| 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 | 38.5 | Very low | 50.8 | Low | 230 Ų | 230 | 151 Ų | 151 | 100% | 1.133 | 77% | 0.774 | S | S | * | * | 0 | 116.8 | 0 | -110.9 | -163.1 | 162.2 | 0 | 0 | 105.9 | |||||
| 2 | I | 47.6 | Very low | 52.2 | Low | 103 Ų | 103 | 141.3 Ų | 141.3 | 53% | 0.528 | 73% | 0.73 | S | S | . | * | cis | -160.3 | 160.8 | 17 | -57.2 | 119.2 | 0 | 0 | 0 | 105.3 | ||||
| 3 | Y | 54 | Low | 53.5 | Low | 199 Ų | 199 | 137.2 Ų | 137.2 | 78% | 0.78 | 71% | 0.709 | S | S | * | * | trans | 75.9 | 118.4 | 168.1 | -35.1 | -74.5 | 0 | 0 | 0 | 114.3 | ||||
| 4 | T | 55.7 | Low | 54.8 | Low | 134 Ų | 134 | 137.1 Ų | 137.1 | 82% | 0.822 | 71% | 0.709 | S | S | * | * | cis | -160.2 | 101.7 | 27.5 | 11.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 5 | V | 53 | Low | 56.2 | Low | 140 Ų | 140 | 133.4 Ų | 133.4 | 85% | 0.848 | 70% | 0.695 | S | S | * | * | trans | -61.7 | 138.1 | 150.9 | 169.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 6 | S | 43.6 | Very low | 57.8 | Low | 102 Ų | 102 | 126.4 Ų | 126.4 | 71% | 0.713 | 66% | 0.658 | S | S | * | * | trans | 107.3 | 76.8 | 166.4 | -43.5 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 7 | K | 50.5 | Low | 59.2 | Low | 203 Ų | 203 | 126.9 Ų | 126.9 | 88% | 0.883 | 65% | 0.653 | S | S | * | * | trans | -147.7 | 20.8 | 152.7 | -103.2 | -161.4 | -173.3 | 178.7 | 0 | 114.6 | ||||
| 8 | T | 53.5 | Low | 60.5 | Low | 126 Ų | 126 | 123.9 Ų | 123.9 | 77% | 0.773 | 64% | 0.644 | S | S | * | * | trans | -129.2 | 35.7 | -150 | 0.4 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 9 | A | 56.3 | Low | 61.7 | Low | 67 Ų | 67 | 125.5 Ų | 125.5 | 55% | 0.554 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -138.2 | -20 | 176 | 0 | 0 | 0 | 0 | 0 | 117.2 | W73 | A9-W73 HydrophobicContact CB-CH2 4.45Š|
| 10 | K | 51.8 | Low | 62.9 | Low | 176 Ų | 176 | 120 Ų | 120 | 77% | 0.765 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -25.7 | -175.6 | -78.8 | -171.4 | 174.9 | -176.8 | 0 | 114.5 | ||
| 11 | Y | 53.9 | Low | 64 | Low | 181 Ų | 181 | 117.2 Ų | 117.2 | 71% | 0.71 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.8 | -10.1 | -175.1 | -60.4 | -74.5 | 0 | 0 | 0 | 114 | T15 | Y11-T15 WeakPolarHBondContact O-CB 3.47Å; Y11-T15 PolarHBondContact O-N 3.44Å; Y11-T15 VanDerWaalsContact O-N 3.11Å; Y11-T15 PolarHBondContact O-OG1 2.97Å |
| 12 | S | 67.9 | Low | 66.2 | Low | 35 Ų | 35 | 113 Ų | 113 | 25% | 0.245 | 57% | 0.573 | C | S | . | * | H | α-helix | trans | -67.2 | -58.3 | -178.2 | -176.9 | 0 | 0 | 0 | 0 | 111.1 | L14 T15 F16 | S12-L14 PolarHBondContact O-N 3.13Å; S12-T15 PolarHBondContact O-N 3.09Å; S12-F16 WeakPolarHBondContact O-CB 3.49Å; S12-F16 PolarHBondContact O-N 3.3Å |
| 13 | L | 69.2 | Low | 68 | Low | 88 Ų | 88 | 111.7 Ų | 111.7 | 46% | 0.461 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -67.9 | -37.9 | -178.3 | -64.6 | 174.1 | 0 | 0 | 0 | 114.4 | F16 F17 I69 W73 | L13-F16 WeakPolarHBondContact O-CB 2.96Å; L13-F16 PolarHBondContact O-N 3.27Å; L13-F17 PolarHBondContact O-N 3.35Å; L13-I69 HydrophobicContact CD2-CD1 4.34Å; L13-I69 HydrophobicContact CD2-CG1 4.36Å; L13-I69 HydrophobicContact CD2-CG2 3.99Å; L13-W73 HydrophobicContact CD1-CZ2 4.44Å; L13-W73 HydrophobicContact CD2-CZ2 4.19Å; L13-W73 HydrophobicContact CG-CZ2 4Å |
| 14 | L | 71.2 | Confident | 69.5 | Low | 135 Ų | 135 | 102.4 Ų | 102.4 | 71% | 0.707 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.6 | -30.9 | 179.2 | -85.4 | 164.7 | 0 | 0 | 0 | 112.7 | S12 P18 | S12-L14 PolarHBondContact O-N 3.13Å; L14-P18 WeakPolarHBondContact O-CD 3.46Å |
| 15 | T | 76.7 | Confident | 70.8 | Confident | 82 Ų | 82 | 99.8 Ų | 99.8 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -85.1 | -28.1 | 173.9 | -48.4 | 0 | 0 | 0 | 0 | 111.4 | Y11 S12 P18 R19 | Y11-T15 WeakPolarHBondContact O-CB 3.47Å; Y11-T15 PolarHBondContact O-N 3.44Å; Y11-T15 VanDerWaalsContact O-N 3.11Å; Y11-T15 PolarHBondContact O-OG1 2.97Å; S12-T15 PolarHBondContact O-N 3.09Å; T15-P18 VanDerWaalsContact O-CD 3.28Å; T15-P18 WeakPolarHBondContact O-CD 3.45Å; T15-P18 WeakPolarHBondContact O-CG 3.34Å; T15-R19 WeakPolarHBondContact O-CB 3.46Å; T15-R19 PolarHBondContact O-N 3.33Å |
| 16 | F | 81.5 | Confident | 72.5 | Confident | 22 Ų | 22 | 101.9 Ų | 101.9 | 10% | 0.096 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -58.1 | -49.3 | 174.3 | 174.6 | -91.2 | 0 | 0 | 0 | 110.8 | S12 L13 R19 F20 A65 E68 I69 | S12-F16 WeakPolarHBondContact O-CB 3.49Å; S12-F16 PolarHBondContact O-N 3.3Å; L13-F16 WeakPolarHBondContact O-CB 2.96Å; L13-F16 PolarHBondContact O-N 3.27Å; F16-R19 PolarHBondContact O-N 3.11Å; F16-R19 VanDerWaalsContact O-N 3.16Å; F16-F20 HydrophobicContact CD1-CB 4.11Å; F16-F20 HydrophobicContact CE1-CB 3.65Å; F16-F20 HydrophobicContact CE1-CD1 4.45Å; F16-F20 HydrophobicContact CE1-CD2 4.1Å; F16-F20 AromaticContact CE1-CG 3.81Å; F16-F20 HydrophobicContact CE1-CG 3.81Å; F16-F20 HydrophobicContact CE2-CB 4.25Å; F16-F20 HydrophobicContact CE2-CD2 4.5Å; F16-F20 HydrophobicContact CZ-CB 3.72Å; F16-F20 AromaticContact CZ-CD2 3.65Å; F16-F20 HydrophobicContact CZ-CD2 3.65Å; F16-F20 AromaticContact CZ-CG 3.81Å; F16-F20 HydrophobicContact CZ-CG 3.81Å; F16-F20 WeakPolarHBondContact O-CB 3.42Å; F16-F20 PolarHBondContact O-N 3.43Å; F16-A65 HydrophobicContact CE1-CB 4.47Å; F16-A65 WeakPolarHBondContact CZ-O 3.46Å; F16-E68 HydrophobicContact CE2-CB 3.71Å; F16-E68 HydrophobicContact CZ-CB 3.73Å; F16-I69 HydrophobicContact CD1-CD1 4.08Å; F16-I69 HydrophobicContact CD1-CG1 3.67Å; F16-I69 HydrophobicContact CD2-CG1 4.18Å; F16-I69 HydrophobicContact CE1-CD1 3.74Å; F16-I69 HydrophobicContact CE1-CG1 3.32Å; F16-I69 HydrophobicContact CE2-CG1 3.87Å; F16-I69 HydrophobicContact CG-CG1 4.1Å; F16-I69 HydrophobicContact CZ-CB 4.46Å; F16-I69 HydrophobicContact CZ-CD1 4.29Å; F16-I69 HydrophobicContact CZ-CG1 3.45Å; F16-I69 VanDerWaalsContact CZ-CG1 3.45Å |
