| 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 | 78.7 | Confident | 89.5 | Confident | 242 Ų | 242 | 153.2 Ų | 153.2 | 100% | 1.192 | 75% | 0.75 | S | S | * | * | 0 | 142.4 | 0 | -67.7 | 171.7 | 174.4 | 0 | 0 | 108.3 | |||||
| 2 | R | 84.9 | Confident | 90 | Very high | 193 Ų | 193 | 145.9 Ų | 145.9 | 73% | 0.728 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 137.1 | 176.9 | -65.3 | -179.3 | -173.4 | 163 | 2 | 109.1 | ||
| 3 | P | 90.4 | Very high | 90.2 | Very high | 81 Ų | 81 | 143.2 Ų | 143.2 | 53% | 0.526 | 74% | 0.738 | S | S | . | * | P | Polyproline II helix | trans | -66.9 | 156 | 179.8 | 28.5 | -34.4 | 0 | 0 | 0 | 111.2 | G5 K6 | P3-G5 PolarHBondContact O-N 3.09Å; P3-K6 HydrophobicContact CG-CB 4.23Å; P3-K6 HydrophobicContact CG-CD 4.11Å; P3-K6 HydrophobicContact CG-CG 4.32Å; P3-K6 PolarHBondContact O-N 3.47Å |
| 4 | W | 90.5 | Very high | 90.5 | Very high | 236 Ų | 236 | 147.2 Ų | 147.2 | 89% | 0.894 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.8 | 140 | 170 | -70.6 | -31.2 | 0 | 0 | 0 | 110.6 | K6 M7 | W4-K6 VanDerWaalsContact C-N 3.34Å; W4-K6 PolarHBondContact O-N 3.47Å; W4-M7 HydrophobicContact CB-CE 4.47Å; W4-M7 HydrophobicContact CG-CE 4.35Å |
| 5 | G | 88.9 | Confident | 90.8 | Very high | 77 Ų | 77 | 144.8 Ų | 144.8 | 79% | 0.794 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.7 | -15.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | P3 | P3-G5 PolarHBondContact O-N 3.09Š|
| 6 | K | 92 | Very high | 91.2 | Very high | 165 Ų | 165 | 148.3 Ų | 148.3 | 72% | 0.717 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -115.4 | 24.3 | 174 | -60.9 | -172.1 | -178.4 | -179.8 | 0 | 113.3 | P3 W4 | P3-K6 HydrophobicContact CG-CB 4.23Å; P3-K6 HydrophobicContact CG-CD 4.11Å; P3-K6 HydrophobicContact CG-CG 4.32Å; P3-K6 PolarHBondContact O-N 3.47Å; W4-K6 VanDerWaalsContact C-N 3.34Å; W4-K6 PolarHBondContact O-N 3.47Å |
| 7 | M | 92.5 | Very high | 91.3 | Very high | 108 Ų | 108 | 144.3 Ų | 144.3 | 53% | 0.532 | 76% | 0.757 | S | S | . | * | S | Bend | trans | -80.6 | -57.1 | -174.9 | -65.1 | -176.5 | -76.5 | 0 | 0 | 112 | W4 | W4-M7 HydrophobicContact CB-CE 4.47Å; W4-M7 HydrophobicContact CG-CE 4.35Å |
| 8 | A | 90.1 | Very high | 91.5 | Very high | 74 Ų | 74 | 142.6 Ų | 142.6 | 61% | 0.612 | 75% | 0.748 | S | S | * | * | trans | -154.9 | 158.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | L10 | A8-L10 HydrophobicContact CB-CG 4.29Š| ||
| 9 | K | 92.1 | Very high | 91.6 | Very high | 181 Ų | 181 | 137.7 Ų | 137.7 | 79% | 0.787 | 73% | 0.727 | S | S | * | * | trans | -93.3 | 110.3 | 167 | -67.3 | -178.1 | -180 | 179.9 | 0 | 107.8 | Y11 | K9-Y11 HydrophobicContact CB-CE2 3.99Š| ||
| 10 | L | 91.4 | Very high | 91.7 | Very high | 135 Ų | 135 | 136.1 Ų | 136.1 | 71% | 0.707 | 72% | 0.724 | S | S | * | * | trans | -118.2 | 132.9 | 177.9 | -63 | 170.5 | 0 | 0 | 0 | 108 | A8 | A8-L10 HydrophobicContact CB-CG 4.29Š| ||
| 11 | Y | 93.2 | Very high | 91.8 | Very high | 193 Ų | 193 | 139 Ų | 139 | 76% | 0.757 | 73% | 0.731 | S | S | * | * | trans | -130.1 | 139.7 | 177.5 | -60.6 | -81.7 | 0 | 0 | 0 | 108.8 | K9 V13 | K9-Y11 HydrophobicContact CB-CE2 3.99Å; Y11-V13 PolarHBondContact O-N 3.45Å | ||
| 12 | G | 94.6 | Very high | 92.6 | Very high | 66 Ų | 66 | 134.3 Ų | 134.3 | 68% | 0.68 | 71% | 0.706 | S | S | * | * | S | Bend | trans | 74.6 | 17.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 13 | V | 93.2 | Very high | 92.9 | Very high | 111 Ų | 111 | 130.1 Ų | 130.1 | 67% | 0.673 | 70% | 0.695 | S | S | * | * | trans | -99.6 | 119.8 | 175.9 | -176.8 | 0 | 0 | 0 | 0 | 109.8 | Y11 | Y11-V13 PolarHBondContact O-N 3.45Š| ||
| 14 | Y | 94.8 | Very high | 93 | Very high | 199 Ų | 199 | 134.7 Ų | 134.7 | 78% | 0.78 | 71% | 0.707 | S | S | * | * | trans | -111 | 136 | 172.3 | -59.1 | -86.2 | 0 | 0 | 0 | 109.2 | ||||
| 15 | S | 95.1 | Very high | 92.9 | Very high | 111 Ų | 111 | 128 Ų | 128 | 78% | 0.776 | 70% | 0.701 | S | S | * | * | trans | -127 | 146.9 | 175.1 | 59 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 16 | F | 96 | Very high | 92.9 | Very high | 201 Ų | 201 | 132.5 Ų | 132.5 | 88% | 0.882 | 70% | 0.7 | S | S | * | * | trans | -118.3 | 141.5 | 178 | -57 | -81 | 0 | 0 | 0 | 109 | ||||
| 17 | G | 93.9 | Very high | 92.5 | Very high | 80 Ų | 80 | 127 Ų | 127 | 83% | 0.825 | 69% | 0.69 | S | S | * | * | trans | -144.4 | 142.3 | 176 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 18 | L | 94.2 | Very high | 92.3 | Very high | 114 Ų | 114 | 127.4 Ų | 127.4 | 60% | 0.597 | 69% | 0.69 | S | S | * | * | trans | -89.2 | 153.7 | 173.3 | -74.4 | 165.9 | 0 | 0 | 0 | 110.1 | Q23 | L18-Q23 HydrophobicContact CB-CG 3.67Å; L18-Q23 HydrophobicContact CD1-CG 4.21Å; L18-Q23 PolarHBondContact O-NE2 2.79Å | ||
