobicContact CG-CG 3.77Å; Q132-R138 PolarHBondContact O-NE 3.28Å; R134-R138 PolarHBondContact O-N 3.22Å; R134-R138 VanDerWaalsContact O-N 3.08Å; D135-R138 WeakPolarHBondContact O-CB 3.28Å; D135-R138 PolarHBondContact O-N 3.31Å; D135-R138 IonicContact OD1-CZ 3.1Å; D135-R138 IonicContact OD1-NH1 2.69Å; D135-R138 PolarHBondContact OD1-NH1 2.93Å; D135-R138 IonicContact OD1-NH2 3.46Å; D135-R138 PolarHBondContact OD1-NH2 3.5Å; R138-L140 VanDerWaalsContact C-N 3.31Å; R138-L140 PolarHBondContact O-N 3.19Å; R138-M141 PolarHBondContact O-N 2.86Å; R138-F142 WeakPolarHBondContact O-CB 3.24Å; R138-F142 PolarHBondContact O-N 3.4Å |
| 139 | Q | 94.3 | Very high | 93.9 | Very high | 48 Ų | 48 | 47.7 Ų | 47.7 | 22% | 0.224 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.4 | -40.6 | -179.3 | -67.7 | -65.3 | -13.5 | 0 | 0 | 111.9 | D135 T136 V137 F142 S143 E178 T182 | D135-Q139 VanDerWaalsContact O-CG 3.3Å; D135-Q139 WeakPolarHBondContact O-CG 3.42Å; D135-Q139 PolarHBondContact O-N 3.45Å; T136-Q139 PolarHBondContact O-N 3.28Å; V137-Q139 VanDerWaalsContact C-N 3.33Å; V137-Q139 PolarHBondContact O-N 2.97Å; Q139-F142 PolarHBondContact O-N 2.97Å; Q139-S143 WeakPolarHBondContact O-CB 3.35Å; Q139-S143 PolarHBondContact O-N 3.39Å; Q139-E178 PolarHBondContact NE2-O 3.07Å; Q139-T182 PolarHBondContact NE2-OG1 3.33Å; Q139-T182 VanDerWaalsContact OE1-CB 3.24Å |
| 140 | L | 93.8 | Very high | 93.3 | Very high | 29 Ų | 29 | 51 Ų | 51 | 15% | 0.152 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.8 | -39.3 | 177.3 | -70 | 169 | 0 | 0 | 0 | 112.7 | I74 M77 V78 P85 T136 V137 R138 S143 A144 | I74-L140 HydrophobicContact CD1-CB 4.14Å; I74-L140 HydrophobicContact CG2-CB 3.65Å; I74-L140 HydrophobicContact CG2-CD1 3.78Å; I74-L140 HydrophobicContact CG2-CG 4.39Å; M77-L140 HydrophobicContact CE-CD1 4.27Å; V78-L140 HydrophobicContact CG2-CD1 3.49Å; V78-L140 VanDerWaalsContact CG2-CD1 3.49Å; P85-L140 HydrophobicContact CB-CD1 3.73Å; P85-L140 HydrophobicContact CB-CD2 4.21Å; P85-L140 HydrophobicContact CG-CD1 3.56Å; P85-L140 HydrophobicContact CG-CD2 3.92Å; P85-L140 HydrophobicContact CG-CG 4.37Å; P85-L140 WeakPolarHBondContact O-CD2 3.24Å; T136-L140 HydrophobicContact CG2-CD1 4.16Å; T136-L140 VanDerWaalsContact O-CG 3.28Å; T136-L140 WeakPolarHBondContact O-CG 3.39Å; T136-L140 PolarHBondContact O-N 2.63Å; T136-L140 VanDerWaalsContact O-N 3.1Å; V137-L140 PolarHBondContact O-N 3.44Å; R138-L140 VanDerWaalsContact C-N 3.31Å; R138-L140 PolarHBondContact O-N 3.19Å; L140-S143 PolarHBondContact O-N 3.2Å; L140-A144 WeakPolarHBondContact O-CB 3.3Å; L140-A144 PolarHBondContact O-N 3.08Å |
| 141 | M | 95.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.4 | -47.4 | 172.5 | -72.9 | 179.1 | 79.1 | 0 | 0 | 110.7 | L70 D71 I74 C128 F129 V137 R138 S143 A144 L145 | L70-M141 HydrophobicContact CG-CG 4.48Å; D71-M141 HydrophobicContact CB-CE 3.94Å; D71-M141 HydrophobicContact CB-SD 4.05Å; D71-M141 VanDerWaalsContact OD1-SD 3.35Å; I74-M141 HydrophobicContact CD1-CB 4.25Å; I74-M141 HydrophobicContact CD1-CG 3.59Å; C128-M141 VanDerWaalsContact SG-CE 3.56Å; F129-M141 HydrophobicContact CE1-CB 4.19Å; F129-M141 HydrophobicContact CZ-CB 4.16Å; V137-M141 HydrophobicContact CG1-CG 4.28Å; V137-M141 HydrophobicContact CG1-SD 4.06Å; V137-M141 WeakPolarHBondContact O-CG 3.25Å; V137-M141 PolarHBondContact O-N 2.83Å; R138-M141 PolarHBondContact O-N 2.86Å; M141-S143 VanDerWaalsContact C-N 3.33Å; M141-S143 PolarHBondContact O-N 2.87Å; M141-A144 PolarHBondContact O-N 3.22Å; M141-L145 VanDerWaalsContact O-CG 3.29Å; M141-L145 WeakPolarHBondContact O-CG 3.42Å; M141-L145 PolarHBondContact O-N 2.96Å |
| 142 | F | 97.1 | Very high | 92.3 | Very high | 2 Ų | 2 | 50.1 Ų | 50.1 | 1% | 0.009 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.3 | -43 | 177.8 | -161.7 | -88.8 | 0 | 0 | 0 | 111.5 | F129 R138 Q139 A144 L145 F146 L161 L164 I176 C179 A180 W183 | F129-F142 HydrophobicContact CE1-CB 3.91Å; F129-F142 HydrophobicContact CE1-CD2 4.01Å; F129-F142 HydrophobicContact CE1-CG 4.5Å; F129-F142 HydrophobicContact CE2-CD2 4.48Å; F129-F142 HydrophobicContact CZ-CB 3.97Å; F129-F142 AromaticContact CZ-CD2 3.81Å; F129-F142 HydrophobicContact CZ-CD2 3.81Å; F129-F142 HydrophobicContact CZ-CG 4.39Å; R138-F142 WeakPolarHBondContact O-CB 3.24Å; R138-F142 PolarHBondContact O-N 3.4Å; Q139-F142 PolarHBondContact O-N 2.97Å; F142-A144 PolarHBondContact O-N 3.35Å; F142-L145 PolarHBondContact O-N 3.16Å; F142-F146 HydrophobicContact CD1-CB 4.47Å; F142-F146 AromaticContact CD1-CD2 3.79Å; F142-F146 HydrophobicContact CD1-CD2 3.79Å; F142-F146 AromaticContact CD2-CD2 3.76Å; F142-F146 HydrophobicContact CD2-CD2 3.76Å; F142-F146 AromaticContact CD2-CE2 3.82Å; F142-F146 HydrophobicContact CD2-CE2 3.82Å; F142-F146 HydrophobicContact CE1-CB 4.3Å; F142-F146 AromaticContact CE1-CD2 3.73Å; F142-F146 HydrophobicContact CE1-CD2 3.73Å; F142-F146 HydrophobicContact CE1-CG 4.38Å; F142-F146 AromaticContact CE2-CD2 3.71Å; F142-F146 HydrophobicContact CE2-CD2 3.71Å; F142-F146 AromaticContact CE2-CE2 3.69Å; F142-F146 HydrophobicContact CE2-CE2 3.69Å; F142-F146 AromaticContact CG-CD2 3.82Å; F142-F146 HydrophobicContact CG-CD2 3.82Å; F142-F146 HydrophobicContact CG-CE2 4.32Å; F142-F146 AromaticContact CZ-CD2 3.71Å; F142-F146 HydrophobicContact CZ-CD2 3.71Å; F142-F146 HydrophobicContact CZ-CE2 4.08Å; F142-F146 WeakPolarHBondContact O-CD2 3.35Å; F142-F146 PolarHBondContact O-N 2.99Å; F142-L161 HydrophobicContact CE1-CD1 3.9Å; F142-L161 HydrophobicContact CE2-CD1 4.27Å; F142-L161 HydrophobicContact CZ-CD1 3.37Å; F142-L164 HydrophobicContact CE2-CD2 4.5Å; F142-I176 HydrophobicContact CE2-CG2 4.29Å; F142-C179 HydrophobicContact CB-CB 3.78Å; F142-C179 HydrophobicContact CD1-CB 3.94Å; F142-C179 HydrophobicContact CD2-CB 3.41Å; F142-C179 VanDerWaalsContact CD2-CB 3.41Å; F142-C179 HydrophobicContact CE1-CB 4.35Å; F142-C179 HydrophobicContact CE2-CB 3.87Å; F142-C179 HydrophobicContact CG-CB 3.43Å; F142-C179 VanDerWaalsContact CG-CB 3.43Å; F142-C179 HydrophobicContact CZ-CB 4.3Å; F142-A180 HydrophobicContact CZ-CB 4.18Å; F142-W183 HydrophobicContact CD1-CB 4.17Å; F142-W183 HydrophobicContact CD1-CG 4.49Å; F142-W183 HydrophobicContact CE1-CB 3.67Å; F142-W183 AromaticContact CE1-CG 3.89Å; F142-W183 HydrophobicContact CE1-CG 3.89Å |
| 143 | S | 94.1 | Very high | 91.9 | Very high | 52 Ų | 52 | 49.4 Ų | 49.4 | 36% | 0.364 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.3 | -41 | 174.3 | -173.7 | 0 | 0 | 0 | 0 | 112.1 | Q139 L140 M141 L145 N147 | Q139-S143 WeakPolarHBondContact O-CB 3.35Å; Q139-S143 PolarHBondContact O-N 3.39Å; L140-S143 PolarHBondContact O-N 3.2Å; M141-S143 VanDerWaalsContact C-N 3.33Å; M141-S143 PolarHBondContact O-N 2.87Å; S143-L145 VanDerWaalsContact C-N 3.28Å; S143-L145 PolarHBondContact O-N 2.89Å; S143-N147 WeakPolarHBondContact O-CB 3.47Å; S143-N147 PolarHBondContact O-N 2.92Å |
| 144 | A | 94.3 | Very high | 91.9 | Very high | 7 Ų | 7 | 45 Ų | 45 | 6% | 0.058 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -36.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | L70 V87 L92 I95 L140 M141 F142 | L70-A144 HydrophobicContact CD1-CB 4.43Å; L70-A144 HydrophobicContact CD2-CB 4.4Å; V87-A144 HydrophobicContact CB-CB 4.32Å; V87-A144 HydrophobicContact CG1-CB 4.41Å; V87-A144 HydrophobicContact CG2-CB 3.89Å; L92-A144 HydrophobicContact CD2-CB 4.41Å; L92-A144 WeakPolarHBondContact CD2-O 3.35Å; I95-A144 HydrophobicContact CD1-CB 3.98Å; L140-A144 WeakPolarHBondContact O-CB 3.3Å; L140-A144 PolarHBondContact O-N 3.08Å; M141-A144 PolarHBondContact O-N 3.22Å; F142-A144 PolarHBondContact O-N 3.35Å |
| 145 | L | 95.9 | Very high | 91.7 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -76 | -40.1 | -179.9 | -68 | 166.2 | 0 | 0 | 0 | 112.8 | L67 I95 I99 M125 F129 M141 F142 S143 R157 | L67-L145 HydrophobicContact CD2-CD1 4.21Å; L67-L145 HydrophobicContact CD2-CD2 4.21Å; I95-L145 HydrophobicContact CD1-CD2 4.35Å; I95-L145 HydrophobicContact CG1-CD2 4.44Å; I95-L145 HydrophobicContact CG2-CD2 3.88Å; I99-L145 HydrophobicContact CD1-CD2 3.58Å; I99-L145 HydrophobicContact CG2-CD2 4.35Å; M125-L145 HydrophobicContact CE-CD1 3.77Å; M125-L145 HydrophobicContact CE-CD2 4.46Å; F129-L145 HydrophobicContact CE2-CD1 3.96Å; F129-L145 HydrophobicContact CZ-CD1 3.95Å; M141-L145 VanDerWaalsContact O-CG 3.29Å; M141-L145 WeakPolarHBondContact O-CG 3.42Å; M141-L145 PolarHBondContact O-N 2.96Å; F142-L145 PolarHBondContact O-N 3.16Å; S143-L145 VanDerWaalsContact C-N 3.28Å; S143-L145 PolarHBondContact O-N 2.89Å; L145-R157 WeakPolarHBondContact O-CD 3.43Å; L145-R157 WeakPolarHBondContact O-CG 3.45Å; L145-R157 PolarHBondContact O-NE 3.21Å |
| 146 | F | 96 | Very high | 91.7 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -126.3 | 1.1 | -163 | -55.7 | -62.7 | 0 | 0 | 0 | 115.4 | M125 F142 L148 L160 L161 L164 W183 | M125-F146 HydrophobicContact CE-CE2 4.26Å; M125-F146 HydrophobicContact CE-CZ 3.69Å; F142-F146 HydrophobicContact CD1-CB 4.47Å; F142-F146 AromaticContact CD1-CD2 3.79Å; F142-F146 HydrophobicContact CD1-CD2 3.79Å; F142-F146 AromaticContact CD2-CD2 3.76Å; F142-F146 HydrophobicContact CD2-CD2 3.76Å; F142-F146 AromaticContact CD2-CE2 3.82Å; F142-F146 HydrophobicContact CD2-CE2 3.82Å; F142-F146 HydrophobicContact CE1-CB 4.3Å; F142-F146 AromaticContact CE1-CD2 3.73Å; F142-F146 HydrophobicContact CE1-CD2 3.73Å; F142-F146 HydrophobicContact CE1-CG 4.38Å; F142-F146 AromaticContact CE2-CD2 3.71Å; F142-F146 HydrophobicContact CE2-CD2 3.71Å; F142-F146 AromaticContact CE2-CE2 3.69Å; F142-F146 HydrophobicContact CE2-CE2 3.69Å; F142-F146 AromaticContact CG-CD2 3.82Å; F142-F146 HydrophobicContact CG-CD2 3.82Å; F142-F146 HydrophobicContact CG-CE2 4.32Å; F142-F146 AromaticContact CZ-CD2 3.71Å; F142-F146 HydrophobicContact CZ-CD2 3.71Å; F142-F146 HydrophobicContact CZ-CE2 4.08Å; F142-F146 WeakPolarHBondContact O-CD2 3.35Å; F142-F146 PolarHBondContact O-N 2.99Å; F146-L148 PolarHBondContact O-N 2.81Å; F146-L160 HydrophobicContact CE1-CB 4.28Å; F146-L160 HydrophobicContact CE1-CD2 4.19Å; F146-L160 HydrophobicContact CE1-CG 4.07Å; F146-L160 HydrophobicContact CZ-CG 4.47Å; F146-L161 HydrophobicContact CB-CD1 4.31Å; F146-L161 HydrophobicContact CD1-CB 3.67Å; F146-L161 HydrophobicContact CD1-CD1 4.13Å; F146-L161 HydrophobicContact CD1-CG 4.4Å; F146-L161 HydrophobicContact CD2-CD1 4.01Å; F146-L161 HydrophobicContact CE1-CB 3.88Å; F146-L161 HydrophobicContact CE1-CD1 4.43Å; F146-L161 HydrophobicContact CE2-CD1 4.32Å; F146-L161 HydrophobicContact CG-CB 4.26Å; F146-L161 HydrophobicContact CG-CD1 3.89Å; F146-L164 HydrophobicContact CE2-CD2 3.76Å; F146-L164 HydrophobicContact CZ-CD2 3.62Å; F146-W183 PolarHBondContact O-NE1 3.46Å |
| 147 | N | 90.8 | Very high | 91.8 | Very high | 75 Ų | 75 | 39.2 Ų | 39.2 | 40% | 0.401 | 22% | 0.219 | S | C | . | . | trans | -71.4 | 126.3 | 173.3 | -164.9 | 30.1 | 0 | 0 | 0 | 109.8 | S143 Q149 | S143-N147 WeakPolarHBondContact O-CB 3.47Å; S143-N147 PolarHBondContact O-N 2.92Å; N147-Q149 PolarHBondContact O-NE2 3.29Å | ||
| 148 | L | 88.9 | Confident | 91.9 | Very high | 29 Ų | 29 | 39.4 Ų | 39.4 | 15% | 0.152 | 22% | 0.22 | C | C | . | . | trans | -79.1 | 135.3 | -171.7 | -56.9 | 174.8 | 0 | 0 | 0 | 110.5 | F146 D154 R157 M158 W183 T187 Y191 | F146-L148 PolarHBondContact O-N 2.81Å; L148-D154 WeakPolarHBondContact CA-OD1 3.3Å; L148-D154 HydrophobicContact CD2-CB 3.95Å; L148-R157 HydrophobicContact CD2-CB 4.3Å; L148-M158 HydrophobicContact CD1-SD 4.28Å; L148-M158 HydrophobicContact CD2-CG 4.12Å; L148-M158 HydrophobicContact CD2-SD 4.19Å; L148-W183 HydrophobicContact CD1-CZ2 4.32Å; L148-T187 HydrophobicContact CD1-CG2 4.1Å; L148-Y191 HydrophobicContact CD1-CD1 3.44Å; L148-Y191 VanDerWaalsContact CD1-CD1 3.44Å; L148-Y191 HydrophobicContact CD1-CD2 3.23Å; L148-Y191 HydrophobicContact CD1-CE1 3.67Å; L148-Y191 HydrophobicContact CD1-CE2 3.49Å; L148-Y191 VanDerWaalsContact CD1-CE2 3.49Å; L148-Y191 HydrophobicContact CD1-CG 3.2Å | ||
| 149 | Q | 83.5 | Confident | 91.8 | Very high | 96 Ų | 96 | 40.3 Ų | 40.3 | 45% | 0.449 | 24% | 0.235 | S | C | . | . | trans | -108.1 | -4 | -172.2 | -56.8 | -56.2 | -53 | 0 | 0 | 113.3 | N147 N151 D154 | N147-Q149 PolarHBondContact O-NE2 3.29Å; Q149-N151 VanDerWaalsContact C-N 3.32Å; Q149-D154 PolarHBondContact N-OD1 3.02Å; Q149-D154 PolarHBondContact N-OD2 2.8Å | ||
| 150 | G | 84.1 | Confident | 91.9 | Very high | 72 Ų | 72 | 39 Ų | 39 | 74% | 0.742 | 23% | 0.229 | S | C | * | . | S | Bend | trans | 73.9 | 23.5 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113 | D154 | G150-D154 VanDerWaalsContact CA-OD2 3.26Å; G150-D154 WeakPolarHBondContact CA-OD2 3.37Å; G150-D154 PolarHBondContact N-OD2 2.87Å |
| 151 | N | 86.3 | Confident | 92.2 | Very high | 61 Ų | 61 | 37.7 Ų | 37.7 | 33% | 0.326 | 22% | 0.222 | S | C | . | . | S | Bend | trans | -115.8 | 172.7 | -176.5 | 75.7 | 16 | 0 | 0 | 0 | 111.7 | E96 Q149 A153 D154 | E96-N151 PolarHBondContact OE1-ND2 2.95Å; Q149-N151 VanDerWaalsContact C-N 3.32Å; N151-A153 PolarHBondContact O-N 3.03Å; N151-A153 VanDerWaalsContact O-N 3.16Å; N151-A153 WeakPolarHBondContact OD1-CA 3.5Å; N151-A153 VanDerWaalsContact OD1-CB 3.31Å; N151-A153 WeakPolarHBondContact OD1-CB 3.49Å; N151-A153 PolarHBondContact OD1-N 3.41Å; N151-D154 PolarHBondContact N-OD2 3Å; N151-D154 VanDerWaalsContact O-CB 3.31Å; N151-D154 WeakPolarHBondContact O-CB 3.36Å; N151-D154 PolarHBondContact O-N 2.88Å; N151-D154 VanDerWaalsContact O-N 3.1Å; N151-D154 PolarHBondContact OD1-N 3.39Å |
| 152 | Q | 84.3 | Confident | 92.2 | Very high | 169 Ų | 169 | 38.1 Ų | 38.1 | 79% | 0.79 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -20 | -178 | -65.4 | -67.9 | 16.3 | 0 | 0 | 113.9 | D154 | Q152-D154 PolarHBondContact O-N 3.12Š|
| 153 | A | 87.8 | Confident | 92.3 | Very high | 2 Ų | 2 | 42 Ų | 42 | 2% | 0.017 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -77 | -11.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | E96 T102 N151 E155 S156 R157 | E96-A153 HydrophobicContact CG-CB 3.99Å; T102-A153 HydrophobicContact CG2-CB 3.94Å; N151-A153 PolarHBondContact O-N 3.03Å; N151-A153 VanDerWaalsContact O-N 3.16Å; N151-A153 WeakPolarHBondContact OD1-CA 3.5Å; N151-A153 VanDerWaalsContact OD1-CB 3.31Å; N151-A153 WeakPolarHBondContact OD1-CB 3.49Å; N151-A153 PolarHBondContact OD1-N 3.41Å; A153-E155 VanDerWaalsContact C-N 3.3Å; A153-E155 PolarHBondContact O-N 3.12Å; A153-S156 PolarHBondContact O-N 3.21Å; A153-R157 WeakPolarHBondContact O-CG 3.09Å; A153-R157 PolarHBondContact O-N 2.88Å; A153-R157 PolarHBondContact O-NH1 2.81Å |
| 154 | D | 91.6 | Very high | 92.5 | Very high | 6 Ų | 6 | 39.5 Ų | 39.5 | 3% | 0.032 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.9 | -33.7 | 175.5 | -75.7 | -12.7 | 0 | 0 | 0 | 112.8 | L148 Q149 G150 N151 Q152 S156 R157 M158 | L148-D154 WeakPolarHBondContact CA-OD1 3.3Å; L148-D154 HydrophobicContact CD2-CB 3.95Å; Q149-D154 PolarHBondContact N-OD1 3.02Å; Q149-D154 PolarHBondContact N-OD2 2.8Å; G150-D154 VanDerWaalsContact CA-OD2 3.26Å; G150-D154 WeakPolarHBondContact CA-OD2 3.37Å; G150-D154 PolarHBondContact N-OD2 2.87Å; N151-D154 PolarHBondContact N-OD2 3Å; N151-D154 VanDerWaalsContact O-CB 3.31Å; N151-D154 WeakPolarHBondContact O-CB 3.36Å; N151-D154 PolarHBondContact O-N 2.88Å; N151-D154 VanDerWaalsContact O-N 3.1Å; N151-D154 PolarHBondContact OD1-N 3.39Å; Q152-D154 PolarHBondContact O-N 3.12Å; D154-S156 VanDerWaalsContact C-N 3.34Å; D154-R157 WeakPolarHBondContact O-CB 3.46Å; D154-R157 PolarHBondContact O-N 3.44Å; D154-M158 WeakPolarHBondContact O-CB 2.96Å; D154-M158 WeakPolarHBondContact O-CG 3.45Å; D154-M158 PolarHBondContact O-N 3.13Å |
| 155 | E | 91.7 | Very high | 92.6 | Very high | 99 Ų | 99 | 39.2 Ų | 39.2 | 46% | 0.463 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -65.9 | -40.1 | 175 | -72.3 | -56.9 | 131.5 | 0 | 0 | 111.4 | A153 M158 A159 R194 | A153-E155 VanDerWaalsContact C-N 3.3Å; A153-E155 PolarHBondContact O-N 3.12Å; E155-M158 PolarHBondContact O-N 3.31Å; E155-A159 WeakPolarHBondContact O-CB 3.42Å; E155-A159 PolarHBondContact O-N 3.25Å; E155-R194 IonicContact OE1-CZ 2.75Å; E155-R194 IonicContact OE1-NH1 2.9Å; E155-R194 PolarHBondContact OE1-NH1 3Å; E155-R194 IonicContact OE1-NH2 3.4Å; E155-R194 PolarHBondContact OE1-NH2 3.45Å; E155-R194 IonicContact OE2-CZ 3.47Å; E155-R194 IonicContact OE2-NH1 3.63Å; E155-R194 IonicContact OE2-NH2 3.39Å; E155-R194 PolarHBondContact OE2-NH2 2.88Å |
| 156 | S | 92.3 | Very high | 92.6 | Very high | 44 Ų | 44 | 39.8 Ų | 39.8 | 31% | 0.308 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -68 | -38.1 | 174.8 | -59 | 0 | 0 | 0 | 0 | 111.5 | A153 D154 A159 L160 | A153-S156 PolarHBondContact O-N 3.21Å; D154-S156 VanDerWaalsContact C-N 3.34Å; S156-A159 PolarHBondContact O-N 3.2Å; S156-L160 WeakPolarHBondContact O-CB 3.38Å; S156-L160 PolarHBondContact O-N 3.09Å |
| 157 | R | 94.8 | Very high | 92.6 | Very high | 1 Ų | 1 | 41.1 Ų | 41.1 | 0% | 0.004 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.9 | -48.6 | 173.3 | -75.2 | 179.4 | 176 | 73.1 | -6.4 | 111.6 | E96 L100 L145 L148 A153 D154 L160 L161 | E96-R157 IonicContact OE1-CZ 3.04Å; E96-R157 IonicContact OE1-NH1 2.88Å; E96-R157 PolarHBondContact OE1-NH1 3.44Å; E96-R157 IonicContact OE1-NH2 3.89Å; E96-R157 PolarHBondContact OE1-NH2 2.87Å; L100-R157 HydrophobicContact CD1-CG 3.41Å; L100-R157 VanDerWaalsContact CD1-CG 3.41Å; L100-R157 HydrophobicContact CD2-CG 3.96Å; L100-R157 HydrophobicContact CG-CG 4.35Å; L145-R157 WeakPolarHBondContact O-CD 3.43Å; L145-R157 WeakPolarHBondContact O-CG 3.45Å; L145-R157 PolarHBondContact O-NE 3.21Å; L148-R157 HydrophobicContact CD2-CB 4.3Å; A153-R157 WeakPolarHBondContact O-CG 3.09Å; A153-R157 PolarHBondContact O-N 2.88Å; A153-R157 PolarHBondContact O-NH1 2.81Å; D154-R157 WeakPolarHBondContact O-CB 3.46Å; D154-R157 PolarHBondContact O-N 3.44Å; R157-L160 PolarHBondContact O-N 3.16Å; R157-L161 WeakPolarHBondContact O-CB 3.47Å; R157-L161 PolarHBondContact O-N 3.28Å |
| 158 | M | 95.9 | Very high | 92.9 | Very high | 4 Ų | 4 | 37.6 Ų | 37.6 | 2% | 0.02 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.5 | -43.5 | 178.9 | -77.1 | -57.4 | -55 | 0 | 0 | 111.3 | L148 D154 E155 L161 S162 W183 Y191 R194 L195 | L148-M158 HydrophobicContact CD1-SD 4.28Å; L148-M158 HydrophobicContact CD2-CG 4.12Å; L148-M158 HydrophobicContact CD2-SD 4.19Å; D154-M158 WeakPolarHBondContact O-CB 2.96Å; D154-M158 WeakPolarHBondContact O-CG 3.45Å; D154-M158 PolarHBondContact O-N 3.13Å; E155-M158 PolarHBondContact O-N 3.31Å; M158-L161 PolarHBondContact O-N 3.23Å; M158-L161 HydrophobicContact SD-CD2 4.14Å; M158-S162 WeakPolarHBondContact O-CB 3.26Å; M158-S162 PolarHBondContact O-N 3.43Å; M158-S162 PolarHBondContact O-OG 3.44Å; M158-S162 VanDerWaalsContact O-OG 3.09Å; M158-W183 HydrophobicContact CE-CH2 4.18Å; M158-W183 HydrophobicContact SD-CH2 3.83Å; M158-W183 HydrophobicContact SD-CZ2 3.9Å; M158-Y191 HydrophobicContact CG-CD1 4.16Å; M158-Y191 HydrophobicContact SD-CD1 4.09Å; M158-Y191 HydrophobicContact SD-CG 4.45Å; M158-R194 HydrophobicContact CE-CB 4.13Å; M158-L195 HydrophobicContact CE-CB 4.46Å |
| 159 | A | 95.1 | Very high | 93.2 | Very high | 50 Ų | 50 | 36.5 Ų | 36.5 | 41% | 0.413 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.2 | -46 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | E155 S156 K163 | E155-A159 WeakPolarHBondContact O-CB 3.42Å; E155-A159 PolarHBondContact O-N 3.25Å; S156-A159 PolarHBondContact O-N 3.2Å; A159-K163 WeakPolarHBondContact O-CG 3.46Å; A159-K163 PolarHBondContact O-N 3.49Å |
| 160 | L | 96.9 | Very high | 93.6 | Very high | 20 Ų | 20 | 34.5 Ų | 34.5 | 11% | 0.105 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -41.7 | 177.8 | -177 | 62.5 | 0 | 0 | 0 | 111.9 | I99 L100 L121 L122 M125 F146 S156 R157 K163 L164 | I99-L160 HydrophobicContact CG2-CD2 3.66Å; L100-L160 HydrophobicContact CD2-CB 4.33Å; L100-L160 HydrophobicContact CD2-CD2 3.76Å; L121-L160 HydrophobicContact CD2-CD1 4.44Å; L122-L160 HydrophobicContact CD2-CD1 3.75Å; M125-L160 HydrophobicContact CE-CD2 4.22Å; M125-L160 HydrophobicContact SD-CD1 4.25Å; M125-L160 HydrophobicContact SD-CD2 4.1Å; M125-L160 HydrophobicContact SD-CG 4.39Å; F146-L160 HydrophobicContact CE1-CB 4.28Å; F146-L160 HydrophobicContact CE1-CD2 4.19Å; F146-L160 HydrophobicContact CE1-CG 4.07Å; F146-L160 HydrophobicContact CZ-CG 4.47Å; S156-L160 WeakPolarHBondContact O-CB 3.38Å; S156-L160 PolarHBondContact O-N 3.09Å; R157-L160 PolarHBondContact O-N 3.16Å; L160-K163 PolarHBondContact O-N 2.89Å; L160-L164 VanDerWaalsContact O-CB 3.31Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.99Å |
| 161 | L | 98.1 | Very high | 94 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.3 | -50.6 | 176.9 | 175.3 | 64 | 0 | 0 | 0 | 111 | F142 F146 R157 M158 K163 L164 V165 W183 L195 | F142-L161 HydrophobicContact CE1-CD1 3.9Å; F142-L161 HydrophobicContact CE2-CD1 4.27Å; F142-L161 HydrophobicContact CZ-CD1 3.37Å; F146-L161 HydrophobicContact CB-CD1 4.31Å; F146-L161 HydrophobicContact CD1-CB 3.67Å; F146-L161 HydrophobicContact CD1-CD1 4.13Å; F146-L161 HydrophobicContact CD1-CG 4.4Å; F146-L161 HydrophobicContact CD2-CD1 4.01Å; F146-L161 HydrophobicContact CE1-CB 3.88Å; F146-L161 HydrophobicContact CE1-CD1 4.43Å; F146-L161 HydrophobicContact CE2-CD1 4.32Å; F146-L161 HydrophobicContact CG-CB 4.26Å; F146-L161 HydrophobicContact CG-CD1 3.89Å; R157-L161 WeakPolarHBondContact O-CB 3.47Å; R157-L161 PolarHBondContact O-N 3.28Å; M158-L161 PolarHBondContact O-N 3.23Å; M158-L161 HydrophobicContact SD-CD2 4.14Å; L161-K163 PolarHBondContact O-N 2.8Å; L161-L164 PolarHBondContact O-N 3.37Å; L161-V165 HydrophobicContact CD1-CG2 3.79Å; L161-V165 HydrophobicContact CG-CG2 4.37Å; L161-V165 WeakPolarHBondContact O-CG2 3.27Å; L161-V165 PolarHBondContact O-N 2.92Å; L161-W183 HydrophobicContact CD2-CD2 4.02Å; L161-W183 HydrophobicContact CD2-CE3 4.1Å; L161-W183 HydrophobicContact CD2-CH2 3.52Å; L161-W183 HydrophobicContact CD2-CZ2 3.39Å; L161-W183 HydrophobicContact CD2-CZ3 3.88Å; L161-L195 HydrophobicContact CD2-CD2 4.37Å |
| 162 | S | 97.7 | Very high | 94.3 | Very high | 10 Ų | 10 | 34.1 Ų | 34.1 | 7% | 0.07 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.9 | -44.4 | -179.1 | -63.7 | 0 | 0 | 0 | 0 | 111.7 | M158 L164 S166 | M158-S162 WeakPolarHBondContact O-CB 3.26Å; M158-S162 PolarHBondContact O-N 3.43Å; M158-S162 PolarHBondContact O-OG 3.44Å; M158-S162 VanDerWaalsContact O-OG 3.09Å; S162-L164 PolarHBondContact O-N 3.33Å; S162-S166 WeakPolarHBondContact O-CB 3.1Å; S162-S166 PolarHBondContact O-N 2.93Å |
| 163 | K | 97.5 | Very high | 94.8 | Very high | 83 Ų | 83 | 30.3 Ų | 30.3 | 36% | 0.361 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -62.4 | -42.7 | 175.1 | -69.5 | 175.2 | -176.7 | 178.8 | 0 | 112.1 | E118 L122 A159 L160 L161 M167 | E118-K163 VanDerWaalsContact CD-NZ 3.28Å; E118-K163 IonicContact OE1-NZ 3.71Å; E118-K163 PolarHBondContact OE1-NZ 2.92Å; E118-K163 IonicContact OE2-NZ 2.67Å; E118-K163 PolarHBondContact OE2-NZ 3.29Å; L122-K163 HydrophobicContact CD1-CB 3.86Å; L122-K163 HydrophobicContact CD2-CB 4.1Å; A159-K163 WeakPolarHBondContact O-CG 3.46Å; A159-K163 PolarHBondContact O-N 3.49Å; L160-K163 PolarHBondContact O-N 2.89Å; L161-K163 PolarHBondContact O-N 2.8Å; K163-M167 WeakPolarHBondContact O-CB 3.4Å; K163-M167 PolarHBondContact O-N 3.41Å |
| 164 | L | 98.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -66.2 | -45.9 | 180 | -177 | 66.7 | 0 | 0 | 0 | 112.2 | L122 M125 F142 F146 L160 L161 S162 M167 A168 I176 | L122-L164 HydrophobicContact CD2-CB 3.88Å; L122-L164 HydrophobicContact CD2-CD1 4.09Å; M125-L164 HydrophobicContact CB-CD1 3.9Å; M125-L164 HydrophobicContact CE-CD2 3.97Å; F142-L164 HydrophobicContact CE2-CD2 4.5Å; F146-L164 HydrophobicContact CE2-CD2 3.76Å; F146-L164 HydrophobicContact CZ-CD2 3.62Å; L160-L164 VanDerWaalsContact O-CB 3.31Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.99Å; L161-L164 PolarHBondContact O-N 3.37Å; S162-L164 PolarHBondContact O-N 3.33Å; L164-M167 PolarHBondContact O-N 3.37Å; L164-A168 VanDerWaalsContact O-CB 3.25Å; L164-A168 WeakPolarHBondContact O-CB 3.3Å; L164-A168 PolarHBondContact O-N 2.94Å; L164-I176 HydrophobicContact CD1-CD1 3.82Å; L164-I176 HydrophobicContact CD2-CD1 4.37Å; L164-I176 HydrophobicContact CD2-CG2 4.41Å; L164-I176 HydrophobicContact CG-CD1 4.12Å; L164-I176 HydrophobicContact CG-CG2 4.21Å |
| 165 | V | 98.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.8 | -42.7 | 178.6 | 176.9 | 0 | 0 | 0 | 0 | 110.2 | L161 M167 A168 V169 A180 L195 L199 F224 | L161-V165 HydrophobicContact CD1-CG2 3.79Å; L161-V165 HydrophobicContact CG-CG2 4.37Å; L161-V165 WeakPolarHBondContact O-CG2 3.27Å; L161-V165 PolarHBondContact O-N 2.92Å; V165-M167 PolarHBondContact O-N 2.97Å; V165-A168 WeakPolarHBondContact O-CB 3.48Å; V165-A168 PolarHBondContact O-N 3.02Å; V165-V169 WeakPolarHBondContact O-CG2 3.35Å; V165-V169 PolarHBondContact O-N 3.09Å; V165-A180 HydrophobicContact CG1-CB 4.42Å; V165-A180 HydrophobicContact CG2-CB 3.84Å; V165-L195 HydrophobicContact CB-CD1 4.23Å; V165-L195 HydrophobicContact CG1-CD1 4.49Å; V165-L195 HydrophobicContact CG2-CD1 4.47Å; V165-L195 HydrophobicContact CG2-CD2 4.44Å; V165-L199 HydrophobicContact CG1-CD1 4.01Å; V165-L199 HydrophobicContact CG1-CD2 4.22Å; V165-F224 HydrophobicContact CG1-CE2 3.81Å; V165-F224 HydrophobicContact CG1-CZ 3.79Å |
| 166 | S | 95.9 | Very high | 95.7 | Very high | 14 Ų | 14 | 28.3 Ų | 28.3 | 10% | 0.098 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58 | -48.8 | 174.3 | -175.9 | 0 | 0 | 0 | 0 | 110.9 | S162 A168 V169 A170 D202 Y203 | S162-S166 WeakPolarHBondContact O-CB 3.1Å; S162-S166 PolarHBondContact O-N 2.93Å; S166-A168 VanDerWaalsContact C-N 3.33Å; S166-A168 PolarHBondContact O-N 3.44Å; S166-V169 WeakPolarHBondContact O-CB 3.34Å; S166-V169 PolarHBondContact O-N 2.91Å; S166-A170 PolarHBondContact O-N 3.07Å; S166-D202 VanDerWaalsContact CB-OD2 3.25Å; S166-D202 WeakPolarHBondContact CB-OD2 3.21Å; S166-D202 PolarHBondContact OG-OD2 2.92Å; S166-Y203 PolarHBondContact O-OH 2.8Å |
| 167 | M | 95.4 | Very high | 96 | Very high | 28 Ų | 28 | 26.2 Ų | 26.2 | 14% | 0.138 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.6 | -38 | 176 | -163.3 | -179.8 | 80.1 | 0 | 0 | 112.5 | L119 L122 E123 C126 K163 L164 V165 V169 A170 V171 | L119-M167 HydrophobicContact CD1-SD 3.93Å; L122-M167 HydrophobicContact CB-CE 3.52Å; L122-M167 HydrophobicContact CB-SD 3.65Å; L122-M167 HydrophobicContact CD1-SD 4.24Å; L122-M167 WeakPolarHBondContact O-CE 3.11Å; E123-M167 HydrophobicContact CG-CE 4.46Å; C126-M167 HydrophobicContact CB-CE 4.08Å; C126-M167 WeakPolarHBondContact SG-CE 3.4Å; K163-M167 WeakPolarHBondContact O-CB 3.4Å; K163-M167 PolarHBondContact O-N 3.41Å; L164-M167 PolarHBondContact O-N 3.37Å; V165-M167 PolarHBondContact O-N 2.97Å; M167-V169 VanDerWaalsContact C-N 3.3Å; M167-V169 PolarHBondContact O-N 3.03Å; M167-A170 WeakPolarHBondContact O-CB 3.28Å; M167-A170 PolarHBondContact O-N 3.05Å; M167-A170 VanDerWaalsContact O-N 3.14Å; M167-V171 HydrophobicContact CG-CG2 4.4Å; M167-V171 WeakPolarHBondContact O-CG2 3.5Å; M167-V171 PolarHBondContact O-N 3.25Å |
| 168 | A | 96.5 | Very high | 96 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.3 | -35 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | L164 V165 S166 G172 R173 I176 L177 | L164-A168 VanDerWaalsContact O-CB 3.25Å; L164-A168 WeakPolarHBondContact O-CB 3.3Å; L164-A168 PolarHBondContact O-N 2.94Å; V165-A168 WeakPolarHBondContact O-CB 3.48Å; V165-A168 PolarHBondContact O-N 3.02Å; S166-A168 VanDerWaalsContact C-N 3.33Å; S166-A168 PolarHBondContact O-N 3.44Å; A168-G172 CarbonylContact O-C 3.54Å; A168-G172 WeakPolarHBondContact O-CA 3.2Å; A168-G172 PolarHBondContact O-N 2.8Å; A168-R173 HydrophobicContact CB-CB 3.94Å; A168-R173 PolarHBondContact O-N 3.12Å; A168-I176 HydrophobicContact CB-CB 3.91Å; A168-I176 HydrophobicContact CB-CD1 4.41Å; A168-I176 HydrophobicContact CB-CG2 3.61Å; A168-L177 HydrophobicContact CB-CD2 4.06Å; A168-L177 HydrophobicContact CB-CG 4.31Å |
| 169 | V | 95.2 | Very high | 96.1 | Very high | 6 Ų | 6 | 27.3 Ų | 27.3 | 4% | 0.036 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.4 | -52.6 | 168.7 | 171.8 | 0 | 0 | 0 | 0 | 109.5 | V165 S166 M167 V171 G172 L177 Y203 T213 L214 I217 F224 | V165-V169 WeakPolarHBondContact O-CG2 3.35Å; V165-V169 PolarHBondContact O-N 3.09Å; S166-V169 WeakPolarHBondContact O-CB 3.34Å; S166-V169 PolarHBondContact O-N 2.91Å; M167-V169 VanDerWaalsContact C-N 3.3Å; M167-V169 PolarHBondContact O-N 3.03Å; V169-V171 VanDerWaalsContact C-N 3.32Å; V169-V171 PolarHBondContact O-N 2.75Å; V169-G172 PolarHBondContact O-N 3.4Å; V169-L177 HydrophobicContact CG2-CD2 3.96Å; V169-Y203 HydrophobicContact CB-CE2 4.02Å; V169-Y203 HydrophobicContact CG1-CD2 4.35Å; V169-Y203 HydrophobicContact CG1-CE1 3.98Å; V169-Y203 HydrophobicContact CG1-CE2 3.79Å; V169-T213 HydrophobicContact CG1-CG2 4.43Å; V169-L214 HydrophobicContact CG1-CB 4.26Å; V169-L214 HydrophobicContact CG1-CD1 3.71Å; V169-L214 HydrophobicContact CG2-CD1 4.2Å; V169-I217 HydrophobicContact CB-CD1 4.06Å; V169-I217 HydrophobicContact CG1-CD1 4.09Å; V169-I217 HydrophobicContact CG2-CD1 3.62Å; V169-F224 HydrophobicContact CG2-CE1 4.27Å; V169-F224 HydrophobicContact CG2-CZ 4.48Å |