| 17 | F | 82.2 | Confident | 74.5 | Confident | 134 Ų | 134 | 104.1 Ų | 104.1 | 59% | 0.588 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -55.3 | -53.3 | -175.6 | -171.8 | -100.3 | 0 | 0 | 0 | 114.5 | L13 R19 L21 | L13-F17 PolarHBondContact O-N 3.35Å; F17-R19 VanDerWaalsContact C-N 3.33Å; F17-R19 PolarHBondContact O-N 3.23Å; F17-L21 HydrophobicContact CE1-CD2 4.26Å; F17-L21 WeakPolarHBondContact O-CB 3.15Å; F17-L21 PolarHBondContact O-N 2.84Å |
| 18 | P | 82.7 | Confident | 76.2 | Confident | 74 Ų | 74 | 104.6 Ų | 104.6 | 48% | 0.481 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.8 | -34.5 | 177.8 | 24.5 | -33.3 | 0 | 0 | 0 | 112.7 | L14 T15 F22 | L14-P18 WeakPolarHBondContact O-CD 3.46Å; T15-P18 VanDerWaalsContact O-CD 3.28Å; T15-P18 WeakPolarHBondContact O-CD 3.45Å; T15-P18 WeakPolarHBondContact O-CG 3.34Å; P18-F22 WeakPolarHBondContact O-CB 3.22Å; P18-F22 PolarHBondContact O-N 2.65Å |
| 19 | R | 83.3 | Confident | 77.7 | Confident | 153 Ų | 153 | 101.2 Ų | 101.2 | 58% | 0.577 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -69.7 | -49.7 | 178.8 | -172.5 | -179.6 | 178.7 | -169.4 | 2.3 | 111.9 | T15 F16 F17 L21 F22 E23 | T15-R19 WeakPolarHBondContact O-CB 3.46Å; T15-R19 PolarHBondContact O-N 3.33Å; F16-R19 PolarHBondContact O-N 3.11Å; F16-R19 VanDerWaalsContact O-N 3.16Å; F17-R19 VanDerWaalsContact C-N 3.33Å; F17-R19 PolarHBondContact O-N 3.23Å; R19-L21 VanDerWaalsContact C-N 3.31Å; R19-L21 PolarHBondContact O-N 3.3Å; R19-F22 WeakPolarHBondContact O-CB 3.38Å; R19-F22 PolarHBondContact O-N 3.19Å; R19-E23 IonicContact NE-OE1 3.44Å; R19-E23 PolarHBondContact O-N 2.75Å |
| 20 | F | 85.5 | Confident | 79.1 | Confident | 15 Ų | 15 | 99 Ų | 99 | 7% | 0.066 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -52.6 | -52 | 172.7 | 171.8 | -101.3 | 0 | 0 | 0 | 110.3 | F16 F22 E23 Q24 L61 A65 E68 | F16-F20 HydrophobicContact CD1-CB 4.11Å; F16-F20 HydrophobicContact CE1-CB 3.65Å; F16-F20 HydrophobicContact CE1-CD1 4.45Å; F16-F20 HydrophobicContact CE1-CD2 4.1Å; F16-F20 AromaticContact CE1-CG 3.81Å; F16-F20 HydrophobicContact CE1-CG 3.81Å; F16-F20 HydrophobicContact CE2-CB 4.25Å; F16-F20 HydrophobicContact CE2-CD2 4.5Å; F16-F20 HydrophobicContact CZ-CB 3.72Å; F16-F20 AromaticContact CZ-CD2 3.65Å; F16-F20 HydrophobicContact CZ-CD2 3.65Å; F16-F20 AromaticContact CZ-CG 3.81Å; F16-F20 HydrophobicContact CZ-CG 3.81Å; F16-F20 WeakPolarHBondContact O-CB 3.42Å; F16-F20 PolarHBondContact O-N 3.43Å; F20-F22 VanDerWaalsContact C-N 3.31Å; F20-F22 PolarHBondContact O-N 3.47Å; F20-E23 PolarHBondContact O-N 3.22Å; F20-E23 VanDerWaalsContact O-N 3.13Å; F20-Q24 HydrophobicContact CD1-CG 4.12Å; F20-Q24 HydrophobicContact CD2-CG 4.12Å; F20-Q24 HydrophobicContact CE1-CG 3.63Å; F20-Q24 HydrophobicContact CE2-CG 3.62Å; F20-Q24 VanDerWaalsContact CE2-NE2 3.26Å; F20-Q24 HydrophobicContact CG-CG 4.34Å; F20-Q24 HydrophobicContact CZ-CG 3.34Å; F20-Q24 WeakPolarHBondContact O-CG 3.28Å; F20-Q24 PolarHBondContact O-N 3.34Å; F20-L61 WeakPolarHBondContact CZ-O 3.11Å; F20-A65 HydrophobicContact CD1-CB 4.21Å; F20-A65 HydrophobicContact CD2-CB 4.34Å; F20-A65 HydrophobicContact CE1-CB 3.63Å; F20-A65 HydrophobicContact CE2-CB 3.8Å; F20-A65 VanDerWaalsContact CZ-CA 3.48Å; F20-A65 HydrophobicContact CZ-CB 3.41Å; F20-A65 VanDerWaalsContact CZ-CB 3.41Å; F20-E68 HydrophobicContact CD2-CB 4.45Å; F20-E68 WeakPolarHBondContact CD2-OE2 3.42Å; F20-E68 WeakPolarHBondContact CE2-OE1 3.48Å |
| 21 | L | 84.5 | Confident | 80.7 | Confident | 62 Ų | 62 | 92.8 Ų | 92.8 | 33% | 0.325 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.7 | -39.5 | -177.7 | -168 | 66.6 | 0 | 0 | 0 | 111.6 | F17 R19 Q24 F25 | F17-L21 HydrophobicContact CE1-CD2 4.26Å; F17-L21 WeakPolarHBondContact O-CB 3.15Å; F17-L21 PolarHBondContact O-N 2.84Å; R19-L21 VanDerWaalsContact C-N 3.31Å; R19-L21 PolarHBondContact O-N 3.3Å; L21-Q24 PolarHBondContact O-N 3.38Å; L21-F25 HydrophobicContact CD1-CD2 4.2Å; L21-F25 HydrophobicContact CD1-CE2 3.58Å; L21-F25 HydrophobicContact CD1-CZ 3.95Å; L21-F25 HydrophobicContact CD2-CE2 3.8Å; L21-F25 HydrophobicContact CG-CD2 3.78Å; L21-F25 HydrophobicContact CG-CE2 3.35Å; L21-F25 HydrophobicContact CG-CZ 4.21Å; L21-F25 WeakPolarHBondContact O-CB 3.47Å; L21-F25 WeakPolarHBondContact O-CD2 3.41Å; L21-F25 WeakPolarHBondContact O-CG 3.46Å; L21-F25 PolarHBondContact O-N 3.11Å |
