| 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 | 60.4 | Low | 72.8 | Confident | 185 Ų | 185 | 103.5 Ų | 103.5 | 91% | 0.911 | 51% | 0.513 | S | S | * | . | 0 | -58.7 | 0 | -77.5 | -101.2 | -85 | 0 | 0 | 112 | Q3 Q4 Q5 | M1-Q3 PolarHBondContact O-N 3.49Å; M1-Q4 PolarHBondContact O-N 3.47Å; M1-Q5 PolarHBondContact O-N 2.85Å | |||
| 2 | Q | 71.9 | Confident | 72.5 | Confident | 156 Ų | 156 | 105.6 Ų | 105.6 | 73% | 0.729 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.4 | -42.9 | -179.8 | -91.4 | 178.7 | 1.7 | 0 | 0 | 114.9 | Q4 Q5 Q6 | Q2-Q4 VanDerWaalsContact C-N 3.31Å; Q2-Q4 PolarHBondContact O-N 3.22Å; Q2-Q5 PolarHBondContact O-N 3.47Å; Q2-Q6 PolarHBondContact O-N 3.03Å |
| 3 | Q | 71.1 | Confident | 72 | Confident | 144 Ų | 144 | 108.5 Ų | 108.5 | 67% | 0.673 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.7 | -35 | -179.3 | -164.5 | 175.6 | 29.3 | 0 | 0 | 112.8 | M1 Q6 Y7 | M1-Q3 PolarHBondContact O-N 3.49Å; Q3-Q6 PolarHBondContact O-N 3.36Å; Q3-Y7 PolarHBondContact O-N 3.04Å |
| 4 | Q | 74.5 | Confident | 71.1 | Confident | 147 Ų | 147 | 109.3 Ų | 109.3 | 69% | 0.687 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -72.3 | -32.6 | 177.3 | -160.5 | 170.6 | 29 | 0 | 0 | 111.9 | M1 Q2 A8 | M1-Q4 PolarHBondContact O-N 3.47Å; Q2-Q4 VanDerWaalsContact C-N 3.31Å; Q2-Q4 PolarHBondContact O-N 3.22Å; Q4-A8 WeakPolarHBondContact O-CB 3.21Å; Q4-A8 PolarHBondContact O-N 3.42Å |
| 5 | Q | 75.3 | Confident | 70.3 | Confident | 123 Ų | 123 | 111.5 Ų | 111.5 | 58% | 0.575 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -70.7 | -38.9 | 173 | -71.6 | 176.2 | -7 | 0 | 0 | 111.9 | M1 Q2 Y7 A8 A9 | M1-Q5 PolarHBondContact O-N 2.85Å; Q2-Q5 PolarHBondContact O-N 3.47Å; Q5-Y7 VanDerWaalsContact C-N 3.33Å; Q5-A8 PolarHBondContact O-N 2.87Å; Q5-A9 WeakPolarHBondContact O-CB 3.4Å; Q5-A9 PolarHBondContact O-N 2.95Å |
| 6 | Q | 74.4 | Confident | 69.1 | Low | 139 Ų | 139 | 113.8 Ų | 113.8 | 65% | 0.65 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.7 | -41 | 172.9 | -75.5 | -178.8 | -21.9 | 0 | 0 | 111.5 | Q2 Q3 A9 Y10 | Q2-Q6 PolarHBondContact O-N 3.03Å; Q3-Q6 PolarHBondContact O-N 3.36Å; Q6-A9 PolarHBondContact O-N 2.63Å; Q6-Y10 VanDerWaalsContact O-CB 3.25Å; Q6-Y10 WeakPolarHBondContact O-CB 3.47Å; Q6-Y10 PolarHBondContact O-N 2.74Å |
| 7 | Y | 72.8 | Confident | 67.9 | Low | 62 Ų | 62 | 114.3 Ų | 114.3 | 24% | 0.243 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -64.6 | -43.2 | 174.4 | -172.8 | -109.2 | 0 | 0 | 0 | 112.6 | Q3 Q5 Y10 M11 I225 E228 | Q3-Y7 PolarHBondContact O-N 3.04Å; Q5-Y7 VanDerWaalsContact C-N 3.33Å; Y7-Y10 WeakPolarHBondContact O-CB 3.38Å; Y7-Y10 PolarHBondContact O-N 2.72Å; Y7-M11 HydrophobicContact CD1-CG 4.27Å; Y7-M11 HydrophobicContact CE1-CG 3.93Å; Y7-M11 HydrophobicContact CE2-CG 4.24Å; Y7-M11 HydrophobicContact CE2-SD 4.46Å; Y7-M11 VanDerWaalsContact O-CG 3.31Å; Y7-M11 WeakPolarHBondContact O-CG 2.94Å; Y7-M11 PolarHBondContact O-N 3.05Å; Y7-I225 HydrophobicContact CD2-CD1 3.64Å; Y7-I225 HydrophobicContact CD2-CG1 4.2Å; Y7-I225 HydrophobicContact CE2-CB 4.33Å; Y7-I225 HydrophobicContact CE2-CD1 3.29Å; Y7-I225 HydrophobicContact CE2-CG1 3.43Å; Y7-I225 VanDerWaalsContact CE2-CG1 3.43Å; Y7-I225 HydrophobicContact CE2-CG2 4.02Å; Y7-E228 PolarHBondContact OH-OE2 3.36Å |
| 8 | A | 75.2 | Confident | 67 | Low | 45 Ų | 45 | 113.2 Ų | 113.2 | 37% | 0.372 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.6 | -40.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q4 Q5 M11 Q12 | Q4-A8 WeakPolarHBondContact O-CB 3.21Å; Q4-A8 PolarHBondContact O-N 3.42Å; Q5-A8 PolarHBondContact O-N 2.87Å; A8-M11 PolarHBondContact O-N 3.45Å; A8-Q12 WeakPolarHBondContact O-CG 3.27Å; A8-Q12 PolarHBondContact O-N 3.31Å |
| 9 | A | 75 | Confident | 65.9 | Low | 50 Ų | 50 | 114.2 Ų | 114.2 | 41% | 0.413 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.2 | -39.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q5 Q6 Q12 Q13 | Q5-A9 WeakPolarHBondContact O-CB 3.4Å; Q5-A9 PolarHBondContact O-N 2.95Å; Q6-A9 PolarHBondContact O-N 2.63Å; A9-Q12 PolarHBondContact O-N 2.95Å; A9-Q13 WeakPolarHBondContact O-CG 3.35Å; A9-Q13 PolarHBondContact O-N 3.09Å; A9-Q13 VanDerWaalsContact O-N 3.16Å |
| 10 | Y | 75.8 | Confident | 64.8 | Low | 43 Ų | 43 | 116.9 Ų | 116.9 | 17% | 0.169 | 58% | 0.584 | C | S | . | * | H | α-helix | trans | -62.2 | -48.1 | 174.4 | -175.8 | -101.7 | 0 | 0 | 0 | 111.5 | Q6 Y7 Q12 Q13 F14 M220 P284 G285 | Q6-Y10 VanDerWaalsContact O-CB 3.25Å; Q6-Y10 WeakPolarHBondContact O-CB 3.47Å; Q6-Y10 PolarHBondContact O-N 2.74Å; Y7-Y10 WeakPolarHBondContact O-CB 3.38Å; Y7-Y10 PolarHBondContact O-N 2.72Å; Y10-Q12 VanDerWaalsContact C-N 3.31Å; Y10-Q12 PolarHBondContact O-N 2.81Å; Y10-Q13 PolarHBondContact O-N 3.23Å; Y10-F14 HydrophobicContact CD1-CD2 4.43Å; Y10-F14 HydrophobicContact CD2-CD2 4.16Å; Y10-F14 AromaticContact CD2-CE2 3.88Å; Y10-F14 HydrophobicContact CD2-CE2 3.88Å; Y10-F14 HydrophobicContact CE1-CD2 4.15Å; Y10-F14 HydrophobicContact CE1-CE2 4.25Å; Y10-F14 AromaticContact CE2-CD2 3.86Å; Y10-F14 HydrophobicContact CE2-CD2 3.86Å; Y10-F14 AromaticContact CE2-CE2 3.27Å; Y10-F14 HydrophobicContact CE2-CE2 3.27Å; Y10-F14 HydrophobicContact CE2-CZ 4.1Å; Y10-F14 HydrophobicContact CG-CD2 4.43Å; Y10-F14 AromaticContact CZ-CD2 3.84Å; Y10-F14 AromaticContact CZ-CE2 3.48Å; Y10-F14 VanDerWaalsContact CZ-CE2 3.48Å; Y10-F14 WeakPolarHBondContact O-CD2 3.28Å; Y10-F14 PolarHBondContact O-N 3.36Å; Y10-M220 HydrophobicContact CD1-CE 4.36Å; Y10-M220 HydrophobicContact CD2-CE 4.35Å; Y10-M220 HydrophobicContact CE1-CE 4.3Å; Y10-M220 HydrophobicContact CE2-CE 4.28Å; Y10-M220 HydrophobicContact CG-CE 4.38Å; Y10-P284 PolarHBondContact OH-O 3.19Å; Y10-G285 WeakPolarHBondContact OH-CA 3.42Å; Y10-G285 PolarHBondContact OH-N 2.74Å |
| 11 | M | 74.7 | Confident | 63.8 | Low | 45 Ų | 45 | 120.4 Ų | 120.4 | 22% | 0.222 | 60% | 0.599 | C | S | . | * | H | α-helix | trans | -62.3 | -36.5 | 176.6 | -70.7 | -69.5 | -80.4 | 0 | 0 | 112.4 | Y7 A8 Q13 F14 Y15 E228 | Y7-M11 HydrophobicContact CD1-CG 4.27Å; Y7-M11 HydrophobicContact CE1-CG 3.93Å; Y7-M11 HydrophobicContact CE2-CG 4.24Å; Y7-M11 HydrophobicContact CE2-SD 4.46Å; Y7-M11 VanDerWaalsContact O-CG 3.31Å; Y7-M11 WeakPolarHBondContact O-CG 2.94Å; Y7-M11 PolarHBondContact O-N 3.05Å; A8-M11 PolarHBondContact O-N 3.45Å; M11-Q13 VanDerWaalsContact C-N 3.34Å; M11-Q13 PolarHBondContact O-N 3.27Å; M11-F14 PolarHBondContact O-N 3.14Å; M11-Y15 HydrophobicContact CE-CD2 4.03Å; M11-Y15 HydrophobicContact CE-CE2 3.53Å; M11-Y15 WeakPolarHBondContact O-CB 3.46Å; M11-Y15 WeakPolarHBondContact O-CD2 3.35Å; M11-Y15 PolarHBondContact O-N 3.4Å; M11-Y15 HydrophobicContact SD-CD2 4.24Å; M11-Y15 HydrophobicContact SD-CE2 3.86Å; M11-E228 WeakPolarHBondContact CE-OE1 3.35Å |