| 170 | A | 92.3 | Very high | 96.2 | Very high | 54 Ų | 54 | 25 Ų | 25 | 45% | 0.446 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -56.8 | -42.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | S166 M167 Y203 | S166-A170 PolarHBondContact O-N 3.07Å; M167-A170 WeakPolarHBondContact O-CB 3.28Å; M167-A170 PolarHBondContact O-N 3.05Å; M167-A170 VanDerWaalsContact O-N 3.14Å; A170-Y203 WeakPolarHBondContact CB-OH 3.31Å; A170-Y203 PolarHBondContact N-OH 3.1Å |
| 171 | V | 92.2 | Very high | 96.2 | Very high | 79 Ų | 79 | 24.2 Ų | 24.2 | 48% | 0.479 | 14% | 0.144 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -106.6 | 11.4 | -175.1 | -62.1 | 0 | 0 | 0 | 0 | 113.8 | M167 V169 R173 | M167-V171 HydrophobicContact CG-CG2 4.4Å; M167-V171 WeakPolarHBondContact O-CG2 3.5Å; M167-V171 PolarHBondContact O-N 3.25Å; V169-V171 VanDerWaalsContact C-N 3.32Å; V169-V171 PolarHBondContact O-N 2.75Å; V171-R173 HydrophobicContact CG2-CG 3.51Å |
| 172 | G | 91.7 | Very high | 96 | Very high | 47 Ų | 47 | 25.7 Ų | 25.7 | 49% | 0.485 | 15% | 0.153 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 65.2 | 39.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | A168 V169 V174 | A168-G172 CarbonylContact O-C 3.54Å; A168-G172 WeakPolarHBondContact O-CA 3.2Å; A168-G172 PolarHBondContact O-N 2.8Å; V169-G172 PolarHBondContact O-N 3.4Å; G172-V174 PolarHBondContact O-N 3.18Å; G172-V174 VanDerWaalsContact O-N 3.1Å |
| 173 | R | 95.2 | Very high | 95.9 | Very high | 89 Ų | 89 | 25.9 Ų | 25.9 | 34% | 0.336 | 15% | 0.152 | S | C | . | . | trans | -85.8 | 77.3 | -177.8 | -58.9 | -65.8 | -179 | 179.7 | 0.5 | 112.1 | C126 A168 V171 P175 I176 L177 | C126-R173 HydrophobicContact CB-CG 4.32Å; A168-R173 HydrophobicContact CB-CB 3.94Å; A168-R173 PolarHBondContact O-N 3.12Å; V171-R173 HydrophobicContact CG2-CG 3.51Å; R173-P175 VanDerWaalsContact C-CD 3.41Å; R173-P175 VanDerWaalsContact C-N 3.34Å; R173-I176 HydrophobicContact CB-CD1 4.38Å; R173-I176 PolarHBondContact O-N 2.9Å; R173-I176 VanDerWaalsContact O-N 3.08Å; R173-L177 PolarHBondContact O-N 3.09Å | ||
| 174 | V | 95.8 | Very high | 95.8 | Very high | 49 Ų | 49 | 22.1 Ų | 22.1 | 30% | 0.297 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -47.2 | -43.8 | -179.9 | -178.1 | 0 | 0 | 0 | 0 | 114.4 | G172 I176 L177 E178 A220 | G172-V174 PolarHBondContact O-N 3.18Å; G172-V174 VanDerWaalsContact O-N 3.1Å; V174-I176 PolarHBondContact O-N 3.42Å; V174-L177 PolarHBondContact O-N 3.33Å; V174-L177 VanDerWaalsContact O-N 3.07Å; V174-E178 HydrophobicContact CG1-CG 4.07Å; V174-E178 PolarHBondContact O-N 3.14Å; V174-A220 HydrophobicContact CG2-CB 3.83Å |
| 175 | P | 96.9 | Very high | 95.4 | Very high | 15 Ų | 15 | 23.3 Ų | 23.3 | 10% | 0.097 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -57.2 | -34.9 | -179.8 | -29.9 | 39.1 | 0 | 0 | 0 | 114.6 | R173 C179 | R173-P175 VanDerWaalsContact C-CD 3.41Å; R173-P175 VanDerWaalsContact C-N 3.34Å; P175-C179 PolarHBondContact O-N 3.33Å; P175-C179 PolarHBondContact O-SG 3.02Å; P175-C179 VanDerWaalsContact O-SG 3.34Å |
| 176 | I | 98 | Very high | 95 | Very high | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -75.4 | -41.2 | 176.7 | -74 | 168 | 0 | 0 | 0 | 110.5 | C126 F129 F142 L164 A168 R173 V174 E178 C179 A180 | C126-I176 HydrophobicContact CB-CD1 4.2Å; C126-I176 WeakPolarHBondContact SG-CD1 3.5Å; F129-I176 HydrophobicContact CB-CD1 4.18Å; F129-I176 HydrophobicContact CB-CG1 3.7Å; F129-I176 HydrophobicContact CD2-CD1 4.31Å; F129-I176 HydrophobicContact CD2-CG1 4.03Å; F129-I176 HydrophobicContact CG-CD1 4.46Å; F129-I176 HydrophobicContact CG-CG1 3.84Å; F142-I176 HydrophobicContact CE2-CG2 4.29Å; L164-I176 HydrophobicContact CD1-CD1 3.82Å; L164-I176 HydrophobicContact CD2-CD1 4.37Å; L164-I176 HydrophobicContact CD2-CG2 4.41Å; L164-I176 HydrophobicContact CG-CD1 4.12Å; L164-I176 HydrophobicContact CG-CG2 4.21Å; A168-I176 HydrophobicContact CB-CB 3.91Å; A168-I176 HydrophobicContact CB-CD1 4.41Å; A168-I176 HydrophobicContact CB-CG2 3.61Å; R173-I176 HydrophobicContact CB-CD1 4.38Å; R173-I176 PolarHBondContact O-N 2.9Å; R173-I176 VanDerWaalsContact O-N 3.08Å; V174-I176 PolarHBondContact O-N 3.42Å; I176-E178 VanDerWaalsContact C-N 3.33Å; I176-E178 PolarHBondContact O-N 3.28Å; I176-C179 CarbonylContact O-C 3.29Å; I176-C179 WeakPolarHBondContact O-CB 3.49Å; I176-C179 PolarHBondContact O-N 2.91Å; I176-C179 VanDerWaalsContact O-N 3.13Å; I176-A180 WeakPolarHBondContact O-CB 3.37Å; I176-A180 PolarHBondContact O-N 3.42Å |
| 177 | L | 97.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.5 | -38.7 | -179.3 | -60.1 | 167.9 | 0 | 0 | 0 | 111.6 | A168 V169 R173 V174 C179 A180 A181 I217 F224 | A168-L177 HydrophobicContact CB-CD2 4.06Å; A168-L177 HydrophobicContact CB-CG 4.31Å; V169-L177 HydrophobicContact CG2-CD2 3.96Å; R173-L177 PolarHBondContact O-N 3.09Å; V174-L177 PolarHBondContact O-N 3.33Å; V174-L177 VanDerWaalsContact O-N 3.07Å; L177-C179 VanDerWaalsContact C-N 3.35Å; L177-C179 PolarHBondContact O-N 3Å; L177-A180 PolarHBondContact O-N 3.21Å; L177-A181 WeakPolarHBondContact O-CB 3.33Å; L177-A181 PolarHBondContact O-N 3.05Å; L177-I217 HydrophobicContact CD1-CD1 3.32Å; L177-I217 HydrophobicContact CD1-CG1 3.59Å; L177-I217 HydrophobicContact CD2-CD1 3.71Å; L177-I217 HydrophobicContact CG-CD1 4.12Å; L177-F224 HydrophobicContact CB-CB 4.16Å; L177-F224 HydrophobicContact CB-CD2 4.48Å; L177-F224 HydrophobicContact CB-CG 4.22Å; L177-F224 HydrophobicContact CD2-CD1 4.23Å; L177-F224 HydrophobicContact CD2-CD2 4.36Å; L177-F224 HydrophobicContact CD2-CE1 4.24Å; L177-F224 HydrophobicContact CD2-CE2 4.37Å; L177-F224 HydrophobicContact CD2-CG 4.29Å; L177-F224 HydrophobicContact CD2-CZ 4.3Å |
| 178 | E | 96.1 | Very high | 94.6 | Very high | 28 Ų | 28 | 32.6 Ų | 32.6 | 13% | 0.131 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.3 | -35.1 | 173.6 | -67.9 | -63.8 | 126.3 | 0 | 0 | 112.5 | Q139 V174 I176 T182 S221 R223 | Q139-E178 PolarHBondContact NE2-O 3.07Å; V174-E178 HydrophobicContact CG1-CG 4.07Å; V174-E178 PolarHBondContact O-N 3.14Å; I176-E178 VanDerWaalsContact C-N 3.33Å; I176-E178 PolarHBondContact O-N 3.28Å; E178-T182 PolarHBondContact O-N 3.16Å; E178-T182 PolarHBondContact O-OG1 3.48Å; E178-S221 PolarHBondContact OE1-OG 3.03Å; E178-R223 WeakPolarHBondContact OE2-CD 3.4Å; E178-R223 IonicContact OE2-CZ 3.92Å; E178-R223 IonicContact OE2-NH1 3.05Å; E178-R223 PolarHBondContact OE2-NH1 3.2Å |
| 179 | C | 97.5 | Very high | 94.5 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.5 | -44.2 | 171 | -68.7 | 0 | 0 | 0 | 0 | 111.8 | F142 P175 I176 L177 A181 T182 W183 | F142-C179 HydrophobicContact CB-CB 3.78Å; F142-C179 HydrophobicContact CD1-CB 3.94Å; F142-C179 HydrophobicContact CD2-CB 3.41Å; F142-C179 VanDerWaalsContact CD2-CB 3.41Å; F142-C179 HydrophobicContact CE1-CB 4.35Å; F142-C179 HydrophobicContact CE2-CB 3.87Å; F142-C179 HydrophobicContact CG-CB 3.43Å; F142-C179 VanDerWaalsContact CG-CB 3.43Å; F142-C179 HydrophobicContact CZ-CB 4.3Å; P175-C179 PolarHBondContact O-N 3.33Å; P175-C179 PolarHBondContact O-SG 3.02Å; P175-C179 VanDerWaalsContact O-SG 3.34Å; I176-C179 CarbonylContact O-C 3.29Å; I176-C179 WeakPolarHBondContact O-CB 3.49Å; I176-C179 PolarHBondContact O-N 2.91Å; I176-C179 VanDerWaalsContact O-N 3.13Å; L177-C179 VanDerWaalsContact C-N 3.35Å; L177-C179 PolarHBondContact O-N 3Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.42Å; C179-T182 WeakPolarHBondContact O-CB 3.33Å; C179-T182 PolarHBondContact O-N 2.94Å; C179-T182 VanDerWaalsContact O-N 3.16Å; C179-W183 WeakPolarHBondContact O-CB 3.48Å; C179-W183 PolarHBondContact O-N 3.22Å |
| 180 | A | 97.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.4 | -39.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | F142 V165 I176 L177 T182 W183 L184 F224 | F142-A180 HydrophobicContact CZ-CB 4.18Å; V165-A180 HydrophobicContact CG1-CB 4.42Å; V165-A180 HydrophobicContact CG2-CB 3.84Å; I176-A180 WeakPolarHBondContact O-CB 3.37Å; I176-A180 PolarHBondContact O-N 3.42Å; L177-A180 PolarHBondContact O-N 3.21Å; A180-T182 VanDerWaalsContact C-N 3.31Å; A180-T182 PolarHBondContact O-N 3.15Å; A180-W183 PolarHBondContact O-N 2.96Å; A180-L184 WeakPolarHBondContact O-CB 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.34Å; A180-L184 PolarHBondContact O-N 3.07Å; A180-F224 HydrophobicContact CB-CD2 3.98Å; A180-F224 HydrophobicContact CB-CE2 3.95Å |
| 181 | A | 96 | Very high | 94.6 | Very high | 4 Ų | 4 | 43.3 Ų | 43.3 | 3% | 0.033 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -58.5 | -45.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L177 C179 W183 L184 Q185 R223 F224 Q227 | L177-A181 WeakPolarHBondContact O-CB 3.33Å; L177-A181 PolarHBondContact O-N 3.05Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.42Å; A181-W183 VanDerWaalsContact C-N 3.33Å; A181-W183 PolarHBondContact O-N 3.21Å; A181-L184 PolarHBondContact O-N 3Å; A181-Q185 PolarHBondContact O-N 3.18Å; A181-Q185 VanDerWaalsContact O-N 3.16Å; A181-R223 HydrophobicContact CB-CB 4.04Å; A181-F224 HydrophobicContact CB-CB 4.17Å; A181-Q227 HydrophobicContact CB-CG 4.41Å |
| 182 | T | 93.8 | Very high | 94.8 | Very high | 32 Ų | 32 | 39.5 Ų | 39.5 | 20% | 0.196 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.7 | -36.5 | 179 | -58.4 | 0 | 0 | 0 | 0 | 112 | Q139 E178 C179 A180 R186 | Q139-T182 PolarHBondContact NE2-OG1 3.33Å; Q139-T182 VanDerWaalsContact OE1-CB 3.24Å; E178-T182 PolarHBondContact O-N 3.16Å; E178-T182 PolarHBondContact O-OG1 3.48Å; C179-T182 WeakPolarHBondContact O-CB 3.33Å; C179-T182 PolarHBondContact O-N 2.94Å; C179-T182 VanDerWaalsContact O-N 3.16Å; A180-T182 VanDerWaalsContact C-N 3.31Å; A180-T182 PolarHBondContact O-N 3.15Å; T182-R186 PolarHBondContact O-N 3.27Å |
| 183 | W | 95.3 | Very high | 95.1 | Very high | 15 Ų | 15 | 38.7 Ų | 38.7 | 6% | 0.057 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.5 | -45.7 | 175 | -178.6 | 95.6 | 0 | 0 | 0 | 111.8 | F142 F146 L148 M158 L161 C179 A180 A181 Q185 R186 T187 L195 | F142-W183 HydrophobicContact CD1-CB 4.17Å; F142-W183 HydrophobicContact CD1-CG 4.49Å; F142-W183 HydrophobicContact CE1-CB 3.67Å; F142-W183 AromaticContact CE1-CG 3.89Å; F142-W183 HydrophobicContact CE1-CG 3.89Å; F146-W183 PolarHBondContact O-NE1 3.46Å; L148-W183 HydrophobicContact CD1-CZ2 4.32Å; M158-W183 HydrophobicContact CE-CH2 4.18Å; M158-W183 HydrophobicContact SD-CH2 3.83Å; M158-W183 HydrophobicContact SD-CZ2 3.9Å; L161-W183 HydrophobicContact CD2-CD2 4.02Å; L161-W183 HydrophobicContact CD2-CE3 4.1Å; L161-W183 HydrophobicContact CD2-CH2 3.52Å; L161-W183 HydrophobicContact CD2-CZ2 3.39Å; L161-W183 HydrophobicContact CD2-CZ3 3.88Å; C179-W183 WeakPolarHBondContact O-CB 3.48Å; C179-W183 PolarHBondContact O-N 3.22Å; A180-W183 PolarHBondContact O-N 2.96Å; A181-W183 VanDerWaalsContact C-N 3.33Å; A181-W183 PolarHBondContact O-N 3.21Å; W183-Q185 PolarHBondContact O-N 3.19Å; W183-R186 PolarHBondContact O-N 2.94Å; W183-R186 VanDerWaalsContact O-N 3.11Å; W183-T187 VanDerWaalsContact CE2-OG1 3.28Å; W183-T187 HydrophobicContact CH2-CG2 3.82Å; W183-T187 HydrophobicContact CZ2-CG2 3.65Å; W183-T187 HydrophobicContact CZ3-CG2 4.33Å; W183-T187 PolarHBondContact NE1-OG1 3.2Å; W183-T187 VanDerWaalsContact O-CB 3.24Å; W183-T187 WeakPolarHBondContact O-CB 3.37Å; W183-T187 PolarHBondContact O-N 3.39Å; W183-T187 PolarHBondContact O-OG1 3.38Å; W183-L195 HydrophobicContact CE3-CD2 4.24Å; W183-L195 HydrophobicContact CZ3-CB 4.45Å; W183-L195 HydrophobicContact CZ3-CD2 3.9Å |
| 184 | L | 95.4 | Very high | 95.1 | Very high | 3 Ų | 3 | 38.9 Ų | 38.9 | 2% | 0.016 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.4 | -37.3 | 176.1 | -77.4 | 168 | 0 | 0 | 0 | 111.9 | A180 A181 R186 C192 L195 F224 Q227 | A180-L184 WeakPolarHBondContact O-CB 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.34Å; A180-L184 PolarHBondContact O-N 3.07Å; A181-L184 PolarHBondContact O-N 3Å; L184-R186 VanDerWaalsContact C-N 3.33Å; L184-R186 PolarHBondContact O-N 2.79Å; L184-C192 HydrophobicContact CD2-CB 3.58Å; L184-C192 PolarHBondContact O-SG 3.16Å; L184-C192 VanDerWaalsContact O-SG 3.35Å; L184-L195 HydrophobicContact CD2-CD2 4.17Å; L184-L195 HydrophobicContact CG-CD2 4.47Å; L184-F224 HydrophobicContact CD1-CD2 4.44Å; L184-F224 HydrophobicContact CD1-CE2 4.23Å; L184-Q227 HydrophobicContact CB-CB 3.86Å; L184-Q227 HydrophobicContact CB-CG 4.3Å; L184-Q227 HydrophobicContact CD1-CB 3.71Å; L184-Q227 HydrophobicContact CG-CB 4.44Å |
| 185 | Q | 91.1 | Very high | 95.2 | Very high | 26 Ų | 26 | 36.6 Ų | 36.6 | 12% | 0.121 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -68.5 | -30.4 | 179.1 | -173.6 | 178 | 19.1 | 0 | 0 | 113.7 | A181 W183 T267 S271 M284 | A181-Q185 PolarHBondContact O-N 3.18Å; A181-Q185 VanDerWaalsContact O-N 3.16Å; W183-Q185 PolarHBondContact O-N 3.19Å; Q185-T267 HydrophobicContact CG-CG2 4.42Å; Q185-S271 PolarHBondContact NE2-OG 3.15Å; Q185-S271 PolarHBondContact OE1-OG 3.24Å; Q185-M284 PolarHBondContact NE2-SD 3.17Å; Q185-M284 VanDerWaalsContact NE2-SD 3.43Å |
| 186 | R | 89.1 | Confident | 95.3 | Very high | 151 Ų | 151 | 35.9 Ų | 35.9 | 57% | 0.57 | 16% | 0.159 | S | C | * | . | H | α-helix | trans | -106.2 | -11 | -171.5 | -69.2 | -171.4 | 166.6 | 90 | -0.5 | 114 | T182 W183 L184 | T182-R186 PolarHBondContact O-N 3.27Å; W183-R186 PolarHBondContact O-N 2.94Å; W183-R186 VanDerWaalsContact O-N 3.11Å; L184-R186 VanDerWaalsContact C-N 3.33Å; L184-R186 PolarHBondContact O-N 2.79Å |
| 187 | T | 91.4 | Very high | 95.2 | Very high | 11 Ų | 11 | 38.5 Ų | 38.5 | 7% | 0.067 | 17% | 0.171 | C | C | . | . | S | Bend | trans | -92.6 | 152.9 | -176.9 | -61.5 | 0 | 0 | 0 | 0 | 111.3 | L148 W183 R189 Y191 | L148-T187 HydrophobicContact CD1-CG2 4.1Å; W183-T187 VanDerWaalsContact CE2-OG1 3.28Å; W183-T187 HydrophobicContact CH2-CG2 3.82Å; W183-T187 HydrophobicContact CZ2-CG2 3.65Å; W183-T187 HydrophobicContact CZ3-CG2 4.33Å; W183-T187 PolarHBondContact NE1-OG1 3.2Å; W183-T187 VanDerWaalsContact O-CB 3.24Å; W183-T187 WeakPolarHBondContact O-CB 3.37Å; W183-T187 PolarHBondContact O-N 3.39Å; W183-T187 PolarHBondContact O-OG1 3.38Å; T187-R189 PolarHBondContact O-N 3.17Å; T187-Y191 HydrophobicContact CG2-CD2 4.12Å; T187-Y191 HydrophobicContact CG2-CG 4.41Å |
| 188 | H | 92.4 | Very high | 95.2 | Very high | 74 Ų | 74 | 40.8 Ų | 40.8 | 34% | 0.343 | 19% | 0.185 | S | C | . | . | B | Isolated β-bridge | trans | -57 | 135.9 | 173.9 | -173.7 | -73.8 | 0 | 0 | 0 | 111.3 | V190 Y191 C192 S280 | H188-V190 PolarHBondContact ND1-N 2.84Å; H188-V190 PolarHBondContact O-N 3.47Å; H188-Y191 HydrophobicContact CB-CD2 3.98Å; H188-Y191 HydrophobicContact CB-CE2 4.27Å; H188-Y191 PolarHBondContact O-N 3.37Å; H188-C192 PolarHBondContact O-N 3.29Å; H188-C192 PolarHBondContact O-SG 3.35Å; H188-S280 WeakPolarHBondContact CA-O 3.04Å; H188-S280 WeakPolarHBondContact CD2-CB 3.32Å; H188-S280 PolarHBondContact CD2-OG 3.3Å; H188-S280 WeakPolarHBondContact NE2-CB 3.45Å |
| 189 | R | 93.6 | Very high | 95.1 | Very high | 144 Ų | 144 | 39.5 Ų | 39.5 | 54% | 0.543 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -50.8 | -36.7 | -172.4 | 65.5 | -175.9 | -179 | -174 | -0.8 | 114.7 | T187 Y191 C192 V193 S280 L282 | T187-R189 PolarHBondContact O-N 3.17Å; R189-Y191 VanDerWaalsContact C-N 3.34Å; R189-Y191 PolarHBondContact O-N 3.45Å; R189-C192 WeakPolarHBondContact O-CB 3.44Å; R189-C192 PolarHBondContact O-N 2.97Å; R189-V193 WeakPolarHBondContact O-CG2 3.48Å; R189-V193 PolarHBondContact O-N 3.02Å; R189-S280 WeakPolarHBondContact CB-O 3.28Å; R189-S280 PolarHBondContact N-O 3Å; R189-L282 HydrophobicContact CB-CD2 3.93Å |
| 190 | V | 93.8 | Very high | 95 | Very high | 78 Ų | 78 | 39.5 Ų | 39.5 | 47% | 0.473 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -57.9 | -43.2 | 179.6 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | H188 R194 | H188-V190 PolarHBondContact ND1-N 2.84Å; H188-V190 PolarHBondContact O-N 3.47Å; V190-R194 WeakPolarHBondContact O-CG 3.26Å; V190-R194 PolarHBondContact O-N 3.27Å |
| 191 | Y | 95.5 | Very high | 94.8 | Very high | 63 Ų | 63 | 41.8 Ų | 41.8 | 25% | 0.247 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -76.4 | -30.1 | 179.4 | -56.6 | -77.3 | 0 | 0 | 0 | 112.3 | L148 M158 T187 H188 R189 R194 L195 | L148-Y191 HydrophobicContact CD1-CD1 3.44Å; L148-Y191 VanDerWaalsContact CD1-CD1 3.44Å; L148-Y191 HydrophobicContact CD1-CD2 3.23Å; L148-Y191 HydrophobicContact CD1-CE1 3.67Å; L148-Y191 HydrophobicContact CD1-CE2 3.49Å; L148-Y191 VanDerWaalsContact CD1-CE2 3.49Å; L148-Y191 HydrophobicContact CD1-CG 3.2Å; M158-Y191 HydrophobicContact CG-CD1 4.16Å; M158-Y191 HydrophobicContact SD-CD1 4.09Å; M158-Y191 HydrophobicContact SD-CG 4.45Å; T187-Y191 HydrophobicContact CG2-CD2 4.12Å; T187-Y191 HydrophobicContact CG2-CG 4.41Å; H188-Y191 HydrophobicContact CB-CD2 3.98Å; H188-Y191 HydrophobicContact CB-CE2 4.27Å; H188-Y191 PolarHBondContact O-N 3.37Å; R189-Y191 VanDerWaalsContact C-N 3.34Å; R189-Y191 PolarHBondContact O-N 3.45Å; Y191-R194 PolarHBondContact O-N 2.9Å; Y191-L195 PolarHBondContact O-N 3.45Å |
| 192 | C | 97 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.1 | -44.4 | 173.9 | -55.5 | 0 | 0 | 0 | 0 | 111 | L184 H188 R189 L195 A196 A231 L282 | L184-C192 HydrophobicContact CD2-CB 3.58Å; L184-C192 PolarHBondContact O-SG 3.16Å; L184-C192 VanDerWaalsContact O-SG 3.35Å; H188-C192 PolarHBondContact O-N 3.29Å; H188-C192 PolarHBondContact O-SG 3.35Å; R189-C192 WeakPolarHBondContact O-CB 3.44Å; R189-C192 PolarHBondContact O-N 2.97Å; C192-L195 PolarHBondContact O-N 3.49Å; C192-A196 WeakPolarHBondContact O-CB 3.5Å; C192-A196 PolarHBondContact O-N 3.48Å; C192-A231 HydrophobicContact CB-CB 4.48Å; C192-L282 HydrophobicContact CB-CD1 3.56Å; C192-L282 HydrophobicContact CB-CD2 4.19Å; C192-L282 HydrophobicContact CB-CG 3.85Å |
| 193 | V | 97.1 | Very high | 94.4 | Very high | 30 Ų | 30 | 42.9 Ų | 42.9 | 18% | 0.182 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.3 | -42.2 | 173.9 | 166.7 | 0 | 0 | 0 | 0 | 111.3 | R189 L195 A196 Q197 T234 L235 | R189-V193 WeakPolarHBondContact O-CG2 3.48Å; R189-V193 PolarHBondContact O-N 3.02Å; V193-L195 PolarHBondContact O-N 3.25Å; V193-A196 PolarHBondContact O-N 2.84Å; V193-Q197 WeakPolarHBondContact O-CB 3.39Å; V193-Q197 PolarHBondContact O-N 2.86Å; V193-T234 HydrophobicContact CG2-CG2 3.77Å; V193-L235 HydrophobicContact CG1-CB 3.8Å; V193-L235 HydrophobicContact CG1-CD1 3.47Å; V193-L235 VanDerWaalsContact CG1-CD1 3.47Å; V193-L235 HydrophobicContact CG1-CG 4.1Å; V193-L235 HydrophobicContact CG2-CB 4.38Å |
| 194 | R | 96.8 | Very high | 94.1 | Very high | 92 Ų | 92 | 42.9 Ų | 42.9 | 35% | 0.347 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -58.7 | -44.7 | 174.5 | -74.7 | 175.9 | 67.7 | 179.4 | 4.6 | 112.5 | E155 M158 V190 Y191 V198 | E155-R194 IonicContact OE1-CZ 2.75Å; E155-R194 IonicContact OE1-NH1 2.9Å; E155-R194 PolarHBondContact OE1-NH1 3Å; E155-R194 IonicContact OE1-NH2 3.4Å; E155-R194 PolarHBondContact OE1-NH2 3.45Å; E155-R194 IonicContact OE2-CZ 3.47Å; E155-R194 IonicContact OE2-NH1 3.63Å; E155-R194 IonicContact OE2-NH2 3.39Å; E155-R194 PolarHBondContact OE2-NH2 2.88Å; M158-R194 HydrophobicContact CE-CB 4.13Å; V190-R194 WeakPolarHBondContact O-CG 3.26Å; V190-R194 PolarHBondContact O-N 3.27Å; Y191-R194 PolarHBondContact O-N 2.9Å; R194-V198 PolarHBondContact O-N 3.21Å |
| 195 | L | 98 | Very high | 93.4 | Very high | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.3 | -45 | 176.6 | 177 | 59.3 | 0 | 0 | 0 | 111.1 | M158 L161 V165 W183 L184 Y191 C192 V193 Q197 V198 L199 | M158-L195 HydrophobicContact CE-CB 4.46Å; L161-L195 HydrophobicContact CD2-CD2 4.37Å; V165-L195 HydrophobicContact CB-CD1 4.23Å; V165-L195 HydrophobicContact CG1-CD1 4.49Å; V165-L195 HydrophobicContact CG2-CD1 4.47Å; V165-L195 HydrophobicContact CG2-CD2 4.44Å; W183-L195 HydrophobicContact CE3-CD2 4.24Å; W183-L195 HydrophobicContact CZ3-CB 4.45Å; W183-L195 HydrophobicContact CZ3-CD2 3.9Å; L184-L195 HydrophobicContact CD2-CD2 4.17Å; L184-L195 HydrophobicContact CG-CD2 4.47Å; Y191-L195 PolarHBondContact O-N 3.45Å; C192-L195 PolarHBondContact O-N 3.49Å; V193-L195 PolarHBondContact O-N 3.25Å; L195-Q197 VanDerWaalsContact C-N 3.33Å; L195-Q197 PolarHBondContact O-N 3.16Å; L195-V198 PolarHBondContact O-N 3.41Å; L195-L199 HydrophobicContact CG-CD1 4.49Å; L195-L199 WeakPolarHBondContact O-CG 3.31Å; L195-L199 PolarHBondContact O-N 3.5Å |
| 196 | A | 97.6 | Very high | 92.6 | Very high | 1 Ų | 1 | 50.3 Ų | 50.3 | 1% | 0.008 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.7 | -42.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | C192 V193 V198 L199 V200 F228 A231 V232 | C192-A196 WeakPolarHBondContact O-CB 3.5Å; C192-A196 PolarHBondContact O-N 3.48Å; V193-A196 PolarHBondContact O-N 2.84Å; A196-V198 PolarHBondContact O-N 3.26Å; A196-L199 PolarHBondContact O-N 3.44Å; A196-V200 VanDerWaalsContact O-CG2 3.32Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 2.87Å; A196-F228 HydrophobicContact CB-CD2 4.34Å; A196-F228 HydrophobicContact CB-CE2 4.15Å; A196-A231 HydrophobicContact CB-CB 3.64Å; A196-V232 HydrophobicContact CB-CG1 3.89Å |
| 197 | Q | 96.9 | Very high | 91.7 | Very high | 55 Ų | 55 | 47 Ų | 47 | 26% | 0.257 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -56.5 | -48.8 | 175.8 | -178.6 | 62.8 | 58.5 | 0 | 0 | 111.4 | V193 L195 L199 V200 D201 L235 | V193-Q197 WeakPolarHBondContact O-CB 3.39Å; V193-Q197 PolarHBondContact O-N 2.86Å; L195-Q197 VanDerWaalsContact C-N 3.33Å; L195-Q197 PolarHBondContact O-N 3.16Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.42Å; Q197-V200 PolarHBondContact O-N 3.24Å; Q197-D201 PolarHBondContact NE2-OD1 3.45Å; Q197-D201 PolarHBondContact NE2-OD2 3.35Å; Q197-D201 VanDerWaalsContact O-CG 3.25Å; Q197-D201 PolarHBondContact O-N 3.27Å; Q197-L235 HydrophobicContact CB-CD2 3.92Å |
| 198 | V | 96.2 | Very high | 90.7 | Very high | 48 Ų | 48 | 52.5 Ų | 52.5 | 29% | 0.291 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -59.4 | -41.7 | 178.9 | 175.9 | 0 | 0 | 0 | 0 | 111.7 | R194 L195 A196 D201 D202 | R194-V198 PolarHBondContact O-N 3.21Å; L195-V198 PolarHBondContact O-N 3.41Å; A196-V198 PolarHBondContact O-N 3.26Å; V198-D201 PolarHBondContact O-N 2.89Å; V198-D202 WeakPolarHBondContact O-CB 3.39Å; V198-D202 VanDerWaalsContact O-CG 3.29Å; V198-D202 PolarHBondContact O-N 2.85Å |
| 199 | L | 95.9 | Very high | 89.6 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 1% | 0.005 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -68.9 | -37.8 | 178.7 | -63.1 | 176.5 | 0 | 0 | 0 | 112.3 | V165 L195 A196 Q197 D201 D202 Y203 F224 F228 | V165-L199 HydrophobicContact CG1-CD1 4.01Å; V165-L199 HydrophobicContact CG1-CD2 4.22Å; L195-L199 HydrophobicContact CG-CD1 4.49Å; L195-L199 WeakPolarHBondContact O-CG 3.31Å; L195-L199 PolarHBondContact O-N 3.5Å; A196-L199 PolarHBondContact O-N 3.44Å; Q197-L199 VanDerWaalsContact C-N 3.3Å; Q197-L199 PolarHBondContact O-N 3.42Å; L199-D201 VanDerWaalsContact C-N 3.32Å; L199-D202 PolarHBondContact O-N 2.95Å; L199-Y203 HydrophobicContact CD2-CE2 4.24Å; L199-Y203 WeakPolarHBondContact O-CB 3.48Å; L199-Y203 VanDerWaalsContact O-CD2 3.29Å; L199-Y203 WeakPolarHBondContact O-CD2 3.35Å; L199-Y203 PolarHBondContact O-N 3.11Å; L199-F224 HydrophobicContact CD1-CZ 3.75Å; L199-F228 HydrophobicContact CB-CE2 3.86Å; L199-F228 HydrophobicContact CB-CZ 4.37Å; L199-F228 HydrophobicContact CD1-CD2 4.04Å; L199-F228 HydrophobicContact CD1-CE2 3.95Å |
| 200 | V | 94.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.5 | -41.5 | 174.5 | 176.6 | 0 | 0 | 0 | 0 | 110 | A196 Q197 Y203 C204 S205 F228 V232 Y236 P246 L249 | A196-V200 VanDerWaalsContact O-CG2 3.32Å; A196-V200 WeakPolarHBondContact O-CG2 3.47Å; A196-V200 PolarHBondContact O-N 2.87Å; Q197-V200 PolarHBondContact O-N 3.24Å; V200-Y203 PolarHBondContact O-N 2.96Å; V200-C204 HydrophobicContact CG1-CB 3.92Å; V200-C204 WeakPolarHBondContact O-CA 3.48Å; V200-C204 VanDerWaalsContact O-CB 3.24Å; V200-C204 WeakPolarHBondContact O-CB 3.24Å; V200-C204 PolarHBondContact O-N 3.41Å; V200-S205 PolarHBondContact O-N 3.38Å; V200-S205 VanDerWaalsContact O-N 3.14Å; V200-F228 HydrophobicContact CG2-CE2 4.34Å; V200-F228 HydrophobicContact CG2-CZ 3.83Å; V200-V232 HydrophobicContact CG2-CG1 3.83Å; V200-Y236 HydrophobicContact CG1-CE2 4.2Å; V200-Y236 VanDerWaalsContact CG1-OH 3.28Å; V200-Y236 WeakPolarHBondContact CG1-OH 3.47Å; V200-Y236 HydrophobicContact CG2-CE2 4.25Å; V200-P246 HydrophobicContact CG1-CG 3.84Å; V200-L249 HydrophobicContact CG1-CD2 4.24Å; V200-L249 HydrophobicContact CG2-CD1 4.22Å; V200-L249 HydrophobicContact CG2-CD2 3.88Å |
| 201 | D | 92.9 | Very high | 88 | Confident | 49 Ų | 49 | 43.3 Ų | 43.3 | 26% | 0.262 | 26% | 0.256 | S | S | . | . | I | π-helix | trans | -60.8 | -48.1 | 175.4 | -67.1 | -27.9 | 0 | 0 | 0 | 111.2 | Q197 V198 L199 Y203 S205 M206 | Q197-D201 PolarHBondContact NE2-OD1 3.45Å; Q197-D201 PolarHBondContact NE2-OD2 3.35Å; Q197-D201 VanDerWaalsContact O-CG 3.25Å; Q197-D201 PolarHBondContact O-N 3.27Å; V198-D201 PolarHBondContact O-N 2.89Å; L199-D201 VanDerWaalsContact C-N 3.32Å; D201-Y203 PolarHBondContact O-N 3.47Å; D201-S205 PolarHBondContact O-N 2.98Å; D201-M206 HydrophobicContact CB-CE 3.82Å; D201-M206 HydrophobicContact CB-CG 4.44Å; D201-M206 HydrophobicContact CB-SD 4.48Å; D201-M206 WeakPolarHBondContact O-CB 3.14Å; D201-M206 VanDerWaalsContact O-CG 3.29Å; D201-M206 WeakPolarHBondContact O-CG 3.26Å; D201-M206 PolarHBondContact O-N 3.45Å |
| 202 | D | 91.4 | Very high | 87.4 | Confident | 42 Ų | 42 | 43.9 Ų | 43.9 | 23% | 0.225 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -64.3 | -40.7 | -179 | -74.1 | -12.3 | 0 | 0 | 0 | 113 | S166 V198 L199 M206 S210 | S166-D202 VanDerWaalsContact CB-OD2 3.25Å; S166-D202 WeakPolarHBondContact CB-OD2 3.21Å; S166-D202 PolarHBondContact OG-OD2 2.92Å; V198-D202 WeakPolarHBondContact O-CB 3.39Å; V198-D202 VanDerWaalsContact O-CG 3.29Å; V198-D202 PolarHBondContact O-N 2.85Å; L199-D202 PolarHBondContact O-N 2.95Å; D202-M206 WeakPolarHBondContact OD1-CE 3.36Å; D202-S210 PolarHBondContact O-OG 3.48Å |
| 203 | Y | 90.9 | Very high | 86.7 | Confident | 17 Ų | 17 | 46.4 Ų | 46.4 | 7% | 0.067 | 28% | 0.283 | C | S | . | . | I | π-helix | trans | -109.1 | -19.5 | -166.6 | -68.8 | -74.1 | 0 | 0 | 0 | 115.8 | S166 V169 A170 L199 V200 D201 S210 G211 T213 L214 | S166-Y203 PolarHBondContact O-OH 2.8Å; V169-Y203 HydrophobicContact CB-CE2 4.02Å; V169-Y203 HydrophobicContact CG1-CD2 4.35Å; V169-Y203 HydrophobicContact CG1-CE1 3.98Å; V169-Y203 HydrophobicContact CG1-CE2 3.79Å; A170-Y203 WeakPolarHBondContact CB-OH 3.31Å; A170-Y203 PolarHBondContact N-OH 3.1Å; L199-Y203 HydrophobicContact CD2-CE2 4.24Å; L199-Y203 WeakPolarHBondContact O-CB 3.48Å; L199-Y203 VanDerWaalsContact O-CD2 3.29Å; L199-Y203 WeakPolarHBondContact O-CD2 3.35Å; L199-Y203 PolarHBondContact O-N 3.11Å; V200-Y203 PolarHBondContact O-N 2.96Å; D201-Y203 PolarHBondContact O-N 3.47Å; Y203-S210 VanDerWaalsContact CA-OG 3.25Å; Y203-S210 WeakPolarHBondContact CA-OG 3.43Å; Y203-S210 PolarHBondContact O-OG 3.38Å; Y203-G211 WeakPolarHBondContact O-CA 3.45Å; Y203-G211 PolarHBondContact O-N 3.18Å; Y203-T213 HydrophobicContact CE1-CG2 3.84Å; Y203-L214 HydrophobicContact CD1-CB 4.22Å; Y203-L214 HydrophobicContact CD2-CD2 4.41Å; Y203-L214 HydrophobicContact CG-CB 3.99Å; Y203-L214 HydrophobicContact CG-CD2 4.27Å |
| 204 | C | 87.8 | Confident | 86 | Confident | 15 Ų | 15 | 45 Ų | 45 | 10% | 0.101 | 27% | 0.274 | C | S | . | . | I | π-helix | trans | -117.8 | -26.1 | -176.7 | -52.1 | 0 | 0 | 0 | 0 | 112.3 | V200 P246 E248 | V200-C204 HydrophobicContact CG1-CB 3.92Å; V200-C204 WeakPolarHBondContact O-CA 3.48Å; V200-C204 VanDerWaalsContact O-CB 3.24Å; V200-C204 WeakPolarHBondContact O-CB 3.24Å; V200-C204 PolarHBondContact O-N 3.41Å; C204-P246 HydrophobicContact CB-CB 4.43Å; C204-E248 HydrophobicContact CB-CB 4.33Å |
| 205 | S | 81.5 | Confident | 85.3 | Confident | 66 Ų | 66 | 43 Ų | 43 | 46% | 0.462 | 27% | 0.269 | S | S | . | . | I | π-helix | trans | -111.4 | -51.1 | -173.3 | -48.6 | 0 | 0 | 0 | 0 | 114.3 | V200 D201 | V200-S205 PolarHBondContact O-N 3.38Å; V200-S205 VanDerWaalsContact O-N 3.14Å; D201-S205 PolarHBondContact O-N 2.98Å |