| 22 | F | 85.8 | Confident | 82.3 | Confident | 141 Ų | 141 | 90.1 Ų | 90.1 | 62% | 0.618 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -61.4 | -44.1 | 173.5 | -175.4 | -99.4 | 0 | 0 | 0 | 112.3 | P18 R19 F20 F25 R26 | P18-F22 WeakPolarHBondContact O-CB 3.22Å; P18-F22 PolarHBondContact O-N 2.65Å; R19-F22 WeakPolarHBondContact O-CB 3.38Å; R19-F22 PolarHBondContact O-N 3.19Å; F20-F22 VanDerWaalsContact C-N 3.31Å; F20-F22 PolarHBondContact O-N 3.47Å; F22-F25 PolarHBondContact O-N 3.13Å; F22-R26 WeakPolarHBondContact O-CG 3.22Å; F22-R26 PolarHBondContact O-N 2.97Å |
| 23 | E | 85.6 | Confident | 82.9 | Confident | 76 Ų | 76 | 92.2 Ų | 92.2 | 36% | 0.355 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -67.2 | -39.9 | 177.2 | -71 | -175.4 | -160.9 | 0 | 0 | 112.5 | R19 F20 F25 R26 | R19-E23 IonicContact NE-OE1 3.44Å; R19-E23 PolarHBondContact O-N 2.75Å; F20-E23 PolarHBondContact O-N 3.22Å; F20-E23 VanDerWaalsContact O-N 3.13Å; E23-F25 VanDerWaalsContact C-N 3.34Å; E23-F25 PolarHBondContact O-N 3.43Å; E23-R26 WeakPolarHBondContact O-CB 3.46Å; E23-R26 PolarHBondContact O-N 2.81Å |
| 24 | Q | 84.5 | Confident | 83.6 | Confident | 5 Ų | 5 | 91.4 Ų | 91.4 | 2% | 0.023 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 174 | -66.3 | -52.1 | -42.9 | 0 | 0 | 111.3 | F20 L21 R26 R27 N30 L61 E68 | F20-Q24 HydrophobicContact CD1-CG 4.12Å; F20-Q24 HydrophobicContact CD2-CG 4.12Å; F20-Q24 HydrophobicContact CE1-CG 3.63Å; F20-Q24 HydrophobicContact CE2-CG 3.62Å; F20-Q24 VanDerWaalsContact CE2-NE2 3.26Å; F20-Q24 HydrophobicContact CG-CG 4.34Å; F20-Q24 HydrophobicContact CZ-CG 3.34Å; F20-Q24 WeakPolarHBondContact O-CG 3.28Å; F20-Q24 PolarHBondContact O-N 3.34Å; L21-Q24 PolarHBondContact O-N 3.38Å; Q24-R26 PolarHBondContact O-N 3.31Å; Q24-R27 WeakPolarHBondContact O-CB 3.49Å; Q24-R27 PolarHBondContact O-N 2.98Å; Q24-R27 VanDerWaalsContact O-N 3.11Å; Q24-N30 VanDerWaalsContact O-CB 3.26Å; Q24-N30 WeakPolarHBondContact O-CB 3.08Å; Q24-N30 PolarHBondContact O-ND2 3.45Å; Q24-N30 PolarHBondContact OE1-ND2 2.98Å; Q24-L61 HydrophobicContact CB-CD2 4.28Å; Q24-L61 HydrophobicContact CG-CD2 4.1Å; Q24-E68 PolarHBondContact NE2-OE1 2.8Å |
| 25 | F | 84.3 | Confident | 84.3 | Confident | 79 Ų | 79 | 90.9 Ų | 90.9 | 35% | 0.346 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -70.5 | -12.7 | 176.4 | -74.8 | -49.5 | 0 | 0 | 0 | 114.7 | L21 F22 E23 R27 V31 L34 | L21-F25 HydrophobicContact CD1-CD2 4.2Å; L21-F25 HydrophobicContact CD1-CE2 3.58Å; L21-F25 HydrophobicContact CD1-CZ 3.95Å; L21-F25 HydrophobicContact CD2-CE2 3.8Å; L21-F25 HydrophobicContact CG-CD2 3.78Å; L21-F25 HydrophobicContact CG-CE2 3.35Å; L21-F25 HydrophobicContact CG-CZ 4.21Å; L21-F25 WeakPolarHBondContact O-CB 3.47Å; L21-F25 WeakPolarHBondContact O-CD2 3.41Å; L21-F25 WeakPolarHBondContact O-CG 3.46Å; L21-F25 PolarHBondContact O-N 3.11Å; F22-F25 PolarHBondContact O-N 3.13Å; E23-F25 VanDerWaalsContact C-N 3.34Å; E23-F25 PolarHBondContact O-N 3.43Å; F25-R27 PolarHBondContact O-N 2.96Å; F25-V31 HydrophobicContact CD1-CG2 4.29Å; F25-V31 WeakPolarHBondContact O-CG2 3.49Å; F25-L34 HydrophobicContact CE1-CB 4.18Å; F25-L34 HydrophobicContact CE1-CD1 3.75Å; F25-L34 HydrophobicContact CE1-CD2 3.67Å; F25-L34 HydrophobicContact CE1-CG 4.04Å; F25-L34 HydrophobicContact CZ-CD1 3.84Å; F25-L34 HydrophobicContact CZ-CD2 4.1Å; F25-L34 HydrophobicContact CZ-CG 4.5Å |
| 26 | R | 87.1 | Confident | 84.5 | Confident | 184 Ų | 184 | 89.1 Ų | 89.1 | 69% | 0.694 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -17.9 | 169.3 | -69.5 | 174.7 | 64.6 | -169.1 | -0.1 | 112.8 | F22 E23 Q24 | F22-R26 WeakPolarHBondContact O-CG 3.22Å; F22-R26 PolarHBondContact O-N 2.97Å; E23-R26 WeakPolarHBondContact O-CB 3.46Å; E23-R26 PolarHBondContact O-N 2.81Å; Q24-R26 PolarHBondContact O-N 3.31Å |
| 27 | R | 86.8 | Confident | 84.4 | Confident | 149 Ų | 149 | 89.2 Ų | 89.2 | 56% | 0.562 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -84.9 | 115.3 | 176.6 | -59.1 | -177 | 178.5 | -162.7 | 1.8 | 109.2 | Q24 F25 A29 N30 V31 | Q24-R27 WeakPolarHBondContact O-CB 3.49Å; Q24-R27 PolarHBondContact O-N 2.98Å; Q24-R27 VanDerWaalsContact O-N 3.11Å; F25-R27 PolarHBondContact O-N 2.96Å; R27-A29 PolarHBondContact O-N 3.43Å; R27-N30 HydrophobicContact CB-CB 4.44Å; R27-N30 PolarHBondContact O-N 3.34Å; R27-V31 PolarHBondContact O-N 2.88Å |
| 28 | Y | 86.7 | Confident | 84.4 | Confident | 213 Ų | 213 | 87.7 Ų | 87.7 | 84% | 0.835 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -50.4 | -36.1 | 179.8 | -67.5 | -73.4 | 0 | 0 | 0 | 113.5 | V31 F32 | Y28-V31 PolarHBondContact O-N 3.21Å; Y28-F32 WeakPolarHBondContact O-CB 3.27Å; Y28-F32 PolarHBondContact O-N 3.48Å |
| 29 | A | 84.7 | Confident | 84.3 | Confident | 55 Ų | 55 | 88.7 Ų | 88.7 | 46% | 0.455 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.4 | -46.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R27 V31 F32 F33 | R27-A29 PolarHBondContact O-N 3.43Å; A29-V31 VanDerWaalsContact C-N 3.33Å; A29-V31 PolarHBondContact O-N 2.97Å; A29-F32 WeakPolarHBondContact O-CB 3.32Å; A29-F32 PolarHBondContact O-N 2.99Å; A29-F33 WeakPolarHBondContact O-CD2 3.03Å; A29-F33 PolarHBondContact O-N 3.27Å |