| 12 | Q | 68.5 | Low | 63.1 | Low | 128 Ų | 128 | 120.8 Ų | 120.8 | 60% | 0.598 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.3 | -31.1 | 176.1 | -76.1 | 179.5 | 31 | 0 | 0 | 113.4 | A8 A9 Y10 Q16 | A8-Q12 WeakPolarHBondContact O-CG 3.27Å; A8-Q12 PolarHBondContact O-N 3.31Å; A9-Q12 PolarHBondContact O-N 2.95Å; Y10-Q12 VanDerWaalsContact C-N 3.31Å; Y10-Q12 PolarHBondContact O-N 2.81Å; Q12-Q16 VanDerWaalsContact O-CG 3.22Å; Q12-Q16 WeakPolarHBondContact O-CG 3.45Å; Q12-Q16 PolarHBondContact O-N 3.35Å; Q12-Q16 PolarHBondContact O-NE2 3.08Å |
| 13 | Q | 66.4 | Low | 61.9 | Low | 144 Ų | 144 | 122.8 Ų | 122.8 | 67% | 0.673 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -74.3 | -33.9 | 177.7 | -73.4 | -179.8 | -6.1 | 0 | 0 | 112.5 | A9 Y10 M11 | A9-Q13 WeakPolarHBondContact O-CG 3.35Å; A9-Q13 PolarHBondContact O-N 3.09Å; A9-Q13 VanDerWaalsContact O-N 3.16Å; Y10-Q13 PolarHBondContact O-N 3.23Å; M11-Q13 VanDerWaalsContact C-N 3.34Å; M11-Q13 PolarHBondContact O-N 3.27Å |
| 14 | F | 59.1 | Low | 60.8 | Low | 119 Ų | 119 | 125 Ų | 125 | 52% | 0.522 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -87.9 | -23.6 | -177.4 | -81.1 | -89.8 | 0 | 0 | 0 | 114 | Y10 M11 | Y10-F14 HydrophobicContact CD1-CD2 4.43Å; Y10-F14 HydrophobicContact CD2-CD2 4.16Å; Y10-F14 AromaticContact CD2-CE2 3.88Å; Y10-F14 HydrophobicContact CD2-CE2 3.88Å; Y10-F14 HydrophobicContact CE1-CD2 4.15Å; Y10-F14 HydrophobicContact CE1-CE2 4.25Å; Y10-F14 AromaticContact CE2-CD2 3.86Å; Y10-F14 HydrophobicContact CE2-CD2 3.86Å; Y10-F14 AromaticContact CE2-CE2 3.27Å; Y10-F14 HydrophobicContact CE2-CE2 3.27Å; Y10-F14 HydrophobicContact CE2-CZ 4.1Å; Y10-F14 HydrophobicContact CG-CD2 4.43Å; Y10-F14 AromaticContact CZ-CD2 3.84Å; Y10-F14 AromaticContact CZ-CE2 3.48Å; Y10-F14 VanDerWaalsContact CZ-CE2 3.48Å; Y10-F14 WeakPolarHBondContact O-CD2 3.28Å; Y10-F14 PolarHBondContact O-N 3.36Å; M11-F14 PolarHBondContact O-N 3.14Å |
| 15 | Y | 58.9 | Low | 59.3 | Low | 143 Ų | 143 | 127.1 Ų | 127.1 | 56% | 0.561 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -103.5 | 11 | 177.9 | -74 | -82.5 | 0 | 0 | 0 | 114.5 | M11 V17 | M11-Y15 HydrophobicContact CE-CD2 4.03Å; M11-Y15 HydrophobicContact CE-CE2 3.53Å; M11-Y15 WeakPolarHBondContact O-CB 3.46Å; M11-Y15 WeakPolarHBondContact O-CD2 3.35Å; M11-Y15 PolarHBondContact O-N 3.4Å; M11-Y15 HydrophobicContact SD-CD2 4.24Å; M11-Y15 HydrophobicContact SD-CE2 3.86Å; Y15-V17 PolarHBondContact O-N 3.42Å |
| 16 | Q | 51.3 | Low | 57.9 | Low | 148 Ų | 148 | 130.2 Ų | 130.2 | 69% | 0.692 | 64% | 0.643 | S | S | * | * | trans | -74 | 80.2 | 167.3 | -92.8 | 173.3 | 81.1 | 0 | 0 | 110.1 | Q12 | Q12-Q16 VanDerWaalsContact O-CG 3.22Å; Q12-Q16 WeakPolarHBondContact O-CG 3.45Å; Q12-Q16 PolarHBondContact O-N 3.35Å; Q12-Q16 PolarHBondContact O-NE2 3.08Å | ||
| 17 | V | 48.6 | Very low | 56.6 | Low | 122 Ų | 122 | 132.4 Ų | 132.4 | 74% | 0.739 | 65% | 0.653 | S | S | * | * | trans | -63.1 | 122.1 | 162.1 | -176.8 | 0 | 0 | 0 | 0 | 107.1 | Y15 | Y15-V17 PolarHBondContact O-N 3.42Š| ||
| 18 | P | 53 | Low | 55.3 | Low | 95 Ų | 95 | 138.4 Ų | 138.4 | 62% | 0.617 | 68% | 0.683 | S | S | * | * | trans | -60.2 | 132.3 | 176.7 | 22.1 | -30.3 | 0 | 0 | 0 | 109.5 | Q20 | P18-Q20 PolarHBondContact O-N 3.09Š| ||
| 19 | P | 44.8 | Very low | 54.6 | Low | 131 Ų | 131 | 142 Ų | 142 | 85% | 0.851 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -78.5 | 73.7 | 178.4 | 32.9 | -33.4 | 0 | 0 | 0 | 109 | ||
| 20 | Q | 44.6 | Very low | 54.2 | Low | 169 Ų | 169 | 145.2 Ų | 145.2 | 79% | 0.79 | 72% | 0.719 | S | S | * | * | trans | -141.4 | 125.2 | 171.2 | -70.8 | -168 | -15.1 | 0 | 0 | 109.9 | P18 | P18-Q20 PolarHBondContact O-N 3.09Š| ||
| 21 | Q | 44.6 | Very low | 53.6 | Low | 190 Ų | 190 | 148.8 Ų | 148.8 | 89% | 0.888 | 75% | 0.747 | S | S | * | * | S | Bend | trans | 107.5 | 11.5 | 167 | -55.5 | -172 | 29.9 | 0 | 0 | 120.6 | ||
| 22 | Q | 44.7 | Very low | 52.7 | Low | 193 Ų | 193 | 152.6 Ų | 152.6 | 90% | 0.902 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | 14.2 | 173.6 | -109.1 | 178.1 | 25.8 | 0 | 0 | 116.8 | ||
| 23 | Q | 47.1 | Very low | 51.5 | Low | 198 Ų | 198 | 153.7 Ų | 153.7 | 93% | 0.925 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.7 | 13.5 | -178 | -87.4 | -174.9 | 14.9 | 0 | 0 | 116.6 | ||
| 24 | Q | 46.6 | Very low | 50.4 | Low | 191 Ų | 191 | 150.5 Ų | 150.5 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -123.5 | 10.9 | -178.9 | -81.9 | -175.2 | 18.4 | 0 | 0 | 117.3 | ||
| 25 | Q | 43.9 | Very low | 49.6 | Very low | 191 Ų | 191 | 151.5 Ų | 151.5 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | trans | -118.2 | 12.7 | 178.3 | -74.5 | -175 | 20.5 | 0 | 0 | 115.9 | Q27 | Q25-Q27 VanDerWaalsContact C-N 3.33Å; Q25-Q27 PolarHBondContact O-N 3.36Å | ||
| 26 | Q | 46.7 | Very low | 48.6 | Very low | 189 Ų | 189 | 150.1 Ų | 150.1 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -88.1 | 22.7 | 178.4 | -88.4 | -176.5 | 19 | 0 | 0 | 115.7 | ||
| 27 | Q | 46 | Very low | 48.1 | Very low | 184 Ų | 184 | 147.7 Ų | 147.7 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | trans | -137.4 | 67.1 | 177.6 | -64.6 | -173.3 | 45.8 | 0 | 0 | 112.1 | Q25 | Q25-Q27 VanDerWaalsContact C-N 3.33Å; Q25-Q27 PolarHBondContact O-N 3.36Å | ||
| 28 | Q | 45.9 | Very low | 47.7 | Very low | 188 Ų | 188 | 151.9 Ų | 151.9 | 88% | 0.879 | 83% | 0.828 | S | S | * | * | trans | -140.9 | 124.2 | 153.9 | -70.3 | -157.1 | -5.1 | 0 | 0 | 111.3 | ||||
| 29 | P | 60.5 | Low | 47.2 | Very low | 120 Ų | 120 | 157.6 Ų | 157.6 | 78% | 0.779 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 156.5 | 175.3 | 31.3 | -33.1 | 0 | 0 | 0 | 111.5 | ||
| 30 | P | 67.2 | Low | 47.1 | Very low | 118 Ų | 118 | 155.9 Ų | 155.9 | 77% | 0.766 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 151.9 | -177.9 | 29.1 | -35.1 | 0 | 0 | 0 | 112.7 | ||
| 31 | P | 62.8 | Low | 47.1 | Very low | 118 Ų | 118 | 153 Ų | 153 | 77% | 0.766 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 147 | -180 | 30.1 | -34.5 | 0 | 0 | 0 | 112.1 | ||
| 32 | P | 55.5 | Low | 46.9 | Very low | 126 Ų | 126 | 152.8 Ų | 152.8 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 137.2 | 176.9 | 30.4 | -32.4 | 0 | 0 | 0 | 111.7 | G34 | P32-G34 PolarHBondContact O-N 2.79Š|
| 33 | T | 42.7 | Very low | 46.9 | Very low | 150 Ų | 150 | 152 Ų | 152 | 92% | 0.92 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 124.3 | 167.3 | 45 | 0 | 0 | 0 | 0 | 111.1 | ||