| 19 | S | 94.8 | Very high | 92.1 | Very high | 50 Ų | 50 | 130.2 Ų | 130.2 | 35% | 0.35 | 69% | 0.689 | S | S | . | * | trans | -61.9 | 141.1 | 171.3 | 177 | 0 | 0 | 0 | 0 | 110.2 | F21 E22 Q23 | S19-F21 PolarHBondContact O-N 3.47Å; S19-F21 VanDerWaalsContact O-N 3.09Å; S19-E22 PolarHBondContact N-OE2 2.94Å; S19-E22 PolarHBondContact O-N 2.84Å; S19-Q23 PolarHBondContact O-N 3.39Å | ||
| 20 | P | 93.1 | Very high | 92 | Very high | 104 Ų | 104 | 124.3 Ų | 124.3 | 68% | 0.675 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -54.8 | -29.3 | 176.3 | -26.7 | 34.9 | 0 | 0 | 0 | 113.6 | E22 Q23 | P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3.25Å; P20-Q23 PolarHBondContact O-N 3.41Å |
| 21 | F | 94.4 | Very high | 92 | Very high | 198 Ų | 198 | 119.9 Ų | 119.9 | 87% | 0.868 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -76.1 | -14.5 | 179 | -58.8 | -74.2 | 0 | 0 | 0 | 113.8 | S19 | S19-F21 PolarHBondContact O-N 3.47Å; S19-F21 VanDerWaalsContact O-N 3.09Å |
| 22 | E | 93.6 | Very high | 92 | Very high | 144 Ų | 144 | 113.7 Ų | 113.7 | 67% | 0.673 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -97.2 | -10.9 | 177.4 | -64 | 174.8 | 154 | 0 | 0 | 112.2 | S19 P20 | S19-E22 PolarHBondContact N-OE2 2.94Å; S19-E22 PolarHBondContact O-N 2.84Å; P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3.25Å |
| 23 | Q | 93.2 | Very high | 92 | Very high | 105 Ų | 105 | 115 Ų | 115 | 49% | 0.491 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -97.3 | 151.4 | -178.2 | -62.2 | -179 | 42.9 | 0 | 0 | 111.4 | L18 S19 P20 | L18-Q23 HydrophobicContact CB-CG 3.67Å; L18-Q23 HydrophobicContact CD1-CG 4.21Å; L18-Q23 PolarHBondContact O-NE2 2.79Å; S19-Q23 PolarHBondContact O-N 3.39Å; P20-Q23 PolarHBondContact O-N 3.41Å |
| 24 | K | 91 | Very high | 92.1 | Very high | 177 Ų | 177 | 117.4 Ų | 117.4 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | trans | -81.7 | 130.1 | 168 | -68.3 | -178.9 | -178.9 | 178.1 | 0 | 109.3 | F26 G27 | K24-F26 VanDerWaalsContact C-N 3.25Å; K24-F26 PolarHBondContact O-N 2.91Å; K24-G27 PolarHBondContact O-N 2.99Å | ||
| 25 | A | 89.5 | Confident | 92.1 | Very high | 95 Ų | 95 | 113.1 Ų | 113.1 | 79% | 0.785 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -37.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 26 | F | 87.5 | Confident | 92.1 | Very high | 172 Ų | 172 | 112.1 Ų | 112.1 | 75% | 0.754 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.4 | 58.5 | 175.8 | -60.6 | -75.1 | 0 | 0 | 0 | 110.3 | K24 E28 | K24-F26 VanDerWaalsContact C-N 3.25Å; K24-F26 PolarHBondContact O-N 2.91Å; F26-E28 VanDerWaalsContact C-N 3.34Å; F26-E28 PolarHBondContact O-N 3.48Å |
| 27 | G | 85 | Confident | 92.1 | Very high | 50 Ų | 50 | 104.1 Ų | 104.1 | 52% | 0.515 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.5 | -31.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | K24 | K24-G27 PolarHBondContact O-N 2.99Š|
| 28 | E | 87.5 | Confident | 92.2 | Very high | 116 Ų | 116 | 106.8 Ų | 106.8 | 54% | 0.542 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -122.8 | 34.5 | -170.3 | -58.3 | -168.2 | 178.4 | 0 | 0 | 113.8 | F26 G30 S31 D32 K35 | F26-E28 VanDerWaalsContact C-N 3.34Å; F26-E28 PolarHBondContact O-N 3.48Å; E28-G30 PolarHBondContact O-N 3.46Å; E28-S31 WeakPolarHBondContact CB-OG 3.39Å; E28-S31 WeakPolarHBondContact O-CA 3.39Å; E28-S31 PolarHBondContact O-N 3.3Å; E28-S31 PolarHBondContact O-OG 2.83Å; E28-S31 PolarHBondContact OE2-OG 2.89Å; E28-D32 PolarHBondContact O-N 3.39Å; E28-K35 IonicContact OE2-NZ 3.46Å |
| 29 | F | 86.8 | Confident | 92.3 | Very high | 133 Ų | 133 | 106.3 Ų | 106.3 | 58% | 0.583 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -48.1 | -40.4 | -174.5 | -174.7 | -98 | 0 | 0 | 0 | 114.2 | D32 M33 | F29-D32 PolarHBondContact O-N 2.85Å; F29-M33 HydrophobicContact CD1-CG 4.06Å; F29-M33 HydrophobicContact CE1-CG 3.69Å; F29-M33 HydrophobicContact CE1-SD 4.13Å; F29-M33 HydrophobicContact CE2-CG 4.35Å; F29-M33 HydrophobicContact CZ-CG 3.85Å; F29-M33 HydrophobicContact CZ-SD 3.85Å; F29-M33 WeakPolarHBondContact O-CB 3.16Å; F29-M33 WeakPolarHBondContact O-CG 3.45Å; F29-M33 PolarHBondContact O-N 3.29Å |
| 30 | G | 89.4 | Confident | 92.3 | Very high | 56 Ų | 56 | 109.9 Ų | 109.9 | 58% | 0.577 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -67.4 | -39.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | E28 D32 Y34 | E28-G30 PolarHBondContact O-N 3.46Å; G30-D32 VanDerWaalsContact C-N 3.34Å; G30-Y34 PolarHBondContact O-N 3.48Å |