| 30 | N | 85.4 | Confident | 83.8 | Confident | 21 Ų | 21 | 82.6 Ų | 82.6 | 11% | 0.112 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.7 | -38.2 | -180 | -69.1 | -21.6 | 0 | 0 | 0 | 111.6 | Q24 R27 F33 L34 | Q24-N30 VanDerWaalsContact O-CB 3.26Å; Q24-N30 WeakPolarHBondContact O-CB 3.08Å; Q24-N30 PolarHBondContact O-ND2 3.45Å; Q24-N30 PolarHBondContact OE1-ND2 2.98Å; R27-N30 HydrophobicContact CB-CB 4.44Å; R27-N30 PolarHBondContact O-N 3.34Å; N30-F33 PolarHBondContact O-N 3.44Å; N30-L34 WeakPolarHBondContact O-CB 3.18Å; N30-L34 PolarHBondContact O-N 2.87Å |
| 31 | V | 86.1 | Confident | 83.2 | Confident | 44 Ų | 44 | 86.6 Ų | 86.6 | 27% | 0.267 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.5 | -47.9 | 173.7 | 177.2 | 0 | 0 | 0 | 0 | 110.4 | F25 R27 Y28 A29 F33 L34 F35 | F25-V31 HydrophobicContact CD1-CG2 4.29Å; F25-V31 WeakPolarHBondContact O-CG2 3.49Å; R27-V31 PolarHBondContact O-N 2.88Å; Y28-V31 PolarHBondContact O-N 3.21Å; A29-V31 VanDerWaalsContact C-N 3.33Å; A29-V31 PolarHBondContact O-N 2.97Å; V31-F33 VanDerWaalsContact C-N 3.33Å; V31-F33 PolarHBondContact O-N 2.97Å; V31-L34 WeakPolarHBondContact O-CB 3.44Å; V31-L34 PolarHBondContact O-N 3.36Å; V31-F35 HydrophobicContact CG1-CD2 3.71Å; V31-F35 HydrophobicContact CG1-CE2 3.55Å; V31-F35 VanDerWaalsContact O-CD2 3.23Å; V31-F35 WeakPolarHBondContact O-CD2 3.16Å; V31-F35 PolarHBondContact O-N 3.49Å |
| 32 | F | 85.8 | Confident | 82.8 | Confident | 126 Ų | 126 | 87.7 Ų | 87.7 | 55% | 0.553 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -54.9 | -49 | 175.5 | 173 | -97.6 | 0 | 0 | 0 | 111.4 | Y28 A29 L34 F35 I36 | Y28-F32 WeakPolarHBondContact O-CB 3.27Å; Y28-F32 PolarHBondContact O-N 3.48Å; A29-F32 WeakPolarHBondContact O-CB 3.32Å; A29-F32 PolarHBondContact O-N 2.99Å; F32-L34 PolarHBondContact O-N 3.06Å; F32-F35 WeakPolarHBondContact O-CB 3.44Å; F32-F35 PolarHBondContact O-N 2.92Å; F32-I36 HydrophobicContact CD1-CG1 4.29Å; F32-I36 HydrophobicContact CE1-CG1 3.9Å; F32-I36 HydrophobicContact CE2-CD1 4.31Å; F32-I36 HydrophobicContact CE2-CG1 4.21Å; F32-I36 HydrophobicContact CZ-CD1 4.06Å; F32-I36 HydrophobicContact CZ-CG1 3.86Å; F32-I36 VanDerWaalsContact O-CG1 3.32Å; F32-I36 WeakPolarHBondContact O-CG1 3.26Å; F32-I36 PolarHBondContact O-N 3.4Å |
| 33 | F | 82.2 | Confident | 82 | Confident | 79 Ų | 79 | 84.4 Ų | 84.4 | 35% | 0.346 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.1 | -33.6 | 179.4 | -73.6 | -69.7 | 0 | 0 | 0 | 113.6 | A29 N30 V31 I36 A37 L57 | A29-F33 WeakPolarHBondContact O-CD2 3.03Å; A29-F33 PolarHBondContact O-N 3.27Å; N30-F33 PolarHBondContact O-N 3.44Å; V31-F33 VanDerWaalsContact C-N 3.33Å; V31-F33 PolarHBondContact O-N 2.97Å; F33-I36 PolarHBondContact O-N 2.96Å; F33-A37 WeakPolarHBondContact O-CB 3.01Å; F33-A37 PolarHBondContact O-N 2.86Å; F33-L57 HydrophobicContact CB-CB 4.46Å; F33-L57 HydrophobicContact CB-CD1 3.35Å; F33-L57 HydrophobicContact CB-CD2 3.3Å; F33-L57 HydrophobicContact CB-CG 3.79Å; F33-L57 HydrophobicContact CD1-CD1 4.19Å; F33-L57 HydrophobicContact CD2-CD1 3.34Å; F33-L57 HydrophobicContact CE2-CD1 4.11Å; F33-L57 HydrophobicContact CG-CD1 3.41Å; F33-L57 VanDerWaalsContact CG-CD1 3.41Å; F33-L57 HydrophobicContact CG-CD2 4.21Å; F33-L57 HydrophobicContact CG-CG 4.2Å |
| 34 | L | 83.3 | Confident | 81.1 | Confident | 70 Ų | 70 | 88.8 Ų | 88.8 | 37% | 0.366 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.6 | -47.2 | 171.3 | -175.3 | 92.9 | 0 | 0 | 0 | 110.5 | F25 N30 V31 F32 I36 A37 L38 | F25-L34 HydrophobicContact CE1-CB 4.18Å; F25-L34 HydrophobicContact CE1-CD1 3.75Å; F25-L34 HydrophobicContact CE1-CD2 3.67Å; F25-L34 HydrophobicContact CE1-CG 4.04Å; F25-L34 HydrophobicContact CZ-CD1 3.84Å; F25-L34 HydrophobicContact CZ-CD2 4.1Å; F25-L34 HydrophobicContact CZ-CG 4.5Å; N30-L34 WeakPolarHBondContact O-CB 3.18Å; N30-L34 PolarHBondContact O-N 2.87Å; V31-L34 WeakPolarHBondContact O-CB 3.44Å; V31-L34 PolarHBondContact O-N 3.36Å; F32-L34 PolarHBondContact O-N 3.06Å; L34-I36 VanDerWaalsContact C-N 3.34Å; L34-I36 PolarHBondContact O-N 3.44Å; L34-A37 PolarHBondContact O-N 3.35Å; L34-L38 HydrophobicContact CD2-CD1 4.26Å; L34-L38 HydrophobicContact CG-CD1 4.32Å; L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 3.49Å |
| 35 | F | 85.3 | Confident | 80.2 | Confident | 125 Ų | 125 | 92.7 Ų | 92.7 | 55% | 0.548 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -59.5 | -44.8 | 175.9 | -86.1 | -72.5 | 0 | 0 | 0 | 111.8 | V31 F32 A37 L38 L39 | V31-F35 HydrophobicContact CG1-CD2 3.71Å; V31-F35 HydrophobicContact CG1-CE2 3.55Å; V31-F35 VanDerWaalsContact O-CD2 3.23Å; V31-F35 WeakPolarHBondContact O-CD2 3.16Å; V31-F35 PolarHBondContact O-N 3.49Å; F32-F35 WeakPolarHBondContact O-CB 3.44Å; F32-F35 PolarHBondContact O-N 2.92Å; F35-A37 VanDerWaalsContact C-N 3.35Å; F35-A37 PolarHBondContact O-N 2.95Å; F35-L38 PolarHBondContact O-N 2.95Å; F35-L39 WeakPolarHBondContact O-CG 3.33Å; F35-L39 PolarHBondContact O-N 3.35Å |