| 34 | G | 43 | Very low | 46.8 | Very low | 78 Ų | 78 | 151.2 Ų | 151.2 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -147.6 | 122.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | P32 | P32-G34 PolarHBondContact O-N 2.79Š| ||
| 35 | T | 43 | Very low | 46.7 | Very low | 140 Ų | 140 | 151.3 Ų | 151.3 | 86% | 0.859 | 84% | 0.835 | S | S | * | * | trans | -74.6 | 161.6 | -179.6 | 42.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 36 | S | 38.6 | Very low | 46.7 | Very low | 113 Ų | 113 | 150.8 Ų | 150.8 | 79% | 0.79 | 83% | 0.833 | S | S | * | * | trans | 80.6 | 138.6 | 161.3 | -131.6 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 37 | S | 40.9 | Very low | 46.5 | Very low | 98 Ų | 98 | 149 Ų | 149 | 69% | 0.685 | 83% | 0.829 | S | S | * | * | cis | -172.6 | 145.6 | 23.7 | -7.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 38 | Y | 38.7 | Very low | 46.6 | Very low | 209 Ų | 209 | 150 Ų | 150 | 82% | 0.82 | 83% | 0.83 | S | S | * | * | trans | 27.6 | 149.2 | 142.2 | -79.9 | -96.7 | 0 | 0 | 0 | 124.7 | ||||
| 39 | Y | 44.2 | Very low | 46.6 | Very low | 216 Ų | 216 | 148.3 Ų | 148.3 | 85% | 0.847 | 82% | 0.823 | S | S | * | * | trans | 91.9 | 103.6 | 166.2 | -60.2 | -78.4 | 0 | 0 | 0 | 116.1 | ||||
| 40 | A | 42.9 | Very low | 45.7 | Very low | 94 Ų | 94 | 151.3 Ų | 151.3 | 78% | 0.777 | 83% | 0.826 | S | S | * | * | 67 | 104 | 74.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 41 | A | 43.2 | Very low | 44.5 | Very low | 108 Ų | 108 | 149.3 Ų | 149.3 | 89% | 0.893 | 83% | 0.827 | S | S | * | * | trans | -171.4 | 113.3 | 147.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 42 | Q | 40.2 | Very low | 43.4 | Very low | 186 Ų | 186 | 149 Ų | 149 | 87% | 0.869 | 83% | 0.834 | S | S | * | * | trans | -85.4 | 131.9 | 153.9 | -82.6 | 176.2 | 1.2 | 0 | 0 | 108.2 | ||||
| 43 | Q | 45.9 | Very low | 42.8 | Very low | 176 Ų | 176 | 147.5 Ų | 147.5 | 82% | 0.822 | 83% | 0.832 | S | S | * | * | trans | -172.2 | 118.3 | 146.7 | -110.2 | 162.5 | 60.7 | 0 | 0 | 113 | ||||
| 44 | Q | 45.3 | Very low | 42.7 | Very low | 182 Ų | 182 | 149.5 Ų | 149.5 | 85% | 0.85 | 83% | 0.834 | S | S | * | * | trans | 34.4 | 119.3 | 130.7 | -56 | 179.5 | 16.3 | 0 | 0 | 119.6 | ||||
| 45 | M | 44.1 | Very low | 42.6 | Very low | 194 Ų | 194 | 149.5 Ų | 149.5 | 96% | 0.956 | 83% | 0.834 | S | S | * | * | trans | -140.6 | 105.1 | 152.9 | -76.3 | -79.1 | -94.4 | 0 | 0 | 108.7 | ||||
| 46 | Q | 43.7 | Very low | 42.3 | Very low | 180 Ų | 180 | 146.2 Ų | 146.2 | 84% | 0.841 | 83% | 0.828 | S | S | * | * | trans | -101.4 | 157 | 162.4 | -98.9 | 172.5 | 2.4 | 0 | 0 | 108.9 | ||||
| 47 | D | 42.6 | Very low | 42.5 | Very low | 152 Ų | 152 | 150.2 Ų | 150.2 | 81% | 0.813 | 84% | 0.837 | S | S | * | * | trans | 78.1 | 107.8 | 165.4 | -68.4 | -42.5 | 0 | 0 | 0 | 120.1 | ||||
| 48 | K | 48.2 | Very low | 42.4 | Very low | 203 Ų | 203 | 154.8 Ų | 154.8 | 88% | 0.883 | 85% | 0.847 | S | S | * | * | trans | -145.7 | 96.2 | 141.3 | -131.6 | 178 | -176.8 | -169.7 | 0 | 112 | ||||
| 49 | Q | 45.1 | Very low | 42.6 | Very low | 153 Ų | 153 | 148.5 Ų | 148.5 | 72% | 0.715 | 84% | 0.839 | S | S | * | * | trans | 26.2 | 115.3 | 136.1 | -68.6 | 177.2 | 5.4 | 0 | 0 | 119 | ||||
| 50 | Q | 42.1 | Very low | 42.5 | Very low | 184 Ų | 184 | 146.3 Ų | 146.3 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | 89.3 | 122.3 | 97 | -72.6 | 175.3 | 19.3 | 0 | 0 | 114.3 | |||||
| 51 | G | 41.5 | Very low | 42.3 | Very low | 75 Ų | 75 | 150 Ų | 150 | 77% | 0.773 | 84% | 0.839 | S | S | * | * | trans | 179.6 | 89 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 52 | A | 41.2 | Very low | 42.4 | Very low | 111 Ų | 111 | 153 Ų | 153 | 92% | 0.917 | 84% | 0.84 | S | S | * | * | trans | 74.6 | 125.4 | 149.3 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 53 | A | 41.9 | Very low | 42.9 | Very low | 95 Ų | 95 | 149.6 Ų | 149.6 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | trans | -85.8 | 159.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 54 | M | 41 | Very low | 42.7 | Very low | 192 Ų | 192 | 143.8 Ų | 143.8 | 95% | 0.946 | 82% | 0.821 | S | S | * | * | 166.1 | 132.3 | 125.5 | -87.7 | -92.8 | -97.1 | 0 | 0 | 112.3 | |||||
| 55 | G | 40.1 | Very low | 42.5 | Very low | 79 Ų | 79 | 145.9 Ų | 145.9 | 81% | 0.814 | 82% | 0.822 | S | S | * | * | trans | 97.3 | 96.3 | 143.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 56 | G | 38.1 | Very low | 42.2 | Very low | 71 Ų | 71 | 140.2 Ų | 140.2 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | trans | -86.3 | 167 | 162.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 57 | M | 42.3 | Very low | 42.1 | Very low | 197 Ų | 197 | 135.4 Ų | 135.4 | 97% | 0.97 | 81% | 0.805 | S | S | * | * | trans | -174.4 | 128.1 | 137.9 | -99.8 | 172.8 | -146.3 | 0 | 0 | 109.5 | ||||
| 58 | Q | 38 | Very low | 41.7 | Very low | 193 Ų | 193 | 139 Ų | 139 | 90% | 0.902 | 81% | 0.809 | S | S | * | * | trans | -67.9 | 157 | 168.6 | -73.6 | 162 | -30 | 0 | 0 | 110.4 | ||||
| 59 | A | 44.3 | Very low | 41.3 | Very low | 78 Ų | 78 | 132.9 Ų | 132.9 | 65% | 0.645 | 80% | 0.802 | S | S | * | * | 145.7 | 139 | 111.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 60 | Q | 40 | Very low | 41.1 | Very low | 169 Ų | 169 | 132.7 Ų | 132.7 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | trans | 76.9 | 105.4 | 144.6 | -15.2 | -165.1 | 48.7 | 0 | 0 | 118.9 | ||||
| 61 | M | 39.2 | Very low | 41.1 | Very low | 173 Ų | 173 | 127.6 Ų | 127.6 | 85% | 0.852 | 81% | 0.809 | S | S | * | * | 78.1 | 116.8 | 87 | -70.8 | -168.7 | -151.6 | 0 | 0 | 115.6 | |||||
| 62 | L | 46.3 | Very low | 41 | Very low | 171 Ų | 171 | 128.2 Ų | 128.2 | 90% | 0.895 | 82% | 0.815 | S | S | * | * | trans | 148.5 | 133.4 | 132.6 | -84.4 | 146.6 | 0 | 0 | 0 | 113.5 | ||||
| 63 | P | 50.2 | Low | 41 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | trans | -110.4 | 151.4 | 170.3 | 37.4 | -26.5 | 0 | 0 | 0 | 113.3 | ||||
| 64 | G | 42.2 | Very low | 41.1 | Very low | 54 Ų | 54 | 132.4 Ų | 132.4 | 56% | 0.557 | 82% | 0.816 | S | S | * | * | trans | -172.5 | 107.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 65 | Y | 40.4 | Very low | 41.2 | Very low | 226 Ų | 226 | 131.4 Ų | 131.4 | 89% | 0.886 | 81% | 0.811 | S | S | * | * | trans | 37.7 | 136.3 | 136.3 | 15.1 | -95.1 | 0 | 0 | 0 | 123.6 | ||||