| 31 | S | 92.2 | Very high | 92.4 | Very high | 42 Ų | 42 | 110.7 Ų | 110.7 | 29% | 0.294 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.9 | -39.2 | 176.2 | 107.7 | 0 | 0 | 0 | 0 | 110.3 | E28 Y34 K35 | E28-S31 WeakPolarHBondContact CB-OG 3.39Å; E28-S31 WeakPolarHBondContact O-CA 3.39Å; E28-S31 PolarHBondContact O-N 3.3Å; E28-S31 PolarHBondContact O-OG 2.83Å; E28-S31 PolarHBondContact OE2-OG 2.89Å; S31-Y34 PolarHBondContact O-N 3.49Å; S31-K35 VanDerWaalsContact O-CG 3.3Å; S31-K35 WeakPolarHBondContact O-CG 3.3Å; S31-K35 PolarHBondContact O-N 3.06Å; S31-K35 PolarHBondContact OG-NZ 2.89Å |
| 32 | D | 92.4 | Very high | 92.4 | Very high | 64 Ų | 64 | 105.9 Ų | 105.9 | 34% | 0.342 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.5 | -41.6 | 178.9 | -65.7 | -25.9 | 0 | 0 | 0 | 111.6 | E28 F29 G30 Y34 K35 L36 | E28-D32 PolarHBondContact O-N 3.39Å; F29-D32 PolarHBondContact O-N 2.85Å; G30-D32 VanDerWaalsContact C-N 3.34Å; D32-Y34 VanDerWaalsContact C-N 3.32Å; D32-Y34 PolarHBondContact O-N 3.07Å; D32-K35 PolarHBondContact O-N 3.3Å; D32-K35 IonicContact OD1-NZ 3.51Å; D32-K35 PolarHBondContact OD1-NZ 3.34Å; D32-L36 WeakPolarHBondContact O-CB 3.31Å; D32-L36 VanDerWaalsContact O-CG 3.31Å; D32-L36 WeakPolarHBondContact O-CG 3.41Å; D32-L36 PolarHBondContact O-N 2.89Å |
| 33 | M | 93.7 | Very high | 92.5 | Very high | 93 Ų | 93 | 103 Ų | 103 | 46% | 0.458 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.5 | -40.8 | 172.5 | -72.9 | -87.1 | 80.5 | 0 | 0 | 111.9 | F29 L36 G37 | F29-M33 HydrophobicContact CD1-CG 4.06Å; F29-M33 HydrophobicContact CE1-CG 3.69Å; F29-M33 HydrophobicContact CE1-SD 4.13Å; F29-M33 HydrophobicContact CE2-CG 4.35Å; F29-M33 HydrophobicContact CZ-CG 3.85Å; F29-M33 HydrophobicContact CZ-SD 3.85Å; F29-M33 WeakPolarHBondContact O-CB 3.16Å; F29-M33 WeakPolarHBondContact O-CG 3.45Å; F29-M33 PolarHBondContact O-N 3.29Å; M33-L36 HydrophobicContact CE-CB 4.48Å; M33-L36 HydrophobicContact CE-CD1 3.48Å; M33-L36 VanDerWaalsContact CE-CD1 3.48Å; M33-L36 PolarHBondContact O-N 3.48Å; M33-G37 PolarHBondContact O-N 2.88Å |
| 34 | Y | 95.4 | Very high | 92.6 | Very high | 161 Ų | 161 | 104.7 Ų | 104.7 | 63% | 0.631 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63.8 | -45.1 | 174.7 | 178.3 | -98 | 0 | 0 | 0 | 112 | G30 S31 D32 L36 G37 R38 | G30-Y34 PolarHBondContact O-N 3.48Å; S31-Y34 PolarHBondContact O-N 3.49Å; D32-Y34 VanDerWaalsContact C-N 3.32Å; D32-Y34 PolarHBondContact O-N 3.07Å; Y34-L36 PolarHBondContact O-N 3.43Å; Y34-G37 PolarHBondContact O-N 2.85Å; Y34-R38 WeakPolarHBondContact O-CB 3.45Å; Y34-R38 PolarHBondContact O-N 3.34Å |
| 35 | K | 95.9 | Very high | 92.7 | Very high | 110 Ų | 110 | 103.6 Ų | 103.6 | 48% | 0.478 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 175.5 | -71 | 166.9 | -165.5 | 153.9 | 0 | 111.4 | E28 S31 D32 R38 M39 | E28-K35 IonicContact OE2-NZ 3.46Å; S31-K35 VanDerWaalsContact O-CG 3.3Å; S31-K35 WeakPolarHBondContact O-CG 3.3Å; S31-K35 PolarHBondContact O-N 3.06Å; S31-K35 PolarHBondContact OG-NZ 2.89Å; D32-K35 PolarHBondContact O-N 3.3Å; D32-K35 IonicContact OD1-NZ 3.51Å; D32-K35 PolarHBondContact OD1-NZ 3.34Å; K35-R38 PolarHBondContact O-N 3.06Å; K35-M39 VanDerWaalsContact O-CB 3.31Å; K35-M39 WeakPolarHBondContact O-CB 3.31Å; K35-M39 PolarHBondContact O-N 3.47Å |
| 36 | L | 95.1 | Very high | 92.9 | Very high | 89 Ų | 89 | 102 Ų | 102 | 47% | 0.466 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63 | -45 | 176.8 | -75.2 | 170.4 | 0 | 0 | 0 | 111.8 | D32 M33 Y34 M39 F40 | D32-L36 WeakPolarHBondContact O-CB 3.31Å; D32-L36 VanDerWaalsContact O-CG 3.31Å; D32-L36 WeakPolarHBondContact O-CG 3.41Å; D32-L36 PolarHBondContact O-N 2.89Å; M33-L36 HydrophobicContact CE-CB 4.48Å; M33-L36 HydrophobicContact CE-CD1 3.48Å; M33-L36 VanDerWaalsContact CE-CD1 3.48Å; M33-L36 PolarHBondContact O-N 3.48Å; Y34-L36 PolarHBondContact O-N 3.43Å; L36-M39 HydrophobicContact CD2-CE 3.91Å; L36-M39 PolarHBondContact O-N 2.84Å; L36-F40 WeakPolarHBondContact O-CB 3.34Å; L36-F40 PolarHBondContact O-N 3.39Å |
| 37 | G | 95.9 | Very high | 93.1 | Very high | 33 Ų | 33 | 98.4 Ų | 98.4 | 34% | 0.34 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | M33 Y34 F40 L41 | M33-G37 PolarHBondContact O-N 2.88Å; Y34-G37 PolarHBondContact O-N 2.85Å; G37-F40 PolarHBondContact O-N 3.36Å; G37-L41 WeakPolarHBondContact O-CG 3.39Å; G37-L41 PolarHBondContact O-N 3.43Å |