| 36 | I | 82 | Confident | 78.9 | Confident | 45 Ų | 45 | 90.4 Ų | 90.4 | 23% | 0.231 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 175.9 | -66.4 | -66.5 | 0 | 0 | 0 | 111.2 | F32 F33 L34 L38 L39 Q40 T53 | F32-I36 HydrophobicContact CD1-CG1 4.29Å; F32-I36 HydrophobicContact CE1-CG1 3.9Å; F32-I36 HydrophobicContact CE2-CD1 4.31Å; F32-I36 HydrophobicContact CE2-CG1 4.21Å; F32-I36 HydrophobicContact CZ-CD1 4.06Å; F32-I36 HydrophobicContact CZ-CG1 3.86Å; F32-I36 VanDerWaalsContact O-CG1 3.32Å; F32-I36 WeakPolarHBondContact O-CG1 3.26Å; F32-I36 PolarHBondContact O-N 3.4Å; F33-I36 PolarHBondContact O-N 2.96Å; L34-I36 VanDerWaalsContact C-N 3.34Å; L34-I36 PolarHBondContact O-N 3.44Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.16Å; I36-L39 PolarHBondContact O-N 3.21Å; I36-Q40 WeakPolarHBondContact O-CB 3.04Å; I36-Q40 VanDerWaalsContact O-CG 3.31Å; I36-Q40 WeakPolarHBondContact O-CG 3.45Å; I36-Q40 PolarHBondContact O-N 3.42Å; I36-T53 HydrophobicContact CG2-CG2 3.97Å |
| 37 | A | 78 | Confident | 77.5 | Confident | 24 Ų | 24 | 88 Ų | 88 | 20% | 0.198 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -63.4 | -38.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F33 L34 F35 Q40 Q41 | F33-A37 WeakPolarHBondContact O-CB 3.01Å; F33-A37 PolarHBondContact O-N 2.86Å; L34-A37 PolarHBondContact O-N 3.35Å; F35-A37 VanDerWaalsContact C-N 3.35Å; F35-A37 PolarHBondContact O-N 2.95Å; A37-Q40 PolarHBondContact O-N 2.84Å; A37-Q41 WeakPolarHBondContact O-CG 3.47Å; A37-Q41 PolarHBondContact O-N 2.91Å |
| 38 | L | 82.8 | Confident | 76.2 | Confident | 101 Ų | 101 | 85.3 Ų | 85.3 | 53% | 0.529 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66.6 | -44.2 | 174.2 | -71.3 | 173.7 | 0 | 0 | 0 | 111.9 | L34 F35 I36 Q40 Q41 | L34-L38 HydrophobicContact CD2-CD1 4.26Å; L34-L38 HydrophobicContact CG-CD1 4.32Å; L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 3.49Å; F35-L38 PolarHBondContact O-N 2.95Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.16Å; L38-Q40 VanDerWaalsContact C-N 3.26Å; L38-Q40 PolarHBondContact O-N 3.5Å; L38-Q41 WeakPolarHBondContact O-CB 3.4Å; L38-Q41 PolarHBondContact O-N 3.27Å; L38-Q41 VanDerWaalsContact O-N 3.1Å |
| 39 | L | 80.7 | Confident | 75 | Confident | 96 Ų | 96 | 77.8 Ų | 77.8 | 50% | 0.503 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.9 | -37.4 | 174.5 | -71.5 | 175.3 | 0 | 0 | 0 | 111.3 | F35 I36 Q41 I42 V45 | F35-L39 WeakPolarHBondContact O-CG 3.33Å; F35-L39 PolarHBondContact O-N 3.35Å; I36-L39 PolarHBondContact O-N 3.21Å; L39-Q41 PolarHBondContact O-N 3.46Å; L39-I42 HydrophobicContact CD2-CD1 4.27Å; L39-I42 WeakPolarHBondContact O-CB 3.46Å; L39-I42 PolarHBondContact O-N 2.94Å; L39-V45 WeakPolarHBondContact O-CG2 3.32Å |
| 40 | Q | 73.5 | Confident | 73.9 | Confident | 24 Ų | 24 | 79.6 Ų | 79.6 | 11% | 0.112 | 44% | 0.435 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70 | -14.4 | 176.3 | -73.8 | -179.3 | 36.2 | 0 | 0 | 114.4 | I36 A37 L38 I42 R50 T53 | I36-Q40 WeakPolarHBondContact O-CB 3.04Å; I36-Q40 VanDerWaalsContact O-CG 3.31Å; I36-Q40 WeakPolarHBondContact O-CG 3.45Å; I36-Q40 PolarHBondContact O-N 3.42Å; A37-Q40 PolarHBondContact O-N 2.84Å; L38-Q40 VanDerWaalsContact C-N 3.26Å; L38-Q40 PolarHBondContact O-N 3.5Å; Q40-I42 VanDerWaalsContact C-N 3.26Å; Q40-R50 PolarHBondContact OE1-O 3.5Å; Q40-T53 PolarHBondContact NE2-OG1 2.87Å; Q40-T53 PolarHBondContact OE1-OG1 3.4Å |
| 41 | Q | 72.8 | Confident | 72.9 | Confident | 99 Ų | 99 | 86.3 Ų | 86.3 | 46% | 0.463 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -21.6 | 171.5 | -63 | -50.7 | -66.3 | 0 | 0 | 112.5 | A37 L38 L39 P43 | A37-Q41 WeakPolarHBondContact O-CG 3.47Å; A37-Q41 PolarHBondContact O-N 2.91Å; L38-Q41 WeakPolarHBondContact O-CB 3.4Å; L38-Q41 PolarHBondContact O-N 3.27Å; L38-Q41 VanDerWaalsContact O-N 3.1Å; L39-Q41 PolarHBondContact O-N 3.46Å; Q41-P43 WeakPolarHBondContact O-CD 3.29Å |
| 42 | I | 76.2 | Confident | 72.1 | Confident | 85 Ų | 85 | 88.4 Ų | 88.4 | 44% | 0.436 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -69 | 120.9 | 177.5 | -54.7 | 173.9 | 0 | 0 | 0 | 107.6 | L39 Q40 V45 | L39-I42 HydrophobicContact CD2-CD1 4.27Å; L39-I42 WeakPolarHBondContact O-CB 3.46Å; L39-I42 PolarHBondContact O-N 2.94Å; Q40-I42 VanDerWaalsContact C-N 3.26Å; I42-V45 HydrophobicContact CB-CG2 3.78Å; I42-V45 HydrophobicContact CG2-CG1 4.14Å; I42-V45 HydrophobicContact CG2-CG2 4.25Å; I42-V45 WeakPolarHBondContact O-CG2 3.23Å |
| 43 | P | 67.2 | Low | 71.3 | Confident | 73 Ų | 73 | 84.8 Ų | 84.8 | 47% | 0.474 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | 148.6 | 171 | 21.1 | -28.2 | 0 | 0 | 0 | 110.5 | Q41 V45 | Q41-P43 WeakPolarHBondContact O-CD 3.29Å; P43-V45 VanDerWaalsContact C-N 3.33Å; P43-V45 PolarHBondContact O-N 3.4Å |
| 44 | D | 67.9 | Low | 70.9 | Confident | 167 Ų | 167 | 81.8 Ų | 81.8 | 89% | 0.893 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74 | -6.6 | 174 | -51.1 | -46.8 | 0 | 0 | 0 | 118.7 | ||
| 45 | V | 64.7 | Low | 70.8 | Confident | 87 Ų | 87 | 82 Ų | 82 | 53% | 0.527 | 46% | 0.455 | S | S | . | . | S | Bend | trans | -95.1 | -13.4 | 175.4 | -59.6 | 0 | 0 | 0 | 0 | 114.7 | L39 I42 P43 P47 | L39-V45 WeakPolarHBondContact O-CG2 3.32Å; I42-V45 HydrophobicContact CB-CG2 3.78Å; I42-V45 HydrophobicContact CG2-CG1 4.14Å; I42-V45 HydrophobicContact CG2-CG2 4.25Å; I42-V45 WeakPolarHBondContact O-CG2 3.23Å; P43-V45 VanDerWaalsContact C-N 3.33Å; P43-V45 PolarHBondContact O-N 3.4Å; V45-P47 VanDerWaalsContact O-CD 3.25Å; V45-P47 WeakPolarHBondContact O-CD 3.32Å |