| 66 | G | 38.8 | Very low | 41.8 | Very low | 74 Ų | 74 | 133.8 Ų | 133.8 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | trans | 104.8 | 104.7 | 143.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 67 | A | 40 | Very low | 42.4 | Very low | 80 Ų | 80 | 137 Ų | 137 | 66% | 0.661 | 82% | 0.817 | S | S | * | * | 89.6 | 122.2 | 76.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 68 | Y | 35 | Very low | 42.2 | Very low | 228 Ų | 228 | 133.9 Ų | 133.9 | 89% | 0.894 | 81% | 0.805 | S | S | * | * | trans | 48.3 | 136.3 | 164.1 | 66.1 | -93.7 | 0 | 0 | 0 | 120.2 | ||||
| 69 | G | 38.9 | Very low | 42.6 | Very low | 73 Ų | 73 | 130.4 Ų | 130.4 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | 150.8 | 105.2 | 159.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 70 | T | 42.7 | Very low | 42.4 | Very low | 150 Ų | 150 | 135 Ų | 135 | 92% | 0.92 | 81% | 0.807 | S | S | * | * | trans | -51.6 | 135.6 | 164.2 | 51.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 71 | G | 41.9 | Very low | 42.4 | Very low | 76 Ų | 76 | 131.8 Ų | 131.8 | 78% | 0.784 | 81% | 0.809 | S | S | * | * | trans | 168.2 | 114.1 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 72 | G | 37.6 | Very low | 42.5 | Very low | 88 Ų | 88 | 128.7 Ų | 128.7 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | trans | -67.9 | 146.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 73 | A | 42.5 | Very low | 42.6 | Very low | 98 Ų | 98 | 129.6 Ų | 129.6 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | trans | -145.1 | 125.2 | 158.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 74 | Q | 43.6 | Very low | 42.2 | Very low | 196 Ų | 196 | 132.9 Ų | 132.9 | 92% | 0.916 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 141.1 | -176.6 | -68.4 | 158 | -51.6 | 0 | 0 | 110.5 | ||
| 75 | M | 44 | Very low | 42.7 | Very low | 172 Ų | 172 | 135.6 Ų | 135.6 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 143.2 | 168.2 | -57 | -70.7 | -136.7 | 0 | 0 | 109.5 | V77 | M75-V77 PolarHBondContact O-N 3.07Š|
| 76 | P | 51.6 | Low | 42.8 | Very low | 129 Ų | 129 | 128.5 Ų | 128.5 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72 | 126.1 | -177.7 | 28.1 | -32.8 | 0 | 0 | 0 | 111.6 | ||
| 77 | V | 50 | Low | 43.5 | Very low | 138 Ų | 138 | 130 Ų | 130 | 84% | 0.836 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -88 | 135 | 171.7 | -78.4 | 0 | 0 | 0 | 0 | 110.9 | M75 | M75-V77 PolarHBondContact O-N 3.07Š|
| 78 | N | 38.5 | Very low | 44.3 | Very low | 132 Ų | 132 | 132 Ų | 132 | 71% | 0.706 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 122.2 | 176.6 | -177.1 | 3.3 | 0 | 0 | 0 | 111.9 | Q80 | N78-Q80 PolarHBondContact O-N 3Š|
| 79 | P | 46.1 | Very low | 45.2 | Very low | 119 Ų | 119 | 127.9 Ų | 127.9 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | -98.3 | 76.8 | -179.9 | 36.4 | -29.5 | 0 | 0 | 0 | 111.7 | ||||
| 80 | Q | 41.6 | Very low | 45.5 | Very low | 176 Ų | 176 | 132 Ų | 132 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -139 | 13.6 | 173.2 | -78.4 | -165.3 | -73.4 | 0 | 0 | 116.8 | N78 | N78-Q80 PolarHBondContact O-N 3Š| ||
| 81 | A | 39 | Very low | 46.1 | Very low | 101 Ų | 101 | 134.6 Ų | 134.6 | 84% | 0.835 | 77% | 0.773 | S | S | * | * | trans | -131.9 | 62 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 82 | S | 42.1 | Very low | 46.7 | Very low | 108 Ų | 108 | 139.5 Ų | 139.5 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | trans | -117.3 | 78.8 | 164.7 | -72.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 83 | Q | 47.9 | Very low | 47 | Very low | 189 Ų | 189 | 144.8 Ų | 144.8 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | -118 | 92.4 | 156.9 | -65.5 | -131 | 19.9 | 0 | 0 | 106.3 | V85 | Q83-V85 PolarHBondContact O-N 2.89Š| ||
| 84 | M | 42.8 | Very low | 47.4 | Very low | 183 Ų | 183 | 146.4 Ų | 146.4 | 90% | 0.901 | 76% | 0.755 | S | S | * | * | trans | -69.3 | 107.2 | 176.3 | -62 | 176.4 | 160.1 | 0 | 0 | 107.7 | S86 | M84-S86 PolarHBondContact O-N 3.48Š| ||
| 85 | V | 51 | Low | 47.4 | Very low | 112 Ų | 112 | 140.3 Ų | 140.3 | 68% | 0.679 | 74% | 0.744 | S | S | * | * | trans | -75.6 | 117.8 | 165.9 | 179.6 | 0 | 0 | 0 | 0 | 107 | Q83 Q89 | Q83-V85 PolarHBondContact O-N 2.89Å; V85-Q89 HydrophobicContact CG1-CB 4.44Å | ||
| 86 | S | 42.6 | Very low | 47.3 | Very low | 77 Ų | 77 | 140.2 Ų | 140.2 | 54% | 0.538 | 74% | 0.742 | S | S | . | * | trans | -60.9 | 138.7 | -175.7 | -133 | 0 | 0 | 0 | 0 | 111.5 | M84 D88 Q89 | M84-S86 PolarHBondContact O-N 3.48Å; S86-D88 PolarHBondContact O-N 2.98Å; S86-Q89 PolarHBondContact O-N 3.31Å; S86-Q89 VanDerWaalsContact O-N 3.12Å | ||
| 87 | P | 54.9 | Low | 46.7 | Very low | 104 Ų | 104 | 144 Ų | 144 | 68% | 0.675 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -61 | -14.9 | -174.3 | 20.5 | -30.8 | 0 | 0 | 0 | 114.9 | ||
| 88 | D | 55.6 | Low | 46.3 | Very low | 122 Ų | 122 | 145.5 Ų | 145.5 | 65% | 0.652 | 74% | 0.739 | S | S | * | * | H | α-helix | trans | -75.8 | -26.9 | 176.9 | -69.3 | -50.7 | 0 | 0 | 0 | 113.9 | S86 Y90 R91 | S86-D88 PolarHBondContact O-N 2.98Å; D88-Y90 VanDerWaalsContact C-N 3.33Å; D88-Y90 PolarHBondContact O-N 3.43Å; D88-R91 PolarHBondContact O-N 3.18Å |
| 89 | Q | 53.9 | Low | 46.4 | Very low | 143 Ų | 143 | 147.5 Ų | 147.5 | 67% | 0.668 | 74% | 0.744 | S | S | * | * | H | α-helix | trans | -74.2 | -25.7 | 179.1 | -113.4 | -161.2 | -4.2 | 0 | 0 | 112.8 | V85 S86 R91 | V85-Q89 HydrophobicContact CG1-CB 4.44Å; S86-Q89 PolarHBondContact O-N 3.31Å; S86-Q89 VanDerWaalsContact O-N 3.12Å; Q89-R91 VanDerWaalsContact C-N 3.35Å |
| 90 | Y | 45.6 | Very low | 46.3 | Very low | 160 Ų | 160 | 147.7 Ų | 147.7 | 63% | 0.627 | 75% | 0.745 | S | S | * | * | H | α-helix | trans | -71.6 | -28.9 | 178.1 | -162.9 | -96.7 | 0 | 0 | 0 | 112.4 | D88 Y94 | D88-Y90 VanDerWaalsContact C-N 3.33Å; D88-Y90 PolarHBondContact O-N 3.43Å; Y90-Y94 HydrophobicContact CD2-CD2 4.43Å; Y90-Y94 HydrophobicContact CE1-CD2 4.17Å; Y90-Y94 HydrophobicContact CE2-CD2 4.03Å; Y90-Y94 AromaticContact CE2-CE2 3.93Å; Y90-Y94 HydrophobicContact CE2-CE2 3.93Å; Y90-Y94 AromaticContact CZ-CD2 3.89Å; Y90-Y94 PolarHBondContact O-N 3.49Å |
| 91 | R | 56.1 | Low | 46.1 | Very low | 204 Ų | 204 | 147.8 Ų | 147.8 | 77% | 0.77 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -73 | -30.2 | 177.4 | -76 | -168.2 | 100.5 | 104.5 | -1.3 | 113.6 | D88 Q89 G95 | D88-R91 PolarHBondContact O-N 3.18Å; Q89-R91 VanDerWaalsContact C-N 3.35Å; R91-G95 WeakPolarHBondContact O-CA 3.35Å; R91-G95 PolarHBondContact O-N 3.16Å |
| 92 | Q | 53.8 | Low | 46.2 | Very low | 179 Ų | 179 | 151.8 Ų | 151.8 | 84% | 0.836 | 75% | 0.747 | S | S | * | * | H | α-helix | trans | -77 | -29 | 178.6 | -69.9 | -166 | -5 | 0 | 0 | 112.6 | ||