| 38 | R | 96.6 | Very high | 93.5 | Very high | 137 Ų | 137 | 99.5 Ų | 99.5 | 52% | 0.517 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -46.6 | 174.5 | -178.2 | 179 | 169.6 | 154.5 | 1.2 | 111.7 | Y34 K35 F40 L41 E42 | Y34-R38 WeakPolarHBondContact O-CB 3.45Å; Y34-R38 PolarHBondContact O-N 3.34Å; K35-R38 PolarHBondContact O-N 3.06Å; R38-F40 VanDerWaalsContact C-N 3.3Å; R38-F40 PolarHBondContact O-N 2.97Å; R38-L41 CarbonylContact O-C 3.53Å; R38-L41 PolarHBondContact O-N 2.83Å; R38-L41 VanDerWaalsContact O-N 3.15Å; R38-E42 HydrophobicContact CG-CG 4.42Å; R38-E42 IonicContact CZ-OE1 3.23Å; R38-E42 IonicContact NE-OE1 3.85Å; R38-E42 PolarHBondContact NE-OE1 2.77Å; R38-E42 IonicContact NH2-OE1 2.77Å; R38-E42 PolarHBondContact NH2-OE1 2.98Å; R38-E42 WeakPolarHBondContact O-CG 3.43Å; R38-E42 PolarHBondContact O-N 3.34Å |
| 39 | M | 95.7 | Very high | 93.8 | Very high | 104 Ų | 104 | 96.9 Ų | 96.9 | 51% | 0.512 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61 | -39.2 | 177.1 | -175.4 | -177.6 | 72.5 | 0 | 0 | 111.6 | K35 L36 E42 N43 | K35-M39 VanDerWaalsContact O-CB 3.31Å; K35-M39 WeakPolarHBondContact O-CB 3.31Å; K35-M39 PolarHBondContact O-N 3.47Å; L36-M39 HydrophobicContact CD2-CE 3.91Å; L36-M39 PolarHBondContact O-N 2.84Å; M39-E42 PolarHBondContact O-N 3.4Å; M39-N43 WeakPolarHBondContact O-CB 3.39Å; M39-N43 PolarHBondContact O-N 2.82Å; M39-N43 VanDerWaalsContact O-N 3.11Å; M39-N43 PolarHBondContact O-ND2 3.11Å |
| 40 | F | 95.1 | Very high | 94.2 | Very high | 125 Ų | 125 | 95.1 Ų | 95.1 | 55% | 0.548 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 173.2 | 177.7 | -98 | 0 | 0 | 0 | 111.6 | L36 G37 R38 E42 N43 W44 L47 | L36-F40 WeakPolarHBondContact O-CB 3.34Å; L36-F40 PolarHBondContact O-N 3.39Å; G37-F40 PolarHBondContact O-N 3.36Å; R38-F40 VanDerWaalsContact C-N 3.3Å; R38-F40 PolarHBondContact O-N 2.97Å; F40-E42 VanDerWaalsContact C-N 3.31Å; F40-E42 PolarHBondContact O-N 3.15Å; F40-N43 CarbonylContact O-C 3.55Å; F40-N43 PolarHBondContact O-N 3.28Å; F40-W44 WeakPolarHBondContact O-CA 3.47Å; F40-W44 WeakPolarHBondContact O-CB 3.47Å; F40-W44 PolarHBondContact O-N 3.08Å; F40-L47 HydrophobicContact CE2-CD1 4.24Å |
| 41 | L | 94.5 | Very high | 94.4 | Very high | 120 Ų | 120 | 95.9 Ų | 95.9 | 63% | 0.628 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -70.2 | -21.4 | 176.6 | -68.4 | 175.7 | 0 | 0 | 0 | 114.1 | G37 R38 | G37-L41 WeakPolarHBondContact O-CG 3.39Å; G37-L41 PolarHBondContact O-N 3.43Å; R38-L41 CarbonylContact O-C 3.53Å; R38-L41 PolarHBondContact O-N 2.83Å; R38-L41 VanDerWaalsContact O-N 3.15Å |
| 42 | E | 95.5 | Very high | 94.6 | Very high | 98 Ų | 98 | 98.7 Ų | 98.7 | 46% | 0.458 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -79.6 | -28.1 | 172.6 | -75.4 | 173.6 | 179.1 | 0 | 0 | 111.4 | R38 M39 F40 W45 | R38-E42 HydrophobicContact CG-CG 4.42Å; R38-E42 IonicContact CZ-OE1 3.23Å; R38-E42 IonicContact NE-OE1 3.85Å; R38-E42 PolarHBondContact NE-OE1 2.77Å; R38-E42 IonicContact NH2-OE1 2.77Å; R38-E42 PolarHBondContact NH2-OE1 2.98Å; R38-E42 WeakPolarHBondContact O-CG 3.43Å; R38-E42 PolarHBondContact O-N 3.34Å; M39-E42 PolarHBondContact O-N 3.4Å; F40-E42 VanDerWaalsContact C-N 3.31Å; F40-E42 PolarHBondContact O-N 3.15Å; E42-W45 PolarHBondContact O-NE1 3.23Å |
| 43 | N | 95 | Very high | 94.8 | Very high | 84 Ų | 84 | 102.3 Ų | 102.3 | 45% | 0.449 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -112.7 | 0.5 | -172.8 | -64.8 | -71.7 | 0 | 0 | 0 | 114.7 | M39 F40 W45 A46 | M39-N43 WeakPolarHBondContact O-CB 3.39Å; M39-N43 PolarHBondContact O-N 2.82Å; M39-N43 VanDerWaalsContact O-N 3.11Å; M39-N43 PolarHBondContact O-ND2 3.11Å; F40-N43 CarbonylContact O-C 3.55Å; F40-N43 PolarHBondContact O-N 3.28Å; N43-W45 PolarHBondContact O-N 2.81Å; N43-W45 VanDerWaalsContact O-N 3.08Å; N43-A46 VanDerWaalsContact O-CB 3.27Å; N43-A46 WeakPolarHBondContact O-CB 3.46Å; N43-A46 PolarHBondContact O-N 2.98Å |
| 44 | W | 94 | Very high | 94.9 | Very high | 140 Ų | 140 | 104.3 Ų | 104.3 | 53% | 0.53 | 51% | 0.506 | S | S | . | . | G | 310 helix | trans | -56.1 | -32.5 | -175.9 | 72.8 | -94.1 | 0 | 0 | 0 | 112.8 | F40 A46 L47 I48 | F40-W44 WeakPolarHBondContact O-CA 3.47Å; F40-W44 WeakPolarHBondContact O-CB 3.47Å; F40-W44 PolarHBondContact O-N 3.08Å; W44-A46 PolarHBondContact O-N 3.23Å; W44-L47 VanDerWaalsContact O-CB 3.3Å; W44-L47 WeakPolarHBondContact O-CB 3.49Å; W44-L47 PolarHBondContact O-N 2.87Å; W44-I48 HydrophobicContact CE3-CG1 4.37Å; W44-I48 HydrophobicContact CH2-CD1 4.12Å; W44-I48 HydrophobicContact CZ3-CD1 3.79Å; W44-I48 HydrophobicContact CZ3-CG1 3.87Å |