| 206 | M | 74.3 | Confident | 84.6 | Confident | 119 Ų | 119 | 47.9 Ų | 47.9 | 59% | 0.586 | 30% | 0.295 | S | S | * | . | S | Bend | trans | -86.4 | -29.5 | -166 | -68.2 | -168.1 | -67.6 | 0 | 0 | 114.3 | D201 D202 | D201-M206 HydrophobicContact CB-CE 3.82Å; D201-M206 HydrophobicContact CB-CG 4.44Å; D201-M206 HydrophobicContact CB-SD 4.48Å; D201-M206 WeakPolarHBondContact O-CB 3.14Å; D201-M206 VanDerWaalsContact O-CG 3.29Å; D201-M206 WeakPolarHBondContact O-CG 3.26Å; D201-M206 PolarHBondContact O-N 3.45Å; D202-M206 WeakPolarHBondContact OD1-CE 3.36Å |
| 207 | V | 69.4 | Low | 84.2 | Confident | 81 Ų | 81 | 48.1 Ų | 48.1 | 49% | 0.491 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -119.7 | 102.4 | -175.4 | -175.6 | 0 | 0 | 0 | 0 | 110 | G209 S210 | V207-G209 PolarHBondContact O-N 3.09Å; V207-S210 PolarHBondContact O-N 3.07Å; V207-S210 VanDerWaalsContact O-N 3.17Å; V207-S210 PolarHBondContact O-OG 2.88Å |
| 208 | P | 69.8 | Low | 83.6 | Confident | 127 Ų | 127 | 47.5 Ų | 47.5 | 83% | 0.825 | 29% | 0.293 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | 128 | 175.5 | -25.1 | 34 | 0 | 0 | 0 | 111.2 | ||
| 209 | G | 70.6 | Confident | 83.2 | Confident | 70 Ų | 70 | 49.8 Ų | 49.8 | 72% | 0.722 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.2 | 9 | 179 | 0 | 0 | 0 | 0 | 0 | 115.8 | V207 P212 | V207-G209 PolarHBondContact O-N 3.09Å; G209-P212 VanDerWaalsContact O-CD 3.25Å; G209-P212 WeakPolarHBondContact O-CD 3.5Å |
| 210 | S | 76.6 | Confident | 82.9 | Confident | 11 Ų | 11 | 52 Ų | 52 | 8% | 0.077 | 33% | 0.329 | C | S | . | . | trans | -83.4 | -13.2 | 171.1 | 63.9 | 0 | 0 | 0 | 0 | 113.7 | D202 Y203 V207 P212 T213 | D202-S210 PolarHBondContact O-OG 3.48Å; Y203-S210 VanDerWaalsContact CA-OG 3.25Å; Y203-S210 WeakPolarHBondContact CA-OG 3.43Å; Y203-S210 PolarHBondContact O-OG 3.38Å; V207-S210 PolarHBondContact O-N 3.07Å; V207-S210 VanDerWaalsContact O-N 3.17Å; V207-S210 PolarHBondContact O-OG 2.88Å; S210-P212 VanDerWaalsContact C-N 3.33Å; S210-T213 VanDerWaalsContact O-CB 3.24Å; S210-T213 WeakPolarHBondContact O-CB 3.33Å; S210-T213 PolarHBondContact O-N 3.31Å; S210-T213 PolarHBondContact O-OG1 3.22Å | ||
| 211 | G | 76.1 | Confident | 82.9 | Confident | 21 Ų | 21 | 52 Ų | 52 | 22% | 0.216 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -47.5 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | Y203 T213 L214 H215 | Y203-G211 WeakPolarHBondContact O-CA 3.45Å; Y203-G211 PolarHBondContact O-N 3.18Å; G211-T213 PolarHBondContact O-N 2.92Å; G211-L214 PolarHBondContact O-N 3.3Å; G211-H215 WeakPolarHBondContact O-CB 3.26Å; G211-H215 PolarHBondContact O-N 3.42Å |
| 212 | P | 83.1 | Confident | 83 | Confident | 76 Ų | 76 | 51.5 Ų | 51.5 | 49% | 0.494 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58.2 | -31.8 | 175.9 | -26 | 35.7 | 0 | 0 | 0 | 114.3 | G209 S210 H215 N216 | G209-P212 VanDerWaalsContact O-CD 3.25Å; G209-P212 WeakPolarHBondContact O-CD 3.5Å; S210-P212 VanDerWaalsContact C-N 3.33Å; P212-H215 PolarHBondContact O-N 3.12Å; P212-N216 PolarHBondContact O-N 2.72Å; P212-N216 PolarHBondContact O-ND2 3.33Å; P212-N216 VanDerWaalsContact O-ND2 3.13Å |
| 213 | T | 83.7 | Confident | 83.2 | Confident | 52 Ų | 52 | 54.2 Ų | 54.2 | 32% | 0.319 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.3 | -47.8 | 179.7 | -56.5 | 0 | 0 | 0 | 0 | 110.9 | V169 Y203 S210 G211 | V169-T213 HydrophobicContact CG1-CG2 4.43Å; Y203-T213 HydrophobicContact CE1-CG2 3.84Å; S210-T213 VanDerWaalsContact O-CB 3.24Å; S210-T213 WeakPolarHBondContact O-CB 3.33Å; S210-T213 PolarHBondContact O-N 3.31Å; S210-T213 PolarHBondContact O-OG1 3.22Å; G211-T213 PolarHBondContact O-N 2.92Å |
| 214 | L | 82 | Confident | 83.5 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68.3 | -40.8 | 174.8 | -174.5 | 57.8 | 0 | 0 | 0 | 110.3 | V169 Y203 G211 N216 I217 F228 M252 W256 | V169-L214 HydrophobicContact CG1-CB 4.26Å; V169-L214 HydrophobicContact CG1-CD1 3.71Å; V169-L214 HydrophobicContact CG2-CD1 4.2Å; Y203-L214 HydrophobicContact CD1-CB 4.22Å; Y203-L214 HydrophobicContact CD2-CD2 4.41Å; Y203-L214 HydrophobicContact CG-CB 3.99Å; Y203-L214 HydrophobicContact CG-CD2 4.27Å; G211-L214 PolarHBondContact O-N 3.3Å; L214-N216 VanDerWaalsContact C-N 3.29Å; L214-N216 PolarHBondContact O-N 3.19Å; L214-I217 HydrophobicContact CD1-CG2 4.34Å; L214-I217 VanDerWaalsContact O-CB 3.3Å; L214-I217 WeakPolarHBondContact O-CB 3.31Å; L214-I217 WeakPolarHBondContact O-CG2 3.45Å; L214-I217 PolarHBondContact O-N 3.35Å; L214-I217 VanDerWaalsContact O-N 3.12Å; L214-F228 HydrophobicContact CD2-CE1 4.02Å; L214-F228 HydrophobicContact CD2-CZ 4.05Å; L214-M252 HydrophobicContact CB-SD 3.93Å; L214-M252 HydrophobicContact CD2-CE 3.64Å; L214-M252 HydrophobicContact CD2-SD 3.97Å; L214-M252 HydrophobicContact CG-CE 4.04Å; L214-M252 HydrophobicContact CG-SD 3.67Å; L214-W256 HydrophobicContact CG-CH2 4.36Å; L214-W256 WeakPolarHBondContact O-CZ2 3.48Å |
| 215 | H | 81.4 | Confident | 83.9 | Confident | 51 Ų | 51 | 52.7 Ų | 52.7 | 24% | 0.236 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -54.8 | -39.9 | 179.1 | -175.4 | -84.1 | 0 | 0 | 0 | 113.4 | G211 P212 I217 H218 M252 S255 W256 | G211-H215 WeakPolarHBondContact O-CB 3.26Å; G211-H215 PolarHBondContact O-N 3.42Å; P212-H215 PolarHBondContact O-N 3.12Å; H215-I217 PolarHBondContact O-N 3.1Å; H215-H218 PolarHBondContact O-ND1 3.43Å; H215-M252 HydrophobicContact CB-CG 4.28Å; H215-M252 HydrophobicContact CB-SD 4.29Å; H215-S255 PolarHBondContact CD2-OG 3.29Å; H215-S255 PolarHBondContact NE2-OG 2.84Å; H215-W256 AromaticContact CD2-NE1 3.72Å; H215-W256 AromaticContact CG-NE1 3.89Å; H215-W256 PolarHBondContact O-NE1 3.05Å |
| 216 | N | 84.5 | Confident | 84.7 | Confident | 103 Ų | 103 | 49.6 Ų | 49.6 | 55% | 0.551 | 31% | 0.306 | S | S | * | . | G | 310 helix | trans | -69.4 | -13.4 | -176.2 | -70.1 | -25.3 | 0 | 0 | 0 | 114 | P212 L214 H218 S219 | P212-N216 PolarHBondContact O-N 2.72Å; P212-N216 PolarHBondContact O-ND2 3.33Å; P212-N216 VanDerWaalsContact O-ND2 3.13Å; L214-N216 VanDerWaalsContact C-N 3.29Å; L214-N216 PolarHBondContact O-N 3.19Å; N216-H218 VanDerWaalsContact C-N 3.35Å; N216-H218 PolarHBondContact O-N 2.9Å; N216-S219 PolarHBondContact O-OG 3.33Å; N216-S219 VanDerWaalsContact O-OG 3.1Å |
| 217 | I | 88.1 | Confident | 85.8 | Confident | 7 Ų | 7 | 44 Ų | 44 | 4% | 0.036 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -73.6 | -23.6 | -172.3 | -144.5 | 175.5 | 0 | 0 | 0 | 113.6 | V169 L177 L214 H215 S219 A220 S221 F224 C225 W256 | V169-I217 HydrophobicContact CB-CD1 4.06Å; V169-I217 HydrophobicContact CG1-CD1 4.09Å; V169-I217 HydrophobicContact CG2-CD1 3.62Å; L177-I217 HydrophobicContact CD1-CD1 3.32Å; L177-I217 HydrophobicContact CD1-CG1 3.59Å; L177-I217 HydrophobicContact CD2-CD1 3.71Å; L177-I217 HydrophobicContact CG-CD1 4.12Å; L214-I217 HydrophobicContact CD1-CG2 4.34Å; L214-I217 VanDerWaalsContact O-CB 3.3Å; L214-I217 WeakPolarHBondContact O-CB 3.31Å; L214-I217 WeakPolarHBondContact O-CG2 3.45Å; L214-I217 PolarHBondContact O-N 3.35Å; L214-I217 VanDerWaalsContact O-N 3.12Å; H215-I217 PolarHBondContact O-N 3.1Å; I217-S219 VanDerWaalsContact C-N 3.25Å; I217-S219 PolarHBondContact O-N 3.16Å; I217-A220 PolarHBondContact O-N 2.73Å; I217-S221 PolarHBondContact O-N 3.46Å; I217-F224 HydrophobicContact CD1-CD1 4.03Å; I217-F224 HydrophobicContact CD1-CE1 4.12Å; I217-C225 WeakPolarHBondContact CG2-SG 3.42Å; I217-W256 HydrophobicContact CG2-CH2 4.28Å; I217-W256 HydrophobicContact CG2-CZ2 4.15Å |
| 218 | H | 85.7 | Confident | 87.1 | Confident | 41 Ų | 41 | 40.2 Ų | 40.2 | 19% | 0.19 | 26% | 0.256 | C | S | . | . | G | 310 helix | trans | -61.3 | -33.8 | -175 | 76.4 | -80.2 | 0 | 0 | 0 | 113.2 | H215 N216 C225 W256 | H215-H218 PolarHBondContact O-ND1 3.43Å; N216-H218 VanDerWaalsContact C-N 3.35Å; N216-H218 PolarHBondContact O-N 2.9Å; H218-C225 WeakPolarHBondContact CA-SG 3.45Å; H218-W256 HydrophobicContact CB-CD2 3.95Å; H218-W256 HydrophobicContact CB-CG 3.86Å; H218-W256 AromaticContact CG-CD1 3.52Å; H218-W256 AromaticContact CG-NE1 3.7Å; H218-W256 AromaticContact ND1-CD1 3.46Å; H218-W256 AromaticContact ND1-NE1 3.4Å; H218-W256 PolarHBondContact ND1-NE1 2.98Å |
| 219 | S | 86.4 | Confident | 88.5 | Confident | 96 Ų | 96 | 34.2 Ų | 34.2 | 67% | 0.671 | 22% | 0.217 | S | C | * | . | G | 310 helix | trans | -72.2 | -29.5 | 175.7 | 67.3 | 0 | 0 | 0 | 0 | 112.8 | N216 I217 | N216-S219 PolarHBondContact O-OG 3.33Å; N216-S219 VanDerWaalsContact O-OG 3.1Å; I217-S219 VanDerWaalsContact C-N 3.25Å; I217-S219 PolarHBondContact O-N 3.16Å |
| 220 | A | 90.9 | Very high | 89.8 | Confident | 47 Ų | 47 | 30.9 Ų | 30.9 | 39% | 0.388 | 18% | 0.183 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | -38.6 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | V174 I217 | V174-A220 HydrophobicContact CG2-CB 3.83Å; I217-A220 PolarHBondContact O-N 2.73Å |
| 221 | S | 94.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | trans | -139.6 | 76.1 | 178.6 | -171.9 | 0 | 0 | 0 | 0 | 111.1 | E178 I217 R223 F224 C225 | E178-S221 PolarHBondContact OE1-OG 3.03Å; I217-S221 PolarHBondContact O-N 3.46Å; S221-R223 PolarHBondContact O-N 2.89Å; S221-F224 PolarHBondContact O-N 3.5Å; S221-F224 VanDerWaalsContact OG-CB 3.28Å; S221-F224 WeakPolarHBondContact OG-CB 3.5Å; S221-C225 PolarHBondContact O-N 2.84Å | ||
| 222 | P | 95.3 | Very high | 91.9 | Very high | 40 Ų | 40 | 29.4 Ų | 29.4 | 26% | 0.26 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -63.3 | -29.5 | 180 | 23.7 | -33.8 | 0 | 0 | 0 | 112.6 | C225 C226 L263 | P222-C225 PolarHBondContact O-N 2.95Å; P222-C226 WeakPolarHBondContact O-CB 3.4Å; P222-C226 PolarHBondContact O-N 3.13Å; P222-L263 HydrophobicContact CB-CD1 3.6Å; P222-L263 WeakPolarHBondContact O-CD1 3.49Å |
| 223 | R | 94.7 | Very high | 92.5 | Very high | 99 Ų | 99 | 25.8 Ų | 25.8 | 37% | 0.374 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -63.8 | -42.6 | 175.8 | -65.8 | -164.5 | -174.8 | 109.9 | -3.3 | 111.8 | E178 A181 S221 C226 Q227 I266 N270 | E178-R223 WeakPolarHBondContact OE2-CD 3.4Å; E178-R223 IonicContact OE2-CZ 3.92Å; E178-R223 IonicContact OE2-NH1 3.05Å; E178-R223 PolarHBondContact OE2-NH1 3.2Å; A181-R223 HydrophobicContact CB-CB 4.04Å; S221-R223 PolarHBondContact O-N 2.89Å; R223-C226 PolarHBondContact O-N 3.04Å; R223-Q227 WeakPolarHBondContact O-CG 3.43Å; R223-Q227 PolarHBondContact O-N 2.99Å; R223-I266 HydrophobicContact CG-CG1 4.27Å; R223-I266 HydrophobicContact CG-CG2 4.38Å; R223-N270 PolarHBondContact NH2-OD1 2.92Å |
| 224 | F | 96.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.8 | -47.9 | 175.3 | 177.9 | -99.3 | 0 | 0 | 0 | 111.1 | V165 V169 L177 A180 A181 L184 L199 I217 S221 C226 Q227 F228 | V165-F224 HydrophobicContact CG1-CE2 3.81Å; V165-F224 HydrophobicContact CG1-CZ 3.79Å; V169-F224 HydrophobicContact CG2-CE1 4.27Å; V169-F224 HydrophobicContact CG2-CZ 4.48Å; L177-F224 HydrophobicContact CB-CB 4.16Å; L177-F224 HydrophobicContact CB-CD2 4.48Å; L177-F224 HydrophobicContact CB-CG 4.22Å; L177-F224 HydrophobicContact CD2-CD1 4.23Å; L177-F224 HydrophobicContact CD2-CD2 4.36Å; L177-F224 HydrophobicContact CD2-CE1 4.24Å; L177-F224 HydrophobicContact CD2-CE2 4.37Å; L177-F224 HydrophobicContact CD2-CG 4.29Å; L177-F224 HydrophobicContact CD2-CZ 4.3Å; A180-F224 HydrophobicContact CB-CD2 3.98Å; A180-F224 HydrophobicContact CB-CE2 3.95Å; A181-F224 HydrophobicContact CB-CB 4.17Å; L184-F224 HydrophobicContact CD1-CD2 4.44Å; L184-F224 HydrophobicContact CD1-CE2 4.23Å; L199-F224 HydrophobicContact CD1-CZ 3.75Å; I217-F224 HydrophobicContact CD1-CD1 4.03Å; I217-F224 HydrophobicContact CD1-CE1 4.12Å; S221-F224 PolarHBondContact O-N 3.5Å; S221-F224 VanDerWaalsContact OG-CB 3.28Å; S221-F224 WeakPolarHBondContact OG-CB 3.5Å; F224-C226 VanDerWaalsContact C-N 3.35Å; F224-C226 PolarHBondContact O-N 3.22Å; F224-Q227 PolarHBondContact O-N 3.02Å; F224-Q227 VanDerWaalsContact O-N 3.16Å; F224-F228 HydrophobicContact CE1-CB 4.38Å; F224-F228 WeakPolarHBondContact O-CB 3.24Å; F224-F228 PolarHBondContact O-N 3.31Å |
| 225 | C | 97 | Very high | 93.9 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.1 | -46.6 | 176.1 | -77.8 | 0 | 0 | 0 | 0 | 112.6 | I217 H218 S221 P222 Q227 F228 I229 W256 L263 | I217-C225 WeakPolarHBondContact CG2-SG 3.42Å; H218-C225 WeakPolarHBondContact CA-SG 3.45Å; S221-C225 PolarHBondContact O-N 2.84Å; P222-C225 PolarHBondContact O-N 2.95Å; C225-Q227 VanDerWaalsContact C-N 3.31Å; C225-Q227 PolarHBondContact O-N 3.33Å; C225-F228 PolarHBondContact O-N 2.91Å; C225-I229 WeakPolarHBondContact O-CG1 3.33Å; C225-I229 PolarHBondContact O-N 2.92Å; C225-W256 HydrophobicContact CB-CE3 4.13Å; C225-W256 HydrophobicContact CB-CH2 4.48Å; C225-W256 HydrophobicContact CB-CZ3 3.95Å; C225-W256 VanDerWaalsContact SG-CH2 3.56Å; C225-L263 HydrophobicContact CB-CD1 3.95Å; C225-L263 HydrophobicContact CB-CD2 4.25Å |
| 226 | C | 97.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -57.1 | -45.1 | 177.3 | -179.7 | 0 | 0 | 0 | 0 | 112.2 | P222 R223 F224 T230 L263 I266 T267 | P222-C226 WeakPolarHBondContact O-CB 3.4Å; P222-C226 PolarHBondContact O-N 3.13Å; R223-C226 PolarHBondContact O-N 3.04Å; F224-C226 VanDerWaalsContact C-N 3.35Å; F224-C226 PolarHBondContact O-N 3.22Å; C226-T230 PolarHBondContact O-N 3.23Å; C226-T230 VanDerWaalsContact O-N 3.14Å; C226-T230 PolarHBondContact O-OG1 2.63Å; C226-L263 WeakPolarHBondContact CB-O 3.33Å; C226-L263 PolarHBondContact SG-O 3.04Å; C226-I266 HydrophobicContact CB-CG2 3.39Å; C226-T267 PolarHBondContact SG-OG1 2.93Å |
| 227 | Q | 97.1 | Very high | 95 | Very high | 3 Ų | 3 | 21.7 Ų | 21.7 | 1% | 0.014 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -70.7 | -37 | 178.7 | -70.8 | -62.1 | -40 | 0 | 0 | 112.7 | A181 L184 R223 F224 C225 T230 A231 T267 | A181-Q227 HydrophobicContact CB-CG 4.41Å; L184-Q227 HydrophobicContact CB-CB 3.86Å; L184-Q227 HydrophobicContact CB-CG 4.3Å; L184-Q227 HydrophobicContact CD1-CB 3.71Å; L184-Q227 HydrophobicContact CG-CB 4.44Å; R223-Q227 WeakPolarHBondContact O-CG 3.43Å; R223-Q227 PolarHBondContact O-N 2.99Å; F224-Q227 PolarHBondContact O-N 3.02Å; F224-Q227 VanDerWaalsContact O-N 3.16Å; C225-Q227 VanDerWaalsContact C-N 3.31Å; C225-Q227 PolarHBondContact O-N 3.33Å; Q227-T230 WeakPolarHBondContact O-CB 3.32Å; Q227-T230 PolarHBondContact O-N 3.09Å; Q227-A231 WeakPolarHBondContact O-CB 3.49Å; Q227-A231 PolarHBondContact O-N 3.09Å; Q227-T267 PolarHBondContact NE2-OG1 3.46Å |
| 228 | F | 97.9 | Very high | 95.2 | Very high | 1 Ų | 1 | 21.3 Ų | 21.3 | 0% | 0.004 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62 | -46 | 174.4 | 179.9 | -110.7 | 0 | 0 | 0 | 111.1 | A196 L199 V200 L214 F224 C225 T230 A231 V232 L249 W256 | A196-F228 HydrophobicContact CB-CD2 4.34Å; A196-F228 HydrophobicContact CB-CE2 4.15Å; L199-F228 HydrophobicContact CB-CE2 3.86Å; L199-F228 HydrophobicContact CB-CZ 4.37Å; L199-F228 HydrophobicContact CD1-CD2 4.04Å; L199-F228 HydrophobicContact CD1-CE2 3.95Å; V200-F228 HydrophobicContact CG2-CE2 4.34Å; V200-F228 HydrophobicContact CG2-CZ 3.83Å; L214-F228 HydrophobicContact CD2-CE1 4.02Å; L214-F228 HydrophobicContact CD2-CZ 4.05Å; F224-F228 HydrophobicContact CE1-CB 4.38Å; F224-F228 WeakPolarHBondContact O-CB 3.24Å; F224-F228 PolarHBondContact O-N 3.31Å; C225-F228 PolarHBondContact O-N 2.91Å; F228-T230 VanDerWaalsContact C-N 3.3Å; F228-T230 PolarHBondContact O-N 3.43Å; F228-A231 PolarHBondContact O-N 3.32Å; F228-A231 VanDerWaalsContact O-N 3.12Å; F228-V232 HydrophobicContact CD1-CG1 4.36Å; F228-V232 HydrophobicContact CD2-CG1 4.07Å; F228-V232 HydrophobicContact CE1-CG1 3.93Å; F228-V232 HydrophobicContact CE2-CG1 3.58Å; F228-V232 HydrophobicContact CG-CG1 4.44Å; F228-V232 HydrophobicContact CZ-CG1 3.52Å; F228-V232 WeakPolarHBondContact O-CG2 3.34Å; F228-V232 PolarHBondContact O-N 3.34Å; F228-L249 HydrophobicContact CE1-CD1 3.89Å; F228-L249 HydrophobicContact CZ-CD1 4.22Å; F228-W256 HydrophobicContact CD1-CH2 4.3Å; F228-W256 HydrophobicContact CD1-CZ3 4.15Å |
| 229 | I | 98.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -58.1 | -43.7 | 174.2 | -60.5 | 162.4 | 0 | 0 | 0 | 110.2 | C225 A231 V232 T233 I253 W256 L263 P286 L290 | C225-I229 WeakPolarHBondContact O-CG1 3.33Å; C225-I229 PolarHBondContact O-N 2.92Å; I229-A231 VanDerWaalsContact C-N 3.32Å; I229-A231 PolarHBondContact O-N 3.22Å; I229-V232 WeakPolarHBondContact O-CG2 3.37Å; I229-V232 PolarHBondContact O-N 3.41Å; I229-T233 HydrophobicContact CG2-CG2 4.08Å; I229-T233 WeakPolarHBondContact O-CB 3.29Å; I229-T233 WeakPolarHBondContact O-CG2 3.41Å; I229-T233 PolarHBondContact O-N 2.95Å; I229-T233 PolarHBondContact O-OG1 3.25Å; I229-I253 HydrophobicContact CG1-CG1 4.23Å; I229-I253 HydrophobicContact CG1-CG2 4.36Å; I229-I253 HydrophobicContact CG2-CG2 4.17Å; I229-W256 HydrophobicContact CD1-CE3 4.13Å; I229-W256 HydrophobicContact CG1-CE3 4.27Å; I229-W256 HydrophobicContact CG1-CZ3 4.31Å; I229-L263 HydrophobicContact CD1-CD2 4.08Å; I229-P286 HydrophobicContact CB-CB 3.96Å; I229-P286 HydrophobicContact CB-CG 4.22Å; I229-P286 HydrophobicContact CG2-CB 3.45Å; I229-P286 VanDerWaalsContact CG2-CB 3.45Å; I229-P286 HydrophobicContact CG2-CG 3.92Å; I229-L290 HydrophobicContact CG2-CD1 4.21Å; I229-L290 HydrophobicContact CG2-CD2 3.85Å; I229-L290 HydrophobicContact CG2-CG 4.2Å |
| 230 | T | 97.8 | Very high | 95.2 | Very high | 1 Ų | 1 | 19 Ų | 19 | 1% | 0.006 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -61.4 | -42.1 | 177.1 | -53.4 | 0 | 0 | 0 | 0 | 111.5 | C226 Q227 F228 T233 T234 L282 D283 | C226-T230 PolarHBondContact O-N 3.23Å; C226-T230 VanDerWaalsContact O-N 3.14Å; C226-T230 PolarHBondContact O-OG1 2.63Å; Q227-T230 WeakPolarHBondContact O-CB 3.32Å; Q227-T230 PolarHBondContact O-N 3.09Å; F228-T230 VanDerWaalsContact C-N 3.3Å; F228-T230 PolarHBondContact O-N 3.43Å; T230-T233 PolarHBondContact O-OG1 3.36Å; T230-T234 WeakPolarHBondContact O-CB 3.25Å; T230-T234 PolarHBondContact O-N 3.27Å; T230-T234 PolarHBondContact O-OG1 3.13Å; T230-L282 HydrophobicContact CG2-CB 3.86Å; T230-L282 HydrophobicContact CG2-CD1 4.26Å; T230-L282 HydrophobicContact CG2-CD2 4.46Å; T230-L282 HydrophobicContact CG2-CG 4.43Å; T230-D283 HydrophobicContact CG2-CB 4.23Å; T230-D283 WeakPolarHBondContact CG2-O 3.22Å |
| 231 | A | 98.2 | Very high | 94.8 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -67.7 | -46.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | C192 A196 Q227 F228 I229 T234 L235 L282 | C192-A231 HydrophobicContact CB-CB 4.48Å; A196-A231 HydrophobicContact CB-CB 3.64Å; Q227-A231 WeakPolarHBondContact O-CB 3.49Å; Q227-A231 PolarHBondContact O-N 3.09Å; F228-A231 PolarHBondContact O-N 3.32Å; F228-A231 VanDerWaalsContact O-N 3.12Å; I229-A231 VanDerWaalsContact C-N 3.32Å; I229-A231 PolarHBondContact O-N 3.22Å; A231-T234 WeakPolarHBondContact O-CB 3.41Å; A231-T234 PolarHBondContact O-N 3.05Å; A231-L235 PolarHBondContact O-N 3.24Å; A231-L282 HydrophobicContact CB-CD1 3.88Å |
| 232 | V | 97.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -70 | -33.1 | -179.3 | -61.1 | 0 | 0 | 0 | 0 | 112.8 | A196 V200 F228 I229 T234 L235 Y236 L249 I253 W293 | A196-V232 HydrophobicContact CB-CG1 3.89Å; V200-V232 HydrophobicContact CG2-CG1 3.83Å; F228-V232 HydrophobicContact CD1-CG1 4.36Å; F228-V232 HydrophobicContact CD2-CG1 4.07Å; F228-V232 HydrophobicContact CE1-CG1 3.93Å; F228-V232 HydrophobicContact CE2-CG1 3.58Å; F228-V232 HydrophobicContact CG-CG1 4.44Å; F228-V232 HydrophobicContact CZ-CG1 3.52Å; F228-V232 WeakPolarHBondContact O-CG2 3.34Å; F228-V232 PolarHBondContact O-N 3.34Å; I229-V232 WeakPolarHBondContact O-CG2 3.37Å; I229-V232 PolarHBondContact O-N 3.41Å; V232-T234 PolarHBondContact O-N 3.48Å; V232-L235 WeakPolarHBondContact O-CB 3.39Å; V232-L235 PolarHBondContact O-N 2.86Å; V232-Y236 HydrophobicContact CB-CD2 4.37Å; V232-Y236 WeakPolarHBondContact O-CD2 3.44Å; V232-Y236 PolarHBondContact O-N 2.89Å; V232-L249 HydrophobicContact CB-CD2 4.14Å; V232-L249 HydrophobicContact CG1-CD1 4.45Å; V232-L249 HydrophobicContact CG1-CD2 4.31Å; V232-L249 HydrophobicContact CG2-CD2 4.44Å; V232-I253 HydrophobicContact CG2-CD1 3.68Å; V232-W293 HydrophobicContact CG2-CH2 4.25Å |
| 233 | T | 97.6 | Very high | 94.2 | Very high | 1 Ų | 1 | 29.4 Ų | 29.4 | 1% | 0.006 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -74.4 | -16.8 | 174 | 58.1 | 0 | 0 | 0 | 0 | 112.9 | I229 T230 L290 R292 W293 | I229-T233 HydrophobicContact CG2-CG2 4.08Å; I229-T233 WeakPolarHBondContact O-CB 3.29Å; I229-T233 WeakPolarHBondContact O-CG2 3.41Å; I229-T233 PolarHBondContact O-N 2.95Å; I229-T233 PolarHBondContact O-OG1 3.25Å; T230-T233 PolarHBondContact O-OG1 3.36Å; T233-L290 HydrophobicContact CG2-CD2 3.66Å; T233-L290 HydrophobicContact CG2-CG 4.13Å; T233-R292 PolarHBondContact O-NH1 2.92Å; T233-W293 HydrophobicContact CG2-CD2 3.95Å; T233-W293 HydrophobicContact CG2-CE3 4.2Å; T233-W293 HydrophobicContact CG2-CH2 3.94Å; T233-W293 HydrophobicContact CG2-CZ2 3.66Å; T233-W293 HydrophobicContact CG2-CZ3 4.19Å |
| 234 | T | 96.4 | Very high | 94.1 | Very high | 43 Ų | 43 | 26.5 Ų | 26.5 | 26% | 0.264 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -82.2 | -36.6 | 167.4 | -57.4 | 0 | 0 | 0 | 0 | 111.5 | V193 T230 A231 V232 L282 | V193-T234 HydrophobicContact CG2-CG2 3.77Å; T230-T234 WeakPolarHBondContact O-CB 3.25Å; T230-T234 PolarHBondContact O-N 3.27Å; T230-T234 PolarHBondContact O-OG1 3.13Å; A231-T234 WeakPolarHBondContact O-CB 3.41Å; A231-T234 PolarHBondContact O-N 3.05Å; V232-T234 PolarHBondContact O-N 3.48Å; T234-L282 HydrophobicContact CG2-CD2 4.26Å |
| 235 | L | 97 | Very high | 93.9 | Very high | 23 Ų | 23 | 26.7 Ų | 26.7 | 12% | 0.12 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -67 | -57.6 | 177 | 172.5 | 56.2 | 0 | 0 | 0 | 112.1 | V193 Q197 A231 V232 D237 | V193-L235 HydrophobicContact CG1-CB 3.8Å; V193-L235 HydrophobicContact CG1-CD1 3.47Å; V193-L235 VanDerWaalsContact CG1-CD1 3.47Å; V193-L235 HydrophobicContact CG1-CG 4.1Å; V193-L235 HydrophobicContact CG2-CB 4.38Å; Q197-L235 HydrophobicContact CB-CD2 3.92Å; A231-L235 PolarHBondContact O-N 3.24Å; V232-L235 WeakPolarHBondContact O-CB 3.39Å; V232-L235 PolarHBondContact O-N 2.86Å; L235-D237 PolarHBondContact O-N 2.59Å |
| 236 | Y | 96.4 | Very high | 93.6 | Very high | 12 Ų | 12 | 28.1 Ų | 28.1 | 5% | 0.047 | 15% | 0.153 | C | C | . | . | trans | -92 | 85.7 | -177.4 | -61.3 | -70 | 0 | 0 | 0 | 109.8 | V200 V232 L243 T244 P245 L249 W293 | V200-Y236 HydrophobicContact CG1-CE2 4.2Å; V200-Y236 VanDerWaalsContact CG1-OH 3.28Å; V200-Y236 WeakPolarHBondContact CG1-OH 3.47Å; V200-Y236 HydrophobicContact CG2-CE2 4.25Å; V232-Y236 HydrophobicContact CB-CD2 4.37Å; V232-Y236 WeakPolarHBondContact O-CD2 3.44Å; V232-Y236 PolarHBondContact O-N 2.89Å; Y236-L243 CarbonylContact C-O 3.35Å; Y236-L243 WeakPolarHBondContact CA-O 3.08Å; Y236-L243 WeakPolarHBondContact CB-O 3.39Å; Y236-T244 VanDerWaalsContact CD1-O 3.3Å; Y236-T244 WeakPolarHBondContact CD1-O 3.5Å; Y236-P245 HydrophobicContact CD2-CB 4.11Å; Y236-P245 HydrophobicContact CG-CB 4.03Å; Y236-L249 HydrophobicContact CD2-CD2 3.88Å; Y236-L249 HydrophobicContact CE2-CD2 3.64Å; Y236-W293 PolarHBondContact O-NE1 2.98Å | ||
| 237 | D | 92.9 | Very high | 93.2 | Very high | 41 Ų | 41 | 30.5 Ų | 30.5 | 22% | 0.219 | 17% | 0.165 | C | C | . | . | trans | -88.3 | -1.5 | -174.7 | 73.3 | 2.1 | 0 | 0 | 0 | 114.2 | L235 T239 L243 K296 | L235-D237 PolarHBondContact O-N 2.59Å; D237-T239 VanDerWaalsContact CG-CG2 3.43Å; D237-T239 PolarHBondContact O-N 3.21Å; D237-T239 VanDerWaalsContact OD1-CB 3.25Å; D237-T239 WeakPolarHBondContact OD1-CB 3.49Å; D237-T239 VanDerWaalsContact OD1-CG2 3.29Å; D237-T239 WeakPolarHBondContact OD1-CG2 3.19Å; D237-T239 PolarHBondContact OD1-N 3.2Å; D237-T239 PolarHBondContact OD1-OG1 3.3Å; D237-T239 WeakPolarHBondContact OD2-CG2 3.48Å; D237-T239 PolarHBondContact OD2-OG1 2.9Å; D237-L243 PolarHBondContact N-O 3.2Å; D237-L243 WeakPolarHBondContact OD1-CD1 3.18Å; D237-K296 VanDerWaalsContact O-CE 3.27Å; D237-K296 WeakPolarHBondContact O-CE 3.4Å; D237-K296 PolarHBondContact O-NZ 2.87Å | ||
| 238 | L | 92.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | S | Bend | trans | 62.2 | 21.6 | -176.1 | -58.7 | 157.7 | 0 | 0 | 0 | 114.5 | L243 T244 W293 K296 A300 Y301 R303 | L238-L243 PolarHBondContact N-O 3.43Å; L238-T244 HydrophobicContact CD2-CG2 3.95Å; L238-W293 HydrophobicContact CD1-CB 4.24Å; L238-W293 HydrophobicContact CD1-CG 4.21Å; L238-K296 HydrophobicContact CB-CB 4.05Å; L238-K296 HydrophobicContact CB-CD 4.46Å; L238-K296 HydrophobicContact CD1-CB 3.92Å; L238-A300 HydrophobicContact CB-CB 3.95Å; L238-A300 HydrophobicContact CD2-CB 3.9Å; L238-A300 HydrophobicContact CG-CB 4.46Å; L238-Y301 HydrophobicContact CD2-CD2 4.34Å; L238-Y301 HydrophobicContact CD2-CE2 3.63Å; L238-R303 PolarHBondContact O-NH2 3.18Å |
| 239 | T | 86.9 | Confident | 92.6 | Very high | 45 Ų | 45 | 35.1 Ų | 35.1 | 28% | 0.276 | 19% | 0.187 | S | C | . | . | S | Bend | trans | -75 | -32.2 | 174.8 | 55.7 | 0 | 0 | 0 | 0 | 113.1 | D237 L243 R303 | D237-T239 VanDerWaalsContact CG-CG2 3.43Å; D237-T239 PolarHBondContact O-N 3.21Å; D237-T239 VanDerWaalsContact OD1-CB 3.25Å; D237-T239 WeakPolarHBondContact OD1-CB 3.49Å; D237-T239 VanDerWaalsContact OD1-CG2 3.29Å; D237-T239 WeakPolarHBondContact OD1-CG2 3.19Å; D237-T239 PolarHBondContact OD1-N 3.2Å; D237-T239 PolarHBondContact OD1-OG1 3.3Å; D237-T239 WeakPolarHBondContact OD2-CG2 3.48Å; D237-T239 PolarHBondContact OD2-OG1 2.9Å; T239-L243 WeakPolarHBondContact OG1-CD1 3.41Å; T239-R303 PolarHBondContact O-NH2 2.78Å |
| 240 | S | 85.3 | Confident | 92.4 | Very high | 42 Ų | 42 | 35.1 Ų | 35.1 | 29% | 0.294 | 19% | 0.187 | S | C | . | . | S | Bend | trans | -130.1 | 176 | 174.2 | 68.5 | 0 | 0 | 0 | 0 | 110.9 | L243 R303 | S240-L243 PolarHBondContact O-N 3.34Å; S240-L243 WeakPolarHBondContact OG-CG 3.25Å; S240-L243 PolarHBondContact OG-N 3.11Å; S240-R303 VanDerWaalsContact C-NH1 3.28Å; S240-R303 PolarHBondContact O-NH1 2.91Å |
| 241 | D | 82.1 | Confident | 92.2 | Very high | 76 Ų | 76 | 39.3 Ų | 39.3 | 41% | 0.406 | 21% | 0.206 | S | C | . | . | S | Bend | trans | -71.3 | -36.1 | 177.3 | -62.8 | -25.4 | 0 | 0 | 0 | 111.5 | L243 T244 R303 | D241-L243 PolarHBondContact O-N 2.68Å; D241-T244 WeakPolarHBondContact O-CB 3.24Å; D241-T244 WeakPolarHBondContact O-CG2 3.5Å; D241-T244 PolarHBondContact O-N 3.03Å; D241-T244 VanDerWaalsContact O-N 3.16Å; D241-T244 PolarHBondContact O-OG1 3.14Å; D241-R303 WeakPolarHBondContact OD1-CB 3.33Å; D241-R303 WeakPolarHBondContact OD1-CD 3.39Å; D241-R303 IonicContact OD1-CZ 2.8Å; D241-R303 IonicContact OD1-NE 3.54Å; D241-R303 IonicContact OD1-NH1 3.68Å; D241-R303 PolarHBondContact OD1-NH1 3.17Å |
| 242 | E | 86.2 | Confident | 91.9 | Very high | 177 Ų | 177 | 39.7 Ų | 39.7 | 83% | 0.827 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -24 | 174.1 | -63.3 | 174.8 | -178.9 | 0 | 0 | 113.1 | T244 | E242-T244 VanDerWaalsContact C-N 3.34Š|
| 243 | L | 91.6 | Very high | 91.8 | Very high | 53 Ų | 53 | 39.7 Ų | 39.7 | 28% | 0.277 | 21% | 0.208 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.2 | 24.1 | 179.6 | -60.8 | 174.7 | 0 | 0 | 0 | 112.1 | Y236 D237 L238 T239 S240 D241 | Y236-L243 CarbonylContact C-O 3.35Å; Y236-L243 WeakPolarHBondContact CA-O 3.08Å; Y236-L243 WeakPolarHBondContact CB-O 3.39Å; D237-L243 PolarHBondContact N-O 3.2Å; D237-L243 WeakPolarHBondContact OD1-CD1 3.18Å; L238-L243 PolarHBondContact N-O 3.43Å; T239-L243 WeakPolarHBondContact OG1-CD1 3.41Å; S240-L243 PolarHBondContact O-N 3.34Å; S240-L243 WeakPolarHBondContact OG-CG 3.25Å; S240-L243 PolarHBondContact OG-N 3.11Å; D241-L243 PolarHBondContact O-N 2.68Å |
| 244 | T | 91.9 | Very high | 91.8 | Very high | 38 Ų | 38 | 39.8 Ų | 39.8 | 23% | 0.233 | 21% | 0.209 | C | C | . | . | S | Bend | trans | -87.7 | 134.9 | 167.9 | 61 | 0 | 0 | 0 | 0 | 110.1 | Y236 L238 D241 E242 | Y236-T244 VanDerWaalsContact CD1-O 3.3Å; Y236-T244 WeakPolarHBondContact CD1-O 3.5Å; L238-T244 HydrophobicContact CD2-CG2 3.95Å; D241-T244 WeakPolarHBondContact O-CB 3.24Å; D241-T244 WeakPolarHBondContact O-CG2 3.5Å; D241-T244 PolarHBondContact O-N 3.03Å; D241-T244 VanDerWaalsContact O-N 3.16Å; D241-T244 PolarHBondContact O-OG1 3.14Å; E242-T244 VanDerWaalsContact C-N 3.34Å |