| 93 | Y | 44.5 | Very low | 46.2 | Very low | 198 Ų | 198 | 155.6 Ų | 155.6 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | H | α-helix | trans | -84.1 | -22.8 | -178 | -147.9 | -96.5 | 0 | 0 | 0 | 113.9 | ||
| 94 | Y | 49.4 | Very low | 46 | Very low | 133 Ų | 133 | 155.4 Ų | 155.4 | 52% | 0.522 | 75% | 0.752 | S | S | . | * | H | α-helix | trans | -116.8 | 7.9 | 179.7 | -76.2 | -83.2 | 0 | 0 | 0 | 114.4 | Y90 Q96 | Y90-Y94 HydrophobicContact CD2-CD2 4.43Å; Y90-Y94 HydrophobicContact CE1-CD2 4.17Å; Y90-Y94 HydrophobicContact CE2-CD2 4.03Å; Y90-Y94 AromaticContact CE2-CE2 3.93Å; Y90-Y94 HydrophobicContact CE2-CE2 3.93Å; Y90-Y94 AromaticContact CZ-CD2 3.89Å; Y90-Y94 PolarHBondContact O-N 3.49Å; Y94-Q96 VanDerWaalsContact C-N 3.29Å; Y94-Q96 PolarHBondContact O-N 3.3Å |
| 95 | G | 44.9 | Very low | 46.2 | Very low | 67 Ų | 67 | 155.1 Ų | 155.1 | 69% | 0.691 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 10.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | R91 | R91-G95 WeakPolarHBondContact O-CA 3.35Å; R91-G95 PolarHBondContact O-N 3.16Å |
| 96 | Q | 41 | Very low | 46.6 | Very low | 170 Ų | 170 | 155.2 Ų | 155.2 | 79% | 0.794 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112 | 9.5 | -172.9 | -145.3 | -175.3 | 8.9 | 0 | 0 | 115.9 | Y94 Q98 | Y94-Q96 VanDerWaalsContact C-N 3.29Å; Y94-Q96 PolarHBondContact O-N 3.3Å; Q96-Q98 VanDerWaalsContact C-N 3.31Å; Q96-Q98 PolarHBondContact O-N 3.12Å |
| 97 | Y | 39.7 | Very low | 47.7 | Very low | 208 Ų | 208 | 157 Ų | 157 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | trans | -76.4 | 90.8 | 171.2 | -73 | -78.6 | 0 | 0 | 0 | 110.7 | Q99 | Y97-Q99 PolarHBondContact O-N 2.99Š| ||
| 98 | Q | 41.6 | Very low | 48.5 | Very low | 170 Ų | 170 | 157.6 Ų | 157.6 | 79% | 0.794 | 77% | 0.765 | S | S | * | * | trans | -40.6 | 131.6 | 159 | -82.3 | 162.2 | -3.2 | 0 | 0 | 109.8 | Q96 | Q96-Q98 VanDerWaalsContact C-N 3.31Å; Q96-Q98 PolarHBondContact O-N 3.12Å | ||
| 99 | Q | 39.4 | Very low | 49.4 | Very low | 174 Ų | 174 | 157.3 Ų | 157.3 | 81% | 0.813 | 77% | 0.77 | S | S | * | * | trans | -47.4 | 138.4 | 173.9 | -66 | -151.8 | -6.8 | 0 | 0 | 110.1 | Y97 Q101 | Y97-Q99 PolarHBondContact O-N 2.99Å; Q99-Q101 VanDerWaalsContact C-N 3.33Å; Q99-Q101 PolarHBondContact O-N 3.49Å | ||
| 100 | P | 44.1 | Very low | 50.3 | Low | 124 Ų | 124 | 156.1 Ų | 156.1 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | trans | -61.5 | 105.6 | 165.8 | 24.7 | -27.9 | 0 | 0 | 0 | 106.6 | Q102 | P100-Q102 PolarHBondContact O-N 3.44Š| ||
| 101 | Q | 39.1 | Very low | 51.6 | Low | 177 Ų | 177 | 154 Ų | 154 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | trans | -48 | 127.9 | 162.6 | -74.6 | -171.5 | -7.4 | 0 | 0 | 106.5 | Q99 Q103 | Q99-Q101 VanDerWaalsContact C-N 3.33Å; Q99-Q101 PolarHBondContact O-N 3.49Å; Q101-Q103 VanDerWaalsContact C-N 3.29Å; Q101-Q103 PolarHBondContact O-N 3.48Å | ||
| 102 | Q | 39.4 | Very low | 52.5 | Low | 185 Ų | 185 | 149.9 Ų | 149.9 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -50.2 | 96.5 | 174.2 | -65.8 | 171.1 | 15.9 | 0 | 0 | 108 | P100 Q104 | P100-Q102 PolarHBondContact O-N 3.44Å; Q102-Q104 VanDerWaalsContact C-N 3.33Å; Q102-Q104 PolarHBondContact O-N 3.28Å | ||
| 103 | Q | 43 | Very low | 53.2 | Low | 189 Ų | 189 | 146.9 Ų | 146.9 | 88% | 0.883 | 78% | 0.776 | S | S | * | * | trans | -68 | 102.5 | 171.4 | -89.8 | 179.3 | 5.3 | 0 | 0 | 106 | Q101 Q105 | Q101-Q103 VanDerWaalsContact C-N 3.29Å; Q101-Q103 PolarHBondContact O-N 3.48Å; Q103-Q105 PolarHBondContact O-N 3.05Å | ||
| 104 | Q | 44.1 | Very low | 53.7 | Low | 184 Ų | 184 | 143.5 Ų | 143.5 | 86% | 0.86 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 118.8 | 175.9 | -63.1 | 169.8 | 24.1 | 0 | 0 | 108 | Q102 | Q102-Q104 VanDerWaalsContact C-N 3.33Å; Q102-Q104 PolarHBondContact O-N 3.28Å |
| 105 | Q | 46.8 | Very low | 54.1 | Low | 178 Ų | 178 | 142.9 Ų | 142.9 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 136.3 | 173.4 | -65.7 | -159.8 | -28.9 | 0 | 0 | 108.8 | Q103 | Q103-Q105 PolarHBondContact O-N 3.05Š|
| 106 | P | 59.3 | Low | 54.4 | Low | 114 Ų | 114 | 144.6 Ų | 144.6 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 140.5 | 170.4 | 26.1 | -32.1 | 0 | 0 | 0 | 109.1 | ||
| 107 | P | 65.4 | Low | 54.5 | Low | 115 Ų | 115 | 139.8 Ų | 139.8 | 75% | 0.747 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 150.2 | -179.5 | 26.6 | -33.6 | 0 | 0 | 0 | 110.9 | ||
| 108 | P | 72.3 | Confident | 55.2 | Low | 116 Ų | 116 | 138.8 Ų | 138.8 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 150.5 | 175.4 | 27.5 | -34.1 | 0 | 0 | 0 | 111 | ||
| 109 | P | 73.6 | Confident | 55.4 | Low | 116 Ų | 116 | 136.9 Ų | 136.9 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 148.6 | 178.5 | 26.9 | -33.9 | 0 | 0 | 0 | 111.4 | ||
| 110 | P | 73.5 | Confident | 55.7 | Low | 117 Ų | 117 | 132.6 Ų | 132.6 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 149.8 | -177.9 | 27.8 | -34.2 | 0 | 0 | 0 | 111.8 | ||
| 111 | P | 73.2 | Confident | 55.9 | Low | 115 Ų | 115 | 130.1 Ų | 130.1 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 152.2 | 174.5 | 28.4 | -33.9 | 0 | 0 | 0 | 111.3 | ||
| 112 | P | 74.4 | Confident | 56.7 | Low | 118 Ų | 118 | 127 Ų | 127 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 147.9 | 177.5 | 27 | -34.2 | 0 | 0 | 0 | 111.2 | ||
| 113 | P | 69 | Low | 57.1 | Low | 117 Ų | 117 | 124.6 Ų | 124.6 | 76% | 0.76 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 147.3 | -177.6 | 27.1 | -34.3 | 0 | 0 | 0 | 111.5 | S115 | P113-S115 PolarHBondContact O-N 3.45Š|
| 114 | P | 55.1 | Low | 57.6 | Low | 126 Ų | 126 | 123.7 Ų | 123.7 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -68 | 117.2 | 177.5 | 28.2 | -31.4 | 0 | 0 | 0 | 108.9 | S116 | P114-S116 PolarHBondContact O-N 3.44Š|
| 115 | S | 57 | Low | 57.7 | Low | 121 Ų | 121 | 123.9 Ų | 123.9 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -63 | 106.3 | 171.2 | -172 | 0 | 0 | 0 | 0 | 108.3 | P113 G117 | P113-S115 PolarHBondContact O-N 3.45Å; S115-G117 PolarHBondContact O-N 3.18Å | ||
| 116 | S | 51.5 | Low | 57.9 | Low | 103 Ų | 103 | 126.5 Ų | 126.5 | 72% | 0.72 | 79% | 0.794 | S | S | * | * | trans | -46.2 | 128.4 | 171.4 | 44.5 | 0 | 0 | 0 | 0 | 110.8 | P114 | P114-S116 PolarHBondContact O-N 3.44Š| ||
| 117 | G | 42.8 | Very low | 57.7 | Low | 68 Ų | 68 | 129.6 Ų | 129.6 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | trans | -66.1 | 151.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | S115 | S115-G117 PolarHBondContact O-N 3.18Š| ||
| 118 | H | 54.2 | Low | 57.2 | Low | 188 Ų | 188 | 129.6 Ų | 129.6 | 87% | 0.87 | 80% | 0.799 | S | S | * | * | trans | -117.2 | 134.4 | 149.8 | -83 | -68.5 | 0 | 0 | 0 | 108.6 | ||||