| 46 | S | 56.9 | Low | 70.6 | Confident | 32 Ų | 32 | 79.3 Ų | 79.3 | 22% | 0.224 | 45% | 0.45 | C | S | . | . | trans | -100.4 | 104.6 | -179.5 | 66.2 | 0 | 0 | 0 | 0 | 111.2 | T48 | S46-T48 PolarHBondContact O-N 2.93Š| ||
| 47 | P | 58.8 | Low | 70.3 | Confident | 133 Ų | 133 | 78 Ų | 78 | 86% | 0.864 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -70.8 | -10.8 | 175.9 | 28 | -33.7 | 0 | 0 | 0 | 113.1 | V45 | V45-P47 VanDerWaalsContact O-CD 3.25Å; V45-P47 WeakPolarHBondContact O-CD 3.32Å |
| 48 | T | 58.9 | Low | 70.5 | Confident | 93 Ų | 93 | 81.7 Ų | 81.7 | 57% | 0.571 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -130.9 | 128.1 | 178.4 | 25.1 | 0 | 0 | 0 | 0 | 107.5 | S46 | S46-T48 PolarHBondContact O-N 2.93Š|
| 49 | G | 61 | Low | 70.6 | Confident | 54 Ų | 54 | 80.2 Ų | 80.2 | 56% | 0.557 | 46% | 0.456 | S | S | * | . | trans | -44.2 | 142.1 | -161.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | Y51 T52 | G49-Y51 PolarHBondContact O-N 3.41Å; G49-T52 PolarHBondContact O-N 2.95Å | ||
| 50 | R | 62.6 | Low | 70.8 | Confident | 94 Ų | 94 | 80.8 Ų | 80.8 | 36% | 0.355 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -40.7 | -21.2 | -173.8 | -63.5 | -178.3 | 164.3 | 178.5 | -6.8 | 117.7 | Q40 | Q40-R50 PolarHBondContact OE1-O 3.5Š|
| 51 | Y | 64.7 | Low | 71.4 | Confident | 161 Ų | 161 | 81.3 Ų | 81.3 | 63% | 0.631 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.5 | -16.1 | -172.2 | -59.2 | -72 | 0 | 0 | 0 | 114.1 | G49 T53 A54 V55 | G49-Y51 PolarHBondContact O-N 3.41Å; Y51-T53 VanDerWaalsContact C-N 3.25Å; Y51-T53 PolarHBondContact O-N 3.25Å; Y51-A54 PolarHBondContact O-N 3.47Å; Y51-V55 WeakPolarHBondContact O-CB 3.45Å; Y51-V55 WeakPolarHBondContact O-CG2 3.41Å; Y51-V55 PolarHBondContact O-N 3.25Å |
| 52 | T | 69 | Low | 72 | Confident | 89 Ų | 89 | 79.6 Ų | 79.6 | 55% | 0.546 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -29.7 | -169.8 | -160.9 | 0 | 0 | 0 | 0 | 113.1 | G49 P56 | G49-T52 PolarHBondContact O-N 2.95Å; T52-P56 WeakPolarHBondContact O-CD 3.5Å |
| 53 | T | 68.8 | Low | 72.6 | Confident | 50 Ų | 50 | 80.2 Ų | 80.2 | 31% | 0.307 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93 | -33.2 | 179.3 | -43.2 | 0 | 0 | 0 | 0 | 112.4 | I36 Q40 Y51 | I36-T53 HydrophobicContact CG2-CG2 3.97Å; Q40-T53 PolarHBondContact NE2-OG1 2.87Å; Q40-T53 PolarHBondContact OE1-OG1 3.4Å; Y51-T53 VanDerWaalsContact C-N 3.25Å; Y51-T53 PolarHBondContact O-N 3.25Å |
| 54 | A | 74.3 | Confident | 73.5 | Confident | 15 Ų | 15 | 78.3 Ų | 78.3 | 12% | 0.124 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -71.1 | -34.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y51 L57 L58 | Y51-A54 PolarHBondContact O-N 3.47Å; A54-L57 PolarHBondContact O-N 3.25Å; A54-L58 WeakPolarHBondContact O-CB 3.42Å; A54-L58 VanDerWaalsContact O-CG 3.28Å; A54-L58 WeakPolarHBondContact O-CG 3.33Å; A54-L58 PolarHBondContact O-N 3.32Å |
| 55 | V | 80.2 | Confident | 74.3 | Confident | 76 Ų | 76 | 71.1 Ų | 71.1 | 46% | 0.461 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.6 | -53 | -176.5 | 167.3 | 0 | 0 | 0 | 0 | 112.4 | Y51 L57 L58 C59 | Y51-V55 WeakPolarHBondContact O-CB 3.45Å; Y51-V55 WeakPolarHBondContact O-CG2 3.41Å; Y51-V55 PolarHBondContact O-N 3.25Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.9Å; V55-L58 PolarHBondContact O-N 3.4Å; V55-C59 PolarHBondContact O-N 3.4Å; V55-C59 PolarHBondContact O-SG 2.96Å |
| 56 | P | 80.8 | Confident | 75.3 | Confident | 68 Ų | 68 | 71.7 Ų | 71.7 | 44% | 0.442 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -58.4 | -41.5 | 178.1 | -25 | 33.7 | 0 | 0 | 0 | 112.9 | T52 C59 I60 | T52-P56 WeakPolarHBondContact O-CD 3.5Å; P56-C59 PolarHBondContact O-N 3.21Å; P56-I60 WeakPolarHBondContact O-CG1 3.31Å; P56-I60 PolarHBondContact O-N 2.88Å |
| 57 | L | 76.2 | Confident | 76.6 | Confident | 18 Ų | 18 | 76 Ų | 76 | 9% | 0.094 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.9 | -51.4 | 177.5 | -178.7 | 72.7 | 0 | 0 | 0 | 111.2 | F33 A54 V55 C59 I60 L61 | F33-L57 HydrophobicContact CB-CB 4.46Å; F33-L57 HydrophobicContact CB-CD1 3.35Å; F33-L57 HydrophobicContact CB-CD2 3.3Å; F33-L57 HydrophobicContact CB-CG 3.79Å; F33-L57 HydrophobicContact CD1-CD1 4.19Å; F33-L57 HydrophobicContact CD2-CD1 3.34Å; F33-L57 HydrophobicContact CE2-CD1 4.11Å; F33-L57 HydrophobicContact CG-CD1 3.41Å; F33-L57 VanDerWaalsContact CG-CD1 3.41Å; F33-L57 HydrophobicContact CG-CD2 4.21Å; F33-L57 HydrophobicContact CG-CG 4.2Å; A54-L57 PolarHBondContact O-N 3.25Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.9Å; L57-C59 VanDerWaalsContact C-N 3.28Å; L57-C59 PolarHBondContact O-N 3.2Å; L57-I60 PolarHBondContact O-N 3.4Å; L57-L61 HydrophobicContact CD1-CD1 4.27Å; L57-L61 HydrophobicContact CD1-CG 4.4Å; L57-L61 HydrophobicContact CD2-CD1 4.11Å; L57-L61 HydrophobicContact CG-CD1 3.84Å; L57-L61 HydrophobicContact CG-CG 4.31Å; L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 WeakPolarHBondContact O-CG 3.32Å; L57-L61 PolarHBondContact O-N 2.84Å |