| 245 | P | 92.9 | Very high | 91.7 | Very high | 4 Ų | 4 | 39 Ų | 39 | 3% | 0.026 | 21% | 0.205 | C | C | . | . | P | Polyproline II helix | trans | -67.7 | 138.5 | 178.7 | 26.8 | -32.4 | 0 | 0 | 0 | 110.7 | Y236 L249 W293 Y301 | Y236-P245 HydrophobicContact CD2-CB 4.11Å; Y236-P245 HydrophobicContact CG-CB 4.03Å; P245-L249 HydrophobicContact CB-CD2 4.22Å; P245-W293 HydrophobicContact CB-CH2 3.76Å; P245-W293 HydrophobicContact CB-CZ2 3.88Å; P245-W293 HydrophobicContact CB-CZ3 4.34Å; P245-W293 HydrophobicContact CG-CD2 4.45Å; P245-W293 HydrophobicContact CG-CE3 4.47Å; P245-W293 HydrophobicContact CG-CH2 4.09Å; P245-W293 HydrophobicContact CG-CZ2 4.05Å; P245-W293 HydrophobicContact CG-CZ3 4.3Å; P245-Y301 VanDerWaalsContact CD-OH 3.23Å; P245-Y301 WeakPolarHBondContact CD-OH 3.44Å; P245-Y301 WeakPolarHBondContact CG-OH 3.37Å; P245-Y301 PolarHBondContact O-OH 3.24Å; P245-Y301 VanDerWaalsContact O-OH 3.09Å |
| 246 | P | 91.6 | Very high | 91.7 | Very high | 31 Ų | 31 | 38 Ų | 38 | 20% | 0.201 | 20% | 0.199 | C | C | . | . | P | Polyproline II helix | trans | -54.9 | 149 | 171.1 | -26.7 | 35.3 | 0 | 0 | 0 | 112.3 | V200 C204 E248 L249 L250 | V200-P246 HydrophobicContact CG1-CG 3.84Å; C204-P246 HydrophobicContact CB-CB 4.43Å; P246-E248 PolarHBondContact O-N 3.38Å; P246-L249 HydrophobicContact CB-CB 4.31Å; P246-L249 WeakPolarHBondContact O-CB 3.46Å; P246-L249 PolarHBondContact O-N 3.26Å; P246-L250 PolarHBondContact O-N 2.91Å |
| 247 | M | 88.4 | Confident | 91.7 | Very high | 50 Ų | 50 | 37.4 Ų | 37.4 | 25% | 0.246 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.1 | -44.5 | -175 | -178.8 | 51 | 63.6 | 0 | 0 | 112.1 | L249 L250 Q251 T319 L322 | M247-L249 VanDerWaalsContact C-N 3.28Å; M247-L249 PolarHBondContact O-N 3.12Å; M247-L250 PolarHBondContact O-N 3.42Å; M247-L250 VanDerWaalsContact O-N 3.14Å; M247-Q251 HydrophobicContact CG-CG 4.37Å; M247-Q251 WeakPolarHBondContact O-CG 3.38Å; M247-Q251 PolarHBondContact O-N 2.87Å; M247-Q251 HydrophobicContact SD-CG 4.04Å; M247-T319 HydrophobicContact CE-CG2 3.89Å; M247-T319 WeakPolarHBondContact CE-OG1 3.35Å; M247-L322 HydrophobicContact SD-CD1 3.5Å; M247-L322 VanDerWaalsContact SD-CD1 3.5Å |
| 248 | E | 89.4 | Confident | 91.8 | Very high | 101 Ų | 101 | 40.6 Ų | 40.6 | 47% | 0.472 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -60.3 | -39.9 | 179.5 | -68.6 | 71.5 | -164 | 0 | 0 | 111 | C204 P246 M252 | C204-E248 HydrophobicContact CB-CB 4.33Å; P246-E248 PolarHBondContact O-N 3.38Å; E248-M252 VanDerWaalsContact O-CB 3.29Å; E248-M252 WeakPolarHBondContact O-CB 3.42Å; E248-M252 PolarHBondContact O-N 3.44Å; E248-M252 VanDerWaalsContact O-N 3.08Å |
| 249 | L | 93.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64 | -46.8 | 174.8 | 177.6 | 64.4 | 0 | 0 | 0 | 111 | V200 F228 V232 Y236 P245 P246 M247 M252 I253 | V200-L249 HydrophobicContact CG1-CD2 4.24Å; V200-L249 HydrophobicContact CG2-CD1 4.22Å; V200-L249 HydrophobicContact CG2-CD2 3.88Å; F228-L249 HydrophobicContact CE1-CD1 3.89Å; F228-L249 HydrophobicContact CZ-CD1 4.22Å; V232-L249 HydrophobicContact CB-CD2 4.14Å; V232-L249 HydrophobicContact CG1-CD1 4.45Å; V232-L249 HydrophobicContact CG1-CD2 4.31Å; V232-L249 HydrophobicContact CG2-CD2 4.44Å; Y236-L249 HydrophobicContact CD2-CD2 3.88Å; Y236-L249 HydrophobicContact CE2-CD2 3.64Å; P245-L249 HydrophobicContact CB-CD2 4.22Å; P246-L249 HydrophobicContact CB-CB 4.31Å; P246-L249 WeakPolarHBondContact O-CB 3.46Å; P246-L249 PolarHBondContact O-N 3.26Å; M247-L249 VanDerWaalsContact C-N 3.28Å; M247-L249 PolarHBondContact O-N 3.12Å; L249-M252 HydrophobicContact CD1-CE 3.67Å; L249-M252 PolarHBondContact O-N 3.22Å; L249-I253 HydrophobicContact CD1-CD1 3.78Å; L249-I253 HydrophobicContact CD1-CG1 4.25Å; L249-I253 HydrophobicContact CG-CD1 3.93Å; L249-I253 WeakPolarHBondContact O-CG1 3.45Å; L249-I253 PolarHBondContact O-N 2.93Å |
| 250 | L | 94.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.2 | -48 | 179.2 | 178.9 | 62.6 | 0 | 0 | 0 | 111.4 | P246 M247 M252 I253 V254 W293 T319 L322 F323 L326 | P246-L250 PolarHBondContact O-N 2.91Å; M247-L250 PolarHBondContact O-N 3.42Å; M247-L250 VanDerWaalsContact O-N 3.14Å; L250-M252 VanDerWaalsContact C-N 3.32Å; L250-M252 PolarHBondContact O-N 3.09Å; L250-I253 PolarHBondContact O-N 2.67Å; L250-V254 HydrophobicContact CD1-CG2 4.15Å; L250-V254 HydrophobicContact CG-CG2 4.48Å; L250-V254 WeakPolarHBondContact O-CB 3.43Å; L250-V254 VanDerWaalsContact O-CG2 3.27Å; L250-V254 WeakPolarHBondContact O-CG2 3.4Å; L250-V254 PolarHBondContact O-N 3.31Å; L250-W293 HydrophobicContact CD1-CE3 4.18Å; L250-W293 HydrophobicContact CD1-CZ3 4.14Å; L250-T319 HydrophobicContact CD2-CG2 4.44Å; L250-L322 HydrophobicContact CD2-CB 4Å; L250-L322 HydrophobicContact CD2-CD1 4.12Å; L250-L322 HydrophobicContact CG-CB 4.23Å; L250-L322 HydrophobicContact CG-CD1 4.27Å; L250-F323 HydrophobicContact CD1-CD1 4.32Å; L250-F323 HydrophobicContact CD1-CE1 3.82Å; L250-F323 HydrophobicContact CD1-CZ 4.07Å; L250-F323 HydrophobicContact CD2-CD2 4.11Å; L250-F323 HydrophobicContact CD2-CE1 4.11Å; L250-F323 HydrophobicContact CD2-CE2 3.58Å; L250-F323 HydrophobicContact CD2-CZ 3.58Å; L250-F323 HydrophobicContact CG-CZ 4.48Å; L250-L326 HydrophobicContact CD1-CD2 4.2Å |
| 251 | Q | 92.8 | Very high | 92.7 | Very high | 89 Ų | 89 | 46.5 Ų | 46.5 | 42% | 0.416 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -56.7 | -46.6 | 178.1 | -75 | 175.8 | -8.4 | 0 | 0 | 111.7 | M247 V254 S255 L322 | M247-Q251 HydrophobicContact CG-CG 4.37Å; M247-Q251 WeakPolarHBondContact O-CG 3.38Å; M247-Q251 PolarHBondContact O-N 2.87Å; M247-Q251 HydrophobicContact SD-CG 4.04Å; Q251-V254 PolarHBondContact O-N 3.29Å; Q251-S255 PolarHBondContact O-N 2.9Å; Q251-S255 PolarHBondContact O-OG 3.19Å; Q251-L322 HydrophobicContact CG-CD1 3.5Å; Q251-L322 HydrophobicContact CG-CD2 4.2Å |
| 252 | M | 93.1 | Very high | 93.2 | Very high | 8 Ų | 8 | 48.7 Ų | 48.7 | 4% | 0.039 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.7 | -42.2 | 178.9 | 173.7 | 179.4 | 52 | 0 | 0 | 112.8 | L214 H215 E248 L249 L250 V254 S255 W256 | L214-M252 HydrophobicContact CB-SD 3.93Å; L214-M252 HydrophobicContact CD2-CE 3.64Å; L214-M252 HydrophobicContact CD2-SD 3.97Å; L214-M252 HydrophobicContact CG-CE 4.04Å; L214-M252 HydrophobicContact CG-SD 3.67Å; H215-M252 HydrophobicContact CB-CG 4.28Å; H215-M252 HydrophobicContact CB-SD 4.29Å; E248-M252 VanDerWaalsContact O-CB 3.29Å; E248-M252 WeakPolarHBondContact O-CB 3.42Å; E248-M252 PolarHBondContact O-N 3.44Å; E248-M252 VanDerWaalsContact O-N 3.08Å; L249-M252 HydrophobicContact CD1-CE 3.67Å; L249-M252 PolarHBondContact O-N 3.22Å; L250-M252 VanDerWaalsContact C-N 3.32Å; L250-M252 PolarHBondContact O-N 3.09Å; M252-V254 VanDerWaalsContact C-N 3.34Å; M252-S255 PolarHBondContact O-N 2.94Å; M252-S255 PolarHBondContact O-OG 3.47Å; M252-W256 HydrophobicContact CE-CH2 4.38Å; M252-W256 HydrophobicContact CG-CD2 4.03Å; M252-W256 VanDerWaalsContact CG-CE2 3.47Å; M252-W256 HydrophobicContact CG-CH2 4.07Å; M252-W256 HydrophobicContact CG-CZ2 3.5Å; M252-W256 WeakPolarHBondContact O-CB 3.29Å; M252-W256 PolarHBondContact O-N 3.34Å; M252-W256 HydrophobicContact SD-CH2 3.78Å; M252-W256 HydrophobicContact SD-CZ2 3.41Å; M252-W256 WeakPolarHBondContact SD-CZ2 3.49Å |
| 253 | I | 96.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.8 | -40.5 | 177.6 | -69.3 | 172.2 | 0 | 0 | 0 | 110.5 | I229 V232 L249 L250 W256 I257 L290 W293 | I229-I253 HydrophobicContact CG1-CG1 4.23Å; I229-I253 HydrophobicContact CG1-CG2 4.36Å; I229-I253 HydrophobicContact CG2-CG2 4.17Å; V232-I253 HydrophobicContact CG2-CD1 3.68Å; L249-I253 HydrophobicContact CD1-CD1 3.78Å; L249-I253 HydrophobicContact CD1-CG1 4.25Å; L249-I253 HydrophobicContact CG-CD1 3.93Å; L249-I253 WeakPolarHBondContact O-CG1 3.45Å; L249-I253 PolarHBondContact O-N 2.93Å; L250-I253 PolarHBondContact O-N 2.67Å; I253-W256 PolarHBondContact O-N 3.18Å; I253-I257 HydrophobicContact CG2-CD1 3.68Å; I253-I257 HydrophobicContact CG2-CG1 4.45Å; I253-I257 VanDerWaalsContact O-CG1 3.25Å; I253-I257 WeakPolarHBondContact O-CG1 3.38Å; I253-I257 PolarHBondContact O-N 3.44Å; I253-I257 VanDerWaalsContact O-N 3.13Å; I253-L290 HydrophobicContact CG2-CD2 4.09Å; I253-W293 HydrophobicContact CD1-CH2 3.82Å; I253-W293 HydrophobicContact CD1-CZ3 3.89Å |
| 254 | V | 96.3 | Very high | 93.9 | Very high | 3 Ų | 3 | 38 Ų | 38 | 2% | 0.018 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.1 | -46.8 | 176.6 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | L250 Q251 M252 I257 Q258 L322 A325 L326 | L250-V254 HydrophobicContact CD1-CG2 4.15Å; L250-V254 HydrophobicContact CG-CG2 4.48Å; L250-V254 WeakPolarHBondContact O-CB 3.43Å; L250-V254 VanDerWaalsContact O-CG2 3.27Å; L250-V254 WeakPolarHBondContact O-CG2 3.4Å; L250-V254 PolarHBondContact O-N 3.31Å; Q251-V254 PolarHBondContact O-N 3.29Å; M252-V254 VanDerWaalsContact C-N 3.34Å; V254-I257 PolarHBondContact O-N 3.05Å; V254-Q258 HydrophobicContact CG1-CG 4.34Å; V254-Q258 WeakPolarHBondContact O-CB 3.39Å; V254-Q258 VanDerWaalsContact O-CG 3.3Å; V254-Q258 WeakPolarHBondContact O-CG 3.17Å; V254-Q258 PolarHBondContact O-N 3.33Å; V254-L322 HydrophobicContact CB-CD2 4.15Å; V254-L322 HydrophobicContact CG1-CD2 4.05Å; V254-L322 HydrophobicContact CG2-CB 4.39Å; V254-L322 HydrophobicContact CG2-CD2 4.27Å; V254-A325 HydrophobicContact CG1-CB 4.15Å; V254-L326 HydrophobicContact CG2-CB 3.96Å; V254-L326 HydrophobicContact CG2-CD1 4.2Å; V254-L326 HydrophobicContact CG2-CG 4.46Å |
| 255 | S | 95 | Very high | 94.1 | Very high | 26 Ų | 26 | 36.2 Ų | 36.2 | 18% | 0.182 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.5 | -46.5 | 178.5 | 63.3 | 0 | 0 | 0 | 0 | 111.8 | H215 Q251 M252 I257 Q258 D259 | H215-S255 PolarHBondContact CD2-OG 3.29Å; H215-S255 PolarHBondContact NE2-OG 2.84Å; Q251-S255 PolarHBondContact O-N 2.9Å; Q251-S255 PolarHBondContact O-OG 3.19Å; M252-S255 PolarHBondContact O-N 2.94Å; M252-S255 PolarHBondContact O-OG 3.47Å; S255-I257 VanDerWaalsContact C-N 3.32Å; S255-I257 PolarHBondContact O-N 2.87Å; S255-Q258 PolarHBondContact O-N 2.99Å; S255-D259 WeakPolarHBondContact O-CB 3.31Å; S255-D259 VanDerWaalsContact O-CG 3.26Å; S255-D259 PolarHBondContact O-N 3.45Å |
| 256 | W | 96.3 | Very high | 94.2 | Very high | 1 Ų | 1 | 37.6 Ų | 37.6 | 0% | 0.004 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -57.2 | -43 | 178.2 | -70.4 | -8.7 | 0 | 0 | 0 | 113.5 | L214 H215 I217 H218 C225 F228 I229 M252 I253 D260 L263 | L214-W256 HydrophobicContact CG-CH2 4.36Å; L214-W256 WeakPolarHBondContact O-CZ2 3.48Å; H215-W256 AromaticContact CD2-NE1 3.72Å; H215-W256 AromaticContact CG-NE1 3.89Å; H215-W256 PolarHBondContact O-NE1 3.05Å; I217-W256 HydrophobicContact CG2-CH2 4.28Å; I217-W256 HydrophobicContact CG2-CZ2 4.15Å; H218-W256 HydrophobicContact CB-CD2 3.95Å; H218-W256 HydrophobicContact CB-CG 3.86Å; H218-W256 AromaticContact CG-CD1 3.52Å; H218-W256 AromaticContact CG-NE1 3.7Å; H218-W256 AromaticContact ND1-CD1 3.46Å; H218-W256 AromaticContact ND1-NE1 3.4Å; H218-W256 PolarHBondContact ND1-NE1 2.98Å; C225-W256 HydrophobicContact CB-CE3 4.13Å; C225-W256 HydrophobicContact CB-CH2 4.48Å; C225-W256 HydrophobicContact CB-CZ3 3.95Å; C225-W256 VanDerWaalsContact SG-CH2 3.56Å; F228-W256 HydrophobicContact CD1-CH2 4.3Å; F228-W256 HydrophobicContact CD1-CZ3 4.15Å; I229-W256 HydrophobicContact CD1-CE3 4.13Å; I229-W256 HydrophobicContact CG1-CE3 4.27Å; I229-W256 HydrophobicContact CG1-CZ3 4.31Å; M252-W256 HydrophobicContact CE-CH2 4.38Å; M252-W256 HydrophobicContact CG-CD2 4.03Å; M252-W256 VanDerWaalsContact CG-CE2 3.47Å; M252-W256 HydrophobicContact CG-CH2 4.07Å; M252-W256 HydrophobicContact CG-CZ2 3.5Å; M252-W256 WeakPolarHBondContact O-CB 3.29Å; M252-W256 PolarHBondContact O-N 3.34Å; M252-W256 HydrophobicContact SD-CH2 3.78Å; M252-W256 HydrophobicContact SD-CZ2 3.41Å; M252-W256 WeakPolarHBondContact SD-CZ2 3.49Å; I253-W256 PolarHBondContact O-N 3.18Å; W256-D260 PolarHBondContact O-N 2.95Å; W256-L263 HydrophobicContact CB-CD2 3.73Å; W256-L263 HydrophobicContact CG-CD2 4.45Å |
| 257 | I | 96.8 | Very high | 94.2 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -74.1 | -34.7 | -178.4 | -62 | 169.8 | 0 | 0 | 0 | 110.7 | I253 V254 S255 D260 P261 V264 L290 L326 | I253-I257 HydrophobicContact CG2-CD1 3.68Å; I253-I257 HydrophobicContact CG2-CG1 4.45Å; I253-I257 VanDerWaalsContact O-CG1 3.25Å; I253-I257 WeakPolarHBondContact O-CG1 3.38Å; I253-I257 PolarHBondContact O-N 3.44Å; I253-I257 VanDerWaalsContact O-N 3.13Å; V254-I257 PolarHBondContact O-N 3.05Å; S255-I257 VanDerWaalsContact C-N 3.32Å; S255-I257 PolarHBondContact O-N 2.87Å; I257-D260 CarbonylContact O-C 3.56Å; I257-D260 VanDerWaalsContact O-C 3.29Å; I257-P261 WeakPolarHBondContact O-CA 3.44Å; I257-P261 WeakPolarHBondContact O-CD 3.36Å; I257-P261 WeakPolarHBondContact O-CG 3.35Å; I257-V264 HydrophobicContact CD1-CG1 3.91Å; I257-V264 HydrophobicContact CG1-CG1 3.85Å; I257-L290 HydrophobicContact CD1-CD1 3.71Å; I257-L290 HydrophobicContact CD1-CD2 4.31Å; I257-L326 HydrophobicContact CD1-CD1 3.71Å |
| 258 | Q | 95.4 | Very high | 94.4 | Very high | 109 Ų | 109 | 34 Ų | 34 | 51% | 0.509 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -67.6 | -37.7 | 174.8 | -74.4 | -176.7 | -41.5 | 0 | 0 | 112.1 | V254 S255 | V254-Q258 HydrophobicContact CG1-CG 4.34Å; V254-Q258 WeakPolarHBondContact O-CB 3.39Å; V254-Q258 VanDerWaalsContact O-CG 3.3Å; V254-Q258 WeakPolarHBondContact O-CG 3.17Å; V254-Q258 PolarHBondContact O-N 3.33Å; S255-Q258 PolarHBondContact O-N 2.99Å |
| 259 | D | 94.4 | Very high | 94.5 | Very high | 108 Ų | 108 | 30.9 Ų | 30.9 | 58% | 0.578 | 15% | 0.153 | S | C | * | . | H | α-helix | trans | -68.9 | -45.1 | 177.6 | -72 | -14.5 | 0 | 0 | 0 | 111.7 | S255 | S255-D259 WeakPolarHBondContact O-CB 3.31Å; S255-D259 VanDerWaalsContact O-CG 3.26Å; S255-D259 PolarHBondContact O-N 3.45Å |
| 260 | D | 94.1 | Very high | 94.2 | Very high | 67 Ų | 67 | 34.5 Ų | 34.5 | 36% | 0.358 | 17% | 0.173 | S | C | . | . | trans | -141.1 | 98.3 | 172.6 | -178.4 | 12.7 | 0 | 0 | 0 | 112.4 | W256 I257 R262 L263 | W256-D260 PolarHBondContact O-N 2.95Å; I257-D260 CarbonylContact O-C 3.56Å; I257-D260 VanDerWaalsContact O-C 3.29Å; D260-R262 PolarHBondContact O-N 3.45Å; D260-R262 VanDerWaalsContact O-N 3.09Å; D260-R262 VanDerWaalsContact OD1-CB 3.26Å; D260-R262 WeakPolarHBondContact OD1-CB 3.41Å; D260-R262 PolarHBondContact OD1-N 2.85Å; D260-L263 WeakPolarHBondContact O-CB 3.3Å; D260-L263 PolarHBondContact O-N 2.96Å | ||
| 261 | P | 94.3 | Very high | 93.7 | Very high | 35 Ų | 35 | 35.3 Ų | 35.3 | 23% | 0.227 | 18% | 0.178 | C | C | . | . | G | 310 helix | trans | -60.3 | -22.4 | 176.2 | -25.6 | 33.9 | 0 | 0 | 0 | 113.6 | I257 L263 V264 V333 L336 | I257-P261 WeakPolarHBondContact O-CA 3.44Å; I257-P261 WeakPolarHBondContact O-CD 3.36Å; I257-P261 WeakPolarHBondContact O-CG 3.35Å; P261-L263 PolarHBondContact O-N 2.83Å; P261-V264 WeakPolarHBondContact O-CG2 3.25Å; P261-V333 HydrophobicContact CB-CG2 3.77Å; P261-V333 VanDerWaalsContact O-CG2 3.27Å; P261-V333 WeakPolarHBondContact O-CG2 3.43Å; P261-L336 HydrophobicContact CB-CD1 4.35Å |
| 262 | R | 93.6 | Very high | 92.8 | Very high | 123 Ų | 123 | 35.7 Ų | 35.7 | 46% | 0.464 | 19% | 0.188 | S | C | . | . | G | 310 helix | trans | -73.9 | -13.6 | 179.1 | -58.8 | 170.9 | 60.8 | 90.8 | -1 | 112.1 | D260 V264 L265 I266 L336 | D260-R262 PolarHBondContact O-N 3.45Å; D260-R262 VanDerWaalsContact O-N 3.09Å; D260-R262 VanDerWaalsContact OD1-CB 3.26Å; D260-R262 WeakPolarHBondContact OD1-CB 3.41Å; D260-R262 PolarHBondContact OD1-N 2.85Å; R262-V264 VanDerWaalsContact C-N 3.26Å; R262-V264 PolarHBondContact O-N 3.38Å; R262-L265 WeakPolarHBondContact O-CA 3.25Å; R262-L265 PolarHBondContact O-N 3.05Å; R262-I266 PolarHBondContact O-N 3.05Å; R262-L336 HydrophobicContact CG-CD1 4.47Å |
| 263 | L | 95.9 | Very high | 91.7 | Very high | 4 Ų | 4 | 39 Ų | 39 | 2% | 0.021 | 21% | 0.205 | C | C | . | . | G | 310 helix | trans | -51 | -45.8 | 176.9 | 178.5 | 62.9 | 0 | 0 | 0 | 111.8 | P222 C225 C226 I229 W256 D260 P261 L265 I266 | P222-L263 HydrophobicContact CB-CD1 3.6Å; P222-L263 WeakPolarHBondContact O-CD1 3.49Å; C225-L263 HydrophobicContact CB-CD1 3.95Å; C225-L263 HydrophobicContact CB-CD2 4.25Å; C226-L263 WeakPolarHBondContact CB-O 3.33Å; C226-L263 PolarHBondContact SG-O 3.04Å; I229-L263 HydrophobicContact CD1-CD2 4.08Å; W256-L263 HydrophobicContact CB-CD2 3.73Å; W256-L263 HydrophobicContact CG-CD2 4.45Å; D260-L263 WeakPolarHBondContact O-CB 3.3Å; D260-L263 PolarHBondContact O-N 2.96Å; P261-L263 PolarHBondContact O-N 2.83Å; L263-L265 PolarHBondContact O-N 3.2Å; L263-L265 VanDerWaalsContact O-N 3.15Å; L263-I266 WeakPolarHBondContact O-CB 3.39Å; L263-I266 WeakPolarHBondContact O-CG2 3.3Å; L263-I266 PolarHBondContact O-N 3.47Å; L263-I266 VanDerWaalsContact O-N 3.16Å |
| 264 | V | 96.7 | Very high | 89.7 | Confident | 1 Ų | 1 | 44.9 Ų | 44.9 | 1% | 0.006 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -70 | -11.9 | -178.4 | -55.8 | 0 | 0 | 0 | 0 | 113.4 | I257 P261 R262 T285 P286 L287 L290 V333 | I257-V264 HydrophobicContact CD1-CG1 3.91Å; I257-V264 HydrophobicContact CG1-CG1 3.85Å; P261-V264 WeakPolarHBondContact O-CG2 3.25Å; R262-V264 VanDerWaalsContact C-N 3.26Å; R262-V264 PolarHBondContact O-N 3.38Å; V264-T285 WeakPolarHBondContact O-CB 3.29Å; V264-P286 HydrophobicContact CB-CG 3.62Å; V264-P286 HydrophobicContact CG1-CG 3.78Å; V264-P286 VanDerWaalsContact O-CD 3.26Å; V264-P286 WeakPolarHBondContact O-CD 3.32Å; V264-L287 HydrophobicContact CG2-CD2 3.97Å; V264-L290 HydrophobicContact CG1-CD1 3.97Å; V264-V333 HydrophobicContact CG2-CB 4.18Å; V264-V333 HydrophobicContact CG2-CG1 3.54Å; V264-V333 HydrophobicContact CG2-CG2 3.74Å |
| 265 | L | 95.4 | Very high | 87.6 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -103.6 | -7.5 | 177.4 | -58.3 | -177.6 | 0 | 0 | 0 | 112.4 | R262 L263 T267 F268 L269 T285 L287 V333 L337 I340 L352 | R262-L265 WeakPolarHBondContact O-CA 3.25Å; R262-L265 PolarHBondContact O-N 3.05Å; L263-L265 PolarHBondContact O-N 3.2Å; L263-L265 VanDerWaalsContact O-N 3.15Å; L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 3.39Å; L265-F268 WeakPolarHBondContact O-CB 3.35Å; L265-F268 PolarHBondContact O-N 3.37Å; L265-F268 VanDerWaalsContact O-N 3.12Å; L265-L269 HydrophobicContact CB-CD1 4.17Å; L265-L269 HydrophobicContact CB-CG 4.29Å; L265-L269 VanDerWaalsContact O-CG 3.3Å; L265-L269 WeakPolarHBondContact O-CG 3.35Å; L265-L269 PolarHBondContact O-N 3.38Å; L265-T285 HydrophobicContact CD2-CG2 4.42Å; L265-L287 HydrophobicContact CD2-CD1 3.97Å; L265-V333 HydrophobicContact CD1-CG1 3.87Å; L265-V333 HydrophobicContact CD2-CG1 3.93Å; L265-V333 HydrophobicContact CG-CG1 3.84Å; L265-L337 HydrophobicContact CD1-CD2 3.73Å; L265-L337 HydrophobicContact CD2-CD2 3.76Å; L265-L337 HydrophobicContact CG-CD2 4.42Å; L265-I340 HydrophobicContact CD1-CD1 3.54Å; L265-L352 HydrophobicContact CD2-CD1 4.27Å |
| 266 | I | 94.6 | Very high | 85.5 | Confident | 33 Ų | 33 | 51.8 Ų | 51.8 | 17% | 0.169 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.5 | -37.4 | -167.8 | -160.4 | 67.8 | 0 | 0 | 0 | 112.4 | R223 C226 R262 L263 L269 N270 | R223-I266 HydrophobicContact CG-CG1 4.27Å; R223-I266 HydrophobicContact CG-CG2 4.38Å; C226-I266 HydrophobicContact CB-CG2 3.39Å; R262-I266 PolarHBondContact O-N 3.05Å; L263-I266 WeakPolarHBondContact O-CB 3.39Å; L263-I266 WeakPolarHBondContact O-CG2 3.3Å; L263-I266 PolarHBondContact O-N 3.47Å; L263-I266 VanDerWaalsContact O-N 3.16Å; I266-L269 PolarHBondContact O-N 3.28Å; I266-N270 WeakPolarHBondContact CD1-ND2 3.38Å; I266-N270 WeakPolarHBondContact O-CB 3.37Å; I266-N270 PolarHBondContact O-N 3.17Å; I266-N270 VanDerWaalsContact O-N 3.12Å; I266-N270 PolarHBondContact O-ND2 2.9Å |
| 267 | T | 92.3 | Very high | 83.8 | Confident | 6 Ų | 6 | 55 Ų | 55 | 4% | 0.037 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.4 | -55.3 | 175.8 | -57.5 | 0 | 0 | 0 | 0 | 109.9 | Q185 C226 Q227 L265 L269 N270 S271 M284 | Q185-T267 HydrophobicContact CG-CG2 4.42Å; C226-T267 PolarHBondContact SG-OG1 2.93Å; Q227-T267 PolarHBondContact NE2-OG1 3.46Å; L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 3.39Å; T267-L269 PolarHBondContact O-N 3.19Å; T267-N270 PolarHBondContact O-N 3.47Å; T267-S271 WeakPolarHBondContact O-CB 3.44Å; T267-S271 PolarHBondContact O-N 2.94Å; T267-S271 PolarHBondContact O-OG 2.89Å; T267-M284 HydrophobicContact CG2-SD 3.71Å |
| 268 | F | 91.9 | Very high | 82.2 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -53.9 | -40.6 | 177.1 | 165.7 | -114.2 | 0 | 0 | 0 | 112.7 | L265 N270 L273 M284 T285 I340 L341 K344 L346 L350 L352 | L265-F268 WeakPolarHBondContact O-CB 3.35Å; L265-F268 PolarHBondContact O-N 3.37Å; L265-F268 VanDerWaalsContact O-N 3.12Å; F268-N270 VanDerWaalsContact C-N 3.3Å; F268-N270 PolarHBondContact O-N 3.25Å; F268-L273 HydrophobicContact CD2-CD2 4.09Å; F268-L273 HydrophobicContact CE2-CD1 4.28Å; F268-L273 HydrophobicContact CE2-CD2 3.96Å; F268-M284 HydrophobicContact CB-CG 4Å; F268-T285 HydrophobicContact CB-CG2 3.85Å; F268-I340 HydrophobicContact CE1-CG2 3.83Å; F268-L341 HydrophobicContact CE1-CD2 4.22Å; F268-L341 HydrophobicContact CZ-CD2 3.83Å; F268-K344 HydrophobicContact CE1-CD 4.22Å; F268-K344 HydrophobicContact CZ-CD 3.89Å; F268-L346 HydrophobicContact CE2-CD1 4.05Å; F268-L346 HydrophobicContact CZ-CD1 3.91Å; F268-L350 HydrophobicContact CD2-CD2 4.16Å; F268-L350 HydrophobicContact CE2-CD2 3.38Å; F268-L350 HydrophobicContact CZ-CD2 4.07Å; F268-L352 HydrophobicContact CD1-CD1 4.34Å; F268-L352 HydrophobicContact CD2-CD2 3.99Å; F268-L352 HydrophobicContact CE2-CD2 4.25Å; F268-L352 HydrophobicContact CG-CD2 4.18Å |
| 269 | L | 91.6 | Very high | 80.7 | Confident | 36 Ų | 36 | 61.6 Ų | 61.6 | 19% | 0.188 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -64.9 | -34.4 | 179.7 | -70.5 | 173.6 | 0 | 0 | 0 | 112.8 | L265 I266 T267 I340 K344 | L265-L269 HydrophobicContact CB-CD1 4.17Å; L265-L269 HydrophobicContact CB-CG 4.29Å; L265-L269 VanDerWaalsContact O-CG 3.3Å; L265-L269 WeakPolarHBondContact O-CG 3.35Å; L265-L269 PolarHBondContact O-N 3.38Å; I266-L269 PolarHBondContact O-N 3.28Å; T267-L269 PolarHBondContact O-N 3.19Å; L269-I340 HydrophobicContact CD2-CG2 3.5Å; L269-K344 PolarHBondContact O-NZ 3.36Å |
| 270 | N | 88 | Confident | 80 | Confident | 76 Ų | 76 | 58.5 Ų | 58.5 | 41% | 0.406 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -103.7 | -12.3 | -171 | -73.8 | -90.4 | 0 | 0 | 0 | 114.6 | R223 I266 T267 F268 | R223-N270 PolarHBondContact NH2-OD1 2.92Å; I266-N270 WeakPolarHBondContact CD1-ND2 3.38Å; I266-N270 WeakPolarHBondContact O-CB 3.37Å; I266-N270 PolarHBondContact O-N 3.17Å; I266-N270 VanDerWaalsContact O-N 3.12Å; I266-N270 PolarHBondContact O-ND2 2.9Å; T267-N270 PolarHBondContact O-N 3.47Å; F268-N270 VanDerWaalsContact C-N 3.3Å; F268-N270 PolarHBondContact O-N 3.25Å |
| 271 | S | 83.5 | Confident | 79.6 | Confident | 16 Ų | 16 | 56.1 Ų | 56.1 | 11% | 0.112 | 33% | 0.334 | C | S | . | . | S | Bend | trans | -91.8 | 137.2 | -177.8 | -63.1 | 0 | 0 | 0 | 0 | 112.3 | Q185 T267 L273 | Q185-S271 PolarHBondContact NE2-OG 3.15Å; Q185-S271 PolarHBondContact OE1-OG 3.24Å; T267-S271 WeakPolarHBondContact O-CB 3.44Å; T267-S271 PolarHBondContact O-N 2.94Å; T267-S271 PolarHBondContact O-OG 2.89Å; S271-L273 PolarHBondContact O-N 3.41Å |
| 272 | P | 73.3 | Confident | 79.4 | Confident | 98 Ų | 98 | 54.7 Ų | 54.7 | 64% | 0.636 | 32% | 0.324 | S | S | * | . | trans | -68.3 | 127.4 | 172.5 | 28.1 | -32.1 | 0 | 0 | 0 | 109.6 | S274 | P272-S274 PolarHBondContact O-N 3.44Š| ||
| 273 | L | 70.1 | Confident | 79.2 | Confident | 76 Ų | 76 | 51.8 Ų | 51.8 | 40% | 0.398 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -1.4 | -178 | -59.5 | 169.3 | 0 | 0 | 0 | 113.3 | F268 S271 G275 L346 L350 | F268-L273 HydrophobicContact CD2-CD2 4.09Å; F268-L273 HydrophobicContact CE2-CD1 4.28Å; F268-L273 HydrophobicContact CE2-CD2 3.96Å; S271-L273 PolarHBondContact O-N 3.41Å; L273-G275 PolarHBondContact O-N 2.72Å; L273-L346 HydrophobicContact CD1-CD1 3.19Å; L273-L346 HydrophobicContact CD1-CD2 3.99Å; L273-L346 HydrophobicContact CD1-CG 4.18Å; L273-L350 HydrophobicContact CD2-CD2 4.28Å |
| 274 | S | 53.5 | Low | 78.9 | Confident | 125 Ų | 125 | 53.3 Ų | 53.3 | 87% | 0.874 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | 8.5 | -171.6 | -55.2 | 0 | 0 | 0 | 0 | 115 | P272 | P272-S274 PolarHBondContact O-N 3.44Š|
| 275 | G | 53.3 | Low | 78.8 | Confident | 51 Ų | 51 | 53.4 Ų | 53.4 | 53% | 0.526 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -115.8 | 133 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | L273 Q277 | L273-G275 PolarHBondContact O-N 2.72Å; G275-Q277 PolarHBondContact O-N 3.44Å |
| 276 | S | 51.3 | Low | 78.9 | Confident | 122 Ų | 122 | 53.4 Ų | 53.4 | 85% | 0.853 | 33% | 0.326 | S | S | * | . | trans | -58 | 110.5 | 165 | 57.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 277 | Q | 59.8 | Low | 79 | Confident | 70 Ų | 70 | 51.9 Ų | 51.9 | 33% | 0.327 | 32% | 0.318 | S | S | . | . | trans | -59.9 | 141.8 | 166.8 | -83.9 | -167.1 | -53.1 | 0 | 0 | 108.3 | G275 I279 M284 | G275-Q277 PolarHBondContact O-N 3.44Å; Q277-I279 PolarHBondContact O-N 2.94Å; Q277-M284 HydrophobicContact CG-CE 4.32Å | ||
| 278 | P | 64.2 | Low | 79.2 | Confident | 63 Ų | 63 | 52 Ų | 52 | 41% | 0.409 | 32% | 0.321 | S | S | . | . | trans | -53.7 | 132.5 | 170.9 | -19.6 | 30.5 | 0 | 0 | 0 | 108.7 | S280 S281 | P278-S280 PolarHBondContact O-N 2.88Å; P278-S281 PolarHBondContact O-N 3.45Å; P278-S281 PolarHBondContact O-OG 3.08Å; P278-S281 VanDerWaalsContact O-OG 3.07Å | ||
| 279 | I | 62.9 | Low | 79.5 | Confident | 184 Ų | 184 | 52.2 Ų | 52.2 | 94% | 0.944 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | -18.9 | -175.6 | -63.9 | 166.2 | 0 | 0 | 0 | 112.5 | Q277 | Q277-I279 PolarHBondContact O-N 2.94Š|
| 280 | S | 79.6 | Confident | 79.8 | Confident | 42 Ų | 42 | 50.5 Ų | 50.5 | 29% | 0.294 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.6 | 9.5 | -176.6 | 56.6 | 0 | 0 | 0 | 0 | 115.2 | H188 R189 P278 | H188-S280 WeakPolarHBondContact CA-O 3.04Å; H188-S280 WeakPolarHBondContact CD2-CB 3.32Å; H188-S280 PolarHBondContact CD2-OG 3.3Å; H188-S280 WeakPolarHBondContact NE2-CB 3.45Å; R189-S280 WeakPolarHBondContact CB-O 3.28Å; R189-S280 PolarHBondContact N-O 3Å; P278-S280 PolarHBondContact O-N 2.88Å |
| 281 | S | 85.3 | Confident | 80.3 | Confident | 17 Ų | 17 | 47.1 Ų | 47.1 | 12% | 0.119 | 30% | 0.296 | C | S | . | . | B | Isolated β-bridge | trans | -73.9 | 171.6 | 174.7 | 66.7 | 0 | 0 | 0 | 0 | 112.2 | P278 | P278-S281 PolarHBondContact O-N 3.45Å; P278-S281 PolarHBondContact O-OG 3.08Å; P278-S281 VanDerWaalsContact O-OG 3.07Å |
| 282 | L | 90.3 | Very high | 80.9 | Confident | 5 Ų | 5 | 48.4 Ų | 48.4 | 3% | 0.026 | 30% | 0.298 | C | S | . | . | P | Polyproline II helix | trans | -63.5 | 158.5 | 167.6 | -68.9 | 179 | 0 | 0 | 0 | 111.7 | R189 C192 T230 A231 T234 | R189-L282 HydrophobicContact CB-CD2 3.93Å; C192-L282 HydrophobicContact CB-CD1 3.56Å; C192-L282 HydrophobicContact CB-CD2 4.19Å; C192-L282 HydrophobicContact CB-CG 3.85Å; T230-L282 HydrophobicContact CG2-CB 3.86Å; T230-L282 HydrophobicContact CG2-CD1 4.26Å; T230-L282 HydrophobicContact CG2-CD2 4.46Å; T230-L282 HydrophobicContact CG2-CG 4.43Å; A231-L282 HydrophobicContact CB-CD1 3.88Å; T234-L282 HydrophobicContact CG2-CD2 4.26Å |
| 283 | D | 90.7 | Very high | 82.1 | Confident | 63 Ų | 63 | 43.7 Ų | 43.7 | 34% | 0.337 | 27% | 0.268 | S | S | . | . | P | Polyproline II helix | trans | -59.4 | 149.5 | 170.8 | -69.8 | -34.9 | 0 | 0 | 0 | 111 | T230 T285 | T230-D283 HydrophobicContact CG2-CB 4.23Å; T230-D283 WeakPolarHBondContact CG2-O 3.22Å; D283-T285 PolarHBondContact O-N 3.41Å |
| 284 | M | 88.9 | Confident | 83.4 | Confident | 36 Ų | 36 | 40.1 Ų | 40.1 | 18% | 0.177 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -61.9 | -28.8 | -179.1 | -174.4 | 62.4 | 72.4 | 0 | 0 | 113 | Q185 T267 F268 Q277 | Q185-M284 PolarHBondContact NE2-SD 3.17Å; Q185-M284 VanDerWaalsContact NE2-SD 3.43Å; T267-M284 HydrophobicContact CG2-SD 3.71Å; F268-M284 HydrophobicContact CB-CG 4Å; Q277-M284 HydrophobicContact CG-CE 4.32Å |
| 285 | T | 94.9 | Very high | 85.5 | Confident | 2 Ų | 2 | 34.1 Ų | 34.1 | 1% | 0.012 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -136.4 | 152.7 | -179.4 | 73.8 | 0 | 0 | 0 | 0 | 109.5 | V264 L265 F268 D283 L287 L352 | V264-T285 WeakPolarHBondContact O-CB 3.29Å; L265-T285 HydrophobicContact CD2-CG2 4.42Å; F268-T285 HydrophobicContact CB-CG2 3.85Å; D283-T285 PolarHBondContact O-N 3.41Å; T285-L287 PolarHBondContact O-N 3Å; T285-L352 HydrophobicContact CG2-CD1 4.36Å; T285-L352 HydrophobicContact CG2-CD2 4.35Å |