| 45 | W | 93.6 | Very high | 95 | Very high | 154 Ų | 154 | 99.9 Ų | 99.9 | 58% | 0.583 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -65.3 | -24.8 | -179.2 | 62.4 | -89.6 | 0 | 0 | 0 | 112.5 | E42 N43 L47 I48 | E42-W45 PolarHBondContact O-NE1 3.23Å; N43-W45 PolarHBondContact O-N 2.81Å; N43-W45 VanDerWaalsContact O-N 3.08Å; W45-L47 PolarHBondContact O-N 2.96Å; W45-I48 HydrophobicContact CB-CD1 3.78Å; W45-I48 VanDerWaalsContact O-CB 3.26Å; W45-I48 WeakPolarHBondContact O-CB 3.36Å; W45-I48 WeakPolarHBondContact O-CD1 3.27Å; W45-I48 VanDerWaalsContact O-CG1 3.23Å; W45-I48 WeakPolarHBondContact O-CG1 3.3Å; W45-I48 PolarHBondContact O-N 3.49Å; W45-I48 VanDerWaalsContact O-N 3.07Å |
| 46 | A | 93.8 | Very high | 95 | Very high | 60 Ų | 60 | 100 Ų | 100 | 50% | 0.496 | 50% | 0.504 | S | S | . | . | G | 310 helix | trans | -64.3 | -17.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | N43 W44 P49 | N43-A46 VanDerWaalsContact O-CB 3.27Å; N43-A46 WeakPolarHBondContact O-CB 3.46Å; N43-A46 PolarHBondContact O-N 2.98Å; W44-A46 PolarHBondContact O-N 3.23Å; A46-P49 WeakPolarHBondContact O-CD 3.34Å |
| 47 | L | 92.5 | Very high | 95.1 | Very high | 97 Ų | 97 | 103.3 Ų | 103.3 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | G | 310 helix | trans | -89.4 | -6.9 | 176 | -57.3 | 173.8 | 0 | 0 | 0 | 113.3 | F40 W44 W45 P49 V50 P51 | F40-L47 HydrophobicContact CE2-CD1 4.24Å; W44-L47 VanDerWaalsContact O-CB 3.3Å; W44-L47 WeakPolarHBondContact O-CB 3.49Å; W44-L47 PolarHBondContact O-N 2.87Å; W45-L47 PolarHBondContact O-N 2.96Å; L47-P49 VanDerWaalsContact C-N 3.31Å; L47-V50 WeakPolarHBondContact O-CB 3.25Å; L47-V50 WeakPolarHBondContact O-CG2 3.34Å; L47-V50 PolarHBondContact O-N 2.93Å; L47-P51 VanDerWaalsContact O-CD 3.3Å; L47-P51 WeakPolarHBondContact O-CD 3.26Å |
| 48 | I | 93 | Very high | 95.1 | Very high | 74 Ų | 74 | 105.2 Ų | 105.2 | 38% | 0.379 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | -35.7 | 177.9 | -68.9 | 168.7 | 0 | 0 | 0 | 113.8 | W44 W45 V50 P51 I52 | W44-I48 HydrophobicContact CE3-CG1 4.37Å; W44-I48 HydrophobicContact CH2-CD1 4.12Å; W44-I48 HydrophobicContact CZ3-CD1 3.79Å; W44-I48 HydrophobicContact CZ3-CG1 3.87Å; W45-I48 HydrophobicContact CB-CD1 3.78Å; W45-I48 VanDerWaalsContact O-CB 3.26Å; W45-I48 WeakPolarHBondContact O-CB 3.36Å; W45-I48 WeakPolarHBondContact O-CD1 3.27Å; W45-I48 VanDerWaalsContact O-CG1 3.23Å; W45-I48 WeakPolarHBondContact O-CG1 3.3Å; W45-I48 PolarHBondContact O-N 3.49Å; W45-I48 VanDerWaalsContact O-N 3.07Å; I48-V50 PolarHBondContact O-N 2.71Å; I48-P51 WeakPolarHBondContact O-CD 3.43Å; I48-P51 VanDerWaalsContact O-CG 3.25Å; I48-P51 WeakPolarHBondContact O-CG 3.46Å; I48-I52 HydrophobicContact CG2-CD1 3.8Å; I48-I52 WeakPolarHBondContact O-CG1 3.15Å |
| 49 | P | 94 | Very high | 95.1 | Very high | 61 Ų | 61 | 105.4 Ų | 105.4 | 40% | 0.396 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -27.5 | 176.5 | -26.5 | 36.6 | 0 | 0 | 0 | 113.9 | A46 L47 I52 F53 | A46-P49 WeakPolarHBondContact O-CD 3.34Å; L47-P49 VanDerWaalsContact C-N 3.31Å; P49-I52 WeakPolarHBondContact O-CB 3.3Å; P49-I52 PolarHBondContact O-N 3Å; P49-F53 HydrophobicContact CB-CD2 4.08Å; P49-F53 HydrophobicContact CB-CE2 3.83Å; P49-F53 WeakPolarHBondContact O-CD2 3.23Å; P49-F53 PolarHBondContact O-N 3.43Å |
| 50 | V | 94 | Very high | 95.2 | Very high | 95 Ų | 95 | 102.2 Ų | 102.2 | 58% | 0.576 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.4 | -56.5 | -177 | -179.3 | 0 | 0 | 0 | 0 | 112.6 | L47 I48 I52 F53 Y54 | L47-V50 WeakPolarHBondContact O-CB 3.25Å; L47-V50 WeakPolarHBondContact O-CG2 3.34Å; L47-V50 PolarHBondContact O-N 2.93Å; I48-V50 PolarHBondContact O-N 2.71Å; V50-I52 PolarHBondContact O-N 3.34Å; V50-F53 PolarHBondContact O-N 3.33Å; V50-Y54 WeakPolarHBondContact O-CB 3.37Å; V50-Y54 PolarHBondContact O-N 2.94Å |
| 51 | P | 95.5 | Very high | 95.2 | Very high | 73 Ų | 73 | 100.8 Ų | 100.8 | 47% | 0.474 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.1 | -28.7 | 176.7 | 24.3 | -35.1 | 0 | 0 | 0 | 113.1 | L47 I48 S55 | L47-P51 VanDerWaalsContact O-CD 3.3Å; L47-P51 WeakPolarHBondContact O-CD 3.26Å; I48-P51 WeakPolarHBondContact O-CD 3.43Å; I48-P51 VanDerWaalsContact O-CG 3.25Å; I48-P51 WeakPolarHBondContact O-CG 3.46Å; P51-S55 WeakPolarHBondContact O-CB 3.49Å; P51-S55 PolarHBondContact O-N 3.2Å; P51-S55 PolarHBondContact O-OG 3.05Å |
| 52 | I | 95.6 | Very high | 95.2 | Very high | 101 Ų | 101 | 100.1 Ų | 100.1 | 52% | 0.518 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.7 | -51.5 | 175.8 | -64.5 | 172.4 | 0 | 0 | 0 | 110.1 | I48 P49 V50 Y54 S55 L56 | I48-I52 HydrophobicContact CG2-CD1 3.8Å; I48-I52 WeakPolarHBondContact O-CG1 3.15Å; P49-I52 WeakPolarHBondContact O-CB 3.3Å; P49-I52 PolarHBondContact O-N 3Å; V50-I52 PolarHBondContact O-N 3.34Å; I52-Y54 VanDerWaalsContact C-N 3.31Å; I52-Y54 PolarHBondContact O-N 3.07Å; I52-S55 PolarHBondContact O-N 3.46Å; I52-L56 PolarHBondContact O-N 2.98Å |