| 119 | P | 46.6 | Very low | 57.1 | Low | 130 Ų | 130 | 130 Ų | 130 | 84% | 0.844 | 80% | 0.801 | S | S | * | * | trans | -89.9 | 149.9 | -177.1 | 35.8 | -31.6 | 0 | 0 | 0 | 110.9 | ||||
| 120 | G | 44.5 | Very low | 55.9 | Low | 84 Ų | 84 | 130.6 Ų | 130.6 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | 123.5 | 114.2 | 154.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 121 | G | 48.4 | Very low | 54.5 | Low | 72 Ų | 72 | 128.2 Ų | 128.2 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | 142.8 | 107.6 | 158.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 122 | P | 56 | Low | 53.5 | Low | 111 Ų | 111 | 133.2 Ų | 133.2 | 72% | 0.721 | 81% | 0.812 | S | S | * | * | trans | -80.8 | 169.6 | -176.1 | 35.9 | -34.5 | 0 | 0 | 0 | 112.5 | ||||
| 123 | P | 48.9 | Very low | 52 | Low | 134 Ų | 134 | 130.4 Ų | 130.4 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | trans | -85.9 | 132.7 | -147.1 | 33.8 | -32.3 | 0 | 0 | 0 | 111.9 | ||||
| 124 | M | 52.1 | Low | 50.9 | Low | 171 Ų | 171 | 133.8 Ų | 133.8 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | trans | -133.3 | 124.1 | 167.7 | 56.9 | -173.2 | 83.6 | 0 | 0 | 111.1 | ||||
| 125 | M | 47.2 | Very low | 50.6 | Low | 188 Ų | 188 | 132.9 Ų | 132.9 | 93% | 0.926 | 80% | 0.804 | S | S | * | * | trans | -41.9 | 131.4 | 178.8 | -67.8 | 151.9 | 137.5 | 0 | 0 | 114.1 | ||||
| 126 | R | 50.5 | Low | 49.9 | Very low | 233 Ų | 233 | 132.2 Ų | 132.2 | 88% | 0.879 | 80% | 0.799 | S | S | * | * | trans | -143.5 | 100.2 | 159.6 | -77.8 | -176.2 | 166 | -101 | -0.5 | 107.7 | ||||
| 127 | Q | 54.5 | Low | 49.6 | Very low | 178 Ų | 178 | 137.4 Ų | 137.4 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | 58 | 125.2 | 90.5 | -67.7 | -164.9 | 14.5 | 0 | 0 | 114 | |||||
| 128 | P | 56.1 | Low | 49.5 | Very low | 116 Ų | 116 | 138.1 Ų | 138.1 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 149.3 | 176.4 | 33.2 | -32.3 | 0 | 0 | 0 | 110.1 | ||
| 129 | P | 69.5 | Low | 48.7 | Very low | 125 Ų | 125 | 132.8 Ų | 132.8 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 140 | -173.5 | 29.3 | -33 | 0 | 0 | 0 | 111.7 | ||
| 130 | P | 48.9 | Very low | 48.4 | Very low | 127 Ų | 127 | 130.8 Ų | 130.8 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 149.5 | 169.8 | 34.6 | -30.1 | 0 | 0 | 0 | 111 | ||
| 131 | G | 44.9 | Very low | 48.3 | Very low | 68 Ų | 68 | 133.9 Ų | 133.9 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 172.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 132 | K | 51.3 | Low | 47.9 | Very low | 220 Ų | 220 | 135.3 Ų | 135.3 | 96% | 0.957 | 80% | 0.798 | S | S | * | * | trans | 167.5 | 139.3 | 161.1 | -91.7 | 157.9 | -170 | -167.1 | 0 | 105.9 | ||||
| 133 | G | 42.4 | Very low | 47.4 | Very low | 59 Ų | 59 | 141.6 Ų | 141.6 | 61% | 0.608 | 81% | 0.807 | S | S | * | * | cis | -170.9 | 145.9 | 2.7 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 134 | Q | 45.5 | Very low | 47 | Very low | 188 Ų | 188 | 143.9 Ų | 143.9 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | 88.3 | 160.6 | 95.8 | -76.8 | -161.6 | -66.7 | 0 | 0 | 113.6 | |||||
| 135 | P | 50.6 | Low | 47.4 | Very low | 107 Ų | 107 | 141.4 Ų | 141.4 | 70% | 0.695 | 81% | 0.805 | S | S | * | * | -142.5 | -173 | -62.3 | 39.5 | -19.6 | 0 | 0 | 0 | 113.6 | |||||
| 136 | S | 41.9 | Very low | 47.6 | Very low | 106 Ų | 106 | 138.3 Ų | 138.3 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | trans | 83.4 | 136.1 | 160.2 | -134 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 137 | Y | 43.8 | Very low | 47.1 | Very low | 212 Ų | 212 | 134.8 Ų | 134.8 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | cis | -165 | 149.7 | 30.9 | 48.9 | -87.9 | 0 | 0 | 0 | 111.2 | ||||
| 138 | G | 41.8 | Very low | 46.5 | Very low | 84 Ų | 84 | 138.4 Ų | 138.4 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | trans | 67.4 | 136.6 | 154.9 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 139 | G | 37 | Very low | 45.7 | Very low | 75 Ų | 75 | 140.2 Ų | 140.2 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | cis | 151.9 | 126.1 | 10 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 140 | A | 39.8 | Very low | 44.2 | Very low | 89 Ų | 89 | 139.1 Ų | 139.1 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | 57.6 | 107.3 | 158.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 141 | N | 42.6 | Very low | 44 | Very low | 148 Ų | 148 | 143.7 Ų | 143.7 | 79% | 0.791 | 79% | 0.792 | S | S | * | * | 161.8 | 120.3 | 105.7 | -90.1 | -38.8 | 0 | 0 | 0 | 113 | |||||
| 142 | S | 40.5 | Very low | 43.7 | Very low | 102 Ų | 102 | 150.1 Ų | 150.1 | 71% | 0.713 | 80% | 0.796 | S | S | * | * | 62.8 | 121.7 | 126.6 | -55 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 143 | R | 45.3 | Very low | 43.1 | Very low | 244 Ų | 244 | 146.9 Ų | 146.9 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | trans | 95.5 | 103.2 | 149 | -70.2 | 177.4 | 174.4 | -179.1 | -2.2 | 118.4 | ||||
| 144 | M | 40.5 | Very low | 42.8 | Very low | 182 Ų | 182 | 149.3 Ų | 149.3 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 151 | 162.7 | -60.5 | -171.8 | 161.7 | 0 | 0 | 112.8 | ||
| 145 | P | 60.2 | Low | 42.7 | Very low | 118 Ų | 118 | 145.7 Ų | 145.7 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 147.1 | 152.6 | 32.9 | -26.5 | 0 | 0 | 0 | 110.6 | ||
| 146 | P | 51.7 | Low | 42.1 | Very low | 124 Ų | 124 | 146.4 Ų | 146.4 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 140 | -162.8 | 31.6 | -33.3 | 0 | 0 | 0 | 113.2 | ||
| 147 | Q | 40.6 | Very low | 41.9 | Very low | 158 Ų | 158 | 144.8 Ų | 144.8 | 74% | 0.738 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 134.8 | 162.9 | -69 | -158.4 | -42.2 | 0 | 0 | 110.4 | H149 | Q147-H149 VanDerWaalsContact C-N 3.32Å; Q147-H149 PolarHBondContact O-N 3.01Å; Q147-H149 PolarHBondContact O-ND1 2.84Å |
| 148 | R | 40.9 | Very low | 41.8 | Very low | 255 Ų | 255 | 142.6 Ų | 142.6 | 96% | 0.962 | 79% | 0.794 | S | S | * | * | trans | -73.9 | 87 | 176.2 | -153.2 | 178.6 | -163.1 | -85.8 | 2.9 | 108.3 | S150 | R148-S150 PolarHBondContact O-N 3.46Š| ||
| 149 | H | 40 | Very low | 41.6 | Very low | 154 Ų | 154 | 145.8 Ų | 145.8 | 71% | 0.713 | 79% | 0.787 | S | S | * | * | trans | -65.2 | 125.5 | 175.9 | -63.8 | 109.6 | 0 | 0 | 0 | 110.5 | Q147 R151 | Q147-H149 VanDerWaalsContact C-N 3.32Å; Q147-H149 PolarHBondContact O-N 3.01Å; Q147-H149 PolarHBondContact O-ND1 2.84Å; H149-R151 PolarHBondContact O-N 2.7Å | ||