| 58 | L | 82.1 | Confident | 77.7 | Confident | 100 Ų | 100 | 71.6 Ų | 71.6 | 52% | 0.524 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.2 | -38.5 | -179 | -74.4 | 175.1 | 0 | 0 | 0 | 111.2 | A54 V55 S62 | A54-L58 WeakPolarHBondContact O-CB 3.42Å; A54-L58 VanDerWaalsContact O-CG 3.28Å; A54-L58 WeakPolarHBondContact O-CG 3.33Å; A54-L58 PolarHBondContact O-N 3.32Å; V55-L58 PolarHBondContact O-N 3.4Å; L58-S62 VanDerWaalsContact O-CB 3.23Å; L58-S62 WeakPolarHBondContact O-CB 3.43Å; L58-S62 PolarHBondContact O-N 3.48Å; L58-S62 PolarHBondContact O-OG 3.02Å |
| 59 | C | 86.6 | Confident | 78.7 | Confident | 71 Ų | 71 | 69.4 Ų | 69.4 | 48% | 0.48 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.4 | -50 | 173.2 | -72.2 | 0 | 0 | 0 | 0 | 111.7 | V55 P56 L57 L61 S62 V63 | V55-C59 PolarHBondContact O-N 3.4Å; V55-C59 PolarHBondContact O-SG 2.96Å; P56-C59 PolarHBondContact O-N 3.21Å; L57-C59 VanDerWaalsContact C-N 3.28Å; L57-C59 PolarHBondContact O-N 3.2Å; C59-L61 PolarHBondContact O-N 2.91Å; C59-S62 PolarHBondContact O-N 2.83Å; C59-V63 WeakPolarHBondContact O-CG2 3.23Å; C59-V63 PolarHBondContact O-N 3.21Å |
| 60 | I | 84.8 | Confident | 79.7 | Confident | 108 Ų | 108 | 72.2 Ų | 72.2 | 55% | 0.554 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -63.8 | -43.6 | -179.6 | -67 | 166 | 0 | 0 | 0 | 111.1 | P56 L57 S62 V63 S64 | P56-I60 WeakPolarHBondContact O-CG1 3.31Å; P56-I60 PolarHBondContact O-N 2.88Å; L57-I60 PolarHBondContact O-N 3.4Å; I60-S62 VanDerWaalsContact C-N 3.34Å; I60-S62 PolarHBondContact O-N 3.27Å; I60-V63 PolarHBondContact O-N 2.91Å; I60-S64 WeakPolarHBondContact O-CB 3.32Å; I60-S64 PolarHBondContact O-N 3.33Å; I60-S64 PolarHBondContact O-OG 3.45Å |
| 61 | L | 84.4 | Confident | 80.4 | Confident | 35 Ų | 35 | 74 Ų | 74 | 18% | 0.183 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 176.4 | -73.8 | 176 | 0 | 0 | 0 | 111.4 | F20 Q24 L57 C59 S64 A65 | F20-L61 WeakPolarHBondContact CZ-O 3.11Å; Q24-L61 HydrophobicContact CB-CD2 4.28Å; Q24-L61 HydrophobicContact CG-CD2 4.1Å; L57-L61 HydrophobicContact CD1-CD1 4.27Å; L57-L61 HydrophobicContact CD1-CG 4.4Å; L57-L61 HydrophobicContact CD2-CD1 4.11Å; L57-L61 HydrophobicContact CG-CD1 3.84Å; L57-L61 HydrophobicContact CG-CG 4.31Å; L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 WeakPolarHBondContact O-CG 3.32Å; L57-L61 PolarHBondContact O-N 2.84Å; C59-L61 PolarHBondContact O-N 2.91Å; L61-S64 PolarHBondContact O-N 3.47Å; L61-A65 WeakPolarHBondContact O-CB 3.33Å; L61-A65 PolarHBondContact O-N 2.66Å |
| 62 | S | 85.8 | Confident | 80.7 | Confident | 62 Ų | 62 | 70.9 Ų | 70.9 | 43% | 0.434 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -67 | -43 | 178.8 | -58.8 | 0 | 0 | 0 | 0 | 111.8 | L58 C59 I60 S64 A65 I66 | L58-S62 VanDerWaalsContact O-CB 3.23Å; L58-S62 WeakPolarHBondContact O-CB 3.43Å; L58-S62 PolarHBondContact O-N 3.48Å; L58-S62 PolarHBondContact O-OG 3.02Å; C59-S62 PolarHBondContact O-N 2.83Å; I60-S62 VanDerWaalsContact C-N 3.34Å; I60-S62 PolarHBondContact O-N 3.27Å; S62-S64 VanDerWaalsContact C-N 3.32Å; S62-S64 PolarHBondContact O-N 3.37Å; S62-A65 WeakPolarHBondContact O-CB 3.28Å; S62-A65 PolarHBondContact O-N 2.87Å; S62-I66 VanDerWaalsContact O-CG1 3.29Å; S62-I66 WeakPolarHBondContact O-CG1 3.37Å; S62-I66 PolarHBondContact O-N 2.88Å |
| 63 | V | 88.8 | Confident | 80.4 | Confident | 99 Ų | 99 | 75.1 Ų | 75.1 | 60% | 0.6 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62.8 | -41.8 | 175.1 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | C59 I60 I66 K67 | C59-V63 WeakPolarHBondContact O-CG2 3.23Å; C59-V63 PolarHBondContact O-N 3.21Å; I60-V63 PolarHBondContact O-N 2.91Å; V63-I66 PolarHBondContact O-N 3.2Å; V63-K67 WeakPolarHBondContact O-CB 3.4Å; V63-K67 PolarHBondContact O-N 3.31Å |
| 64 | S | 85.6 | Confident | 80.9 | Confident | 32 Ų | 32 | 76.4 Ų | 76.4 | 22% | 0.224 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.6 | -56.5 | 0 | 0 | 0 | 0 | 111.5 | I60 L61 S62 K67 E68 | I60-S64 WeakPolarHBondContact O-CB 3.32Å; I60-S64 PolarHBondContact O-N 3.33Å; I60-S64 PolarHBondContact O-OG 3.45Å; L61-S64 PolarHBondContact O-N 3.47Å; S62-S64 VanDerWaalsContact C-N 3.32Å; S62-S64 PolarHBondContact O-N 3.37Å; S64-K67 PolarHBondContact O-N 3.03Å; S64-E68 WeakPolarHBondContact O-CG 3.18Å; S64-E68 PolarHBondContact O-N 3.32Å |
| 65 | A | 84.7 | Confident | 81.3 | Confident | 17 Ų | 17 | 79.6 Ų | 79.6 | 14% | 0.14 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61 | -47.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F16 F20 L61 S62 K67 E68 I69 | F16-A65 HydrophobicContact CE1-CB 4.47Å; F16-A65 WeakPolarHBondContact CZ-O 3.46Å; F20-A65 HydrophobicContact CD1-CB 4.21Å; F20-A65 HydrophobicContact CD2-CB 4.34Å; F20-A65 HydrophobicContact CE1-CB 3.63Å; F20-A65 HydrophobicContact CE2-CB 3.8Å; F20-A65 VanDerWaalsContact CZ-CA 3.48Å; F20-A65 HydrophobicContact CZ-CB 3.41Å; F20-A65 VanDerWaalsContact CZ-CB 3.41Å; L61-A65 WeakPolarHBondContact O-CB 3.33Å; L61-A65 PolarHBondContact O-N 2.66Å; S62-A65 WeakPolarHBondContact O-CB 3.28Å; S62-A65 PolarHBondContact O-N 2.87Å; A65-K67 VanDerWaalsContact C-N 3.31Å; A65-K67 PolarHBondContact O-N 3.33Å; A65-E68 PolarHBondContact O-N 3.1Å; A65-I69 WeakPolarHBondContact O-CB 3.13Å; A65-I69 WeakPolarHBondContact O-CG1 3.17Å; A65-I69 PolarHBondContact O-N 3.28Å |