| 286 | P | 97.1 | Very high | 87.5 | Confident | 1 Ų | 1 | 31.8 Ų | 31.8 | 1% | 0.006 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.3 | -1.5 | 177.4 | 31 | -34.6 | 0 | 0 | 0 | 113.4 | I229 V264 G288 G289 L290 | I229-P286 HydrophobicContact CB-CB 3.96Å; I229-P286 HydrophobicContact CB-CG 4.22Å; I229-P286 HydrophobicContact CG2-CB 3.45Å; I229-P286 VanDerWaalsContact CG2-CB 3.45Å; I229-P286 HydrophobicContact CG2-CG 3.92Å; V264-P286 HydrophobicContact CB-CG 3.62Å; V264-P286 HydrophobicContact CG1-CG 3.78Å; V264-P286 VanDerWaalsContact O-CD 3.26Å; V264-P286 WeakPolarHBondContact O-CD 3.32Å; P286-G288 VanDerWaalsContact C-N 3.32Å; P286-G288 PolarHBondContact O-N 3.47Å; P286-G289 PolarHBondContact O-N 3.49Å; P286-G289 VanDerWaalsContact O-N 3.09Å; P286-L290 HydrophobicContact CB-CD1 4.06Å; P286-L290 HydrophobicContact CB-CG 4.23Å; P286-L290 HydrophobicContact CG-CD1 4.1Å; P286-L290 WeakPolarHBondContact O-CG 3.41Å; P286-L290 PolarHBondContact O-N 2.98Å |
| 287 | L | 97.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -53.1 | -46 | -172.9 | -69.6 | 174.3 | 0 | 0 | 0 | 112.8 | V264 L265 T285 G289 L290 I291 V330 V333 F334 L337 L352 | V264-L287 HydrophobicContact CG2-CD2 3.97Å; L265-L287 HydrophobicContact CD2-CD1 3.97Å; T285-L287 PolarHBondContact O-N 3Å; L287-G289 PolarHBondContact O-N 2.99Å; L287-L290 PolarHBondContact O-N 3.28Å; L287-I291 WeakPolarHBondContact O-CB 3.4Å; L287-I291 WeakPolarHBondContact O-CD1 3.46Å; L287-I291 WeakPolarHBondContact O-CG1 3.38Å; L287-I291 PolarHBondContact O-N 3.35Å; L287-V330 HydrophobicContact CD2-CG1 4.36Å; L287-V333 HydrophobicContact CD2-CB 4.34Å; L287-V333 HydrophobicContact CD2-CG1 3.88Å; L287-F334 HydrophobicContact CD1-CD1 4.26Å; L287-F334 HydrophobicContact CD1-CE1 3.91Å; L287-L337 HydrophobicContact CD1-CD1 4.4Å; L287-L352 HydrophobicContact CD1-CD1 4.35Å |
| 288 | G | 96.2 | Very high | 91.1 | Very high | 10 Ų | 10 | 23.8 Ų | 23.8 | 10% | 0.103 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.9 | -43.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113 | P286 R292 | P286-G288 VanDerWaalsContact C-N 3.32Å; P286-G288 PolarHBondContact O-N 3.47Å; G288-R292 WeakPolarHBondContact O-CB 3.07Å; G288-R292 PolarHBondContact O-N 2.89Å |
| 289 | G | 97.3 | Very high | 92.4 | Very high | 3 Ų | 3 | 21.3 Ų | 21.3 | 3% | 0.031 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -67.7 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P286 L287 R292 W293 | P286-G289 PolarHBondContact O-N 3.49Å; P286-G289 VanDerWaalsContact O-N 3.09Å; L287-G289 PolarHBondContact O-N 2.99Å; G289-R292 WeakPolarHBondContact O-CB 3.33Å; G289-R292 PolarHBondContact O-N 3.18Å; G289-W293 PolarHBondContact O-N 3.33Å |
| 290 | L | 98.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -66.3 | -37.9 | 177.8 | -65.5 | 172.4 | 0 | 0 | 0 | 112.4 | I229 T233 I253 I257 V264 P286 L287 W293 C294 L326 V330 | I229-L290 HydrophobicContact CG2-CD1 4.21Å; I229-L290 HydrophobicContact CG2-CD2 3.85Å; I229-L290 HydrophobicContact CG2-CG 4.2Å; T233-L290 HydrophobicContact CG2-CD2 3.66Å; T233-L290 HydrophobicContact CG2-CG 4.13Å; I253-L290 HydrophobicContact CG2-CD2 4.09Å; I257-L290 HydrophobicContact CD1-CD1 3.71Å; I257-L290 HydrophobicContact CD1-CD2 4.31Å; V264-L290 HydrophobicContact CG1-CD1 3.97Å; P286-L290 HydrophobicContact CB-CD1 4.06Å; P286-L290 HydrophobicContact CB-CG 4.23Å; P286-L290 HydrophobicContact CG-CD1 4.1Å; P286-L290 WeakPolarHBondContact O-CG 3.41Å; P286-L290 PolarHBondContact O-N 2.98Å; L287-L290 PolarHBondContact O-N 3.28Å; L290-W293 HydrophobicContact CD2-CE3 4.34Å; L290-W293 WeakPolarHBondContact O-CB 3.17Å; L290-W293 PolarHBondContact O-N 3.21Å; L290-C294 PolarHBondContact O-N 3.5Å; L290-C294 PolarHBondContact O-SG 2.98Å; L290-L326 HydrophobicContact CD2-CD1 4.22Å; L290-L326 HydrophobicContact CD2-CD2 4.23Å; L290-V330 HydrophobicContact CB-CG2 3.8Å; L290-V330 HydrophobicContact CD1-CG2 4.2Å |
| 291 | I | 97.8 | Very high | 93.6 | Very high | 5 Ų | 5 | 12.1 Ų | 12.1 | 3% | 0.026 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -64.8 | -45.2 | 174 | -71.2 | 164 | 0 | 0 | 0 | 110.6 | L287 W293 C294 I295 V330 F334 L353 L361 A397 | L287-I291 WeakPolarHBondContact O-CB 3.4Å; L287-I291 WeakPolarHBondContact O-CD1 3.46Å; L287-I291 WeakPolarHBondContact O-CG1 3.38Å; L287-I291 PolarHBondContact O-N 3.35Å; I291-W293 VanDerWaalsContact C-N 3.25Å; I291-W293 PolarHBondContact O-N 3.23Å; I291-C294 PolarHBondContact O-N 3.46Å; I291-I295 HydrophobicContact CG2-CD1 3.41Å; I291-I295 VanDerWaalsContact CG2-CD1 3.41Å; I291-I295 HydrophobicContact CG2-CG1 4.41Å; I291-I295 WeakPolarHBondContact O-CB 3.21Å; I291-I295 WeakPolarHBondContact O-CG1 3.36Å; I291-I295 PolarHBondContact O-N 3.46Å; I291-V330 HydrophobicContact CD1-CG1 4.2Å; I291-V330 HydrophobicContact CG1-CG1 3.6Å; I291-F334 HydrophobicContact CD1-CE1 4.35Å; I291-F334 HydrophobicContact CD1-CE2 3.4Å; I291-F334 HydrophobicContact CD1-CZ 3.19Å; I291-F334 HydrophobicContact CG1-CE2 4.25Å; I291-F334 HydrophobicContact CG1-CZ 4.4Å; I291-L353 HydrophobicContact CD1-CD1 4.37Å; I291-L353 HydrophobicContact CD1-CD2 4.17Å; I291-L361 HydrophobicContact CG2-CD2 4.17Å; I291-A397 HydrophobicContact CG2-CB 4Å |
| 292 | R | 97.5 | Very high | 93 | Very high | 43 Ų | 43 | 14.7 Ų | 14.7 | 16% | 0.162 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -54.9 | -44.6 | 173.7 | 175.1 | -171.3 | -52.8 | 136.5 | 3.9 | 110.8 | T233 G288 G289 K296 L361 | T233-R292 PolarHBondContact O-NH1 2.92Å; G288-R292 WeakPolarHBondContact O-CB 3.07Å; G288-R292 PolarHBondContact O-N 2.89Å; G289-R292 WeakPolarHBondContact O-CB 3.33Å; G289-R292 PolarHBondContact O-N 3.18Å; R292-K296 HydrophobicContact CG-CD 3.63Å; R292-K296 HydrophobicContact CG-CG 4.45Å; R292-K296 WeakPolarHBondContact O-CB 3.5Å; R292-K296 WeakPolarHBondContact O-CG 3.43Å; R292-K296 PolarHBondContact O-N 2.92Å; R292-L361 HydrophobicContact CB-CD1 4.12Å; R292-L361 HydrophobicContact CG-CD1 3.95Å |
| 293 | W | 97.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -57.1 | -55.1 | 174.5 | -78.4 | 13.3 | 0 | 0 | 0 | 112.2 | V232 T233 Y236 L238 P245 L250 I253 G289 L290 I291 I295 K296 A297 F323 L326 | V232-W293 HydrophobicContact CG2-CH2 4.25Å; T233-W293 HydrophobicContact CG2-CD2 3.95Å; T233-W293 HydrophobicContact CG2-CE3 4.2Å; T233-W293 HydrophobicContact CG2-CH2 3.94Å; T233-W293 HydrophobicContact CG2-CZ2 3.66Å; T233-W293 HydrophobicContact CG2-CZ3 4.19Å; Y236-W293 PolarHBondContact O-NE1 2.98Å; L238-W293 HydrophobicContact CD1-CB 4.24Å; L238-W293 HydrophobicContact CD1-CG 4.21Å; P245-W293 HydrophobicContact CB-CH2 3.76Å; P245-W293 HydrophobicContact CB-CZ2 3.88Å; P245-W293 HydrophobicContact CB-CZ3 4.34Å; P245-W293 HydrophobicContact CG-CD2 4.45Å; P245-W293 HydrophobicContact CG-CE3 4.47Å; P245-W293 HydrophobicContact CG-CH2 4.09Å; P245-W293 HydrophobicContact CG-CZ2 4.05Å; P245-W293 HydrophobicContact CG-CZ3 4.3Å; L250-W293 HydrophobicContact CD1-CE3 4.18Å; L250-W293 HydrophobicContact CD1-CZ3 4.14Å; I253-W293 HydrophobicContact CD1-CH2 3.82Å; I253-W293 HydrophobicContact CD1-CZ3 3.89Å; G289-W293 PolarHBondContact O-N 3.33Å; L290-W293 HydrophobicContact CD2-CE3 4.34Å; L290-W293 WeakPolarHBondContact O-CB 3.17Å; L290-W293 PolarHBondContact O-N 3.21Å; I291-W293 VanDerWaalsContact C-N 3.25Å; I291-W293 PolarHBondContact O-N 3.23Å; W293-I295 VanDerWaalsContact C-N 3.29Å; W293-I295 PolarHBondContact O-N 3.35Å; W293-K296 PolarHBondContact O-N 2.79Å; W293-A297 WeakPolarHBondContact O-CB 3.36Å; W293-A297 PolarHBondContact O-N 3.41Å; W293-F323 HydrophobicContact CB-CE1 4.1Å; W293-L326 HydrophobicContact CE3-CD2 4.15Å |
| 294 | C | 97.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -59.1 | -39.8 | -177 | -64.6 | 0 | 0 | 0 | 0 | 112.4 | L290 I291 P298 H327 R393 | L290-C294 PolarHBondContact O-N 3.5Å; L290-C294 PolarHBondContact O-SG 2.98Å; I291-C294 PolarHBondContact O-N 3.46Å; C294-P298 WeakPolarHBondContact O-CD 3.44Å; C294-H327 HydrophobicContact CB-CB 3.96Å; C294-H327 VanDerWaalsContact SG-CA 3.55Å; C294-H327 PolarHBondContact SG-N 3.48Å; C294-R393 WeakPolarHBondContact O-CD 3.33Å; C294-R393 PolarHBondContact O-NH1 3.2Å |
| 295 | I | 97.7 | Very high | 87.7 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -75.9 | -42.1 | -177.4 | -70.3 | 163.8 | 0 | 0 | 0 | 112.1 | I291 W293 P298 L361 L365 A390 R393 L394 A397 | I291-I295 HydrophobicContact CG2-CD1 3.41Å; I291-I295 VanDerWaalsContact CG2-CD1 3.41Å; I291-I295 HydrophobicContact CG2-CG1 4.41Å; I291-I295 WeakPolarHBondContact O-CB 3.21Å; I291-I295 WeakPolarHBondContact O-CG1 3.36Å; I291-I295 PolarHBondContact O-N 3.46Å; W293-I295 VanDerWaalsContact C-N 3.29Å; W293-I295 PolarHBondContact O-N 3.35Å; I295-P298 WeakPolarHBondContact O-CD 3.43Å; I295-L361 HydrophobicContact CD1-CD2 3.72Å; I295-L361 HydrophobicContact CG2-CD1 4.44Å; I295-L365 HydrophobicContact CG2-CD1 4.19Å; I295-L365 HydrophobicContact CG2-CD2 3.89Å; I295-A390 VanDerWaalsContact O-CB 3.31Å; I295-A390 WeakPolarHBondContact O-CB 3.45Å; I295-R393 HydrophobicContact CG1-CB 4.03Å; I295-L394 HydrophobicContact CD1-CB 3.98Å; I295-L394 HydrophobicContact CD1-CD1 3.78Å; I295-L394 HydrophobicContact CG1-CB 4.22Å; I295-L394 HydrophobicContact CG2-CB 4.21Å; I295-A397 HydrophobicContact CD1-CB 4.37Å |
| 296 | K | 95.9 | Very high | 85.6 | Confident | 1 Ų | 1 | 31.5 Ų | 31.5 | 0% | 0.004 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -81.2 | -27 | -176.7 | -65.2 | 176.4 | 71.8 | 174.6 | 0 | 112.9 | D237 L238 R292 W293 P298 L299 A300 L361 D364 L368 | D237-K296 VanDerWaalsContact O-CE 3.27Å; D237-K296 WeakPolarHBondContact O-CE 3.4Å; D237-K296 PolarHBondContact O-NZ 2.87Å; L238-K296 HydrophobicContact CB-CB 4.05Å; L238-K296 HydrophobicContact CB-CD 4.46Å; L238-K296 HydrophobicContact CD1-CB 3.92Å; R292-K296 HydrophobicContact CG-CD 3.63Å; R292-K296 HydrophobicContact CG-CG 4.45Å; R292-K296 WeakPolarHBondContact O-CB 3.5Å; R292-K296 WeakPolarHBondContact O-CG 3.43Å; R292-K296 PolarHBondContact O-N 2.92Å; W293-K296 PolarHBondContact O-N 2.79Å; K296-P298 VanDerWaalsContact C-CD 3.47Å; K296-L299 PolarHBondContact O-N 3.09Å; K296-A300 PolarHBondContact O-N 3.39Å; K296-L361 HydrophobicContact CD-CD1 4.14Å; K296-L361 HydrophobicContact CG-CD1 4.13Å; K296-D364 IonicContact NZ-OD2 3.7Å; K296-L368 HydrophobicContact CB-CD1 4.19Å; K296-L368 HydrophobicContact CD-CD1 4.35Å; K296-L368 HydrophobicContact CG-CD1 4.01Å |
| 297 | A | 94.2 | Very high | 83.1 | Confident | 3 Ų | 3 | 39.5 Ų | 39.5 | 3% | 0.025 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -52 | -44.5 | -174 | 0 | 0 | 0 | 0 | 0 | 115.3 | W293 L299 A300 Y301 F323 | W293-A297 WeakPolarHBondContact O-CB 3.36Å; W293-A297 PolarHBondContact O-N 3.41Å; A297-L299 PolarHBondContact O-N 3.37Å; A297-L299 VanDerWaalsContact O-N 3.12Å; A297-A300 PolarHBondContact O-N 2.91Å; A297-Y301 HydrophobicContact CB-CD2 4.22Å; A297-Y301 PolarHBondContact O-N 3.44Å; A297-Y301 VanDerWaalsContact O-N 3.11Å; A297-F323 HydrophobicContact CB-CB 4.32Å; A297-F323 HydrophobicContact CB-CD1 3.67Å; A297-F323 HydrophobicContact CB-CD2 3.52Å; A297-F323 HydrophobicContact CB-CE1 3.78Å; A297-F323 HydrophobicContact CB-CE2 3.61Å; A297-F323 HydrophobicContact CB-CG 3.55Å; A297-F323 HydrophobicContact CB-CZ 3.75Å |
| 298 | P | 92.7 | Very high | 80.6 | Confident | 22 Ų | 22 | 43.8 Ų | 43.8 | 14% | 0.143 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -57.5 | -28.7 | 178.4 | -25.1 | 35.4 | 0 | 0 | 0 | 113.9 | C294 I295 K296 A386 L389 A390 | C294-P298 WeakPolarHBondContact O-CD 3.44Å; I295-P298 WeakPolarHBondContact O-CD 3.43Å; K296-P298 VanDerWaalsContact C-CD 3.47Å; P298-A386 HydrophobicContact CB-CB 4.35Å; P298-L389 HydrophobicContact CB-CD2 4.25Å; P298-L389 HydrophobicContact CB-CG 4.46Å; P298-L389 HydrophobicContact CG-CB 4.49Å; P298-L389 HydrophobicContact CG-CD2 3.99Å; P298-L389 HydrophobicContact CG-CG 4Å; P298-A390 HydrophobicContact CB-CB 4.41Å; P298-A390 HydrophobicContact CG-CB 4.36Å |
| 299 | L | 90.8 | Very high | 78.1 | Confident | 11 Ų | 11 | 51.2 Ų | 51.2 | 6% | 0.058 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -94 | -35.1 | -179.5 | -59.5 | 177.3 | 0 | 0 | 0 | 112.4 | K296 A297 L365 L368 L369 A386 A390 | K296-L299 PolarHBondContact O-N 3.09Å; A297-L299 PolarHBondContact O-N 3.37Å; A297-L299 VanDerWaalsContact O-N 3.12Å; L299-L365 HydrophobicContact CD1-CD1 3.6Å; L299-L368 HydrophobicContact CB-CB 4.47Å; L299-L368 HydrophobicContact CD1-CB 3.8Å; L299-L369 HydrophobicContact CD1-CD2 3.73Å; L299-L369 HydrophobicContact CD1-CG 3.96Å; L299-L369 HydrophobicContact CD2-CD2 4.23Å; L299-A386 HydrophobicContact CD2-CB 4.4Å; L299-A390 HydrophobicContact CD1-CB 4.14Å; L299-A390 HydrophobicContact CG-CB 4.15Å |
| 300 | A | 88.2 | Confident | 75.4 | Confident | 1 Ų | 1 | 57.6 Ų | 57.6 | 1% | 0.008 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -72.3 | -50.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L238 K296 A297 R302 R303 | L238-A300 HydrophobicContact CB-CB 3.95Å; L238-A300 HydrophobicContact CD2-CB 3.9Å; L238-A300 HydrophobicContact CG-CB 4.46Å; K296-A300 PolarHBondContact O-N 3.39Å; A297-A300 PolarHBondContact O-N 2.91Å; A300-R302 PolarHBondContact O-N 2.94Å; A300-R302 VanDerWaalsContact O-N 3.16Å; A300-R303 PolarHBondContact O-N 2.98Å; A300-R303 VanDerWaalsContact O-N 3.12Å |
| 301 | Y | 79.9 | Confident | 72.8 | Confident | 32 Ų | 32 | 62 Ų | 62 | 13% | 0.125 | 32% | 0.323 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -7.4 | -177.9 | -76.3 | -91.5 | 0 | 0 | 0 | 113.6 | L238 P245 A297 R303 T319 F323 | L238-Y301 HydrophobicContact CD2-CD2 4.34Å; L238-Y301 HydrophobicContact CD2-CE2 3.63Å; P245-Y301 VanDerWaalsContact CD-OH 3.23Å; P245-Y301 WeakPolarHBondContact CD-OH 3.44Å; P245-Y301 WeakPolarHBondContact CG-OH 3.37Å; P245-Y301 PolarHBondContact O-OH 3.24Å; P245-Y301 VanDerWaalsContact O-OH 3.09Å; A297-Y301 HydrophobicContact CB-CD2 4.22Å; A297-Y301 PolarHBondContact O-N 3.44Å; A297-Y301 VanDerWaalsContact O-N 3.11Å; Y301-R303 VanDerWaalsContact C-N 3.35Å; Y301-T319 HydrophobicContact CD1-CG2 3.91Å; Y301-T319 HydrophobicContact CE1-CG2 4Å; Y301-T319 HydrophobicContact CG-CG2 4.21Å; Y301-F323 AromaticContact CD2-CE2 3.74Å; Y301-F323 HydrophobicContact CD2-CE2 3.74Å; Y301-F323 HydrophobicContact CD2-CZ 4.24Å; Y301-F323 AromaticContact CE2-CE2 3.34Å; Y301-F323 HydrophobicContact CE2-CE2 3.34Å; Y301-F323 AromaticContact CE2-CZ 3.46Å; Y301-F323 HydrophobicContact CE2-CZ 3.46Å; Y301-F323 VanDerWaalsContact CE2-CZ 3.46Å; Y301-F323 AromaticContact CZ-CE2 3.87Å |
| 302 | R | 71.1 | Confident | 70.2 | Confident | 70 Ų | 70 | 66.4 Ų | 66.4 | 26% | 0.264 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -29.7 | 169.3 | -178.7 | -179.7 | 168.8 | -145.7 | -7.3 | 112.6 | A300 D304 K305 T376 T383 | A300-R302 PolarHBondContact O-N 2.94Å; A300-R302 VanDerWaalsContact O-N 3.16Å; R302-D304 PolarHBondContact O-N 2.76Å; R302-K305 WeakPolarHBondContact O-CB 3.33Å; R302-K305 PolarHBondContact O-N 3.18Å; R302-T376 PolarHBondContact NH2-OG1 3.49Å; R302-T383 PolarHBondContact NH1-OG1 2.85Å; R302-T383 PolarHBondContact NH2-OG1 3.41Å |
| 303 | R | 57 | Low | 67.8 | Low | 65 Ų | 65 | 69.2 Ų | 69.2 | 25% | 0.245 | 38% | 0.381 | C | S | . | . | G | 310 helix | trans | -60.3 | -34.6 | -175.7 | -67.6 | -167.2 | -136 | 105 | 0.5 | 112 | L238 T239 S240 D241 A300 Y301 K305 K306 | L238-R303 PolarHBondContact O-NH2 3.18Å; T239-R303 PolarHBondContact O-NH2 2.78Å; S240-R303 VanDerWaalsContact C-NH1 3.28Å; S240-R303 PolarHBondContact O-NH1 2.91Å; D241-R303 WeakPolarHBondContact OD1-CB 3.33Å; D241-R303 WeakPolarHBondContact OD1-CD 3.39Å; D241-R303 IonicContact OD1-CZ 2.8Å; D241-R303 IonicContact OD1-NE 3.54Å; D241-R303 IonicContact OD1-NH1 3.68Å; D241-R303 PolarHBondContact OD1-NH1 3.17Å; A300-R303 PolarHBondContact O-N 2.98Å; A300-R303 VanDerWaalsContact O-N 3.12Å; Y301-R303 VanDerWaalsContact C-N 3.35Å; R303-K305 PolarHBondContact O-N 2.87Å; R303-K306 PolarHBondContact O-N 3.5Å |
| 304 | D | 51.8 | Low | 65.4 | Low | 105 Ų | 105 | 75.8 Ų | 75.8 | 56% | 0.561 | 42% | 0.416 | S | S | * | . | G | 310 helix | trans | -64 | -29.6 | -178.5 | -137.9 | -4.2 | 0 | 0 | 0 | 112.9 | R302 K306 Q307 | R302-D304 PolarHBondContact O-N 2.76Å; D304-K306 PolarHBondContact O-N 3.46Å; D304-Q307 PolarHBondContact O-N 3.27Å |
| 305 | K | 51.5 | Low | 63.2 | Low | 135 Ų | 135 | 79.4 Ų | 79.4 | 59% | 0.587 | 44% | 0.442 | S | S | * | . | G | 310 helix | trans | -66.9 | -11.2 | -179.2 | -138.8 | 166.8 | -171.6 | 156.5 | 0 | 114.1 | R302 R303 E316 | R302-K305 WeakPolarHBondContact O-CB 3.33Å; R302-K305 PolarHBondContact O-N 3.18Å; R303-K305 PolarHBondContact O-N 2.87Å; K305-E316 IonicContact NZ-OE2 3.96Å; K305-E316 PolarHBondContact NZ-OE2 2.91Å |
| 306 | K | 50.2 | Low | 61.1 | Low | 154 Ų | 154 | 83.2 Ų | 83.2 | 67% | 0.67 | 46% | 0.459 | S | S | * | . | G | 310 helix | trans | -93.2 | -9.1 | -177.9 | -132.6 | 175.1 | 179.3 | 177.8 | 0 | 113.4 | R303 D304 H375 | R303-K306 PolarHBondContact O-N 3.5Å; D304-K306 PolarHBondContact O-N 3.46Å; K306-H375 PolarHBondContact NZ-O 3.03Å |
| 307 | Q | 45.3 | Very low | 59.5 | Low | 169 Ų | 169 | 85.7 Ų | 85.7 | 79% | 0.79 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.3 | -16.9 | -178 | -71.5 | -166.4 | 1.2 | 0 | 0 | 115.3 | D304 | D304-Q307 PolarHBondContact O-N 3.27Š|
| 308 | V | 44 | Very low | 58.8 | Low | 91 Ų | 91 | 88.8 Ų | 88.8 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | trans | -116.1 | 91.6 | -177.4 | -171.9 | 0 | 0 | 0 | 0 | 110.8 | D310 | V308-D310 HydrophobicContact CG1-CB 4.21Å; V308-D310 WeakPolarHBondContact CG1-O 3.24Å; V308-D310 PolarHBondContact O-N 2.95Å | ||
| 309 | N | 44.1 | Very low | 58.5 | Low | 166 Ų | 166 | 88.2 Ų | 88.2 | 89% | 0.888 | 49% | 0.488 | S | S | * | . | trans | -83 | 28 | 165.3 | -165.8 | 43.7 | 0 | 0 | 0 | 111.9 | ||||
| 310 | D | 40.4 | Very low | 58.4 | Low | 136 Ų | 136 | 90.4 Ų | 90.4 | 73% | 0.727 | 51% | 0.507 | S | S | * | . | S | Bend | trans | -127.3 | 100.6 | 179.1 | -93.6 | -25.6 | 0 | 0 | 0 | 111.4 | V308 S312 | V308-D310 HydrophobicContact CG1-CB 4.21Å; V308-D310 WeakPolarHBondContact CG1-O 3.24Å; V308-D310 PolarHBondContact O-N 2.95Å; D310-S312 PolarHBondContact O-N 3.29Å |
| 311 | G | 42.6 | Very low | 58.6 | Low | 92 Ų | 92 | 97.6 Ų | 97.6 | 95% | 0.948 | 53% | 0.534 | S | S | * | . | S | Bend | 63.6 | -6.9 | 128.8 | 0 | 0 | 0 | 0 | 0 | 123.4 | |||
| 312 | S | 44.4 | Very low | 59.4 | Low | 99 Ų | 99 | 97.5 Ų | 97.5 | 69% | 0.692 | 54% | 0.536 | S | S | * | . | trans | -119.9 | 94.5 | 178 | 74 | 0 | 0 | 0 | 0 | 112.5 | D310 | D310-S312 PolarHBondContact O-N 3.29Š| ||
| 313 | S | 47 | Very low | 60.6 | Low | 102 Ų | 102 | 94.4 Ų | 94.4 | 71% | 0.713 | 52% | 0.524 | S | S | * | . | trans | -93.7 | 10.4 | -175.3 | 67.9 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 314 | D | 46.2 | Very low | 62.5 | Low | 137 Ų | 137 | 94.1 Ų | 94.1 | 73% | 0.733 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -89.3 | -15.7 | -166.3 | -90.2 | -4.2 | 0 | 0 | 0 | 115.5 | ||
| 315 | S | 52.2 | Low | 64.6 | Low | 77 Ų | 77 | 90.3 Ų | 90.3 | 54% | 0.538 | 52% | 0.516 | S | S | . | . | S | Bend | trans | -95.1 | -26 | -174.6 | 57 | 0 | 0 | 0 | 0 | 115.6 | P317 D318 T319 | S315-P317 VanDerWaalsContact C-CD 3.47Å; S315-D318 PolarHBondContact O-N 3.27Å; S315-T319 PolarHBondContact O-N 3.12Å; S315-T319 PolarHBondContact O-OG1 3.34Å |
| 316 | E | 54.8 | Low | 66.9 | Low | 80 Ų | 80 | 83.9 Ų | 83.9 | 37% | 0.374 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -56.8 | -44.7 | 179.3 | -97.5 | -92.8 | 111.5 | 0 | 0 | 115.4 | K305 D318 A320 | K305-E316 IonicContact NZ-OE2 3.96Å; K305-E316 PolarHBondContact NZ-OE2 2.91Å; E316-D318 PolarHBondContact O-N 2.96Å; E316-A320 PolarHBondContact O-N 3.05Å |
| 317 | P | 61.6 | Low | 69.1 | Low | 53 Ų | 53 | 77.2 Ų | 77.2 | 34% | 0.344 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -71.4 | -21.3 | -176.5 | 31.3 | -36.3 | 0 | 0 | 0 | 112.1 | S315 R321 | S315-P317 VanDerWaalsContact C-CD 3.47Å; P317-R321 WeakPolarHBondContact O-CD 3.24Å; P317-R321 WeakPolarHBondContact O-CG 3.41Å; P317-R321 PolarHBondContact O-N 2.9Å; P317-R321 PolarHBondContact O-NE 2.74Å |
| 318 | D | 78.8 | Confident | 71.7 | Confident | 68 Ų | 68 | 73.7 Ų | 73.7 | 36% | 0.364 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -79.2 | -42.8 | -179.4 | -68.6 | -9.2 | 0 | 0 | 0 | 111 | S315 E316 A320 R321 L322 | S315-D318 PolarHBondContact O-N 3.27Å; E316-D318 PolarHBondContact O-N 2.96Å; D318-A320 PolarHBondContact O-N 3.48Å; D318-R321 WeakPolarHBondContact O-CB 3.27Å; D318-R321 PolarHBondContact O-N 3.22Å; D318-R321 IonicContact OD1-CZ 2.76Å; D318-R321 IonicContact OD1-NH1 3.31Å; D318-R321 PolarHBondContact OD1-NH1 3.35Å; D318-R321 IonicContact OD1-NH2 3.93Å; D318-L322 WeakPolarHBondContact O-CG 3.33Å; D318-L322 PolarHBondContact O-N 2.62Å |
| 319 | T | 86.1 | Confident | 74.2 | Confident | 10 Ų | 10 | 69.6 Ų | 69.6 | 6% | 0.061 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -59 | -47.1 | 175.8 | -47 | 0 | 0 | 0 | 0 | 112.4 | M247 L250 Y301 S315 R321 L322 F323 | M247-T319 HydrophobicContact CE-CG2 3.89Å; M247-T319 WeakPolarHBondContact CE-OG1 3.35Å; L250-T319 HydrophobicContact CD2-CG2 4.44Å; Y301-T319 HydrophobicContact CD1-CG2 3.91Å; Y301-T319 HydrophobicContact CE1-CG2 4Å; Y301-T319 HydrophobicContact CG-CG2 4.21Å; S315-T319 PolarHBondContact O-N 3.12Å; S315-T319 PolarHBondContact O-OG1 3.34Å; T319-R321 VanDerWaalsContact C-N 3.31Å; T319-R321 PolarHBondContact O-N 3.18Å; T319-L322 PolarHBondContact O-N 3.48Å; T319-F323 HydrophobicContact CG2-CD2 3.93Å; T319-F323 HydrophobicContact CG2-CE2 3.69Å; T319-F323 WeakPolarHBondContact O-CD2 3.25Å; T319-F323 PolarHBondContact O-N 3.47Å |
| 320 | A | 89.5 | Confident | 76.8 | Confident | 57 Ų | 57 | 61.9 Ų | 61.9 | 47% | 0.471 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.9 | -37.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | E316 D318 S324 | E316-A320 PolarHBondContact O-N 3.05Å; D318-A320 PolarHBondContact O-N 3.48Å; A320-S324 WeakPolarHBondContact O-CB 3.48Å; A320-S324 PolarHBondContact O-N 3.14Å; A320-S324 VanDerWaalsContact O-N 3.13Å; A320-S324 PolarHBondContact O-OG 3.25Å |
| 321 | R | 92.9 | Very high | 79.6 | Confident | 152 Ų | 152 | 56.5 Ų | 56.5 | 57% | 0.574 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -65.5 | -44.2 | 173.6 | -74.4 | 175.8 | -145.6 | 145.1 | 5.8 | 111.2 | P317 D318 T319 F323 S324 A325 | P317-R321 WeakPolarHBondContact O-CD 3.24Å; P317-R321 WeakPolarHBondContact O-CG 3.41Å; P317-R321 PolarHBondContact O-N 2.9Å; P317-R321 PolarHBondContact O-NE 2.74Å; D318-R321 WeakPolarHBondContact O-CB 3.27Å; D318-R321 PolarHBondContact O-N 3.22Å; D318-R321 IonicContact OD1-CZ 2.76Å; D318-R321 IonicContact OD1-NH1 3.31Å; D318-R321 PolarHBondContact OD1-NH1 3.35Å; D318-R321 IonicContact OD1-NH2 3.93Å; T319-R321 VanDerWaalsContact C-N 3.31Å; T319-R321 PolarHBondContact O-N 3.18Å; R321-F323 PolarHBondContact O-N 3.32Å; R321-S324 PolarHBondContact O-N 3.31Å; R321-S324 VanDerWaalsContact O-N 3.14Å; R321-A325 WeakPolarHBondContact O-CB 3.28Å; R321-A325 PolarHBondContact O-N 2.8Å |
| 322 | L | 95.3 | Very high | 82.1 | Confident | 30 Ų | 30 | 56.8 Ų | 56.8 | 16% | 0.157 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.1 | -47.8 | 178.1 | -71.9 | 169.1 | 0 | 0 | 0 | 112 | M247 L250 Q251 V254 D318 T319 S324 A325 L326 | M247-L322 HydrophobicContact SD-CD1 3.5Å; M247-L322 VanDerWaalsContact SD-CD1 3.5Å; L250-L322 HydrophobicContact CD2-CB 4Å; L250-L322 HydrophobicContact CD2-CD1 4.12Å; L250-L322 HydrophobicContact CG-CB 4.23Å; L250-L322 HydrophobicContact CG-CD1 4.27Å; Q251-L322 HydrophobicContact CG-CD1 3.5Å; Q251-L322 HydrophobicContact CG-CD2 4.2Å; V254-L322 HydrophobicContact CB-CD2 4.15Å; V254-L322 HydrophobicContact CG1-CD2 4.05Å; V254-L322 HydrophobicContact CG2-CB 4.39Å; V254-L322 HydrophobicContact CG2-CD2 4.27Å; D318-L322 WeakPolarHBondContact O-CG 3.33Å; D318-L322 PolarHBondContact O-N 2.62Å; T319-L322 PolarHBondContact O-N 3.48Å; L322-S324 VanDerWaalsContact C-N 3.28Å; L322-S324 PolarHBondContact O-N 3.07Å; L322-A325 PolarHBondContact O-N 2.81Å; L322-L326 WeakPolarHBondContact O-CB 3.29Å; L322-L326 PolarHBondContact O-N 3.47Å |
| 323 | F | 96.5 | Very high | 84.7 | Confident | 4 Ų | 4 | 52.1 Ų | 52.1 | 2% | 0.018 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.8 | -29.6 | 176.7 | -76.6 | -65.6 | 0 | 0 | 0 | 113.4 | L250 W293 A297 Y301 T319 R321 L326 H327 | L250-F323 HydrophobicContact CD1-CD1 4.32Å; L250-F323 HydrophobicContact CD1-CE1 3.82Å; L250-F323 HydrophobicContact CD1-CZ 4.07Å; L250-F323 HydrophobicContact CD2-CD2 4.11Å; L250-F323 HydrophobicContact CD2-CE1 4.11Å; L250-F323 HydrophobicContact CD2-CE2 3.58Å; L250-F323 HydrophobicContact CD2-CZ 3.58Å; L250-F323 HydrophobicContact CG-CZ 4.48Å; W293-F323 HydrophobicContact CB-CE1 4.1Å; A297-F323 HydrophobicContact CB-CB 4.32Å; A297-F323 HydrophobicContact CB-CD1 3.67Å; A297-F323 HydrophobicContact CB-CD2 3.52Å; A297-F323 HydrophobicContact CB-CE1 3.78Å; A297-F323 HydrophobicContact CB-CE2 3.61Å; A297-F323 HydrophobicContact CB-CG 3.55Å; A297-F323 HydrophobicContact CB-CZ 3.75Å; Y301-F323 AromaticContact CD2-CE2 3.74Å; Y301-F323 HydrophobicContact CD2-CE2 3.74Å; Y301-F323 HydrophobicContact CD2-CZ 4.24Å; Y301-F323 AromaticContact CE2-CE2 3.34Å; Y301-F323 HydrophobicContact CE2-CE2 3.34Å; Y301-F323 AromaticContact CE2-CZ 3.46Å; Y301-F323 HydrophobicContact CE2-CZ 3.46Å; Y301-F323 VanDerWaalsContact CE2-CZ 3.46Å; Y301-F323 AromaticContact CZ-CE2 3.87Å; T319-F323 HydrophobicContact CG2-CD2 3.93Å; T319-F323 HydrophobicContact CG2-CE2 3.69Å; T319-F323 WeakPolarHBondContact O-CD2 3.25Å; T319-F323 PolarHBondContact O-N 3.47Å; R321-F323 PolarHBondContact O-N 3.32Å; F323-L326 HydrophobicContact CD1-CD2 4.35Å; F323-H327 VanDerWaalsContact O-CB 3.24Å; F323-H327 WeakPolarHBondContact O-CB 3.21Å; F323-H327 PolarHBondContact O-N 2.92Å |
| 324 | S | 96.4 | Very high | 87 | Confident | 59 Ų | 59 | 47.2 Ų | 47.2 | 41% | 0.413 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -71.5 | -42 | 175.4 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | A320 R321 L322 H327 L328 R393 | A320-S324 WeakPolarHBondContact O-CB 3.48Å; A320-S324 PolarHBondContact O-N 3.14Å; A320-S324 VanDerWaalsContact O-N 3.13Å; A320-S324 PolarHBondContact O-OG 3.25Å; R321-S324 PolarHBondContact O-N 3.31Å; R321-S324 VanDerWaalsContact O-N 3.14Å; L322-S324 VanDerWaalsContact C-N 3.28Å; L322-S324 PolarHBondContact O-N 3.07Å; S324-H327 PolarHBondContact O-N 2.8Å; S324-L328 PolarHBondContact O-N 3.36Å; S324-R393 PolarHBondContact OG-NH2 3.4Å |
| 325 | A | 97.6 | Very high | 89.4 | Confident | 26 Ų | 26 | 46.7 Ų | 46.7 | 22% | 0.215 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.8 | -42.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V254 R321 L322 L328 S329 | V254-A325 HydrophobicContact CG1-CB 4.15Å; R321-A325 WeakPolarHBondContact O-CB 3.28Å; R321-A325 PolarHBondContact O-N 2.8Å; L322-A325 PolarHBondContact O-N 2.81Å; A325-L328 PolarHBondContact O-N 2.87Å; A325-S329 WeakPolarHBondContact O-CB 3.42Å; A325-S329 PolarHBondContact O-N 3.37Å; A325-S329 PolarHBondContact O-OG 3.44Å |
| 326 | L | 98.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.5 | -48.9 | 176 | -172.9 | 57.2 | 0 | 0 | 0 | 111.2 | L250 V254 I257 L290 W293 L322 F323 L328 S329 V330 | L250-L326 HydrophobicContact CD1-CD2 4.2Å; V254-L326 HydrophobicContact CG2-CB 3.96Å; V254-L326 HydrophobicContact CG2-CD1 4.2Å; V254-L326 HydrophobicContact CG2-CG 4.46Å; I257-L326 HydrophobicContact CD1-CD1 3.71Å; L290-L326 HydrophobicContact CD2-CD1 4.22Å; L290-L326 HydrophobicContact CD2-CD2 4.23Å; W293-L326 HydrophobicContact CE3-CD2 4.15Å; L322-L326 WeakPolarHBondContact O-CB 3.29Å; L322-L326 PolarHBondContact O-N 3.47Å; F323-L326 HydrophobicContact CD1-CD2 4.35Å; L326-L328 PolarHBondContact O-N 3.03Å; L326-S329 PolarHBondContact O-N 3.21Å; L326-S329 VanDerWaalsContact O-N 3.15Å; L326-V330 HydrophobicContact CD1-CG2 4.4Å; L326-V330 HydrophobicContact CG-CG2 4.49Å; L326-V330 WeakPolarHBondContact O-CG2 3.36Å; L326-V330 PolarHBondContact O-N 3.46Å |
| 327 | H | 98.3 | Very high | 93.3 | Very high | 13 Ų | 13 | 42.4 Ų | 42.4 | 6% | 0.06 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.7 | -48.8 | 179 | -176.8 | 69.8 | 0 | 0 | 0 | 111.1 | C294 F323 S324 S329 V330 L331 R393 Q396 | C294-H327 HydrophobicContact CB-CB 3.96Å; C294-H327 VanDerWaalsContact SG-CA 3.55Å; C294-H327 PolarHBondContact SG-N 3.48Å; F323-H327 VanDerWaalsContact O-CB 3.24Å; F323-H327 WeakPolarHBondContact O-CB 3.21Å; F323-H327 PolarHBondContact O-N 2.92Å; S324-H327 PolarHBondContact O-N 2.8Å; H327-S329 VanDerWaalsContact C-N 3.33Å; H327-S329 PolarHBondContact O-N 3.4Å; H327-V330 PolarHBondContact O-N 3.14Å; H327-L331 WeakPolarHBondContact O-CG 3.24Å; H327-L331 PolarHBondContact O-N 2.8Å; H327-R393 PolarHBondContact CE1-O 3.31Å; H327-Q396 PolarHBondContact NE2-OE1 3.11Å |