| 150 | S | 38.4 | Very low | 41.9 | Very low | 101 Ų | 101 | 148.2 Ų | 148.2 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | trans | -54.3 | 132.3 | 162.9 | -62.2 | 0 | 0 | 0 | 0 | 109.1 | R148 W152 | R148-S150 PolarHBondContact O-N 3.46Å; S150-W152 PolarHBondContact O-N 2.91Å | ||
| 151 | R | 44.6 | Very low | 42 | Very low | 223 Ų | 223 | 151.7 Ų | 151.7 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -64.5 | 8.5 | -175.6 | -166.6 | 175.9 | -170.8 | -150.3 | 1.8 | 114.8 | H149 | H149-R151 PolarHBondContact O-N 2.7Š|
| 152 | W | 39.2 | Very low | 41.9 | Very low | 203 Ų | 203 | 148.1 Ų | 148.1 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -139 | 94.4 | -175.9 | -49.1 | 100.3 | 0 | 0 | 0 | 104.4 | S150 | S150-W152 PolarHBondContact O-N 2.91Š|
| 153 | D | 38.8 | Very low | 41.7 | Very low | 153 Ų | 153 | 146.7 Ų | 146.7 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | 160.4 | 105.5 | 150.4 | -81 | -47.4 | 0 | 0 | 0 | 112 | ||||
| 154 | S | 35.7 | Very low | 41.5 | Very low | 110 Ų | 110 | 145.7 Ų | 145.7 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | 77 | 164.8 | 143.4 | -59.2 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 155 | P | 43.3 | Very low | 41.3 | Very low | 111 Ų | 111 | 145.3 Ų | 145.3 | 72% | 0.721 | 78% | 0.782 | S | S | * | * | cis | -141.3 | 173.6 | -37.2 | 35.3 | -16.4 | 0 | 0 | 0 | 114.5 | ||||
| 156 | S | 37.1 | Very low | 40.6 | Very low | 122 Ų | 122 | 148 Ų | 148 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | trans | 64.6 | 120 | 152 | 61.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 157 | G | 38.8 | Very low | 40 | Very low | 72 Ų | 72 | 149.4 Ų | 149.4 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | 162.5 | 74.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 158 | Q | 40.3 | Very low | 40.1 | Very low | 166 Ų | 166 | 149.8 Ų | 149.8 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | 68 | 106.6 | 83.6 | -158.4 | 171.4 | 70.9 | 0 | 0 | 111.1 | |||||
| 159 | Q | 38.2 | Very low | 39.9 | Very low | 151 Ų | 151 | 148 Ų | 148 | 71% | 0.706 | 79% | 0.788 | S | S | * | * | trans | 72.4 | 123 | 146 | -74 | 171.4 | 45.1 | 0 | 0 | 114.4 | ||||
| 160 | D | 43.7 | Very low | 40 | Very low | 126 Ų | 126 | 147.7 Ų | 147.7 | 67% | 0.674 | 79% | 0.791 | S | S | * | * | cis | -169.5 | 157.2 | 34.2 | -65.9 | -55.1 | 0 | 0 | 0 | 112.1 | ||||
| 161 | D | 42 | Very low | 40.1 | Very low | 162 Ų | 162 | 154.1 Ų | 154.1 | 87% | 0.866 | 80% | 0.8 | S | S | * | * | trans | 55 | 121.5 | 145.8 | -77.3 | -73.7 | 0 | 0 | 0 | 124.1 | ||||
| 162 | G | 39.2 | Very low | 39.9 | Very low | 73 Ų | 73 | 149.1 Ų | 149.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | 120.4 | 58 | 115.8 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 163 | G | 36.5 | Very low | 39.9 | Very low | 72 Ų | 72 | 142.9 Ų | 142.9 | 74% | 0.742 | 80% | 0.798 | S | S | * | * | 80.8 | 147.2 | 121.6 | 0 | 0 | 0 | 0 | 0 | 123.3 | |||||
| 164 | R | 42.7 | Very low | 40.2 | Very low | 223 Ų | 223 | 142 Ų | 142 | 84% | 0.842 | 80% | 0.804 | S | S | * | * | trans | 82.2 | 97.9 | 149.1 | -48.8 | -171.3 | -166.1 | -172.3 | 5 | 116 | ||||
| 165 | M | 36 | Very low | 40.5 | Very low | 175 Ų | 175 | 139.7 Ų | 139.7 | 86% | 0.862 | 80% | 0.797 | S | S | * | * | 46.2 | 108.7 | 70 | -46.4 | -173.1 | -160.7 | 0 | 0 | 112.9 | |||||
| 166 | M | 45.7 | Very low | 40.6 | Very low | 173 Ų | 173 | 145.2 Ų | 145.2 | 85% | 0.852 | 81% | 0.806 | S | S | * | * | trans | -172.9 | 112.2 | 145.9 | -99.8 | 154.7 | -160.3 | 0 | 0 | 111.5 | ||||
| 167 | D | 38.1 | Very low | 41.3 | Very low | 154 Ų | 154 | 144.3 Ų | 144.3 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -48.8 | 144.6 | 154.5 | -57.1 | -92.5 | 0 | 0 | 0 | 111.6 | ||||
| 168 | N | 43.3 | Very low | 41.5 | Very low | 167 Ų | 167 | 150 Ų | 150 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | trans | -150.4 | 97.1 | 151 | -95.2 | -24.9 | 0 | 0 | 0 | 110 | ||||
| 169 | R | 36.9 | Very low | 41.5 | Very low | 217 Ų | 217 | 146 Ų | 146 | 82% | 0.819 | 81% | 0.807 | S | S | * | * | trans | -61.4 | 163 | 144.9 | -77.1 | 177.1 | 174.2 | 153.4 | -0.4 | 109 | ||||
| 170 | D | 42.3 | Very low | 41.7 | Very low | 147 Ų | 147 | 142 Ų | 142 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | trans | 85.9 | 92.7 | 159.8 | -47.4 | -49 | 0 | 0 | 0 | 117.9 | ||||
| 171 | R | 39.9 | Very low | 41.6 | Very low | 237 Ų | 237 | 144.7 Ų | 144.7 | 89% | 0.894 | 82% | 0.819 | S | S | * | * | trans | 177.6 | 94.8 | 131.6 | -106.9 | 167.3 | 170.6 | 167 | -0.9 | 110.1 | ||||
| 172 | S | 39.7 | Very low | 41.5 | Very low | 117 Ų | 117 | 140.1 Ų | 140.1 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | 63.7 | 124.3 | 79.9 | 74.2 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 173 | G | 40.4 | Very low | 41.8 | Very low | 73 Ų | 73 | 143.3 Ų | 143.3 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | trans | 129.5 | 85.4 | 167.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 174 | S | 44.8 | Very low | 42 | Very low | 133 Ų | 133 | 143.2 Ų | 143.2 | 93% | 0.93 | 82% | 0.817 | S | S | * | * | 81.8 | 125.6 | 95.8 | -165.9 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 175 | G | 41.7 | Very low | 42.3 | Very low | 62 Ų | 62 | 142.2 Ų | 142.2 | 64% | 0.639 | 82% | 0.819 | S | S | * | * | cis | -172.6 | 140.5 | 7.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 176 | Y | 44.4 | Very low | 42.5 | Very low | 228 Ų | 228 | 145.9 Ų | 145.9 | 89% | 0.894 | 82% | 0.823 | S | S | * | * | trans | -15.1 | -178.5 | 150.8 | -54.8 | -79.3 | 0 | 0 | 0 | 120.2 | ||||
| 177 | P | 53.4 | Low | 42.3 | Very low | 102 Ų | 102 | 140.5 Ų | 140.5 | 66% | 0.662 | 81% | 0.812 | S | S | * | * | -146 | -162.2 | -50.3 | 41.3 | -22.6 | 0 | 0 | 0 | 112.4 | |||||
| 178 | Q | 43 | Very low | 42.5 | Very low | 191 Ų | 191 | 140.8 Ų | 140.8 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | trans | 118.6 | 126.8 | 130 | -126.1 | -179.3 | 52.5 | 0 | 0 | 118.8 | ||||
| 179 | G | 39.5 | Very low | 42.3 | Very low | 82 Ų | 82 | 138.8 Ų | 138.8 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 99.4 | 121.3 | 156.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 180 | G | 42 | Very low | 42.7 | Very low | 68 Ų | 68 | 139.1 Ų | 139.1 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | cis | 135.3 | 112.7 | 12.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 181 | I | 42.9 | Very low | 42.8 | Very low | 182 Ų | 182 | 140.5 Ų | 140.5 | 93% | 0.933 | 81% | 0.812 | S | S | * | * | trans | 71.8 | 119.2 | 141.7 | -49 | 164.5 | 0 | 0 | 0 | 118.7 | ||||