| 66 | I | 85.8 | Confident | 81.3 | Confident | 99 Ų | 99 | 79.8 Ų | 79.8 | 51% | 0.508 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 178.2 | -68.7 | 162.7 | 0 | 0 | 0 | 110.5 | S62 V63 I69 I70 | S62-I66 VanDerWaalsContact O-CG1 3.29Å; S62-I66 WeakPolarHBondContact O-CG1 3.37Å; S62-I66 PolarHBondContact O-N 2.88Å; V63-I66 PolarHBondContact O-N 3.2Å; I66-I69 PolarHBondContact O-N 3.31Å; I66-I70 HydrophobicContact CG2-CD1 3.76Å; I66-I70 HydrophobicContact CG2-CG1 4.46Å; I66-I70 VanDerWaalsContact O-CG1 3.27Å; I66-I70 WeakPolarHBondContact O-CG1 3.43Å; I66-I70 PolarHBondContact O-N 3.35Å |
| 67 | K | 84.7 | Confident | 81.4 | Confident | 123 Ų | 123 | 80.5 Ų | 80.5 | 54% | 0.535 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.3 | -49.6 | 177.5 | -175 | -169.4 | 167.2 | -164.2 | 0 | 111.2 | V63 S64 A65 I69 I70 E71 | V63-K67 WeakPolarHBondContact O-CB 3.4Å; V63-K67 PolarHBondContact O-N 3.31Å; S64-K67 PolarHBondContact O-N 3.03Å; A65-K67 VanDerWaalsContact C-N 3.31Å; A65-K67 PolarHBondContact O-N 3.33Å; K67-I69 VanDerWaalsContact C-N 3.34Å; K67-I69 PolarHBondContact O-N 3.39Å; K67-I70 PolarHBondContact O-N 3.4Å; K67-E71 WeakPolarHBondContact CE-OE1 3.41Å; K67-E71 IonicContact NZ-OE1 3.61Å; K67-E71 PolarHBondContact NZ-OE1 3.18Å; K67-E71 WeakPolarHBondContact O-CG 3.39Å; K67-E71 PolarHBondContact O-N 3.37Å |
| 68 | E | 82.9 | Confident | 81.7 | Confident | 39 Ų | 39 | 84.4 Ų | 84.4 | 18% | 0.182 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -66.1 | -35.5 | 180 | -72.7 | -179.1 | -138.7 | 0 | 0 | 112.2 | F16 F20 Q24 S64 A65 E71 D72 | F16-E68 HydrophobicContact CE2-CB 3.71Å; F16-E68 HydrophobicContact CZ-CB 3.73Å; F20-E68 HydrophobicContact CD2-CB 4.45Å; F20-E68 WeakPolarHBondContact CD2-OE2 3.42Å; F20-E68 WeakPolarHBondContact CE2-OE1 3.48Å; Q24-E68 PolarHBondContact NE2-OE1 2.8Å; S64-E68 WeakPolarHBondContact O-CG 3.18Å; S64-E68 PolarHBondContact O-N 3.32Å; A65-E68 PolarHBondContact O-N 3.1Å; E68-E71 PolarHBondContact O-N 2.91Å; E68-D72 WeakPolarHBondContact O-CB 3.25Å; E68-D72 PolarHBondContact O-N 2.74Å; E68-D72 VanDerWaalsContact O-N 3.09Å |
| 69 | I | 79.1 | Confident | 81.7 | Confident | 47 Ų | 47 | 83.4 Ų | 83.4 | 24% | 0.241 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -57.7 | -53.2 | 170.9 | -71 | 167.7 | 0 | 0 | 0 | 109 | L13 F16 A65 I66 K67 E71 D72 W73 | L13-I69 HydrophobicContact CD2-CD1 4.34Å; L13-I69 HydrophobicContact CD2-CG1 4.36Å; L13-I69 HydrophobicContact CD2-CG2 3.99Å; F16-I69 HydrophobicContact CD1-CD1 4.08Å; F16-I69 HydrophobicContact CD1-CG1 3.67Å; F16-I69 HydrophobicContact CD2-CG1 4.18Å; F16-I69 HydrophobicContact CE1-CD1 3.74Å; F16-I69 HydrophobicContact CE1-CG1 3.32Å; F16-I69 HydrophobicContact CE2-CG1 3.87Å; F16-I69 HydrophobicContact CG-CG1 4.1Å; F16-I69 HydrophobicContact CZ-CB 4.46Å; F16-I69 HydrophobicContact CZ-CD1 4.29Å; F16-I69 HydrophobicContact CZ-CG1 3.45Å; F16-I69 VanDerWaalsContact CZ-CG1 3.45Å; A65-I69 WeakPolarHBondContact O-CB 3.13Å; A65-I69 WeakPolarHBondContact O-CG1 3.17Å; A65-I69 PolarHBondContact O-N 3.28Å; I66-I69 PolarHBondContact O-N 3.31Å; K67-I69 VanDerWaalsContact C-N 3.34Å; K67-I69 PolarHBondContact O-N 3.39Å; I69-E71 VanDerWaalsContact C-N 3.26Å; I69-E71 PolarHBondContact O-N 3Å; I69-D72 PolarHBondContact O-N 3.24Å; I69-D72 VanDerWaalsContact O-N 3.13Å; I69-W73 VanDerWaalsContact CG2-CD1 3.46Å; I69-W73 PolarHBondContact O-N 3.25Å |
| 70 | I | 81.8 | Confident | 81.3 | Confident | 113 Ų | 113 | 84.3 Ų | 84.3 | 58% | 0.579 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -60.5 | -34.6 | -179 | -65.9 | 164.8 | 0 | 0 | 0 | 112 | I66 K67 | I66-I70 HydrophobicContact CG2-CD1 3.76Å; I66-I70 HydrophobicContact CG2-CG1 4.46Å; I66-I70 VanDerWaalsContact O-CG1 3.27Å; I66-I70 WeakPolarHBondContact O-CG1 3.43Å; I66-I70 PolarHBondContact O-N 3.35Å; K67-I70 PolarHBondContact O-N 3.4Å |
| 71 | E | 77.4 | Confident | 81.1 | Confident | 131 Ų | 131 | 82.5 Ų | 82.5 | 61% | 0.612 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -73.6 | -25.1 | 178 | -73.7 | 177.8 | 160.4 | 0 | 0 | 113.5 | K67 E68 I69 | K67-E71 WeakPolarHBondContact CE-OE1 3.41Å; K67-E71 IonicContact NZ-OE1 3.61Å; K67-E71 PolarHBondContact NZ-OE1 3.18Å; K67-E71 WeakPolarHBondContact O-CG 3.39Å; K67-E71 PolarHBondContact O-N 3.37Å; E68-E71 PolarHBondContact O-N 2.91Å; I69-E71 VanDerWaalsContact C-N 3.26Å; I69-E71 PolarHBondContact O-N 3Å |
| 72 | D | 70.7 | Confident | 80.8 | Confident | 97 Ų | 97 | 86.4 Ų | 86.4 | 52% | 0.519 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -90.5 | -7.1 | 179.3 | -153 | 40.4 | 0 | 0 | 0 | 113 | E68 I69 | E68-D72 WeakPolarHBondContact O-CB 3.25Å; E68-D72 PolarHBondContact O-N 2.74Å; E68-D72 VanDerWaalsContact O-N 3.09Å; I69-D72 PolarHBondContact O-N 3.24Å; I69-D72 VanDerWaalsContact O-N 3.13Å |
| 73 | W | 62.2 | Low | 80.3 | Confident | 178 Ų | 178 | 88.6 Ų | 88.6 | 67% | 0.674 | 44% | 0.438 | S | S | * | . | trans | -101 | 0 | 174.2 | -73.8 | 110.6 | 0 | 0 | 0 | 112.5 | A9 L13 I69 | A9-W73 HydrophobicContact CB-CH2 4.45Å; L13-W73 HydrophobicContact CD1-CZ2 4.44Å; L13-W73 HydrophobicContact CD2-CZ2 4.19Å; L13-W73 HydrophobicContact CG-CZ2 4Å; I69-W73 VanDerWaalsContact CG2-CD1 3.46Å; I69-W73 PolarHBondContact O-N 3.25Å |
Retrieved 73 of 73 residues in 18.6 ms
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