| 53 | F | 96.5 | Very high | 95.1 | Very high | 139 Ų | 139 | 99 Ų | 99 | 61% | 0.61 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.2 | -37.6 | 178.2 | -74.2 | -60.3 | 0 | 0 | 0 | 112.3 | P49 V50 L56 R57 | P49-F53 HydrophobicContact CB-CD2 4.08Å; P49-F53 HydrophobicContact CB-CE2 3.83Å; P49-F53 WeakPolarHBondContact O-CD2 3.23Å; P49-F53 PolarHBondContact O-N 3.43Å; V50-F53 PolarHBondContact O-N 3.33Å; F53-L56 PolarHBondContact O-N 3.28Å; F53-R57 WeakPolarHBondContact O-CB 3.47Å; F53-R57 PolarHBondContact O-N 3.3Å |
| 54 | Y | 96.6 | Very high | 95.1 | Very high | 136 Ų | 136 | 99.7 Ų | 99.7 | 53% | 0.533 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.7 | -46.4 | 173.4 | -178.9 | -91.4 | 0 | 0 | 0 | 111.6 | V50 I52 L56 R57 E58 | V50-Y54 WeakPolarHBondContact O-CB 3.37Å; V50-Y54 PolarHBondContact O-N 2.94Å; I52-Y54 VanDerWaalsContact C-N 3.31Å; I52-Y54 PolarHBondContact O-N 3.07Å; Y54-L56 PolarHBondContact O-N 3.17Å; Y54-R57 WeakPolarHBondContact O-CB 3.03Å; Y54-R57 PolarHBondContact O-N 2.95Å; Y54-E58 PolarHBondContact O-N 3.47Å |
| 55 | S | 96.7 | Very high | 95 | Very high | 68 Ų | 68 | 97.8 Ų | 97.8 | 48% | 0.476 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.6 | -39.6 | 179.4 | -55.6 | 0 | 0 | 0 | 0 | 111.9 | P51 I52 E58 Y59 | P51-S55 WeakPolarHBondContact O-CB 3.49Å; P51-S55 PolarHBondContact O-N 3.2Å; P51-S55 PolarHBondContact O-OG 3.05Å; I52-S55 PolarHBondContact O-N 3.46Å; S55-E58 PolarHBondContact O-N 3.4Å; S55-Y59 WeakPolarHBondContact O-CB 3.44Å; S55-Y59 PolarHBondContact O-N 2.69Å |
| 56 | L | 97 | Very high | 94.9 | Very high | 111 Ų | 111 | 96.9 Ų | 96.9 | 58% | 0.581 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.7 | -43.2 | 175.3 | -175.9 | 66.8 | 0 | 0 | 0 | 111.6 | I52 F53 Y54 Y59 G60 | I52-L56 PolarHBondContact O-N 2.98Å; F53-L56 PolarHBondContact O-N 3.28Å; Y54-L56 PolarHBondContact O-N 3.17Å; L56-Y59 PolarHBondContact O-N 3.18Å; L56-G60 PolarHBondContact O-N 3.42Å |
| 57 | R | 95.8 | Very high | 94.7 | Very high | 160 Ų | 160 | 103.6 Ų | 103.6 | 60% | 0.604 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59 | -49.5 | 173.7 | 178.3 | -165.2 | 174.4 | -105.7 | -1.9 | 110.7 | F53 Y54 Y59 G60 M61 | F53-R57 WeakPolarHBondContact O-CB 3.47Å; F53-R57 PolarHBondContact O-N 3.3Å; Y54-R57 WeakPolarHBondContact O-CB 3.03Å; Y54-R57 PolarHBondContact O-N 2.95Å; R57-Y59 VanDerWaalsContact C-N 3.3Å; R57-Y59 PolarHBondContact O-N 2.96Å; R57-G60 PolarHBondContact O-N 3.4Å; R57-M61 WeakPolarHBondContact O-CG 3.49Å; R57-M61 PolarHBondContact O-N 3.28Å |
| 58 | E | 96.8 | Very high | 94.5 | Very high | 73 Ų | 73 | 105.1 Ų | 105.1 | 34% | 0.341 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -40.4 | -179.2 | -165.1 | -173.3 | 148.8 | 0 | 0 | 111.8 | Y54 S55 M61 K62 | Y54-E58 PolarHBondContact O-N 3.47Å; S55-E58 PolarHBondContact O-N 3.4Å; E58-M61 PolarHBondContact O-N 2.9Å; E58-K62 HydrophobicContact CG-CD 4.41Å; E58-K62 WeakPolarHBondContact O-CB 3.39Å; E58-K62 WeakPolarHBondContact O-CG 3.47Å; E58-K62 PolarHBondContact O-N 3.21Å; E58-K62 WeakPolarHBondContact OE1-CE 3.44Å; E58-K62 IonicContact OE1-NZ 3.3Å; E58-K62 PolarHBondContact OE1-NZ 3.35Å |
| 59 | Y | 96.6 | Very high | 94.2 | Very high | 140 Ų | 140 | 109.5 Ų | 109.5 | 55% | 0.549 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.1 | -47.2 | 172.9 | 177.3 | -98.2 | 0 | 0 | 0 | 112 | S55 L56 R57 M61 K62 Q63 | S55-Y59 WeakPolarHBondContact O-CB 3.44Å; S55-Y59 PolarHBondContact O-N 2.69Å; L56-Y59 PolarHBondContact O-N 3.18Å; R57-Y59 VanDerWaalsContact C-N 3.3Å; R57-Y59 PolarHBondContact O-N 2.96Å; Y59-M61 PolarHBondContact O-N 3.32Å; Y59-K62 PolarHBondContact O-N 2.64Å; Y59-Q63 HydrophobicContact CD1-CG 4.23Å; Y59-Q63 HydrophobicContact CD2-CG 4.45Å; Y59-Q63 HydrophobicContact CE1-CG 3.8Å; Y59-Q63 HydrophobicContact CE2-CG 4.05Å; Y59-Q63 VanDerWaalsContact CE2-NE2 3.3Å; Y59-Q63 VanDerWaalsContact CZ-NE2 3.31Å; Y59-Q63 WeakPolarHBondContact O-CG 3.4Å; Y59-Q63 PolarHBondContact O-N 3Å; Y59-Q63 PolarHBondContact OH-NE2 3.4Å; Y59-Q63 VanDerWaalsContact OH-NE2 3.09Å |
| 60 | G | 96.4 | Very high | 93.6 | Very high | 37 Ų | 37 | 115 Ų | 115 | 38% | 0.381 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -57.5 | -47.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | L56 R57 K62 Q63 E64 | L56-G60 PolarHBondContact O-N 3.42Å; R57-G60 PolarHBondContact O-N 3.4Å; G60-K62 PolarHBondContact O-N 3.46Å; G60-Q63 PolarHBondContact O-N 3Å; G60-E64 PolarHBondContact O-N 3.36Å |