| 328 | L | 98.1 | Very high | 94.9 | Very high | 96 Ų | 96 | 41.3 Ų | 41.3 | 50% | 0.503 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -57.9 | -45.7 | 175.5 | 178 | 61 | 0 | 0 | 0 | 111.9 | S324 A325 L326 V330 L331 Q332 | S324-L328 PolarHBondContact O-N 3.36Å; A325-L328 PolarHBondContact O-N 2.87Å; L326-L328 PolarHBondContact O-N 3.03Å; L328-V330 VanDerWaalsContact C-N 3.34Å; L328-V330 PolarHBondContact O-N 3.14Å; L328-L331 PolarHBondContact O-N 3.05Å; L328-Q332 HydrophobicContact CD1-CG 4.39Å; L328-Q332 WeakPolarHBondContact O-CG 3.48Å; L328-Q332 PolarHBondContact O-N 2.81Å |
| 329 | S | 98.2 | Very high | 95.6 | Very high | 5 Ų | 5 | 43.1 Ų | 43.1 | 4% | 0.035 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.9 | -42.3 | -179.9 | -54 | 0 | 0 | 0 | 0 | 111.4 | A325 L326 H327 Q332 V333 | A325-S329 WeakPolarHBondContact O-CB 3.42Å; A325-S329 PolarHBondContact O-N 3.37Å; A325-S329 PolarHBondContact O-OG 3.44Å; L326-S329 PolarHBondContact O-N 3.21Å; L326-S329 VanDerWaalsContact O-N 3.15Å; H327-S329 VanDerWaalsContact C-N 3.33Å; H327-S329 PolarHBondContact O-N 3.4Å; S329-Q332 WeakPolarHBondContact O-CB 3.46Å; S329-Q332 PolarHBondContact O-N 3.4Å; S329-V333 WeakPolarHBondContact O-CG2 3.3Å; S329-V333 PolarHBondContact O-N 2.77Å |
| 330 | V | 98.1 | Very high | 96 | Very high | 3 Ų | 3 | 43.1 Ų | 43.1 | 2% | 0.018 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.9 | -43.5 | 175.4 | 170.9 | 0 | 0 | 0 | 0 | 111.6 | L287 L290 I291 L326 H327 L328 Q332 V333 F334 | L287-V330 HydrophobicContact CD2-CG1 4.36Å; L290-V330 HydrophobicContact CB-CG2 3.8Å; L290-V330 HydrophobicContact CD1-CG2 4.2Å; I291-V330 HydrophobicContact CD1-CG1 4.2Å; I291-V330 HydrophobicContact CG1-CG1 3.6Å; L326-V330 HydrophobicContact CD1-CG2 4.4Å; L326-V330 HydrophobicContact CG-CG2 4.49Å; L326-V330 WeakPolarHBondContact O-CG2 3.36Å; L326-V330 PolarHBondContact O-N 3.46Å; H327-V330 PolarHBondContact O-N 3.14Å; L328-V330 VanDerWaalsContact C-N 3.34Å; L328-V330 PolarHBondContact O-N 3.14Å; V330-Q332 VanDerWaalsContact C-N 3.32Å; V330-Q332 PolarHBondContact O-N 3.17Å; V330-V333 WeakPolarHBondContact O-CB 3.38Å; V330-V333 PolarHBondContact O-N 2.84Å; V330-F334 HydrophobicContact CG1-CD2 4.45Å; V330-F334 HydrophobicContact CG1-CE2 4.25Å; V330-F334 PolarHBondContact O-N 3.32Å |
| 331 | L | 98.1 | Very high | 96.1 | Very high | 24 Ų | 24 | 40.4 Ų | 40.4 | 13% | 0.126 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.1 | -40.9 | 175 | -64.2 | -178 | 0 | 0 | 0 | 111.4 | H327 L328 V333 F334 M335 Q396 V400 | H327-L331 WeakPolarHBondContact O-CG 3.24Å; H327-L331 PolarHBondContact O-N 2.8Å; L328-L331 PolarHBondContact O-N 3.05Å; L331-V333 VanDerWaalsContact C-N 3.34Å; L331-V333 PolarHBondContact O-N 2.89Å; L331-F334 HydrophobicContact CD2-CD2 4.43Å; L331-F334 WeakPolarHBondContact O-CB 3.38Å; L331-F334 PolarHBondContact O-N 2.94Å; L331-M335 WeakPolarHBondContact O-CG 3.34Å; L331-M335 PolarHBondContact O-N 3.4Å; L331-M335 VanDerWaalsContact O-N 3.09Å; L331-Q396 HydrophobicContact CD1-CB 4.29Å; L331-V400 HydrophobicContact CD2-CB 3.99Å; L331-V400 HydrophobicContact CD2-CG1 4.33Å; L331-V400 HydrophobicContact CD2-CG2 4.05Å |
| 332 | Q | 96.6 | Very high | 96.2 | Very high | 97 Ų | 97 | 37.7 Ų | 37.7 | 45% | 0.453 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -62.1 | -40.9 | 175.2 | -73 | 172.7 | -25.5 | 0 | 0 | 111.7 | L328 S329 V330 F334 M335 L336 | L328-Q332 HydrophobicContact CD1-CG 4.39Å; L328-Q332 WeakPolarHBondContact O-CG 3.48Å; L328-Q332 PolarHBondContact O-N 2.81Å; S329-Q332 WeakPolarHBondContact O-CB 3.46Å; S329-Q332 PolarHBondContact O-N 3.4Å; V330-Q332 VanDerWaalsContact C-N 3.32Å; V330-Q332 PolarHBondContact O-N 3.17Å; Q332-F334 VanDerWaalsContact C-N 3.32Å; Q332-F334 PolarHBondContact O-N 3.19Å; Q332-M335 WeakPolarHBondContact O-CB 3.39Å; Q332-M335 PolarHBondContact O-N 2.99Å; Q332-M335 VanDerWaalsContact O-N 3.09Å; Q332-L336 PolarHBondContact O-N 2.84Å |
| 333 | V | 97.3 | Very high | 96 | Very high | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.006 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.3 | -44.3 | 174 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | P261 V264 L265 L287 S329 V330 L331 M335 L336 L337 | P261-V333 HydrophobicContact CB-CG2 3.77Å; P261-V333 VanDerWaalsContact O-CG2 3.27Å; P261-V333 WeakPolarHBondContact O-CG2 3.43Å; V264-V333 HydrophobicContact CG2-CB 4.18Å; V264-V333 HydrophobicContact CG2-CG1 3.54Å; V264-V333 HydrophobicContact CG2-CG2 3.74Å; L265-V333 HydrophobicContact CD1-CG1 3.87Å; L265-V333 HydrophobicContact CD2-CG1 3.93Å; L265-V333 HydrophobicContact CG-CG1 3.84Å; L287-V333 HydrophobicContact CD2-CB 4.34Å; L287-V333 HydrophobicContact CD2-CG1 3.88Å; S329-V333 WeakPolarHBondContact O-CG2 3.3Å; S329-V333 PolarHBondContact O-N 2.77Å; V330-V333 WeakPolarHBondContact O-CB 3.38Å; V330-V333 PolarHBondContact O-N 2.84Å; L331-V333 VanDerWaalsContact C-N 3.34Å; L331-V333 PolarHBondContact O-N 2.89Å; V333-M335 PolarHBondContact O-N 3.42Å; V333-L336 WeakPolarHBondContact O-CB 3.49Å; V333-L336 PolarHBondContact O-N 3.48Å; V333-L337 PolarHBondContact O-N 3.27Å |
| 334 | F | 97.2 | Very high | 95.7 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.5 | -38.4 | 175 | -76.4 | -40.6 | 0 | 0 | 0 | 112.4 | L287 I291 V330 L331 Q332 L336 L337 P338 L353 V400 A401 S404 A406 | L287-F334 HydrophobicContact CD1-CD1 4.26Å; L287-F334 HydrophobicContact CD1-CE1 3.91Å; I291-F334 HydrophobicContact CD1-CE1 4.35Å; I291-F334 HydrophobicContact CD1-CE2 3.4Å; I291-F334 HydrophobicContact CD1-CZ 3.19Å; I291-F334 HydrophobicContact CG1-CE2 4.25Å; I291-F334 HydrophobicContact CG1-CZ 4.4Å; V330-F334 HydrophobicContact CG1-CD2 4.45Å; V330-F334 HydrophobicContact CG1-CE2 4.25Å; V330-F334 PolarHBondContact O-N 3.32Å; L331-F334 HydrophobicContact CD2-CD2 4.43Å; L331-F334 WeakPolarHBondContact O-CB 3.38Å; L331-F334 PolarHBondContact O-N 2.94Å; Q332-F334 VanDerWaalsContact C-N 3.32Å; Q332-F334 PolarHBondContact O-N 3.19Å; F334-L336 PolarHBondContact O-N 2.91Å; F334-L337 HydrophobicContact CD1-CD1 3.66Å; F334-L337 HydrophobicContact CE1-CD1 4.29Å; F334-L337 WeakPolarHBondContact O-CB 3.44Å; F334-L337 PolarHBondContact O-N 2.98Å; F334-P338 WeakPolarHBondContact O-CD 3.47Å; F334-L353 HydrophobicContact CZ-CD2 4.47Å; F334-V400 HydrophobicContact CB-CG1 3.59Å; F334-V400 HydrophobicContact CD2-CG1 4.17Å; F334-V400 HydrophobicContact CG-CG1 4.34Å; F334-A401 HydrophobicContact CD2-CB 4.4Å; F334-A401 HydrophobicContact CE1-CB 4.26Å; F334-A401 HydrophobicContact CE2-CB 3.88Å; F334-A401 HydrophobicContact CZ-CB 3.75Å; F334-S404 WeakPolarHBondContact O-CB 3.47Å; F334-A406 HydrophobicContact CD1-CB 3.62Å; F334-A406 HydrophobicContact CE1-CB 3.48Å; F334-A406 VanDerWaalsContact CE1-CB 3.48Å; F334-A406 HydrophobicContact CZ-CB 4.39Å |
| 335 | M | 95.7 | Very high | 95.4 | Very high | 126 Ų | 126 | 47.4 Ų | 47.4 | 62% | 0.621 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -65.3 | -19.4 | 176.2 | -63.3 | -59.1 | -66.5 | 0 | 0 | 113.6 | L331 Q332 V333 V400 | L331-M335 WeakPolarHBondContact O-CG 3.34Å; L331-M335 PolarHBondContact O-N 3.4Å; L331-M335 VanDerWaalsContact O-N 3.09Å; Q332-M335 WeakPolarHBondContact O-CB 3.39Å; Q332-M335 PolarHBondContact O-N 2.99Å; Q332-M335 VanDerWaalsContact O-N 3.09Å; V333-M335 PolarHBondContact O-N 3.42Å; M335-V400 HydrophobicContact CG-CG1 4.31Å; M335-V400 HydrophobicContact SD-CG1 3.89Å |
| 336 | L | 95.3 | Very high | 95.1 | Very high | 67 Ų | 67 | 47.7 Ų | 47.7 | 35% | 0.351 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -80.4 | -24.6 | 173.1 | -57.7 | 176.4 | 0 | 0 | 0 | 113 | P261 R262 Q332 V333 F334 I340 | P261-L336 HydrophobicContact CB-CD1 4.35Å; R262-L336 HydrophobicContact CG-CD1 4.47Å; Q332-L336 PolarHBondContact O-N 2.84Å; V333-L336 WeakPolarHBondContact O-CB 3.49Å; V333-L336 PolarHBondContact O-N 3.48Å; F334-L336 PolarHBondContact O-N 2.91Å; L336-I340 HydrophobicContact CB-CD1 4.35Å |
| 337 | L | 94.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.8 | -39.8 | -171.6 | -75.2 | 177.7 | 0 | 0 | 0 | 115.5 | L265 L287 V333 F334 N339 I340 L341 L352 A406 | L265-L337 HydrophobicContact CD1-CD2 3.73Å; L265-L337 HydrophobicContact CD2-CD2 3.76Å; L265-L337 HydrophobicContact CG-CD2 4.42Å; L287-L337 HydrophobicContact CD1-CD1 4.4Å; V333-L337 PolarHBondContact O-N 3.27Å; F334-L337 HydrophobicContact CD1-CD1 3.66Å; F334-L337 HydrophobicContact CE1-CD1 4.29Å; F334-L337 WeakPolarHBondContact O-CB 3.44Å; F334-L337 PolarHBondContact O-N 2.98Å; L337-N339 VanDerWaalsContact C-N 3.25Å; L337-N339 PolarHBondContact O-N 3.36Å; L337-I340 PolarHBondContact O-N 3.07Å; L337-I340 VanDerWaalsContact O-N 3.11Å; L337-L341 HydrophobicContact CB-CD1 4.21Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.31Å; L337-L341 WeakPolarHBondContact O-CG 3.42Å; L337-L341 PolarHBondContact O-N 2.94Å; L337-L352 HydrophobicContact CD1-CD1 3.88Å; L337-L352 HydrophobicContact CD2-CD1 3.47Å; L337-L352 VanDerWaalsContact CD2-CD1 3.47Å; L337-L352 HydrophobicContact CG-CD1 4.35Å; L337-A406 HydrophobicContact CD1-CB 3.52Å |
| 338 | P | 94.5 | Very high | 94.4 | Very high | 30 Ų | 30 | 53.3 Ų | 53.3 | 20% | 0.195 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -53.7 | -44.6 | -177.9 | -30.5 | 37.5 | 0 | 0 | 0 | 112.4 | F334 N342 F347 | F334-P338 WeakPolarHBondContact O-CD 3.47Å; P338-N342 VanDerWaalsContact O-CB 3.24Å; P338-N342 WeakPolarHBondContact O-CB 3.41Å; P338-N342 VanDerWaalsContact O-CG 3.23Å; P338-N342 PolarHBondContact O-N 3.44Å; P338-N342 PolarHBondContact O-ND2 2.92Å; P338-F347 HydrophobicContact CB-CD2 4.48Å; P338-F347 HydrophobicContact CB-CE2 4Å; P338-F347 HydrophobicContact CG-CE2 4.44Å |
| 339 | N | 94.1 | Very high | 93.9 | Very high | 106 Ų | 106 | 58.4 Ų | 58.4 | 57% | 0.567 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -64.4 | -48.2 | 179.3 | -64.7 | -25.5 | 0 | 0 | 0 | 110.8 | L337 L341 N342 E343 | L337-N339 VanDerWaalsContact C-N 3.25Å; L337-N339 PolarHBondContact O-N 3.36Å; N339-L341 PolarHBondContact O-N 3.31Å; N339-N342 PolarHBondContact O-N 2.93Å; N339-E343 WeakPolarHBondContact O-CG 3.38Å; N339-E343 PolarHBondContact O-N 3.3Å |
| 340 | I | 93.4 | Very high | 93.5 | Very high | 10 Ų | 10 | 60.6 Ų | 60.6 | 5% | 0.051 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.2 | -44.2 | -179.6 | -63.5 | 169.8 | 0 | 0 | 0 | 111.5 | L265 F268 L269 L336 L337 K344 | L265-I340 HydrophobicContact CD1-CD1 3.54Å; F268-I340 HydrophobicContact CE1-CG2 3.83Å; L269-I340 HydrophobicContact CD2-CG2 3.5Å; L336-I340 HydrophobicContact CB-CD1 4.35Å; L337-I340 PolarHBondContact O-N 3.07Å; L337-I340 VanDerWaalsContact O-N 3.11Å; I340-K344 PolarHBondContact O-N 2.86Å; I340-K344 VanDerWaalsContact O-N 3.13Å |
| 341 | L | 92.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.7 | -38.1 | 179.8 | -69.8 | 175.3 | 0 | 0 | 0 | 111.3 | F268 L337 N339 K344 G345 L346 F347 | F268-L341 HydrophobicContact CE1-CD2 4.22Å; F268-L341 HydrophobicContact CZ-CD2 3.83Å; L337-L341 HydrophobicContact CB-CD1 4.21Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.31Å; L337-L341 WeakPolarHBondContact O-CG 3.42Å; L337-L341 PolarHBondContact O-N 2.94Å; N339-L341 PolarHBondContact O-N 3.31Å; L341-K344 PolarHBondContact O-N 3.43Å; L341-G345 PolarHBondContact O-N 2.66Å; L341-L346 HydrophobicContact CD2-CB 4.05Å; L341-L346 PolarHBondContact O-N 2.88Å; L341-F347 HydrophobicContact CB-CB 4.06Å; L341-F347 HydrophobicContact CB-CD2 4.08Å; L341-F347 HydrophobicContact CD1-CD2 4.38Å; L341-F347 PolarHBondContact O-N 3.25Å |
| 342 | N | 93.6 | Very high | 92.8 | Very high | 94 Ų | 94 | 61.1 Ų | 61.1 | 50% | 0.503 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.1 | -46.2 | 174.7 | -80.3 | -44 | 0 | 0 | 0 | 111.6 | P338 N339 K344 G345 F347 | P338-N342 VanDerWaalsContact O-CB 3.24Å; P338-N342 WeakPolarHBondContact O-CB 3.41Å; P338-N342 VanDerWaalsContact O-CG 3.23Å; P338-N342 PolarHBondContact O-N 3.44Å; P338-N342 PolarHBondContact O-ND2 2.92Å; N339-N342 PolarHBondContact O-N 2.93Å; N342-K344 PolarHBondContact O-N 3.43Å; N342-G345 PolarHBondContact O-N 3.04Å; N342-F347 VanDerWaalsContact OD1-CB 3.24Å; N342-F347 WeakPolarHBondContact OD1-CB 3.36Å |
| 343 | E | 92.3 | Very high | 92.7 | Very high | 168 Ų | 168 | 57 Ų | 57 | 79% | 0.785 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -57.9 | -36.9 | 176.3 | -75.4 | 174.5 | -176.8 | 0 | 0 | 112.4 | N339 | N339-E343 WeakPolarHBondContact O-CG 3.38Å; N339-E343 PolarHBondContact O-N 3.3Å |
| 344 | K | 89.6 | Confident | 92.4 | Very high | 87 Ų | 87 | 61.7 Ų | 61.7 | 38% | 0.378 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | -4.1 | 176.2 | -70.8 | -179.7 | 176.9 | -83.2 | 0 | 114.1 | F268 L269 I340 L341 N342 L346 | F268-K344 HydrophobicContact CE1-CD 4.22Å; F268-K344 HydrophobicContact CZ-CD 3.89Å; L269-K344 PolarHBondContact O-NZ 3.36Å; I340-K344 PolarHBondContact O-N 2.86Å; I340-K344 VanDerWaalsContact O-N 3.13Å; L341-K344 PolarHBondContact O-N 3.43Å; N342-K344 PolarHBondContact O-N 3.43Å; K344-L346 VanDerWaalsContact C-N 3.3Å; K344-L346 HydrophobicContact CB-CD1 3.6Å; K344-L346 HydrophobicContact CB-CG 3.94Å; K344-L346 HydrophobicContact CD-CD1 4.11Å; K344-L346 HydrophobicContact CG-CD1 4.49Å; K344-L346 PolarHBondContact O-N 3.08Å |
| 345 | G | 90.9 | Very high | 92.2 | Very high | 42 Ų | 42 | 63.9 Ų | 63.9 | 43% | 0.433 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.3 | 26.8 | -177 | 0 | 0 | 0 | 0 | 0 | 114.6 | L341 N342 | L341-G345 PolarHBondContact O-N 2.66Å; N342-G345 PolarHBondContact O-N 3.04Å |
| 346 | L | 91.5 | Very high | 92.1 | Very high | 33 Ų | 33 | 65.4 Ų | 65.4 | 17% | 0.173 | 34% | 0.335 | C | S | . | . | trans | -110.9 | -3.7 | -174.1 | -61.4 | 167.8 | 0 | 0 | 0 | 113.5 | F268 L273 L341 K344 G348 R349 L350 | F268-L346 HydrophobicContact CE2-CD1 4.05Å; F268-L346 HydrophobicContact CZ-CD1 3.91Å; L273-L346 HydrophobicContact CD1-CD1 3.19Å; L273-L346 HydrophobicContact CD1-CD2 3.99Å; L273-L346 HydrophobicContact CD1-CG 4.18Å; L341-L346 HydrophobicContact CD2-CB 4.05Å; L341-L346 PolarHBondContact O-N 2.88Å; K344-L346 VanDerWaalsContact C-N 3.3Å; K344-L346 HydrophobicContact CB-CD1 3.6Å; K344-L346 HydrophobicContact CB-CG 3.94Å; K344-L346 HydrophobicContact CD-CD1 4.11Å; K344-L346 HydrophobicContact CG-CD1 4.49Å; K344-L346 PolarHBondContact O-N 3.08Å; L346-G348 PolarHBondContact O-N 3.31Å; L346-R349 WeakPolarHBondContact O-CA 3.45Å; L346-R349 WeakPolarHBondContact O-CB 3.45Å; L346-R349 PolarHBondContact O-N 2.69Å; L346-L350 HydrophobicContact CB-CB 4.14Å; L346-L350 HydrophobicContact CD1-CD2 4.08Å; L346-L350 PolarHBondContact O-N 3.4Å; L346-L350 VanDerWaalsContact O-N 3.09Å | ||
| 347 | F | 91.8 | Very high | 92 | Very high | 85 Ų | 85 | 63.6 Ų | 63.6 | 37% | 0.373 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58 | 127.1 | 179.4 | -168.7 | -90.7 | 0 | 0 | 0 | 110.6 | P338 L341 N342 R349 | P338-F347 HydrophobicContact CB-CD2 4.48Å; P338-F347 HydrophobicContact CB-CE2 4Å; P338-F347 HydrophobicContact CG-CE2 4.44Å; L341-F347 HydrophobicContact CB-CB 4.06Å; L341-F347 HydrophobicContact CB-CD2 4.08Å; L341-F347 HydrophobicContact CD1-CD2 4.38Å; L341-F347 PolarHBondContact O-N 3.25Å; N342-F347 VanDerWaalsContact OD1-CB 3.24Å; N342-F347 WeakPolarHBondContact OD1-CB 3.36Å; F347-R349 PolarHBondContact O-N 3.4Å |
| 348 | G | 88.9 | Confident | 92.1 | Very high | 45 Ų | 45 | 63.8 Ų | 63.8 | 46% | 0.464 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.8 | 2.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | L346 | L346-G348 PolarHBondContact O-N 3.31Š|
| 349 | R | 88.8 | Confident | 92.1 | Very high | 204 Ų | 204 | 64 Ų | 64 | 77% | 0.77 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | -27.5 | -177.9 | -60.9 | 179.8 | 179 | -177.8 | -3.1 | 113.4 | L346 F347 | L346-R349 WeakPolarHBondContact O-CA 3.45Å; L346-R349 WeakPolarHBondContact O-CB 3.45Å; L346-R349 PolarHBondContact O-N 2.69Å; F347-R349 PolarHBondContact O-N 3.4Å |
| 350 | L | 88.8 | Confident | 92.2 | Very high | 50 Ų | 50 | 62.5 Ų | 62.5 | 26% | 0.262 | 33% | 0.328 | S | S | . | . | trans | -123.4 | 120 | 178.1 | -179.2 | 68.4 | 0 | 0 | 0 | 109.6 | F268 L273 L346 L352 | F268-L350 HydrophobicContact CD2-CD2 4.16Å; F268-L350 HydrophobicContact CE2-CD2 3.38Å; F268-L350 HydrophobicContact CZ-CD2 4.07Å; L273-L350 HydrophobicContact CD2-CD2 4.28Å; L346-L350 HydrophobicContact CB-CB 4.14Å; L346-L350 HydrophobicContact CD1-CD2 4.08Å; L346-L350 PolarHBondContact O-N 3.4Å; L346-L350 VanDerWaalsContact O-N 3.09Å; L350-L352 HydrophobicContact CD2-CD2 4.11Å; L350-L352 HydrophobicContact CG-CD2 4.41Å | ||
| 351 | A | 90.4 | Very high | 92.4 | Very high | 17 Ų | 17 | 62.5 Ų | 62.5 | 14% | 0.14 | 33% | 0.328 | C | S | . | . | trans | -89 | 128.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q354 A406 L408 | A351-Q354 PolarHBondContact O-NE2 2.88Å; A351-Q354 VanDerWaalsContact O-NE2 3.09Å; A351-A406 CarbonylContact C-O 3.59Å; A351-A406 WeakPolarHBondContact CA-O 3.26Å; A351-L408 HydrophobicContact CB-CB 4.28Å; A351-L408 HydrophobicContact CB-CD1 4.11Å; A351-L408 HydrophobicContact CB-CG 3.91Å | ||
| 352 | L | 92.1 | Very high | 92.6 | Very high | 21 Ų | 21 | 62.7 Ų | 62.7 | 11% | 0.11 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -86.9 | -22.1 | 170 | -64.6 | -175.5 | 0 | 0 | 0 | 111.9 | L265 F268 T285 L287 L337 L350 A406 | L265-L352 HydrophobicContact CD2-CD1 4.27Å; F268-L352 HydrophobicContact CD1-CD1 4.34Å; F268-L352 HydrophobicContact CD2-CD2 3.99Å; F268-L352 HydrophobicContact CE2-CD2 4.25Å; F268-L352 HydrophobicContact CG-CD2 4.18Å; T285-L352 HydrophobicContact CG2-CD1 4.36Å; T285-L352 HydrophobicContact CG2-CD2 4.35Å; L287-L352 HydrophobicContact CD1-CD1 4.35Å; L337-L352 HydrophobicContact CD1-CD1 3.88Å; L337-L352 HydrophobicContact CD2-CD1 3.47Å; L337-L352 VanDerWaalsContact CD2-CD1 3.47Å; L337-L352 HydrophobicContact CG-CD1 4.35Å; L350-L352 HydrophobicContact CD2-CD2 4.11Å; L350-L352 HydrophobicContact CG-CD2 4.41Å; L352-A406 PolarHBondContact N-O 3.02Å |
| 353 | L | 93.8 | Very high | 92.7 | Very high | 11 Ų | 11 | 61 Ų | 61 | 6% | 0.058 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -109.8 | 112.8 | 171.4 | -173 | 65.5 | 0 | 0 | 0 | 108.8 | I291 F334 V358 A401 A406 L407 | I291-L353 HydrophobicContact CD1-CD1 4.37Å; I291-L353 HydrophobicContact CD1-CD2 4.17Å; F334-L353 HydrophobicContact CZ-CD2 4.47Å; L353-V358 HydrophobicContact CD1-CG2 4.3Å; L353-V358 HydrophobicContact CD2-CG2 3.69Å; L353-V358 HydrophobicContact CG-CG2 3.71Å; L353-A401 HydrophobicContact CD2-CB 4.2Å; L353-A406 PolarHBondContact N-O 2.99Å; L353-L407 HydrophobicContact CB-CB 4.44Å; L353-L407 HydrophobicContact CD2-CB 4.45Å; L353-L407 VanDerWaalsContact O-CD1 3.29Å; L353-L407 WeakPolarHBondContact O-CD1 3.44Å |
| 354 | Q | 91.9 | Very high | 92.8 | Very high | 99 Ų | 99 | 54.2 Ų | 54.2 | 46% | 0.463 | 29% | 0.294 | S | S | . | . | trans | -76.2 | 138.9 | -178.5 | -60.8 | -58.7 | -37.7 | 0 | 0 | 111.1 | A351 E356 S357 V358 | A351-Q354 PolarHBondContact O-NE2 2.88Å; A351-Q354 VanDerWaalsContact O-NE2 3.09Å; Q354-E356 VanDerWaalsContact C-N 3.26Å; Q354-E356 PolarHBondContact O-N 2.9Å; Q354-S357 WeakPolarHBondContact O-CB 3.15Å; Q354-S357 PolarHBondContact O-N 3.35Å; Q354-S357 VanDerWaalsContact O-N 3.12Å; Q354-V358 WeakPolarHBondContact O-CG2 3.35Å; Q354-V358 PolarHBondContact O-N 3.16Å | ||
| 355 | M | 93.1 | Very high | 93.1 | Very high | 46 Ų | 46 | 50.1 Ų | 50.1 | 23% | 0.227 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.5 | -35.5 | 179.7 | -172.7 | 60.5 | -169.4 | 0 | 0 | 112.2 | S357 V358 A359 L407 C409 D413 I417 | M355-S357 PolarHBondContact O-N 3.09Å; M355-V358 PolarHBondContact O-N 2.8Å; M355-A359 PolarHBondContact O-N 2.89Å; M355-L407 HydrophobicContact SD-CD1 4.25Å; M355-C409 HydrophobicContact SD-CB 3.72Å; M355-D413 HydrophobicContact CE-CB 3.93Å; M355-I417 HydrophobicContact CE-CB 4.46Å; M355-I417 HydrophobicContact CE-CD1 3.35Å; M355-I417 HydrophobicContact CE-CG1 3.7Å; M355-I417 HydrophobicContact CE-CG2 3.92Å; M355-I417 HydrophobicContact SD-CD1 4.39Å |
| 356 | E | 93.3 | Very high | 93.3 | Very high | 159 Ų | 159 | 48.3 Ų | 48.3 | 74% | 0.743 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -59 | -46 | 174.4 | -174.5 | 178.2 | 178.3 | 0 | 0 | 111.5 | Q354 V358 A359 T360 | Q354-E356 VanDerWaalsContact C-N 3.26Å; Q354-E356 PolarHBondContact O-N 2.9Å; E356-V358 VanDerWaalsContact C-N 3.28Å; E356-V358 PolarHBondContact O-N 2.97Å; E356-A359 WeakPolarHBondContact O-CB 3.5Å; E356-A359 PolarHBondContact O-N 2.62Å; E356-A359 VanDerWaalsContact O-N 3.16Å; E356-T360 PolarHBondContact O-N 3.3Å; E356-T360 PolarHBondContact O-OG1 3.37Å; E356-T360 VanDerWaalsContact O-OG1 3.09Å |
| 357 | S | 92.6 | Very high | 93.3 | Very high | 29 Ų | 29 | 52.4 Ų | 52.4 | 20% | 0.203 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62 | -36.5 | 177.3 | -49 | 0 | 0 | 0 | 0 | 112.3 | Q354 M355 L361 | Q354-S357 WeakPolarHBondContact O-CB 3.15Å; Q354-S357 PolarHBondContact O-N 3.35Å; Q354-S357 VanDerWaalsContact O-N 3.12Å; M355-S357 PolarHBondContact O-N 3.09Å; S357-L361 WeakPolarHBondContact O-CB 2.95Å; S357-L361 PolarHBondContact O-N 3.23Å |
| 358 | V | 95.6 | Very high | 93.3 | Very high | 4 Ų | 4 | 48.9 Ų | 48.9 | 2% | 0.024 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69.1 | -40.1 | 175.4 | -178.6 | 0 | 0 | 0 | 0 | 111.2 | L353 Q354 M355 E356 L361 T362 L398 L407 I417 | L353-V358 HydrophobicContact CD1-CG2 4.3Å; L353-V358 HydrophobicContact CD2-CG2 3.69Å; L353-V358 HydrophobicContact CG-CG2 3.71Å; Q354-V358 WeakPolarHBondContact O-CG2 3.35Å; Q354-V358 PolarHBondContact O-N 3.16Å; M355-V358 PolarHBondContact O-N 2.8Å; E356-V358 VanDerWaalsContact C-N 3.28Å; E356-V358 PolarHBondContact O-N 2.97Å; V358-L361 PolarHBondContact O-N 3.29Å; V358-T362 WeakPolarHBondContact O-CB 3.46Å; V358-T362 PolarHBondContact O-N 3.13Å; V358-T362 PolarHBondContact O-OG1 2.91Å; V358-L398 HydrophobicContact CG1-CD2 3.59Å; V358-L407 HydrophobicContact CG2-CD1 4.1Å; V358-L407 HydrophobicContact CG2-CD2 4.33Å; V358-I417 HydrophobicContact CB-CD1 4.32Å; V358-I417 HydrophobicContact CG1-CD1 3.6Å |
| 359 | A | 96.3 | Very high | 93.4 | Very high | 33 Ų | 33 | 46.9 Ų | 46.9 | 27% | 0.273 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63 | -45.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | M355 E356 T362 S363 I417 | M355-A359 PolarHBondContact O-N 2.89Å; E356-A359 WeakPolarHBondContact O-CB 3.5Å; E356-A359 PolarHBondContact O-N 2.62Å; E356-A359 VanDerWaalsContact O-N 3.16Å; A359-T362 PolarHBondContact O-N 3.49Å; A359-S363 PolarHBondContact O-N 3.41Å; A359-I417 HydrophobicContact CB-CG2 3.88Å |
| 360 | T | 95.5 | Very high | 93.5 | Very high | 75 Ų | 75 | 40.6 Ų | 40.6 | 46% | 0.46 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59 | -47.6 | 173.9 | -53.4 | 0 | 0 | 0 | 0 | 111.3 | E356 T362 S363 D364 | E356-T360 PolarHBondContact O-N 3.3Å; E356-T360 PolarHBondContact O-OG1 3.37Å; E356-T360 VanDerWaalsContact O-OG1 3.09Å; T360-T362 VanDerWaalsContact C-N 3.3Å; T360-T362 PolarHBondContact O-N 2.85Å; T360-S363 PolarHBondContact O-N 3.26Å; T360-D364 WeakPolarHBondContact O-CB 3.35Å; T360-D364 PolarHBondContact O-N 3.41Å |
| 361 | L | 96.4 | Very high | 93.3 | Very high | 11 Ų | 11 | 41.8 Ų | 41.8 | 6% | 0.058 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.4 | -41.4 | 177.8 | 176.3 | 58 | 0 | 0 | 0 | 112.2 | I291 R292 I295 K296 S357 V358 D364 L365 | I291-L361 HydrophobicContact CG2-CD2 4.17Å; R292-L361 HydrophobicContact CB-CD1 4.12Å; R292-L361 HydrophobicContact CG-CD1 3.95Å; I295-L361 HydrophobicContact CD1-CD2 3.72Å; I295-L361 HydrophobicContact CG2-CD1 4.44Å; K296-L361 HydrophobicContact CD-CD1 4.14Å; K296-L361 HydrophobicContact CG-CD1 4.13Å; S357-L361 WeakPolarHBondContact O-CB 2.95Å; S357-L361 PolarHBondContact O-N 3.23Å; V358-L361 PolarHBondContact O-N 3.29Å; L361-D364 PolarHBondContact O-N 2.94Å; L361-L365 VanDerWaalsContact O-CB 3.3Å; L361-L365 WeakPolarHBondContact O-CB 3.44Å; L361-L365 PolarHBondContact O-N 3.14Å |
| 362 | T | 96.9 | Very high | 92.9 | Very high | 3 Ų | 3 | 41.6 Ų | 41.6 | 2% | 0.018 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.2 | -41.5 | 179.4 | -59.1 | 0 | 0 | 0 | 0 | 111.6 | V358 A359 T360 L365 S366 I417 L421 | V358-T362 WeakPolarHBondContact O-CB 3.46Å; V358-T362 PolarHBondContact O-N 3.13Å; V358-T362 PolarHBondContact O-OG1 2.91Å; A359-T362 PolarHBondContact O-N 3.49Å; T360-T362 VanDerWaalsContact C-N 3.3Å; T360-T362 PolarHBondContact O-N 2.85Å; T362-L365 PolarHBondContact O-N 2.79Å; T362-S366 WeakPolarHBondContact O-CB 3.01Å; T362-S366 PolarHBondContact O-N 3.37Å; T362-I417 WeakPolarHBondContact CG2-O 3.43Å; T362-L421 HydrophobicContact CG2-CD1 3.77Å; T362-L421 HydrophobicContact CG2-CD2 4.15Å; T362-L421 HydrophobicContact CG2-CG 3.89Å |
| 363 | S | 95.9 | Very high | 92.2 | Very high | 59 Ų | 59 | 45 Ų | 45 | 41% | 0.413 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63 | -44.3 | 174.3 | -172.4 | 0 | 0 | 0 | 0 | 111.8 | A359 T360 S366 R367 | A359-S363 PolarHBondContact O-N 3.41Å; T360-S363 PolarHBondContact O-N 3.26Å; S363-S366 PolarHBondContact O-N 3.46Å; S363-R367 PolarHBondContact O-N 3.46Å |
| 364 | D | 94.8 | Very high | 91.2 | Very high | 26 Ų | 26 | 51.9 Ų | 51.9 | 14% | 0.139 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.5 | -43 | 175.6 | -86.1 | -17.6 | 0 | 0 | 0 | 112.4 | K296 T360 L361 R367 L368 | K296-D364 IonicContact NZ-OD2 3.7Å; T360-D364 WeakPolarHBondContact O-CB 3.35Å; T360-D364 PolarHBondContact O-N 3.41Å; L361-D364 PolarHBondContact O-N 2.94Å; D364-R367 PolarHBondContact O-N 3.44Å; D364-R367 IonicContact OD1-CZ 3.69Å; D364-R367 IonicContact OD1-NE 2.69Å; D364-R367 IonicContact OD1-NH2 2.69Å; D364-R367 PolarHBondContact OD1-NH2 3.01Å; D364-L368 WeakPolarHBondContact O-CG 3.48Å; D364-L368 PolarHBondContact O-N 2.9Å |
| 365 | L | 95.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.8 | -45 | 177.1 | -179.6 | 61.8 | 0 | 0 | 0 | 111 | I295 L299 L361 T362 R367 L368 L369 A390 L391 L394 L421 | I295-L365 HydrophobicContact CG2-CD1 4.19Å; I295-L365 HydrophobicContact CG2-CD2 3.89Å; L299-L365 HydrophobicContact CD1-CD1 3.6Å; L361-L365 VanDerWaalsContact O-CB 3.3Å; L361-L365 WeakPolarHBondContact O-CB 3.44Å; L361-L365 PolarHBondContact O-N 3.14Å; T362-L365 PolarHBondContact O-N 2.79Å; L365-R367 VanDerWaalsContact C-N 3.3Å; L365-R367 PolarHBondContact O-N 3.13Å; L365-L368 PolarHBondContact O-N 3.07Å; L365-L368 VanDerWaalsContact O-N 3.15Å; L365-L369 HydrophobicContact CD1-CD1 4.17Å; L365-L369 HydrophobicContact CD1-CG 4.2Å; L365-L369 HydrophobicContact CG-CD1 3.85Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.5Å; L365-L369 VanDerWaalsContact O-CG 3.26Å; L365-L369 WeakPolarHBondContact O-CG 3.14Å; L365-L369 PolarHBondContact O-N 2.98Å; L365-A390 HydrophobicContact CD1-CB 4.04Å; L365-L391 HydrophobicContact CD2-CD2 4.11Å; L365-L394 HydrophobicContact CD2-CB 4.37Å; L365-L394 HydrophobicContact CD2-CD2 3.71Å; L365-L421 HydrophobicContact CB-CD2 4.44Å; L365-L421 HydrophobicContact CD2-CD2 4.18Å; L365-L421 HydrophobicContact CG-CD2 4.21Å |
| 366 | S | 95.1 | Very high | 88.2 | Confident | 4 Ų | 4 | 52.3 Ų | 52.3 | 3% | 0.028 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -55.2 | -46.3 | 174.2 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | T362 S363 L368 L369 D370 R420 | T362-S366 WeakPolarHBondContact O-CB 3.01Å; T362-S366 PolarHBondContact O-N 3.37Å; S363-S366 PolarHBondContact O-N 3.46Å; S366-L368 PolarHBondContact O-N 2.77Å; S366-L369 PolarHBondContact O-N 3.39Å; S366-D370 VanDerWaalsContact O-CG 3.23Å; S366-D370 PolarHBondContact O-N 3.04Å; S366-R420 PolarHBondContact OG-NH2 3.29Å |
| 367 | R | 92.6 | Very high | 86.1 | Confident | 120 Ų | 120 | 54.1 Ų | 54.1 | 45% | 0.453 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 176.3 | 177.2 | 175.7 | 59.6 | 163.6 | -4.1 | 112.7 | S363 D364 L365 Q371 | S363-R367 PolarHBondContact O-N 3.46Å; D364-R367 PolarHBondContact O-N 3.44Å; D364-R367 IonicContact OD1-CZ 3.69Å; D364-R367 IonicContact OD1-NE 2.69Å; D364-R367 IonicContact OD1-NH2 2.69Å; D364-R367 PolarHBondContact OD1-NH2 3.01Å; L365-R367 VanDerWaalsContact C-N 3.3Å; L365-R367 PolarHBondContact O-N 3.13Å; R367-Q371 VanDerWaalsContact O-CG 3.24Å; R367-Q371 WeakPolarHBondContact O-CG 3.37Å; R367-Q371 PolarHBondContact O-N 3.16Å |
| 368 | L | 91.1 | Very high | 84 | Confident | 10 Ų | 10 | 56.3 Ų | 56.3 | 5% | 0.052 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -67.1 | -38.6 | 178.1 | -73.9 | 175.6 | 0 | 0 | 0 | 112.2 | K296 L299 D364 L365 S366 Q371 A372 | K296-L368 HydrophobicContact CB-CD1 4.19Å; K296-L368 HydrophobicContact CD-CD1 4.35Å; K296-L368 HydrophobicContact CG-CD1 4.01Å; L299-L368 HydrophobicContact CB-CB 4.47Å; L299-L368 HydrophobicContact CD1-CB 3.8Å; D364-L368 WeakPolarHBondContact O-CG 3.48Å; D364-L368 PolarHBondContact O-N 2.9Å; L365-L368 PolarHBondContact O-N 3.07Å; L365-L368 VanDerWaalsContact O-N 3.15Å; S366-L368 PolarHBondContact O-N 2.77Å; L368-Q371 PolarHBondContact O-N 3.34Å; L368-A372 WeakPolarHBondContact O-CB 3.3Å; L368-A372 PolarHBondContact O-N 2.93Å |
| 369 | L | 91.7 | Very high | 82.1 | Confident | 3 Ų | 3 | 60.6 Ų | 60.6 | 2% | 0.016 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.9 | -46.9 | 175.2 | -69.2 | 167 | 0 | 0 | 0 | 110.7 | L299 L365 S366 Q371 A372 D373 S387 L391 L421 P422 | L299-L369 HydrophobicContact CD1-CD2 3.73Å; L299-L369 HydrophobicContact CD1-CG 3.96Å; L299-L369 HydrophobicContact CD2-CD2 4.23Å; L365-L369 HydrophobicContact CD1-CD1 4.17Å; L365-L369 HydrophobicContact CD1-CG 4.2Å; L365-L369 HydrophobicContact CG-CD1 3.85Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.5Å; L365-L369 VanDerWaalsContact O-CG 3.26Å; L365-L369 WeakPolarHBondContact O-CG 3.14Å; L365-L369 PolarHBondContact O-N 2.98Å; S366-L369 PolarHBondContact O-N 3.39Å; L369-Q371 VanDerWaalsContact C-N 3.26Å; L369-Q371 PolarHBondContact O-N 3.28Å; L369-A372 WeakPolarHBondContact O-CB 3.4Å; L369-A372 PolarHBondContact O-N 3.09Å; L369-D373 PolarHBondContact O-N 3.12Å; L369-S387 VanDerWaalsContact CD2-CB 3.5Å; L369-S387 WeakPolarHBondContact CD2-OG 3.38Å; L369-L391 HydrophobicContact CD1-CD2 3.95Å; L369-L391 HydrophobicContact CD1-CG 4.34Å; L369-L421 HydrophobicContact CD1-CD2 4.15Å; L369-P422 HydrophobicContact CD1-CG 3.87Å |
| 370 | D | 89.8 | Confident | 80.4 | Confident | 72 Ų | 72 | 62.8 Ų | 62.8 | 39% | 0.385 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -58.2 | -39.2 | 175.6 | -69.9 | -18.8 | 0 | 0 | 0 | 112 | S366 K374 | S366-D370 VanDerWaalsContact O-CG 3.23Å; S366-D370 PolarHBondContact O-N 3.04Å; D370-K374 VanDerWaalsContact O-CG 3.28Å; D370-K374 WeakPolarHBondContact O-CG 3.23Å; D370-K374 PolarHBondContact O-N 3.38Å; D370-K374 VanDerWaalsContact O-N 3.1Å |
| 371 | Q | 85.9 | Confident | 78.9 | Confident | 75 Ų | 75 | 62.1 Ų | 62.1 | 35% | 0.35 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -67 | -44.1 | 175 | -73.7 | 170.8 | 3.5 | 0 | 0 | 111.2 | R367 L368 L369 D373 K374 H375 | R367-Q371 VanDerWaalsContact O-CG 3.24Å; R367-Q371 WeakPolarHBondContact O-CG 3.37Å; R367-Q371 PolarHBondContact O-N 3.16Å; L368-Q371 PolarHBondContact O-N 3.34Å; L369-Q371 VanDerWaalsContact C-N 3.26Å; L369-Q371 PolarHBondContact O-N 3.28Å; Q371-D373 VanDerWaalsContact C-N 3.25Å; Q371-D373 PolarHBondContact O-N 2.83Å; Q371-K374 PolarHBondContact O-N 3.38Å; Q371-H375 PolarHBondContact O-N 2.87Å; Q371-H375 PolarHBondContact O-ND1 3.08Å |
| 372 | A | 80.3 | Confident | 77.6 | Confident | 13 Ų | 13 | 67.7 Ų | 67.7 | 11% | 0.107 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.3 | -35.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L368 L369 T376 | L368-A372 WeakPolarHBondContact O-CB 3.3Å; L368-A372 PolarHBondContact O-N 2.93Å; L369-A372 WeakPolarHBondContact O-CB 3.4Å; L369-A372 PolarHBondContact O-N 3.09Å; A372-T376 PolarHBondContact O-OG1 3.24Å |
| 373 | D | 77.8 | Confident | 76.6 | Confident | 92 Ų | 92 | 67.9 Ų | 67.9 | 49% | 0.492 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -73.8 | -46 | 178.7 | -68.9 | -17.3 | 0 | 0 | 0 | 111.9 | L369 Q371 H375 T376 | L369-D373 PolarHBondContact O-N 3.12Å; Q371-D373 VanDerWaalsContact C-N 3.25Å; Q371-D373 PolarHBondContact O-N 2.83Å; D373-H375 VanDerWaalsContact C-N 3.35Å; D373-H375 PolarHBondContact O-N 3.27Å; D373-T376 PolarHBondContact O-N 3Å |
| 374 | K | 73.7 | Confident | 76 | Confident | 157 Ų | 157 | 70.8 Ų | 70.8 | 68% | 0.683 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -63.6 | -34.9 | -179.8 | -73.1 | 172.5 | -173.5 | 176 | 0 | 114 | D370 Q371 T376 | D370-K374 VanDerWaalsContact O-CG 3.28Å; D370-K374 WeakPolarHBondContact O-CG 3.23Å; D370-K374 PolarHBondContact O-N 3.38Å; D370-K374 VanDerWaalsContact O-N 3.1Å; Q371-K374 PolarHBondContact O-N 3.38Å; K374-T376 PolarHBondContact O-N 3.03Å |
| 375 | H | 62.8 | Low | 75.8 | Confident | 128 Ų | 128 | 72.3 Ų | 72.3 | 59% | 0.593 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | 4.3 | -179.2 | -71.4 | 88.4 | 0 | 0 | 0 | 113.6 | K306 Q371 D373 | K306-H375 PolarHBondContact NZ-O 3.03Å; Q371-H375 PolarHBondContact O-N 2.87Å; Q371-H375 PolarHBondContact O-ND1 3.08Å; D373-H375 VanDerWaalsContact C-N 3.35Å; D373-H375 PolarHBondContact O-N 3.27Å |
| 376 | T | 58.3 | Low | 75.5 | Confident | 25 Ų | 25 | 73.1 Ų | 73.1 | 15% | 0.153 | 41% | 0.411 | C | S | . | . | trans | -135.2 | 71.3 | -168.5 | -38.9 | 0 | 0 | 0 | 0 | 110.9 | R302 A372 D373 K374 A378 | R302-T376 PolarHBondContact NH2-OG1 3.49Å; A372-T376 PolarHBondContact O-OG1 3.24Å; D373-T376 PolarHBondContact O-N 3Å; K374-T376 PolarHBondContact O-N 3.03Å; T376-A378 WeakPolarHBondContact CG2-O 3.36Å; T376-A378 PolarHBondContact O-N 3.16Å; T376-A378 VanDerWaalsContact O-N 3.09Å | ||
| 377 | H | 50 | Low | 75.4 | Confident | 198 Ų | 198 | 73.3 Ų | 73.3 | 92% | 0.917 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -64.9 | -5.3 | 171.5 | -81 | -63 | 0 | 0 | 0 | 114.2 | ||
| 378 | A | 48.9 | Very low | 75.5 | Confident | 75 Ų | 75 | 69.8 Ų | 69.8 | 62% | 0.62 | 40% | 0.401 | S | S | * | . | S | Bend | trans | -133.1 | 97.9 | 168 | 0 | 0 | 0 | 0 | 0 | 108.7 | T376 T380 | T376-A378 WeakPolarHBondContact CG2-O 3.36Å; T376-A378 PolarHBondContact O-N 3.16Å; T376-A378 VanDerWaalsContact O-N 3.09Å; A378-T380 PolarHBondContact O-N 3.43Å |
| 379 | A | 54 | Low | 75.8 | Confident | 93 Ų | 93 | 72.9 Ų | 72.9 | 77% | 0.769 | 42% | 0.417 | S | S | * | . | trans | -54.6 | 96.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 380 | T | 60.8 | Low | 76 | Confident | 80 Ų | 80 | 72.7 Ų | 72.7 | 49% | 0.491 | 42% | 0.417 | S | S | . | . | trans | -71.3 | 130.7 | 166.6 | 53 | 0 | 0 | 0 | 0 | 107.5 | A378 N382 T383 | A378-T380 PolarHBondContact O-N 3.43Å; T380-N382 PolarHBondContact O-N 2.75Å; T380-T383 WeakPolarHBondContact O-CB 3.41Å; T380-T383 PolarHBondContact O-N 3.5Å; T380-T383 PolarHBondContact O-OG1 3.41Å; T380-T383 PolarHBondContact OG1-OG1 2.68Å; T380-T383 VanDerWaalsContact OG1-OG1 3.06Å | ||
| 381 | G | 64.6 | Low | 76.4 | Confident | 61 Ų | 61 | 69.3 Ų | 69.3 | 63% | 0.629 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -52.4 | -25.4 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | T383 H384 A385 | G381-T383 VanDerWaalsContact C-N 3.34Å; G381-T383 PolarHBondContact O-N 2.94Å; G381-H384 PolarHBondContact O-N 3.35Å; G381-A385 PolarHBondContact O-N 3.27Å; G381-A385 VanDerWaalsContact O-N 3.15Å |
| 382 | N | 69.8 | Low | 77 | Confident | 128 Ų | 128 | 68.1 Ų | 68.1 | 68% | 0.684 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -66.2 | -30.7 | 175.5 | -66.5 | -11.9 | 0 | 0 | 0 | 113.7 | T380 A386 | T380-N382 PolarHBondContact O-N 2.75Å; N382-A386 PolarHBondContact O-N 3.42Å; N382-A386 VanDerWaalsContact O-N 3.12Å |
| 383 | T | 75.5 | Confident | 77.9 | Confident | 7 Ų | 7 | 68 Ų | 68 | 4% | 0.043 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64.4 | -50.1 | 176.8 | -57.9 | 0 | 0 | 0 | 0 | 110.8 | R302 T380 G381 A385 A386 S387 | R302-T383 PolarHBondContact NH1-OG1 2.85Å; R302-T383 PolarHBondContact NH2-OG1 3.41Å; T380-T383 WeakPolarHBondContact O-CB 3.41Å; T380-T383 PolarHBondContact O-N 3.5Å; T380-T383 PolarHBondContact O-OG1 3.41Å; T380-T383 PolarHBondContact OG1-OG1 2.68Å; T380-T383 VanDerWaalsContact OG1-OG1 3.06Å; G381-T383 VanDerWaalsContact C-N 3.34Å; G381-T383 PolarHBondContact O-N 2.94Å; T383-A385 VanDerWaalsContact C-N 3.31Å; T383-A385 PolarHBondContact O-N 3.43Å; T383-A386 PolarHBondContact O-N 2.93Å; T383-S387 PolarHBondContact O-N 3.4Å; T383-S387 PolarHBondContact O-OG 2.92Å |
| 384 | H | 83.8 | Confident | 78.9 | Confident | 119 Ų | 119 | 63.7 Ų | 63.7 | 55% | 0.551 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -64 | -39.8 | 179.9 | -176 | -92 | 0 | 0 | 0 | 110.9 | G381 A386 S387 Q388 | G381-H384 PolarHBondContact O-N 3.35Å; H384-A386 PolarHBondContact O-N 2.83Å; H384-S387 PolarHBondContact O-N 3.31Å; H384-Q388 VanDerWaalsContact CE1-CG 3.46Å; H384-Q388 WeakPolarHBondContact CE1-CG 3.29Å; H384-Q388 PolarHBondContact NE2-NE2 3.29Å; H384-Q388 WeakPolarHBondContact O-CB 3.38Å; H384-Q388 VanDerWaalsContact O-CG 3.3Å; H384-Q388 WeakPolarHBondContact O-CG 3.31Å; H384-Q388 PolarHBondContact O-N 2.62Å |
| 385 | A | 88.9 | Confident | 80 | Confident | 58 Ų | 58 | 56.2 Ų | 56.2 | 48% | 0.479 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G381 T383 Q388 L389 | G381-A385 PolarHBondContact O-N 3.27Å; G381-A385 VanDerWaalsContact O-N 3.15Å; T383-A385 VanDerWaalsContact C-N 3.31Å; T383-A385 PolarHBondContact O-N 3.43Å; A385-Q388 PolarHBondContact O-N 3.38Å; A385-L389 WeakPolarHBondContact O-CB 3.27Å; A385-L389 PolarHBondContact O-N 3.37Å |
| 386 | A | 90.4 | Very high | 81.7 | Confident | 17 Ų | 17 | 53.6 Ų | 53.6 | 14% | 0.14 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.3 | -41.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | P298 L299 N382 T383 H384 L389 A390 | P298-A386 HydrophobicContact CB-CB 4.35Å; L299-A386 HydrophobicContact CD2-CB 4.4Å; N382-A386 PolarHBondContact O-N 3.42Å; N382-A386 VanDerWaalsContact O-N 3.12Å; T383-A386 PolarHBondContact O-N 2.93Å; H384-A386 PolarHBondContact O-N 2.83Å; A386-L389 PolarHBondContact O-N 2.76Å; A386-A390 PolarHBondContact O-N 2.75Å |
| 387 | S | 93.5 | Very high | 83.6 | Confident | 8 Ų | 8 | 52.6 Ų | 52.6 | 6% | 0.056 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.1 | -46.5 | 174.5 | -64.4 | 0 | 0 | 0 | 0 | 112 | L369 T383 H384 A390 L391 | L369-S387 VanDerWaalsContact CD2-CB 3.5Å; L369-S387 WeakPolarHBondContact CD2-OG 3.38Å; T383-S387 PolarHBondContact O-N 3.4Å; T383-S387 PolarHBondContact O-OG 2.92Å; H384-S387 PolarHBondContact O-N 3.31Å; S387-A390 PolarHBondContact O-N 3.31Å; S387-L391 WeakPolarHBondContact O-CD1 3.27Å; S387-L391 WeakPolarHBondContact O-CG 3.3Å; S387-L391 PolarHBondContact O-N 3.32Å; S387-L391 VanDerWaalsContact O-N 3.13Å |
| 388 | Q | 94.9 | Very high | 85.8 | Confident | 46 Ų | 46 | 43.3 Ų | 43.3 | 22% | 0.215 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.6 | -42.4 | 176.2 | -69.2 | -59.7 | -33.6 | 0 | 0 | 111.6 | H384 A385 A390 L391 D392 H423 N424 | H384-Q388 VanDerWaalsContact CE1-CG 3.46Å; H384-Q388 WeakPolarHBondContact CE1-CG 3.29Å; H384-Q388 PolarHBondContact NE2-NE2 3.29Å; H384-Q388 WeakPolarHBondContact O-CB 3.38Å; H384-Q388 VanDerWaalsContact O-CG 3.3Å; H384-Q388 WeakPolarHBondContact O-CG 3.31Å; H384-Q388 PolarHBondContact O-N 2.62Å; A385-Q388 PolarHBondContact O-N 3.38Å; Q388-A390 VanDerWaalsContact C-N 3.34Å; Q388-A390 PolarHBondContact O-N 2.97Å; Q388-L391 PolarHBondContact O-N 3.27Å; Q388-D392 WeakPolarHBondContact O-CB 3.17Å; Q388-D392 VanDerWaalsContact O-CG 3.25Å; Q388-D392 PolarHBondContact O-N 2.94Å; Q388-H423 PolarHBondContact NE2-O 2.93Å; Q388-N424 PolarHBondContact OE1-ND2 3.28Å |
| 389 | L | 95.8 | Very high | 88.1 | Confident | 75 Ų | 75 | 43.9 Ų | 43.9 | 39% | 0.393 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.3 | -40.5 | 177 | -180 | 60.4 | 0 | 0 | 0 | 112.6 | P298 A385 A386 D392 R393 | P298-L389 HydrophobicContact CB-CD2 4.25Å; P298-L389 HydrophobicContact CB-CG 4.46Å; P298-L389 HydrophobicContact CG-CB 4.49Å; P298-L389 HydrophobicContact CG-CD2 3.99Å; P298-L389 HydrophobicContact CG-CG 4Å; A385-L389 WeakPolarHBondContact O-CB 3.27Å; A385-L389 PolarHBondContact O-N 3.37Å; A386-L389 PolarHBondContact O-N 2.76Å; L389-D392 PolarHBondContact O-N 2.9Å; L389-R393 HydrophobicContact CD1-CG 4.4Å; L389-R393 WeakPolarHBondContact O-CB 3.29Å; L389-R393 WeakPolarHBondContact O-CG 3.25Å; L389-R393 PolarHBondContact O-N 3.37Å |
| 390 | A | 97.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63 | -43 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I295 P298 L299 L365 A386 S387 Q388 R393 L394 | I295-A390 VanDerWaalsContact O-CB 3.31Å; I295-A390 WeakPolarHBondContact O-CB 3.45Å; P298-A390 HydrophobicContact CB-CB 4.41Å; P298-A390 HydrophobicContact CG-CB 4.36Å; L299-A390 HydrophobicContact CD1-CB 4.14Å; L299-A390 HydrophobicContact CG-CB 4.15Å; L365-A390 HydrophobicContact CD1-CB 4.04Å; A386-A390 PolarHBondContact O-N 2.75Å; S387-A390 PolarHBondContact O-N 3.31Å; Q388-A390 VanDerWaalsContact C-N 3.34Å; Q388-A390 PolarHBondContact O-N 2.97Å; A390-R393 PolarHBondContact O-N 2.81Å; A390-L394 PolarHBondContact O-N 2.98Å |
| 391 | L | 98 | Very high | 91.9 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68.1 | -39.7 | 177.1 | -66.1 | 163.1 | 0 | 0 | 0 | 112.1 | L365 L369 S387 Q388 L394 A395 L421 P422 N424 L427 | L365-L391 HydrophobicContact CD2-CD2 4.11Å; L369-L391 HydrophobicContact CD1-CD2 3.95Å; L369-L391 HydrophobicContact CD1-CG 4.34Å; S387-L391 WeakPolarHBondContact O-CD1 3.27Å; S387-L391 WeakPolarHBondContact O-CG 3.3Å; S387-L391 PolarHBondContact O-N 3.32Å; S387-L391 VanDerWaalsContact O-N 3.13Å; Q388-L391 PolarHBondContact O-N 3.27Å; L391-L394 PolarHBondContact O-N 3.37Å; L391-A395 WeakPolarHBondContact O-CB 3.3Å; L391-A395 PolarHBondContact O-N 3.47Å; L391-L421 HydrophobicContact CD2-CB 4.16Å; L391-L421 HydrophobicContact CD2-CD1 4.09Å; L391-L421 HydrophobicContact CD2-CD2 4.31Å; L391-L421 HydrophobicContact CD2-CG 4.44Å; L391-P422 HydrophobicContact CD1-CG 3.76Å; L391-N424 HydrophobicContact CB-CB 3.73Å; L391-N424 HydrophobicContact CD1-CB 3.92Å; L391-N424 HydrophobicContact CG-CB 4.35Å; L391-L427 HydrophobicContact CD2-CD2 4.48Å |
| 392 | D | 98.3 | Very high | 93.3 | Very high | 51 Ų | 51 | 36.5 Ų | 36.5 | 27% | 0.273 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -61.8 | -45 | 175 | -73.3 | -22.6 | 0 | 0 | 0 | 110.7 | Q388 L389 L394 A395 Q396 N424 L426 | Q388-D392 WeakPolarHBondContact O-CB 3.17Å; Q388-D392 VanDerWaalsContact O-CG 3.25Å; Q388-D392 PolarHBondContact O-N 2.94Å; L389-D392 PolarHBondContact O-N 2.9Å; D392-L394 VanDerWaalsContact C-N 3.33Å; D392-L394 PolarHBondContact O-N 3.43Å; D392-A395 PolarHBondContact O-N 3.28Å; D392-Q396 WeakPolarHBondContact O-CB 3.08Å; D392-Q396 VanDerWaalsContact O-CG 3.25Å; D392-Q396 WeakPolarHBondContact O-CG 3.49Å; D392-Q396 PolarHBondContact O-N 3.4Å; D392-N424 PolarHBondContact OD1-ND2 2.76Å; D392-N424 PolarHBondContact OD1-OD1 2.91Å; D392-L426 HydrophobicContact CB-CD2 4.36Å |
| 393 | R | 98.4 | Very high | 94.5 | Very high | 9 Ų | 9 | 34.1 Ų | 34.1 | 3% | 0.034 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.3 | -40.5 | 175.9 | -74.3 | -177.8 | 176.8 | 176.3 | -1.5 | 111.9 | C294 I295 S324 H327 L389 A390 A397 | C294-R393 WeakPolarHBondContact O-CD 3.33Å; C294-R393 PolarHBondContact O-NH1 3.2Å; I295-R393 HydrophobicContact CG1-CB 4.03Å; S324-R393 PolarHBondContact OG-NH2 3.4Å; H327-R393 PolarHBondContact CE1-O 3.31Å; L389-R393 HydrophobicContact CD1-CG 4.4Å; L389-R393 WeakPolarHBondContact O-CB 3.29Å; L389-R393 WeakPolarHBondContact O-CG 3.25Å; L389-R393 PolarHBondContact O-N 3.37Å; A390-R393 PolarHBondContact O-N 2.81Å; R393-A397 VanDerWaalsContact O-CB 3.3Å; R393-A397 WeakPolarHBondContact O-CB 3.48Å; R393-A397 PolarHBondContact O-N 2.68Å |
| 394 | L | 98.5 | Very high | 95.5 | Very high | 2 Ų | 2 | 33.9 Ų | 33.9 | 1% | 0.01 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.1 | -50.3 | 174.2 | 174.4 | 65.4 | 0 | 0 | 0 | 110.7 | I295 L365 A390 L391 D392 Q396 A397 L398 L421 | I295-L394 HydrophobicContact CD1-CB 3.98Å; I295-L394 HydrophobicContact CD1-CD1 3.78Å; I295-L394 HydrophobicContact CG1-CB 4.22Å; I295-L394 HydrophobicContact CG2-CB 4.21Å; L365-L394 HydrophobicContact CD2-CB 4.37Å; L365-L394 HydrophobicContact CD2-CD2 3.71Å; A390-L394 PolarHBondContact O-N 2.98Å; L391-L394 PolarHBondContact O-N 3.37Å; D392-L394 VanDerWaalsContact C-N 3.33Å; D392-L394 PolarHBondContact O-N 3.43Å; L394-Q396 PolarHBondContact O-N 3.27Å; L394-A397 PolarHBondContact O-N 3.5Å; L394-L398 HydrophobicContact CD1-CD1 3.77Å; L394-L398 HydrophobicContact CD1-CD2 4.4Å; L394-L398 HydrophobicContact CD1-CG 3.91Å; L394-L398 HydrophobicContact CD2-CD1 4.44Å; L394-L398 HydrophobicContact CG-CD1 3.76Å; L394-L398 HydrophobicContact CG-CG 4.31Å; L394-L398 WeakPolarHBondContact O-CB 3.47Å; L394-L398 VanDerWaalsContact O-CG 3.24Å; L394-L398 WeakPolarHBondContact O-CG 3.39Å; L394-L398 PolarHBondContact O-N 3.17Å; L394-L421 HydrophobicContact CD2-CD1 3.47Å; L394-L421 VanDerWaalsContact CD2-CD1 3.47Å |
| 395 | A | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -59.1 | -46.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112 | L391 D392 L398 Q399 L426 L427 V430 | L391-A395 WeakPolarHBondContact O-CB 3.3Å; L391-A395 PolarHBondContact O-N 3.47Å; D392-A395 PolarHBondContact O-N 3.28Å; A395-L398 PolarHBondContact O-N 3.12Å; A395-Q399 WeakPolarHBondContact O-CB 3.41Å; A395-Q399 PolarHBondContact O-N 3.34Å; A395-L426 HydrophobicContact CB-CB 4.07Å; A395-L426 HydrophobicContact CB-CD2 4.04Å; A395-L426 HydrophobicContact CB-CG 3.69Å; A395-L427 HydrophobicContact CB-CB 3.96Å; A395-L427 HydrophobicContact CB-CD1 4.13Å; A395-V430 HydrophobicContact CB-CG2 3.98Å |
| 396 | Q | 98.1 | Very high | 96.2 | Very high | 74 Ų | 74 | 25.7 Ų | 25.7 | 35% | 0.346 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -60 | -47.5 | 176 | -69.6 | 172.5 | 1.7 | 0 | 0 | 111.9 | H327 L331 D392 L394 L398 Q399 V400 L426 | H327-Q396 PolarHBondContact NE2-OE1 3.11Å; L331-Q396 HydrophobicContact CD1-CB 4.29Å; D392-Q396 WeakPolarHBondContact O-CB 3.08Å; D392-Q396 VanDerWaalsContact O-CG 3.25Å; D392-Q396 WeakPolarHBondContact O-CG 3.49Å; D392-Q396 PolarHBondContact O-N 3.4Å; L394-Q396 PolarHBondContact O-N 3.27Å; Q396-L398 PolarHBondContact O-N 3.37Å; Q396-Q399 PolarHBondContact O-N 3.13Å; Q396-V400 WeakPolarHBondContact O-CB 3.44Å; Q396-V400 VanDerWaalsContact O-CG2 3.3Å; Q396-V400 WeakPolarHBondContact O-CG2 3.33Å; Q396-V400 PolarHBondContact O-N 3.02Å; Q396-L426 HydrophobicContact CG-CD2 3.59Å |
| 397 | A | 98.1 | Very high | 96.5 | Very high | 3 Ų | 3 | 25.1 Ų | 25.1 | 3% | 0.025 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.4 | -45.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | I291 I295 R393 L394 A401 | I291-A397 HydrophobicContact CG2-CB 4Å; I295-A397 HydrophobicContact CD1-CB 4.37Å; R393-A397 VanDerWaalsContact O-CB 3.3Å; R393-A397 WeakPolarHBondContact O-CB 3.48Å; R393-A397 PolarHBondContact O-N 2.68Å; L394-A397 PolarHBondContact O-N 3.5Å; A397-A401 WeakPolarHBondContact O-CB 3.48Å; A397-A401 PolarHBondContact O-N 3.31Å |
| 398 | L | 97.4 | Very high | 96.5 | Very high | 3 Ų | 3 | 28.1 Ų | 28.1 | 2% | 0.016 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.3 | -49.7 | 176.8 | -70 | 170.4 | 0 | 0 | 0 | 111.6 | V358 L394 A395 Q396 V400 A401 M402 L407 L414 L427 V430 | V358-L398 HydrophobicContact CG1-CD2 3.59Å; L394-L398 HydrophobicContact CD1-CD1 3.77Å; L394-L398 HydrophobicContact CD1-CD2 4.4Å; L394-L398 HydrophobicContact CD1-CG 3.91Å; L394-L398 HydrophobicContact CD2-CD1 4.44Å; L394-L398 HydrophobicContact CG-CD1 3.76Å; L394-L398 HydrophobicContact CG-CG 4.31Å; L394-L398 WeakPolarHBondContact O-CB 3.47Å; L394-L398 VanDerWaalsContact O-CG 3.24Å; L394-L398 WeakPolarHBondContact O-CG 3.39Å; L394-L398 PolarHBondContact O-N 3.17Å; A395-L398 PolarHBondContact O-N 3.12Å; Q396-L398 PolarHBondContact O-N 3.37Å; L398-V400 PolarHBondContact O-N 2.96Å; L398-A401 PolarHBondContact O-N 2.85Å; L398-M402 WeakPolarHBondContact O-CB 3.36Å; L398-M402 WeakPolarHBondContact O-CG 3.34Å; L398-M402 PolarHBondContact O-N 2.99Å; L398-L407 HydrophobicContact CD2-CD2 3.89Å; L398-L414 HydrophobicContact CD1-CD1 3.81Å; L398-L414 HydrophobicContact CD1-CD2 4.31Å; L398-L414 HydrophobicContact CD1-CG 4.43Å; L398-L414 HydrophobicContact CD2-CD1 3.78Å; L398-L414 HydrophobicContact CG-CD1 4.29Å; L398-L427 HydrophobicContact CD1-CD1 4.08Å; L398-V430 HydrophobicContact CB-CG1 4.41Å |
| 399 | Q | 96.1 | Very high | 96.4 | Very high | 87 Ų | 87 | 27.3 Ų | 27.3 | 41% | 0.407 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -62.2 | -46 | -177.8 | -179.1 | 153.1 | 7.8 | 0 | 0 | 111.9 | A395 Q396 A403 V430 | A395-Q399 WeakPolarHBondContact O-CB 3.41Å; A395-Q399 PolarHBondContact O-N 3.34Å; Q396-Q399 PolarHBondContact O-N 3.13Å; Q399-A403 VanDerWaalsContact O-CB 3.28Å; Q399-A403 WeakPolarHBondContact O-CB 3.32Å; Q399-A403 PolarHBondContact O-N 3.49Å; Q399-V430 HydrophobicContact CB-CG1 4.09Å; Q399-V430 HydrophobicContact CB-CG2 3.93Å |
| 400 | V | 97.3 | Very high | 96.3 | Very high | 29 Ų | 29 | 25.8 Ų | 25.8 | 18% | 0.176 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -70 | -39.9 | 179.7 | 178.8 | 0 | 0 | 0 | 0 | 111 | L331 F334 M335 Q396 L398 M402 A403 S404 | L331-V400 HydrophobicContact CD2-CB 3.99Å; L331-V400 HydrophobicContact CD2-CG1 4.33Å; L331-V400 HydrophobicContact CD2-CG2 4.05Å; F334-V400 HydrophobicContact CB-CG1 3.59Å; F334-V400 HydrophobicContact CD2-CG1 4.17Å; F334-V400 HydrophobicContact CG-CG1 4.34Å; M335-V400 HydrophobicContact CG-CG1 4.31Å; M335-V400 HydrophobicContact SD-CG1 3.89Å; Q396-V400 WeakPolarHBondContact O-CB 3.44Å; Q396-V400 VanDerWaalsContact O-CG2 3.3Å; Q396-V400 WeakPolarHBondContact O-CG2 3.33Å; Q396-V400 PolarHBondContact O-N 3.02Å; L398-V400 PolarHBondContact O-N 2.96Å; V400-M402 PolarHBondContact O-N 3.33Å; V400-A403 PolarHBondContact O-N 2.69Å; V400-S404 VanDerWaalsContact O-CB 3.24Å; V400-S404 WeakPolarHBondContact O-CB 3.37Å; V400-S404 PolarHBondContact O-N 2.89Å; V400-S404 PolarHBondContact O-OG 2.95Å |
| 401 | A | 96.9 | Very high | 96 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.9 | -40.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | F334 L353 A397 L398 S404 G405 A406 L407 | F334-A401 HydrophobicContact CD2-CB 4.4Å; F334-A401 HydrophobicContact CE1-CB 4.26Å; F334-A401 HydrophobicContact CE2-CB 3.88Å; F334-A401 HydrophobicContact CZ-CB 3.75Å; L353-A401 HydrophobicContact CD2-CB 4.2Å; A397-A401 WeakPolarHBondContact O-CB 3.48Å; A397-A401 PolarHBondContact O-N 3.31Å; L398-A401 PolarHBondContact O-N 2.85Å; A401-S404 WeakPolarHBondContact CA-OG 3.37Å; A401-S404 PolarHBondContact O-OG 3.45Å; A401-S404 VanDerWaalsContact O-OG 3.11Å; A401-G405 PolarHBondContact O-N 3.4Å; A401-A406 HydrophobicContact CB-CB 4.24Å; A401-A406 PolarHBondContact O-N 2.95Å; A401-L407 HydrophobicContact CB-CB 3.83Å; A401-L407 PolarHBondContact O-N 3.41Å |
| 402 | M | 95.4 | Very high | 95.7 | Very high | 50 Ų | 50 | 35.9 Ų | 35.9 | 25% | 0.246 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.9 | -47.2 | 175 | -69.9 | 174.7 | 72.4 | 0 | 0 | 111.6 | L398 V400 S404 G405 L407 L414 | L398-M402 WeakPolarHBondContact O-CB 3.36Å; L398-M402 WeakPolarHBondContact O-CG 3.34Å; L398-M402 PolarHBondContact O-N 2.99Å; V400-M402 PolarHBondContact O-N 3.33Å; M402-S404 VanDerWaalsContact C-N 3.25Å; M402-S404 PolarHBondContact O-N 3.38Å; M402-G405 PolarHBondContact O-N 3.29Å; M402-L407 HydrophobicContact CG-CB 4.43Å; M402-L407 HydrophobicContact CG-CD2 4.03Å; M402-L407 HydrophobicContact CG-CG 4.36Å; M402-L414 HydrophobicContact SD-CD2 3.84Å |
| 403 | A | 94.6 | Very high | 95.5 | Very high | 79 Ų | 79 | 37.1 Ų | 37.1 | 65% | 0.653 | 20% | 0.199 | S | C | * | . | H | α-helix | trans | -64.3 | -31.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q399 V400 G405 | Q399-A403 VanDerWaalsContact O-CB 3.28Å; Q399-A403 WeakPolarHBondContact O-CB 3.32Å; Q399-A403 PolarHBondContact O-N 3.49Å; V400-A403 PolarHBondContact O-N 2.69Å; A403-G405 VanDerWaalsContact C-N 3.35Å |
| 404 | S | 95.4 | Very high | 95.3 | Very high | 2 Ų | 2 | 36.7 Ų | 36.7 | 1% | 0.014 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84 | -6.3 | 178.8 | 57.2 | 0 | 0 | 0 | 0 | 114.6 | F334 V400 A401 M402 A406 | F334-S404 WeakPolarHBondContact O-CB 3.47Å; V400-S404 VanDerWaalsContact O-CB 3.24Å; V400-S404 WeakPolarHBondContact O-CB 3.37Å; V400-S404 PolarHBondContact O-N 2.89Å; V400-S404 PolarHBondContact O-OG 2.95Å; A401-S404 WeakPolarHBondContact CA-OG 3.37Å; A401-S404 PolarHBondContact O-OG 3.45Å; A401-S404 VanDerWaalsContact O-OG 3.11Å; M402-S404 VanDerWaalsContact C-N 3.25Å; M402-S404 PolarHBondContact O-N 3.38Å; S404-A406 PolarHBondContact O-N 3.15Å |
| 405 | G | 93.4 | Very high | 95.2 | Very high | 4 Ų | 4 | 41.7 Ų | 41.7 | 4% | 0.041 | 22% | 0.216 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 73.5 | 11.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A401 M402 A403 | A401-G405 PolarHBondContact O-N 3.4Å; M402-G405 PolarHBondContact O-N 3.29Å; A403-G405 VanDerWaalsContact C-N 3.35Å |
| 406 | A | 95.2 | Very high | 95 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -74.9 | -30.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | F334 L337 A351 L352 L353 A401 S404 | F334-A406 HydrophobicContact CD1-CB 3.62Å; F334-A406 HydrophobicContact CE1-CB 3.48Å; F334-A406 VanDerWaalsContact CE1-CB 3.48Å; F334-A406 HydrophobicContact CZ-CB 4.39Å; L337-A406 HydrophobicContact CD1-CB 3.52Å; A351-A406 CarbonylContact C-O 3.59Å; A351-A406 WeakPolarHBondContact CA-O 3.26Å; L352-A406 PolarHBondContact N-O 3.02Å; L353-A406 PolarHBondContact N-O 2.99Å; A401-A406 HydrophobicContact CB-CB 4.24Å; A401-A406 PolarHBondContact O-N 2.95Å; S404-A406 PolarHBondContact O-N 3.15Å |
| 407 | L | 95.9 | Very high | 94.9 | Very high | 5 Ų | 5 | 43.1 Ų | 43.1 | 3% | 0.026 | 23% | 0.234 | C | C | . | . | S | Bend | trans | -118.4 | 123.2 | 173.9 | 176.5 | 63.5 | 0 | 0 | 0 | 109.1 | L353 M355 V358 L398 A401 M402 | L353-L407 HydrophobicContact CB-CB 4.44Å; L353-L407 HydrophobicContact CD2-CB 4.45Å; L353-L407 VanDerWaalsContact O-CD1 3.29Å; L353-L407 WeakPolarHBondContact O-CD1 3.44Å; M355-L407 HydrophobicContact SD-CD1 4.25Å; V358-L407 HydrophobicContact CG2-CD1 4.1Å; V358-L407 HydrophobicContact CG2-CD2 4.33Å; L398-L407 HydrophobicContact CD2-CD2 3.89Å; A401-L407 HydrophobicContact CB-CB 3.83Å; A401-L407 PolarHBondContact O-N 3.41Å; M402-L407 HydrophobicContact CG-CB 4.43Å; M402-L407 HydrophobicContact CG-CD2 4.03Å; M402-L407 HydrophobicContact CG-CG 4.36Å |
| 408 | L | 94.3 | Very high | 94.8 | Very high | 71 Ų | 71 | 43.1 Ų | 43.1 | 37% | 0.372 | 23% | 0.234 | S | C | . | . | trans | -106 | 96.7 | 178.5 | -56.1 | 179.2 | 0 | 0 | 0 | 109 | A351 | A351-L408 HydrophobicContact CB-CB 4.28Å; A351-L408 HydrophobicContact CB-CD1 4.11Å; A351-L408 HydrophobicContact CB-CG 3.91Å | ||
| 409 | C | 93.1 | Very high | 94.6 | Very high | 30 Ų | 30 | 47.3 Ų | 47.3 | 20% | 0.203 | 26% | 0.264 | C | S | . | . | trans | -149.4 | 158.3 | 176.7 | 71.4 | 0 | 0 | 0 | 0 | 111.7 | M355 D413 | M355-C409 HydrophobicContact SD-CB 3.72Å; C409-D413 HydrophobicContact CB-CB 4.36Å | ||
| 410 | S | 92.1 | Very high | 94.3 | Very high | 42 Ų | 42 | 50.3 Ų | 50.3 | 29% | 0.294 | 27% | 0.271 | S | S | . | . | trans | -79.7 | 167.2 | 169 | 72.3 | 0 | 0 | 0 | 0 | 111.1 | E412 D413 L414 | S410-E412 VanDerWaalsContact C-N 3.28Å; S410-E412 PolarHBondContact OG-N 2.69Å; S410-D413 WeakPolarHBondContact CB-OD2 3.46Å; S410-D413 PolarHBondContact N-OD2 3.37Å; S410-D413 PolarHBondContact OG-N 2.91Å; S410-D413 PolarHBondContact OG-OD1 3.47Å; S410-D413 PolarHBondContact OG-OD2 3.45Å; S410-L414 PolarHBondContact O-N 3.05Å | ||
| 411 | R | 90.9 | Very high | 94.2 | Very high | 102 Ų | 102 | 49.8 Ų | 49.8 | 39% | 0.385 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -71.7 | -28.7 | 172.9 | -69.3 | -172.5 | -177.4 | 117.9 | 10.5 | 111.5 | L414 R415 | R411-L414 PolarHBondContact O-N 3.15Å; R411-R415 WeakPolarHBondContact O-CB 3.48Å; R411-R415 WeakPolarHBondContact O-CG 3.45Å; R411-R415 PolarHBondContact O-N 3.38Å |
| 412 | E | 93.1 | Very high | 94 | Very high | 111 Ų | 111 | 52.5 Ų | 52.5 | 52% | 0.519 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -61.2 | -47.8 | 173.3 | -69.4 | 63.8 | -144.6 | 0 | 0 | 110.8 | S410 L414 R415 A416 | S410-E412 VanDerWaalsContact C-N 3.28Å; S410-E412 PolarHBondContact OG-N 2.69Å; E412-L414 VanDerWaalsContact C-N 3.28Å; E412-L414 PolarHBondContact O-N 3.24Å; E412-R415 VanDerWaalsContact CD-NH2 3.31Å; E412-R415 PolarHBondContact O-N 3.16Å; E412-R415 IonicContact OE1-CZ 2.67Å; E412-R415 IonicContact OE1-NH1 3.65Å; E412-R415 IonicContact OE1-NH2 3.18Å; E412-R415 PolarHBondContact OE1-NH2 3.29Å; E412-R415 IonicContact OE2-NH2 2.75Å; E412-A416 PolarHBondContact O-N 3.48Å |
| 413 | D | 93.5 | Very high | 93.8 | Very high | 76 Ų | 76 | 55.9 Ų | 55.9 | 41% | 0.406 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 177.1 | -56 | -42.9 | 0 | 0 | 0 | 110.7 | M355 C409 S410 A416 I417 | M355-D413 HydrophobicContact CE-CB 3.93Å; C409-D413 HydrophobicContact CB-CB 4.36Å; S410-D413 WeakPolarHBondContact CB-OD2 3.46Å; S410-D413 PolarHBondContact N-OD2 3.37Å; S410-D413 PolarHBondContact OG-N 2.91Å; S410-D413 PolarHBondContact OG-OD1 3.47Å; S410-D413 PolarHBondContact OG-OD2 3.45Å; D413-A416 WeakPolarHBondContact O-CB 3.3Å; D413-A416 PolarHBondContact O-N 3.31Å; D413-I417 PolarHBondContact O-N 3.12Å; D413-I417 VanDerWaalsContact O-N 3.13Å |