| 61 | M | 95.8 | Very high | 93.1 | Very high | 96 Ų | 96 | 115.4 Ų | 115.4 | 47% | 0.473 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 177.1 | -67 | -63.8 | -54.7 | 0 | 0 | 112.1 | R57 E58 Y59 Q63 E64 E65 | R57-M61 WeakPolarHBondContact O-CG 3.49Å; R57-M61 PolarHBondContact O-N 3.28Å; E58-M61 PolarHBondContact O-N 2.9Å; Y59-M61 PolarHBondContact O-N 3.32Å; M61-Q63 VanDerWaalsContact C-N 3.34Å; M61-Q63 PolarHBondContact O-N 2.92Å; M61-E64 PolarHBondContact O-N 2.96Å; M61-E65 WeakPolarHBondContact O-CB 3.47Å; M61-E65 PolarHBondContact O-N 3.24Å |
| 62 | K | 95.5 | Very high | 92.5 | Very high | 105 Ų | 105 | 116.9 Ų | 116.9 | 46% | 0.457 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.9 | -37.3 | 177.3 | -78.8 | 172.6 | 170.7 | 167.4 | 0 | 112.4 | E58 Y59 G60 K66 | E58-K62 HydrophobicContact CG-CD 4.41Å; E58-K62 WeakPolarHBondContact O-CB 3.39Å; E58-K62 WeakPolarHBondContact O-CG 3.47Å; E58-K62 PolarHBondContact O-N 3.21Å; E58-K62 WeakPolarHBondContact OE1-CE 3.44Å; E58-K62 IonicContact OE1-NZ 3.3Å; E58-K62 PolarHBondContact OE1-NZ 3.35Å; Y59-K62 PolarHBondContact O-N 2.64Å; G60-K62 PolarHBondContact O-N 3.46Å; K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 VanDerWaalsContact O-CG 3.26Å; K62-K66 WeakPolarHBondContact O-CG 3.26Å; K62-K66 PolarHBondContact O-N 3.4Å; K62-K66 VanDerWaalsContact O-N 3.07Å |
| 63 | Q | 93.4 | Very high | 91.9 | Very high | 75 Ų | 75 | 115.4 Ų | 115.4 | 35% | 0.35 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.8 | -40.2 | 176.9 | -68.8 | -64.4 | -9.8 | 0 | 0 | 111.8 | Y59 G60 M61 K66 R67 | Y59-Q63 HydrophobicContact CD1-CG 4.23Å; Y59-Q63 HydrophobicContact CD2-CG 4.45Å; Y59-Q63 HydrophobicContact CE1-CG 3.8Å; Y59-Q63 HydrophobicContact CE2-CG 4.05Å; Y59-Q63 VanDerWaalsContact CE2-NE2 3.3Å; Y59-Q63 VanDerWaalsContact CZ-NE2 3.31Å; Y59-Q63 WeakPolarHBondContact O-CG 3.4Å; Y59-Q63 PolarHBondContact O-N 3Å; Y59-Q63 PolarHBondContact OH-NE2 3.4Å; Y59-Q63 VanDerWaalsContact OH-NE2 3.09Å; G60-Q63 PolarHBondContact O-N 3Å; M61-Q63 VanDerWaalsContact C-N 3.34Å; M61-Q63 PolarHBondContact O-N 2.92Å; Q63-K66 PolarHBondContact O-N 2.96Å; Q63-R67 WeakPolarHBondContact O-CB 3.34Å; Q63-R67 PolarHBondContact O-N 3.12Å |
| 64 | E | 93.5 | Very high | 91.2 | Very high | 98 Ų | 98 | 112.1 Ų | 112.1 | 46% | 0.458 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.8 | -47.6 | 174.2 | -177.9 | 173.3 | -156.3 | 0 | 0 | 111.4 | G60 M61 K66 R67 L68 | G60-E64 PolarHBondContact O-N 3.36Å; M61-E64 PolarHBondContact O-N 2.96Å; E64-K66 VanDerWaalsContact C-N 3.34Å; E64-K66 PolarHBondContact O-N 2.95Å; E64-R67 PolarHBondContact O-N 3.36Å; E64-R67 VanDerWaalsContact O-N 3.12Å; E64-L68 HydrophobicContact CG-CD1 4.26Å; E64-L68 WeakPolarHBondContact O-CG 3.47Å; E64-L68 PolarHBondContact O-N 3.46Å |
| 65 | E | 93.5 | Very high | 90.4 | Very high | 100 Ų | 100 | 110.8 Ų | 110.8 | 47% | 0.467 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.2 | -42.5 | 177 | -168.4 | -174.1 | 174.9 | 0 | 0 | 111.9 | M61 R67 L68 R69 | M61-E65 WeakPolarHBondContact O-CB 3.47Å; M61-E65 PolarHBondContact O-N 3.24Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 3.45Å; E65-L68 PolarHBondContact O-N 3.07Å; E65-R69 WeakPolarHBondContact O-CG 3.33Å; E65-R69 PolarHBondContact O-N 2.98Å; E65-R69 IonicContact OE1-CZ 2.69Å; E65-R69 IonicContact OE1-NE 3.62Å; E65-R69 IonicContact OE1-NH2 2.64Å; E65-R69 PolarHBondContact OE1-NH2 3.32Å |
| 66 | K | 91.4 | Very high | 89.5 | Confident | 135 Ų | 135 | 111 Ų | 111 | 59% | 0.587 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.5 | -39.4 | 174.5 | -77.2 | 175.7 | -177.6 | -177 | 0 | 112.4 | K62 Q63 E64 R69 | K62-K66 WeakPolarHBondContact O-CB 3.46Å; K62-K66 VanDerWaalsContact O-CG 3.26Å; K62-K66 WeakPolarHBondContact O-CG 3.26Å; K62-K66 PolarHBondContact O-N 3.4Å; K62-K66 VanDerWaalsContact O-N 3.07Å; Q63-K66 PolarHBondContact O-N 2.96Å; E64-K66 VanDerWaalsContact C-N 3.34Å; E64-K66 PolarHBondContact O-N 2.95Å; K66-R69 PolarHBondContact O-N 3.45Å |
| 67 | R | 88 | Confident | 88.6 | Confident | 202 Ų | 202 | 113 Ų | 113 | 76% | 0.762 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.2 | -33.4 | 179.3 | -166.3 | -175.4 | 78.2 | -179.7 | 2.1 | 112.5 | Q63 E64 E65 R69 | Q63-R67 WeakPolarHBondContact O-CB 3.34Å; Q63-R67 PolarHBondContact O-N 3.12Å; E64-R67 PolarHBondContact O-N 3.36Å; E64-R67 VanDerWaalsContact O-N 3.12Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 3.45Å; R67-R69 VanDerWaalsContact C-N 3.3Å |