| 414 | L | 94.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 178.9 | -163.1 | 63.8 | 0 | 0 | 0 | 112 | L398 M402 S410 R411 E412 A416 I417 C418 V430 L431 | L398-L414 HydrophobicContact CD1-CD1 3.81Å; L398-L414 HydrophobicContact CD1-CD2 4.31Å; L398-L414 HydrophobicContact CD1-CG 4.43Å; L398-L414 HydrophobicContact CD2-CD1 3.78Å; L398-L414 HydrophobicContact CG-CD1 4.29Å; M402-L414 HydrophobicContact SD-CD2 3.84Å; S410-L414 PolarHBondContact O-N 3.05Å; R411-L414 PolarHBondContact O-N 3.15Å; E412-L414 VanDerWaalsContact C-N 3.28Å; E412-L414 PolarHBondContact O-N 3.24Å; L414-A416 VanDerWaalsContact C-N 3.3Å; L414-A416 PolarHBondContact O-N 3.06Å; L414-I417 HydrophobicContact CD1-CD1 4.15Å; L414-I417 HydrophobicContact CD1-CG1 4.34Å; L414-I417 WeakPolarHBondContact O-CG1 3.46Å; L414-I417 PolarHBondContact O-N 3.12Å; L414-C418 VanDerWaalsContact O-CB 3.3Å; L414-C418 WeakPolarHBondContact O-CB 3.46Å; L414-C418 PolarHBondContact O-N 3.21Å; L414-C418 PolarHBondContact O-SG 3.28Å; L414-C418 VanDerWaalsContact O-SG 3.42Å; L414-V430 HydrophobicContact CD2-CG1 3.97Å; L414-L431 HydrophobicContact CB-CD2 4.05Å; L414-L431 HydrophobicContact CD2-CD2 3.83Å; L414-L431 HydrophobicContact CG-CD2 3.61Å |
| 415 | R | 95.1 | Very high | 93.9 | Very high | 108 Ų | 108 | 58.1 Ų | 58.1 | 41% | 0.408 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.6 | -41.5 | 174 | -82.6 | -175.3 | -98.3 | 112.7 | -4.7 | 111.6 | R411 E412 S419 L431 | R411-R415 WeakPolarHBondContact O-CB 3.48Å; R411-R415 WeakPolarHBondContact O-CG 3.45Å; R411-R415 PolarHBondContact O-N 3.38Å; E412-R415 VanDerWaalsContact CD-NH2 3.31Å; E412-R415 PolarHBondContact O-N 3.16Å; E412-R415 IonicContact OE1-CZ 2.67Å; E412-R415 IonicContact OE1-NH1 3.65Å; E412-R415 IonicContact OE1-NH2 3.18Å; E412-R415 PolarHBondContact OE1-NH2 3.29Å; E412-R415 IonicContact OE2-NH2 2.75Å; R415-S419 WeakPolarHBondContact O-CB 3.42Å; R415-S419 PolarHBondContact O-N 2.94Å; R415-L431 HydrophobicContact CG-CB 4.1Å; R415-L431 HydrophobicContact CG-CD2 4.01Å; R415-L431 HydrophobicContact CG-CG 4.47Å |
| 416 | A | 95.3 | Very high | 94 | Very high | 65 Ų | 65 | 60.4 Ų | 60.4 | 54% | 0.537 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.2 | -51.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | E412 D413 L414 S419 | E412-A416 PolarHBondContact O-N 3.48Å; D413-A416 WeakPolarHBondContact O-CB 3.3Å; D413-A416 PolarHBondContact O-N 3.31Å; L414-A416 VanDerWaalsContact C-N 3.3Å; L414-A416 PolarHBondContact O-N 3.06Å; A416-S419 PolarHBondContact O-OG 3.28Å |
| 417 | I | 95.8 | Very high | 94.1 | Very high | 38 Ų | 38 | 60.5 Ų | 60.5 | 20% | 0.195 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -73.4 | -33.6 | -177.6 | 63.7 | 157.8 | 0 | 0 | 0 | 113.3 | M355 V358 A359 T362 D413 L414 | M355-I417 HydrophobicContact CE-CB 4.46Å; M355-I417 HydrophobicContact CE-CD1 3.35Å; M355-I417 HydrophobicContact CE-CG1 3.7Å; M355-I417 HydrophobicContact CE-CG2 3.92Å; M355-I417 HydrophobicContact SD-CD1 4.39Å; V358-I417 HydrophobicContact CB-CD1 4.32Å; V358-I417 HydrophobicContact CG1-CD1 3.6Å; A359-I417 HydrophobicContact CB-CG2 3.88Å; T362-I417 WeakPolarHBondContact CG2-O 3.43Å; D413-I417 PolarHBondContact O-N 3.12Å; D413-I417 VanDerWaalsContact O-N 3.13Å; L414-I417 HydrophobicContact CD1-CD1 4.15Å; L414-I417 HydrophobicContact CD1-CG1 4.34Å; L414-I417 WeakPolarHBondContact O-CG1 3.46Å; L414-I417 PolarHBondContact O-N 3.12Å |
| 418 | C | 95.8 | Very high | 94 | Very high | 4 Ų | 4 | 63.9 Ų | 63.9 | 3% | 0.027 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -85.1 | -8 | -178.9 | -65.6 | 0 | 0 | 0 | 0 | 114.1 | L414 R420 L421 L427 L431 | L414-C418 VanDerWaalsContact O-CB 3.3Å; L414-C418 WeakPolarHBondContact O-CB 3.46Å; L414-C418 PolarHBondContact O-N 3.21Å; L414-C418 PolarHBondContact O-SG 3.28Å; L414-C418 VanDerWaalsContact O-SG 3.42Å; C418-R420 PolarHBondContact O-N 3.29Å; C418-L421 HydrophobicContact CB-CD1 4.17Å; C418-L421 WeakPolarHBondContact O-CB 3.39Å; C418-L421 PolarHBondContact O-N 3.5Å; C418-L427 HydrophobicContact CB-CD2 4.49Å; C418-L431 HydrophobicContact CB-CD1 4.15Å; C418-L431 HydrophobicContact CB-CD2 4.13Å |
| 419 | S | 92.4 | Very high | 94 | Very high | 90 Ų | 90 | 65.5 Ų | 65.5 | 63% | 0.629 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.4 | -26.2 | -177.8 | 58.8 | 0 | 0 | 0 | 0 | 115.2 | R415 A416 | R415-S419 WeakPolarHBondContact O-CB 3.42Å; R415-S419 PolarHBondContact O-N 2.94Å; A416-S419 PolarHBondContact O-OG 3.28Å |
| 420 | R | 90.4 | Very high | 94 | Very high | 151 Ų | 151 | 64.5 Ų | 64.5 | 57% | 0.57 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.1 | -5.8 | -179.6 | -66.3 | -178.3 | 57.7 | -147.4 | -10.4 | 114.1 | S366 C418 | S366-R420 PolarHBondContact OG-NH2 3.29Å; C418-R420 PolarHBondContact O-N 3.29Å |
| 421 | L | 95.2 | Very high | 94 | Very high | 18 Ų | 18 | 63.1 Ų | 63.1 | 9% | 0.094 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -82.2 | 147.2 | 179.7 | -64.3 | 177.9 | 0 | 0 | 0 | 110.7 | T362 L365 L369 L391 L394 C418 L427 | T362-L421 HydrophobicContact CG2-CD1 3.77Å; T362-L421 HydrophobicContact CG2-CD2 4.15Å; T362-L421 HydrophobicContact CG2-CG 3.89Å; L365-L421 HydrophobicContact CB-CD2 4.44Å; L365-L421 HydrophobicContact CD2-CD2 4.18Å; L365-L421 HydrophobicContact CG-CD2 4.21Å; L369-L421 HydrophobicContact CD1-CD2 4.15Å; L391-L421 HydrophobicContact CD2-CB 4.16Å; L391-L421 HydrophobicContact CD2-CD1 4.09Å; L391-L421 HydrophobicContact CD2-CD2 4.31Å; L391-L421 HydrophobicContact CD2-CG 4.44Å; L394-L421 HydrophobicContact CD2-CD1 3.47Å; L394-L421 VanDerWaalsContact CD2-CD1 3.47Å; C418-L421 HydrophobicContact CB-CD1 4.17Å; C418-L421 WeakPolarHBondContact O-CB 3.39Å; C418-L421 PolarHBondContact O-N 3.5Å; L421-L427 HydrophobicContact CB-CD2 4.3Å; L421-L427 HydrophobicContact CD1-CD2 3.71Å |
| 422 | P | 93.4 | Very high | 93.9 | Very high | 56 Ų | 56 | 62.5 Ų | 62.5 | 36% | 0.364 | 33% | 0.33 | S | S | . | . | P | Polyproline II helix | trans | -66.3 | 164.7 | 174.7 | 29.9 | -35.7 | 0 | 0 | 0 | 111.4 | L369 L391 N424 | L369-P422 HydrophobicContact CD1-CG 3.87Å; L391-P422 HydrophobicContact CD1-CG 3.76Å; P422-N424 PolarHBondContact O-N 2.96Å |
| 423 | H | 91.8 | Very high | 93.1 | Very high | 121 Ų | 121 | 57.8 Ų | 57.8 | 56% | 0.56 | 31% | 0.312 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 129.2 | -178.3 | -176.2 | 77.7 | 0 | 0 | 0 | 112 | Q388 N425 | Q388-H423 PolarHBondContact NE2-O 2.93Å; H423-N425 PolarHBondContact NE2-OD1 3.03Å |
| 424 | N | 95.9 | Very high | 91.8 | Very high | 2 Ų | 2 | 58 Ų | 58 | 1% | 0.011 | 32% | 0.317 | C | S | . | . | trans | -143.9 | 128 | 172.1 | 171.3 | -90.1 | 0 | 0 | 0 | 109 | Q388 L391 D392 P422 L426 L427 Q428 | Q388-N424 PolarHBondContact OE1-ND2 3.28Å; L391-N424 HydrophobicContact CB-CB 3.73Å; L391-N424 HydrophobicContact CD1-CB 3.92Å; L391-N424 HydrophobicContact CG-CB 4.35Å; D392-N424 PolarHBondContact OD1-ND2 2.76Å; D392-N424 PolarHBondContact OD1-OD1 2.91Å; P422-N424 PolarHBondContact O-N 2.96Å; N424-L426 VanDerWaalsContact C-N 3.34Å; N424-L426 PolarHBondContact O-N 3.32Å; N424-L426 PolarHBondContact OD1-N 2.92Å; N424-L426 VanDerWaalsContact OD1-N 3.17Å; N424-L427 HydrophobicContact CB-CB 4.06Å; N424-L427 PolarHBondContact O-N 3.48Å; N424-L427 WeakPolarHBondContact OD1-CB 3.24Å; N424-L427 PolarHBondContact OD1-N 3.46Å; N424-Q428 WeakPolarHBondContact O-CG 3.4Å; N424-Q428 PolarHBondContact O-N 3.06Å | ||
| 425 | N | 95.1 | Very high | 89.5 | Confident | 126 Ų | 126 | 63.4 Ų | 63.4 | 67% | 0.674 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -61.8 | -41.4 | -172.1 | -67.7 | -25.6 | 0 | 0 | 0 | 112.4 | H423 Q428 L429 | H423-N425 PolarHBondContact NE2-OD1 3.03Å; N425-Q428 PolarHBondContact O-N 3.41Å; N425-L429 PolarHBondContact O-N 2.86Å; N425-L429 VanDerWaalsContact O-N 3.16Å |
| 426 | L | 95.9 | Very high | 86.8 | Confident | 52 Ų | 52 | 65 Ų | 65 | 27% | 0.272 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.6 | -46.6 | -178.6 | -174.1 | 57.4 | 0 | 0 | 0 | 110.6 | D392 A395 Q396 N424 Q428 L429 V430 | D392-L426 HydrophobicContact CB-CD2 4.36Å; A395-L426 HydrophobicContact CB-CB 4.07Å; A395-L426 HydrophobicContact CB-CD2 4.04Å; A395-L426 HydrophobicContact CB-CG 3.69Å; Q396-L426 HydrophobicContact CG-CD2 3.59Å; N424-L426 VanDerWaalsContact C-N 3.34Å; N424-L426 PolarHBondContact O-N 3.32Å; N424-L426 PolarHBondContact OD1-N 2.92Å; N424-L426 VanDerWaalsContact OD1-N 3.17Å; L426-Q428 VanDerWaalsContact C-N 3.32Å; L426-Q428 PolarHBondContact O-N 2.85Å; L426-L429 WeakPolarHBondContact O-CB 3.39Å; L426-L429 PolarHBondContact O-N 2.94Å; L426-L429 VanDerWaalsContact O-N 3.08Å; L426-V430 WeakPolarHBondContact O-CG2 3.33Å; L426-V430 PolarHBondContact O-N 3.06Å |
| 427 | L | 96.1 | Very high | 83.8 | Confident | 2 Ų | 2 | 71.7 Ų | 71.7 | 1% | 0.01 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -58.2 | -43.6 | 176.6 | -174.4 | 60.2 | 0 | 0 | 0 | 111.6 | L391 A395 L398 C418 L421 N424 L429 V430 L431 | L391-L427 HydrophobicContact CD2-CD2 4.48Å; A395-L427 HydrophobicContact CB-CB 3.96Å; A395-L427 HydrophobicContact CB-CD1 4.13Å; L398-L427 HydrophobicContact CD1-CD1 4.08Å; C418-L427 HydrophobicContact CB-CD2 4.49Å; L421-L427 HydrophobicContact CB-CD2 4.3Å; L421-L427 HydrophobicContact CD1-CD2 3.71Å; N424-L427 HydrophobicContact CB-CB 4.06Å; N424-L427 PolarHBondContact O-N 3.48Å; N424-L427 WeakPolarHBondContact OD1-CB 3.24Å; N424-L427 PolarHBondContact OD1-N 3.46Å; L427-L429 VanDerWaalsContact C-N 3.27Å; L427-L429 PolarHBondContact O-N 3.35Å; L427-V430 WeakPolarHBondContact O-CB 3.35Å; L427-V430 PolarHBondContact O-N 2.79Å; L427-V430 VanDerWaalsContact O-N 3.12Å; L427-L431 HydrophobicContact CD1-CG 4.4Å; L427-L431 HydrophobicContact CG-CD1 4.12Å; L427-L431 HydrophobicContact CG-CG 4.37Å; L427-L431 VanDerWaalsContact O-CG 3.27Å; L427-L431 WeakPolarHBondContact O-CG 3.28Å; L427-L431 PolarHBondContact O-N 3.29Å |
| 428 | Q | 94.4 | Very high | 80.7 | Confident | 77 Ų | 77 | 80.4 Ų | 80.4 | 36% | 0.36 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.3 | -37.4 | 176.1 | -70.9 | -57.1 | -39.6 | 0 | 0 | 112.5 | N424 N425 L426 L431 S432 | N424-Q428 WeakPolarHBondContact O-CG 3.4Å; N424-Q428 PolarHBondContact O-N 3.06Å; N425-Q428 PolarHBondContact O-N 3.41Å; L426-Q428 VanDerWaalsContact C-N 3.32Å; L426-Q428 PolarHBondContact O-N 2.85Å; Q428-L431 PolarHBondContact O-N 3.3Å; Q428-S432 VanDerWaalsContact O-CB 3.29Å; Q428-S432 WeakPolarHBondContact O-CB 3.21Å; Q428-S432 PolarHBondContact O-N 3.06Å; Q428-S432 PolarHBondContact O-OG 3.36Å |
| 429 | L | 94.1 | Very high | 77.8 | Confident | 104 Ų | 104 | 87 Ų | 87 | 55% | 0.545 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65 | -41.4 | 174.7 | -174.2 | 136.3 | 0 | 0 | 0 | 111.7 | N425 L426 L427 S432 G433 | N425-L429 PolarHBondContact O-N 2.86Å; N425-L429 VanDerWaalsContact O-N 3.16Å; L426-L429 WeakPolarHBondContact O-CB 3.39Å; L426-L429 PolarHBondContact O-N 2.94Å; L426-L429 VanDerWaalsContact O-N 3.08Å; L427-L429 VanDerWaalsContact C-N 3.27Å; L427-L429 PolarHBondContact O-N 3.35Å; L429-S432 PolarHBondContact O-N 2.71Å; L429-G433 PolarHBondContact O-N 3.2Å; L429-G433 VanDerWaalsContact O-N 3.08Å |
| 430 | V | 93.9 | Very high | 74.8 | Confident | 10 Ų | 10 | 89.4 Ų | 89.4 | 6% | 0.061 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -61.6 | -45.8 | 174.4 | -174 | 0 | 0 | 0 | 0 | 111.4 | A395 L398 Q399 L414 L426 L427 G433 | A395-V430 HydrophobicContact CB-CG2 3.98Å; L398-V430 HydrophobicContact CB-CG1 4.41Å; Q399-V430 HydrophobicContact CB-CG1 4.09Å; Q399-V430 HydrophobicContact CB-CG2 3.93Å; L414-V430 HydrophobicContact CD2-CG1 3.97Å; L426-V430 WeakPolarHBondContact O-CG2 3.33Å; L426-V430 PolarHBondContact O-N 3.06Å; L427-V430 WeakPolarHBondContact O-CB 3.35Å; L427-V430 PolarHBondContact O-N 2.79Å; L427-V430 VanDerWaalsContact O-N 3.12Å; V430-G433 PolarHBondContact O-N 3.37Å |
| 431 | L | 92.6 | Very high | 72.5 | Confident | 12 Ų | 12 | 89.5 Ų | 89.5 | 6% | 0.063 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -67.8 | -34.7 | -177.9 | -66.6 | 177.2 | 0 | 0 | 0 | 113 | L414 R415 C418 L427 Q428 | L414-L431 HydrophobicContact CB-CD2 4.05Å; L414-L431 HydrophobicContact CD2-CD2 3.83Å; L414-L431 HydrophobicContact CG-CD2 3.61Å; R415-L431 HydrophobicContact CG-CB 4.1Å; R415-L431 HydrophobicContact CG-CD2 4.01Å; R415-L431 HydrophobicContact CG-CG 4.47Å; C418-L431 HydrophobicContact CB-CD1 4.15Å; C418-L431 HydrophobicContact CB-CD2 4.13Å; L427-L431 HydrophobicContact CD1-CG 4.4Å; L427-L431 HydrophobicContact CG-CD1 4.12Å; L427-L431 HydrophobicContact CG-CG 4.37Å; L427-L431 VanDerWaalsContact O-CG 3.27Å; L427-L431 WeakPolarHBondContact O-CG 3.28Å; L427-L431 PolarHBondContact O-N 3.29Å; Q428-L431 PolarHBondContact O-N 3.3Å |
| 432 | S | 88.3 | Confident | 69.9 | Low | 89 Ų | 89 | 97.1 Ų | 97.1 | 62% | 0.622 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -77.4 | -29.7 | 179.3 | -56.8 | 0 | 0 | 0 | 0 | 112.2 | Q428 L429 | Q428-S432 VanDerWaalsContact O-CB 3.29Å; Q428-S432 WeakPolarHBondContact O-CB 3.21Å; Q428-S432 PolarHBondContact O-N 3.06Å; Q428-S432 PolarHBondContact O-OG 3.36Å; L429-S432 PolarHBondContact O-N 2.71Å |
| 433 | G | 74.9 | Confident | 66.9 | Low | 13 Ų | 13 | 100.9 Ų | 100.9 | 13% | 0.134 | 52% | 0.516 | C | S | . | . | trans | 77.7 | 174.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L429 V430 V435 | L429-G433 PolarHBondContact O-N 3.2Å; L429-G433 VanDerWaalsContact O-N 3.08Å; V430-G433 PolarHBondContact O-N 3.37Å; G433-V435 PolarHBondContact O-N 3.43Å | ||
| 434 | P | 66.2 | Low | 64 | Low | 79 Ų | 79 | 100.7 Ų | 100.7 | 51% | 0.513 | 53% | 0.526 | S | S | . | . | trans | -60.4 | 131.8 | 175.6 | 23.7 | -26.3 | 0 | 0 | 0 | 109 | M436 | P434-M436 VanDerWaalsContact C-N 3.32Å; P434-M436 HydrophobicContact CG-CE 4.34Å; P434-M436 PolarHBondContact O-N 3.1Å | ||
| 435 | V | 46.8 | Very low | 61.1 | Low | 114 Ų | 114 | 106.3 Ų | 106.3 | 69% | 0.691 | 56% | 0.562 | S | S | * | * | trans | -60.5 | 99.4 | 168.6 | -179 | 0 | 0 | 0 | 0 | 106.6 | G433 Y437 | G433-V435 PolarHBondContact O-N 3.43Å; V435-Y437 HydrophobicContact CB-CE2 4.43Å; V435-Y437 HydrophobicContact CG1-CD2 3.94Å; V435-Y437 HydrophobicContact CG1-CE2 3.86Å; V435-Y437 PolarHBondContact O-N 3.36Å | ||
| 436 | M | 38.5 | Very low | 58.1 | Low | 141 Ų | 141 | 108.7 Ų | 108.7 | 70% | 0.695 | 57% | 0.574 | S | S | * | * | trans | -68.7 | 92.5 | 168.5 | -67.2 | -65.3 | -173.2 | 0 | 0 | 106.2 | P434 Y438 | P434-M436 VanDerWaalsContact C-N 3.32Å; P434-M436 HydrophobicContact CG-CE 4.34Å; P434-M436 PolarHBondContact O-N 3.1Å; M436-Y438 VanDerWaalsContact C-N 3.28Å; M436-Y438 PolarHBondContact O-N 3.34Å | ||
| 437 | Y | 32 | Very low | 55.1 | Low | 207 Ų | 207 | 110.7 Ų | 110.7 | 81% | 0.812 | 60% | 0.598 | S | S | * | * | trans | -61.3 | 100.4 | 160.1 | -81.3 | -86.8 | 0 | 0 | 0 | 106.3 | V435 N439 | V435-Y437 HydrophobicContact CB-CE2 4.43Å; V435-Y437 HydrophobicContact CG1-CD2 3.94Å; V435-Y437 HydrophobicContact CG1-CE2 3.86Å; V435-Y437 PolarHBondContact O-N 3.36Å; Y437-N439 PolarHBondContact O-N 2.73Å | ||
| 438 | Y | 31.3 | Very low | 52 | Low | 221 Ų | 221 | 122 Ų | 122 | 87% | 0.867 | 64% | 0.643 | S | S | * | * | trans | -64.8 | 82 | 159.4 | -85 | -84.2 | 0 | 0 | 0 | 107.2 | M436 N440 | M436-Y438 VanDerWaalsContact C-N 3.28Å; M436-Y438 PolarHBondContact O-N 3.34Å; Y438-N440 VanDerWaalsContact C-N 3.33Å; Y438-N440 PolarHBondContact O-N 2.85Å | ||
| 439 | N | 34.5 | Very low | 48.7 | Very low | 143 Ų | 143 | 123.6 Ų | 123.6 | 77% | 0.765 | 66% | 0.662 | S | S | * | * | trans | -86.7 | 87.7 | 159.3 | -153.8 | 27.6 | 0 | 0 | 0 | 106 | Y437 | Y437-N439 PolarHBondContact O-N 2.73Š| ||
| 440 | N | 30.2 | Very low | 46 | Very low | 140 Ų | 140 | 123.6 Ų | 123.6 | 75% | 0.749 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -170.2 | 123.7 | 140.7 | -89.4 | -20.8 | 0 | 0 | 0 | 110.8 | Y438 | Y438-N440 VanDerWaalsContact C-N 3.33Å; Y438-N440 PolarHBondContact O-N 2.85Å |
| 441 | I | 40.9 | Very low | 42.9 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 79% | 0.785 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -28.1 | 126.4 | 161.4 | -64 | 155.3 | 0 | 0 | 0 | 112.2 | ||
| 442 | H | 40.8 | Very low | 39.8 | Very low | 178 Ų | 178 | 136.2 Ų | 136.2 | 82% | 0.824 | 74% | 0.742 | S | S | * | * | S | Bend | trans | 39.4 | 96.4 | 163.4 | -81.7 | -69.6 | 0 | 0 | 0 | 118.5 | ||
| 443 | T | 30.1 | Very low | 37 | Very low | 134 Ų | 134 | 135.7 Ų | 135.7 | 82% | 0.822 | 74% | 0.743 | S | S | * | * | trans | -167.8 | 125.9 | 130.4 | 26.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 444 | P | 32 | Very low | 34.8 | Very low | 118 Ų | 118 | 144.1 Ų | 144.1 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | trans | -80.9 | 147.3 | 175.1 | 32 | -30.6 | 0 | 0 | 0 | 111 | ||||
| 445 | P | 35.2 | Very low | 32.9 | Very low | 120 Ų | 120 | 145.6 Ų | 145.6 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | trans | -79.4 | 137.5 | 177.1 | 28.5 | -26.4 | 0 | 0 | 0 | 111.5 | A447 | P445-A447 PolarHBondContact O-N 3.09Å; P445-A447 VanDerWaalsContact O-N 3.14Å | ||
| 446 | L | 32.4 | Very low | 32.6 | Very low | 175 Ų | 175 | 145.4 Ų | 145.4 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | trans | -62.1 | 106.6 | 171.7 | -73.4 | 162.4 | 0 | 0 | 0 | 110.1 | ||||
| 447 | A | 32.7 | Very low | 32 | Very low | 95 Ų | 95 | 145.9 Ų | 145.9 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -79.3 | 117.4 | 166 | 0 | 0 | 0 | 0 | 0 | 109.3 | P445 S449 | P445-A447 PolarHBondContact O-N 3.09Å; P445-A447 VanDerWaalsContact O-N 3.14Å; A447-S449 PolarHBondContact O-N 3.2Å | ||
| 448 | Y | 30 | Very low | 32.2 | Very low | 240 Ų | 240 | 141.7 Ų | 141.7 | 94% | 0.941 | 79% | 0.794 | S | S | * | * | trans | -67.2 | 122 | 159.8 | -98.2 | -97.6 | 0 | 0 | 0 | 108.7 | ||||
| 449 | S | 26.5 | Very low | 32 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | -141 | 128.5 | 161.9 | -163.7 | 0 | 0 | 0 | 0 | 108.7 | A447 | A447-S449 PolarHBondContact O-N 3.2Š| ||
| 450 | P | 36.1 | Very low | 31.6 | Very low | 105 Ų | 105 | 137.6 Ų | 137.6 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | trans | -90.8 | 130.2 | -179.9 | 34.2 | -27.6 | 0 | 0 | 0 | 109.9 | ||||
| 451 | H | 29.4 | Very low | 31.9 | Very low | 191 Ų | 191 | 135.9 Ų | 135.9 | 88% | 0.884 | 79% | 0.791 | S | S | * | * | 175.9 | 130 | 129.7 | -90.4 | -62.4 | 0 | 0 | 0 | 110.7 | |||||
| 452 | A | 28.2 | Very low | 31.3 | Very low | 96 Ų | 96 | 134 Ų | 134 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | trans | -63.2 | 167.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 453 | A | 28.6 | Very low | 30.6 | Very low | 77 Ų | 77 | 132.9 Ų | 132.9 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | cis | -163.6 | 178.2 | 19.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 454 | H | 29.1 | Very low | 31.1 | Very low | 190 Ų | 190 | 132.1 Ų | 132.1 | 88% | 0.88 | 78% | 0.783 | S | S | * | * | trans | 110.6 | 98.7 | 164.4 | -56.4 | -66 | 0 | 0 | 0 | 116.9 | ||||
| 455 | S | 26.1 | Very low | 31.6 | Very low | 110 Ų | 110 | 131 Ų | 131 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -79.4 | 174 | 154.1 | -72.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 456 | P | 39.4 | Very low | 31.4 | Very low | 110 Ų | 110 | 134 Ų | 134 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | cis | -144.7 | 155.5 | 24.4 | 38.4 | -16.2 | 0 | 0 | 0 | 119.6 | ||||
| 457 | I | 27.7 | Very low | 31.4 | Very low | 152 Ų | 152 | 131.4 Ų | 131.4 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | 39 | 148.9 | 127.3 | -59.6 | 175.9 | 0 | 0 | 0 | 119.2 | |||||
| 458 | P | 35.6 | Very low | 31.7 | Very low | 118 Ų | 118 | 132 Ų | 132 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | cis | -145.5 | 177 | 25.7 | 19.4 | 9.5 | 0 | 0 | 0 | 120.5 | ||||
| 459 | A | 26.6 | Very low | 31.8 | Very low | 97 Ų | 97 | 128.9 Ų | 128.9 | 80% | 0.802 | 76% | 0.76 | S | S | * | * | trans | 109.6 | 114.7 | 135.2 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 460 | H | 25.4 | Very low | 32.1 | Very low | 181 Ų | 181 | 129.7 Ų | 129.7 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | trans | -45.1 | 171.7 | 158.7 | -77.4 | -63.2 | 0 | 0 | 0 | 115.3 | ||||
| 461 | P | 38.2 | Very low | 32.1 | Very low | 105 Ų | 105 | 130.1 Ų | 130.1 | 68% | 0.682 | 76% | 0.764 | S | S | * | * | cis | -154.7 | 166.8 | 37.1 | 41.7 | -17.9 | 0 | 0 | 0 | 121.7 | ||||
| 462 | T | 27.6 | Very low | 32 | Very low | 112 Ų | 112 | 129.3 Ų | 129.3 | 69% | 0.687 | 77% | 0.765 | S | S | * | * | trans | 63.3 | 115.8 | 137.2 | 53.8 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 463 | L | 26.3 | Very low | 32.1 | Very low | 156 Ų | 156 | 129 Ų | 129 | 82% | 0.817 | 76% | 0.762 | S | S | * | * | 44.5 | 157.8 | 120.8 | -75.7 | 151.9 | 0 | 0 | 0 | 120.7 | |||||
| 464 | P | 39.4 | Very low | 32.1 | Very low | 117 Ų | 117 | 129.2 Ų | 129.2 | 76% | 0.76 | 76% | 0.764 | S | S | * | * | cis | -142.8 | -173 | 26.7 | 41.6 | -18.2 | 0 | 0 | 0 | 116.1 | ||||
| 465 | P | 42.7 | Very low | 32 | Very low | 95 Ų | 95 | 128.8 Ų | 128.8 | 62% | 0.617 | 76% | 0.762 | S | S | * | * | trans | -112.1 | 156.8 | -156.4 | 40.1 | -29.9 | 0 | 0 | 0 | 115.1 | ||||
| 466 | H | 31 | Very low | 32.5 | Very low | 182 Ų | 182 | 128.9 Ų | 128.9 | 84% | 0.843 | 76% | 0.76 | S | S | * | * | trans | -150.9 | 107.1 | 160.7 | -81.8 | -63.7 | 0 | 0 | 0 | 114.4 | ||||
| 467 | T | 32.3 | Very low | 32.1 | Very low | 122 Ų | 122 | 128.1 Ų | 128.1 | 75% | 0.748 | 76% | 0.763 | S | S | * | * | trans | 46.7 | 150.4 | 131 | 47.7 | 0 | 0 | 0 | 0 | 125 | ||||
| 468 | P | 40.2 | Very low | 32.4 | Very low | 106 Ų | 106 | 125.7 Ų | 125.7 | 69% | 0.688 | 76% | 0.757 | S | S | * | * | trans | -111 | 145.5 | -160.9 | 38 | -23.5 | 0 | 0 | 0 | 113.9 | ||||
| 469 | H | 32 | Very low | 32.2 | Very low | 175 Ų | 175 | 128.6 Ų | 128.6 | 81% | 0.81 | 76% | 0.76 | S | S | * | * | trans | -145.5 | 110.4 | 166.4 | -78.7 | -64.3 | 0 | 0 | 0 | 113.8 | ||||
| 470 | T | 31.8 | Very low | 32.2 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 78% | 0.779 | 76% | 0.757 | S | S | * | * | trans | 50.9 | 140.3 | 134.3 | 27.3 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 471 | P | 36.6 | Very low | 32.3 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 74% | 0.74 | 76% | 0.762 | S | S | * | * | trans | -97.5 | 144.2 | -176.2 | 38.3 | -30.6 | 0 | 0 | 0 | 113.6 | ||||
| 472 | L | 28 | Very low | 31.9 | Very low | 174 Ų | 174 | 134.9 Ų | 134.9 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | trans | -160.9 | 151.3 | 161.7 | -90.2 | 117.3 | 0 | 0 | 0 | 106.4 | ||||
| 473 | A | 28.7 | Very low | 32 | Very low | 90 Ų | 90 | 135.2 Ų | 135.2 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | cis | -161.6 | 161 | -22.5 | 0 | 0 | 0 | 0 | 0 | 104 | ||||
| 474 | A | 28.6 | Very low | 32.1 | Very low | 80 Ų | 80 | 132.7 Ų | 132.7 | 66% | 0.661 | 78% | 0.777 | S | S | * | * | trans | -57.3 | 156.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 475 | H | 28.6 | Very low | 31.6 | Very low | 181 Ų | 181 | 135.7 Ų | 135.7 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | 160.1 | 165.8 | 134.5 | -78 | -52.9 | 0 | 0 | 0 | 109.8 | ||||
| 476 | P | 36 | Very low | 31.2 | Very low | 113 Ų | 113 | 136.7 Ų | 136.7 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | -122.5 | 169.2 | -82.1 | 25.3 | -2.9 | 0 | 0 | 0 | 112.5 | |||||
| 477 | A | 31.1 | Very low | 31.2 | Very low | 94 Ų | 94 | 137.5 Ų | 137.5 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | -63.7 | 158.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 478 | P | 34.5 | Very low | 31 | Very low | 100 Ų | 100 | 141 Ų | 141 | 65% | 0.649 | 80% | 0.799 | S | S | * | * | -146.3 | 156.4 | 94.1 | 34.7 | -17.6 | 0 | 0 | 0 | 114 | |||||
| 479 | H | 29.7 | Very low | 30.5 | Very low | 180 Ų | 180 | 142.9 Ų | 142.9 | 83% | 0.833 | 81% | 0.808 | S | S | * | * | 178.1 | 111 | 124.4 | -85.2 | -55.8 | 0 | 0 | 0 | 112.3 | |||||
| 480 | A | 27.9 | Very low | 30.4 | Very low | 90 Ų | 90 | 137.7 Ų | 137.7 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | trans | 31 | 110.3 | 144.8 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 481 | Q | 27.1 | Very low | 30.3 | Very low | 199 Ų | 199 | 140.1 Ų | 140.1 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 135.5 | 155.7 | -72.1 | 168.5 | -44.6 | 0 | 0 | 110.5 | ||
| 482 | Y | 28.7 | Very low | 30.1 | Very low | 226 Ų | 226 | 140.3 Ų | 140.3 | 89% | 0.886 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 145.2 | 164.1 | -88.2 | -87.8 | 0 | 0 | 0 | 110.7 | ||
| 483 | P | 31 | Very low | 30.3 | Very low | 119 Ų | 119 | 141.1 Ų | 141.1 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 133.4 | -173 | 32.3 | -31.7 | 0 | 0 | 0 | 112.6 | ||
| 484 | A | 28.3 | Very low | 30.4 | Very low | 102 Ų | 102 | 142.9 Ų | 142.9 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 133 | 166.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 485 | Q | 29.4 | Very low | 30.5 | Very low | 180 Ų | 180 | 147.5 Ų | 147.5 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 139.9 | 171.8 | -75.6 | -104.6 | -33.7 | 0 | 0 | 110.5 | ||
| 486 | P | 34 | Very low | 30.5 | Very low | 117 Ų | 117 | 150.4 Ų | 150.4 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 137.6 | -175.5 | 30.8 | -31.9 | 0 | 0 | 0 | 113.1 | ||
| 487 | F | 30.2 | Very low | 30.2 | Very low | 198 Ų | 198 | 149.6 Ų | 149.6 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 132.8 | 170.4 | -92.4 | -100.7 | 0 | 0 | 0 | 111.7 | T489 | F487-T489 PolarHBondContact O-N 3.22Š|
| 488 | M | 28.8 | Very low | 30.3 | Very low | 197 Ų | 197 | 148.9 Ų | 148.9 | 97% | 0.97 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 121 | 166.3 | -84.4 | -160.8 | 142.5 | 0 | 0 | 110.5 | ||
| 489 | T | 29.9 | Very low | 30.3 | Very low | 144 Ų | 144 | 156.9 Ų | 156.9 | 88% | 0.883 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -98 | 138 | 174.3 | -5.3 | 0 | 0 | 0 | 0 | 109.1 | F487 | F487-T489 PolarHBondContact O-N 3.22Š|
| 490 | G | 28.6 | Very low | 30.3 | Very low | 67 Ų | 67 | 155.8 Ų | 155.8 | 69% | 0.691 | 84% | 0.843 | S | S | * | * | trans | 113.5 | 99.3 | 150.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 491 | M | 29.6 | Very low | 30.4 | Very low | 177 Ų | 177 | 159.2 Ų | 159.2 | 87% | 0.872 | 85% | 0.849 | S | S | * | * | trans | -135.8 | 129.2 | 137.2 | -74.2 | -61.8 | -83.9 | 0 | 0 | 108.2 | ||||
| 492 | P | 32.6 | Very low | 30.6 | Very low | 119 Ų | 119 | 157 Ų | 157 | 77% | 0.773 | 84% | 0.844 | S | S | * | * | trans | -80.9 | 143.1 | -173.7 | 31.3 | -32.7 | 0 | 0 | 0 | 112.7 | ||||
| 493 | F | 32.7 | Very low | 30.7 | Very low | 190 Ų | 190 | 152.9 Ų | 152.9 | 83% | 0.833 | 84% | 0.842 | S | S | * | * | trans | -81.3 | 137.8 | 172.2 | -82.4 | -91.3 | 0 | 0 | 0 | 112 | F495 | F493-F495 PolarHBondContact O-N 3.45Š| ||
| 494 | P | 31.9 | Very low | 30.7 | Very low | 128 Ų | 128 | 155.1 Ų | 155.1 | 83% | 0.831 | 85% | 0.846 | S | S | * | * | trans | -86.5 | 97.2 | 153.3 | 31.4 | -24.7 | 0 | 0 | 0 | 109.1 | ||||
| 495 | F | 29.1 | Very low | 30.8 | Very low | 176 Ų | 176 | 158.6 Ų | 158.6 | 77% | 0.772 | 85% | 0.846 | S | S | * | * | trans | -82.6 | 123.6 | 168.3 | -165.6 | -97.7 | 0 | 0 | 0 | 108.8 | F493 P497 | F493-F495 PolarHBondContact O-N 3.45Å; F495-P497 HydrophobicContact CD1-CG 4.23Å; F495-P497 HydrophobicContact CE1-CB 4.05Å; F495-P497 HydrophobicContact CE1-CG 3.97Å | ||
| 496 | R | 29.7 | Very low | 30.9 | Very low | 242 Ų | 242 | 157.1 Ų | 157.1 | 91% | 0.913 | 85% | 0.846 | S | S | * | * | trans | -126.8 | 110.5 | 166.1 | -128.7 | -172.9 | -166.1 | 179.1 | 5 | 108.6 | ||||
| 497 | P | 28.6 | Very low | 30.7 | Very low | 96 Ų | 96 | 160.2 Ų | 160.2 | 62% | 0.623 | 85% | 0.853 | S | S | * | * | trans | -78.2 | 125 | 169.4 | 25.4 | -19.9 | 0 | 0 | 0 | 108.9 | F495 | F495-P497 HydrophobicContact CD1-CG 4.23Å; F495-P497 HydrophobicContact CE1-CB 4.05Å; F495-P497 HydrophobicContact CE1-CG 3.97Å | ||
| 498 | G | 34.8 | Very low | 30.7 | Very low | 79 Ų | 79 | 157 Ų | 157 | 81% | 0.814 | 85% | 0.852 | S | S | * | * | trans | -84.3 | 127.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 499 | H | 32.8 | Very low | 30.9 | Very low | 269 Ų | 269 | 153.4 Ų | 153.4 | 100% | 1.245 | 84% | 0.841 | S | S | * | * | trans | -75.8 | 0 | 159.9 | -82.6 | -71 | 0 | 0 | 0 | 111.2 |
Retrieved 499 of 499 residues in 1114.1 ms
(Link to these results)