| 68 | L | 89.3 | Confident | 87.4 | Confident | 129 Ų | 129 | 111.5 Ų | 111.5 | 68% | 0.675 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -72.9 | -22.8 | 177.8 | -69.9 | 171.9 | 0 | 0 | 0 | 112.8 | E64 E65 | E64-L68 HydrophobicContact CG-CD1 4.26Å; E64-L68 WeakPolarHBondContact O-CG 3.47Å; E64-L68 PolarHBondContact O-N 3.46Å; E65-L68 PolarHBondContact O-N 3.07Å |
| 69 | R | 87.2 | Confident | 85.7 | Confident | 166 Ų | 166 | 117.8 Ų | 117.8 | 63% | 0.626 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -76.4 | 131.5 | 175.8 | -68.3 | 178.1 | -173.3 | -169.7 | 3.9 | 110.2 | E65 K66 R67 N71 | E65-R69 WeakPolarHBondContact O-CG 3.33Å; E65-R69 PolarHBondContact O-N 2.98Å; E65-R69 IonicContact OE1-CZ 2.69Å; E65-R69 IonicContact OE1-NE 3.62Å; E65-R69 IonicContact OE1-NH2 2.64Å; E65-R69 PolarHBondContact OE1-NH2 3.32Å; K66-R69 PolarHBondContact O-N 3.45Å; R67-R69 VanDerWaalsContact C-N 3.3Å; R69-N71 PolarHBondContact O-N 3.09Å |
| 70 | K | 81.5 | Confident | 85.2 | Confident | 176 Ų | 176 | 116.7 Ų | 116.7 | 77% | 0.765 | 61% | 0.61 | S | S | * | * | trans | -60.5 | 133.5 | 174.4 | -68.2 | -174.5 | -179.6 | -175.6 | 0 | 110 | P72 F75 | K70-P72 WeakPolarHBondContact O-CD 3.42Å; K70-F75 HydrophobicContact CB-CE2 4.19Å; K70-F75 HydrophobicContact CD-CE2 4.36Å; K70-F75 HydrophobicContact CD-CZ 4.28Å | ||
| 71 | N | 83.6 | Confident | 84.6 | Confident | 103 Ų | 103 | 120.8 Ų | 120.8 | 55% | 0.551 | 62% | 0.622 | S | S | * | * | trans | -84.9 | 113.8 | 171.7 | -177.7 | 2.7 | 0 | 0 | 0 | 109.2 | R69 A73 A74 F75 | R69-N71 PolarHBondContact O-N 3.09Å; N71-A73 PolarHBondContact O-N 3.4Å; N71-A73 WeakPolarHBondContact OD1-CB 3.48Å; N71-A73 PolarHBondContact OD1-N 3.13Å; N71-A73 VanDerWaalsContact OD1-N 3.1Å; N71-A74 WeakPolarHBondContact O-CB 3.32Å; N71-A74 PolarHBondContact O-N 3.03Å; N71-F75 WeakPolarHBondContact O-CD2 3.37Å | ||
| 72 | P | 81.2 | Confident | 84 | Confident | 105 Ų | 105 | 122.2 Ų | 122.2 | 68% | 0.682 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -60.2 | -27.2 | 179.4 | 24.6 | -33.6 | 0 | 0 | 0 | 112.8 | K70 A74 F75 | K70-P72 WeakPolarHBondContact O-CD 3.42Å; P72-A74 PolarHBondContact O-N 3.23Å; P72-F75 PolarHBondContact O-N 3.18Å; P72-F75 VanDerWaalsContact O-N 3.13Å |
| 73 | A | 83.9 | Confident | 83.3 | Confident | 69 Ų | 69 | 123.2 Ų | 123.2 | 57% | 0.57 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -65.2 | -21.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | N71 F75 | N71-A73 PolarHBondContact O-N 3.4Å; N71-A73 WeakPolarHBondContact OD1-CB 3.48Å; N71-A73 PolarHBondContact OD1-N 3.13Å; N71-A73 VanDerWaalsContact OD1-N 3.1Å; A73-F75 PolarHBondContact O-N 3.1Å |
| 74 | A | 80.9 | Confident | 82.7 | Confident | 70 Ų | 70 | 126.3 Ų | 126.3 | 58% | 0.579 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -71.3 | -18.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | N71 P72 | N71-A74 WeakPolarHBondContact O-CB 3.32Å; N71-A74 PolarHBondContact O-N 3.03Å; P72-A74 PolarHBondContact O-N 3.23Å |
| 75 | F | 80.6 | Confident | 82 | Confident | 108 Ų | 108 | 128.1 Ų | 128.1 | 47% | 0.474 | 67% | 0.672 | S | S | . | * | G | 310 helix | trans | -107.8 | 3.8 | -178.7 | -51.9 | -77.9 | 0 | 0 | 0 | 112.6 | K70 N71 P72 A73 N77 D78 | K70-F75 HydrophobicContact CB-CE2 4.19Å; K70-F75 HydrophobicContact CD-CE2 4.36Å; K70-F75 HydrophobicContact CD-CZ 4.28Å; N71-F75 WeakPolarHBondContact O-CD2 3.37Å; P72-F75 PolarHBondContact O-N 3.18Å; P72-F75 VanDerWaalsContact O-N 3.13Å; A73-F75 PolarHBondContact O-N 3.1Å; F75-N77 PolarHBondContact O-N 3.06Å; F75-D78 PolarHBondContact O-N 3.37Å |
| 76 | A | 77.7 | Confident | 81.1 | Confident | 73 Ų | 73 | 130.1 Ų | 130.1 | 60% | 0.603 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -25.2 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 77 | N | 78.5 | Confident | 80.4 | Confident | 154 Ų | 154 | 129.8 Ų | 129.8 | 82% | 0.824 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.1 | 15.2 | -179.3 | -61.8 | -25.2 | 0 | 0 | 0 | 112.5 | F75 V79 | F75-N77 PolarHBondContact O-N 3.06Å; N77-V79 PolarHBondContact O-N 3.3Å |
| 78 | D | 70.6 | Confident | 79.7 | Confident | 128 Ų | 128 | 123.8 Ų | 123.8 | 68% | 0.684 | 69% | 0.689 | S | S | * | * | trans | -80.2 | 76.4 | 170.8 | -106.3 | -9.8 | 0 | 0 | 0 | 108.3 | F75 | F75-D78 PolarHBondContact O-N 3.37Š| ||
| 79 | V | 61.6 | Low | 78.8 | Confident | 204 Ų | 204 | 123.3 Ų | 123.3 | 100% | 1.236 | 69% | 0.69 | S | S | * | * | trans | -139.4 | 0 | 170.2 | -179.8 | 0 | 0 | 0 | 0 | 109.2 | N77 | N77-V79 PolarHBondContact O-N 3.3Š|
Retrieved 79 of 79 residues in 107.4 ms
(Link to these results)