| 182 | G | 40 | Very low | 42.9 | Very low | 67 Ų | 67 | 136.1 Ų | 136.1 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | 128.4 | 121.3 | 138.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 183 | P | 43.7 | Very low | 43 | Very low | 140 Ų | 140 | 139.8 Ų | 139.8 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | trans | -92 | 133.6 | -178 | 35.2 | -28.8 | 0 | 0 | 0 | 111.6 | ||||
| 184 | G | 42.5 | Very low | 42.8 | Very low | 70 Ų | 70 | 139 Ų | 139 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | 164.6 | 100.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 185 | K | 47.3 | Very low | 42.7 | Very low | 201 Ų | 201 | 139.9 Ų | 139.9 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | 42.1 | 103.3 | 139.8 | -51.4 | -165.8 | -178.4 | -157.6 | 0 | 118.1 | ||||
| 186 | R | 41.7 | Very low | 43.1 | Very low | 252 Ų | 252 | 143.1 Ų | 143.1 | 95% | 0.951 | 81% | 0.809 | S | S | * | * | trans | 171.7 | 110.4 | 137.6 | -91.9 | 162.3 | -142.8 | -157.3 | 5.5 | 103.5 | ||||
| 187 | G | 41.5 | Very low | 43.1 | Very low | 61 Ų | 61 | 134.6 Ų | 134.6 | 63% | 0.629 | 79% | 0.791 | S | S | * | * | 93.2 | 126.4 | 68.8 | 0 | 0 | 0 | 0 | 0 | 106.1 | |||||
| 188 | D | 42.4 | Very low | 42.6 | Very low | 160 Ų | 160 | 140.4 Ų | 140.4 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | trans | 97.6 | 117.3 | 166.3 | -41.6 | -46.5 | 0 | 0 | 0 | 116.7 | ||||
| 189 | V | 39 | Very low | 42.3 | Very low | 124 Ų | 124 | 134.8 Ų | 134.8 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | 84.5 | 63.5 | 158.5 | -152.4 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 190 | Y | 44.6 | Very low | 42.6 | Very low | 224 Ų | 224 | 137.2 Ų | 137.2 | 88% | 0.878 | 79% | 0.793 | S | S | * | * | trans | -123.1 | 93.2 | 136.7 | -88.9 | -82.7 | 0 | 0 | 0 | 108.2 | ||||
| 191 | Q | 44.2 | Very low | 42.8 | Very low | 177 Ų | 177 | 142.6 Ų | 142.6 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | -69.9 | 141.2 | 160.9 | -157.8 | 149.5 | 15.1 | 0 | 0 | 107 | ||||
| 192 | D | 43 | Very low | 42.8 | Very low | 144 Ų | 144 | 139.1 Ų | 139.1 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | trans | 84.4 | 67.9 | 167.7 | -138.3 | -110.6 | 0 | 0 | 0 | 117.5 | ||||
| 193 | Q | 41.4 | Very low | 43 | Very low | 194 Ų | 194 | 141.1 Ų | 141.1 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -135 | 67.4 | 150.6 | -84.4 | -176.9 | 58.2 | 0 | 0 | 109 | ||||
| 194 | G | 36 | Very low | 42.9 | Very low | 56 Ų | 56 | 140 Ų | 140 | 58% | 0.577 | 77% | 0.774 | S | S | * | * | trans | -128.5 | 136 | 157.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 195 | D | 42.9 | Very low | 42.8 | Very low | 153 Ų | 153 | 140.8 Ų | 140.8 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | 84.8 | 83.7 | 176.4 | -149.1 | 49.2 | 0 | 0 | 0 | 117.2 | ||||
| 196 | S | 49.6 | Very low | 42.8 | Very low | 130 Ų | 130 | 136.3 Ų | 136.3 | 91% | 0.909 | 76% | 0.761 | S | S | * | * | trans | -134.1 | 55.7 | 145.1 | -73.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 197 | G | 44.6 | Very low | 43.1 | Very low | 49 Ų | 49 | 129.8 Ų | 129.8 | 51% | 0.505 | 75% | 0.746 | S | S | . | * | trans | -62.5 | 139.1 | 160.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | G199 | G197-G199 PolarHBondContact O-N 2.81Š| ||
| 198 | Y | 42.2 | Very low | 43.8 | Very low | 224 Ų | 224 | 131.7 Ų | 131.7 | 88% | 0.878 | 75% | 0.745 | S | S | * | * | trans | -17.9 | 105.7 | 170.1 | -65.9 | -90.2 | 0 | 0 | 0 | 112.7 | T200 | Y198-T200 VanDerWaalsContact C-N 3.26Å; Y198-T200 PolarHBondContact O-N 3.2Å; Y198-T200 PolarHBondContact O-OG1 2.71Å | ||
| 199 | G | 36.8 | Very low | 45.3 | Very low | 72 Ų | 72 | 125.7 Ų | 125.7 | 74% | 0.742 | 71% | 0.713 | S | S | * | * | trans | -51.4 | 95.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | G197 K201 | G197-G199 PolarHBondContact O-N 2.81Å; G199-K201 PolarHBondContact O-N 3.46Å | ||
| 200 | T | 45.4 | Very low | 47.7 | Very low | 134 Ų | 134 | 122.3 Ų | 122.3 | 82% | 0.822 | 69% | 0.691 | S | S | * | * | trans | -66.1 | 100.7 | 165.1 | -53.7 | 0 | 0 | 0 | 0 | 102.4 | Y198 P202 | Y198-T200 VanDerWaalsContact C-N 3.26Å; Y198-T200 PolarHBondContact O-N 3.2Å; Y198-T200 PolarHBondContact O-OG1 2.71Å; T200-P202 VanDerWaalsContact O-N 3.15Å | ||
| 201 | K | 46.7 | Very low | 50 | Low | 181 Ų | 181 | 112.6 Ų | 112.6 | 79% | 0.787 | 66% | 0.657 | S | S | * | * | trans | -39.3 | 125.2 | 177.5 | -44.4 | 176.7 | -175.9 | -171.5 | 0 | 106.7 | G199 | G199-K201 PolarHBondContact O-N 3.46Š| ||
| 202 | P | 42.5 | Very low | 52.3 | Low | 108 Ų | 108 | 104.2 Ų | 104.2 | 70% | 0.701 | 62% | 0.617 | S | S | * | * | trans | -47.4 | 140.1 | 166.9 | -20.6 | 30.6 | 0 | 0 | 0 | 106.9 | T200 D204 | T200-P202 VanDerWaalsContact O-N 3.15Å; P202-D204 PolarHBondContact O-N 3.37Å | ||
| 203 | P | 45.5 | Very low | 54.7 | Low | 109 Ų | 109 | 99.2 Ų | 99.2 | 71% | 0.708 | 59% | 0.589 | S | S | * | * | trans | -53.9 | 113.3 | 173.7 | 24.5 | -31.6 | 0 | 0 | 0 | 105.4 | S205 | P203-S205 PolarHBondContact O-N 2.93Å; P203-S205 PolarHBondContact O-OG 3.43Å | ||
| 204 | D | 40.5 | Very low | 57.2 | Low | 118 Ų | 118 | 90 Ų | 90 | 63% | 0.631 | 55% | 0.546 | S | S | * | . | trans | -63.8 | 80 | 172.5 | -176.7 | 8.7 | 0 | 0 | 0 | 106.5 | P202 | P202-D204 PolarHBondContact O-N 3.37Š| ||
| 205 | S | 42.2 | Very low | 59.8 | Low | 86 Ų | 86 | 90.9 Ų | 90.9 | 60% | 0.601 | 54% | 0.535 | S | S | * | . | trans | -89.2 | 113.9 | 172.4 | -47.5 | 0 | 0 | 0 | 0 | 101.8 | P203 | P203-S205 PolarHBondContact O-N 2.93Å; P203-S205 PolarHBondContact O-OG 3.43Å | ||
| 206 | S | 46.6 | Very low | 62 | Low | 106 Ų | 106 | 84.5 Ų | 84.5 | 74% | 0.741 | 51% | 0.506 | S | S | * | . | trans | 102.8 | 7.9 | 160.6 | 81.8 | 0 | 0 | 0 | 0 | 121.6 | V208 | S206-V208 PolarHBondContact O-N 2.87Š| ||
| 207 | D | 47.6 | Very low | 63.8 | Low | 116 Ų | 116 | 78.8 Ų | 78.8 | 62% | 0.62 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -69.8 | 81.4 | 154.2 | -83.4 | -10.7 | 0 | 0 | 0 | 108.3 | N209 | D207-N209 VanDerWaalsContact C-N 3.3Å; D207-N209 VanDerWaalsContact O-CG 3.28Å; D207-N209 PolarHBondContact O-N 2.75Å; D207-N209 PolarHBondContact O-OD1 2.86Å |
| 208 | V | 57 | Low | 65.6 | Low | 100 Ų | 100 | 76.9 Ų | 76.9 | 61% | 0.606 | 44% | 0.443 | S | S | * | . | trans | -19.9 | 77.8 | -179.6 | -83.3 | 0 | 0 | 0 | 0 | 114.2 | S206 N210 P268 | S206-V208 PolarHBondContact O-N 2.87Å; V208-N210 PolarHBondContact O-N 2.76Å; V208-N210 PolarHBondContact O-OD1 2.92Å; V208-P268 HydrophobicContact CB-CB 3.56Å; V208-P268 HydrophobicContact CB-CG 3.85Å; V208-P268 HydrophobicContact CG1-CB 3.63Å; V208-P268 HydrophobicContact CG1-CG 3.71Å | ||
| 209 | N | 73.9 | Confident | 67.4 | Low | 35 Ų | 35 | 70.9 Ų | 70.9 | 19% | 0.187 | 43% | 0.427 | C | S | . | . | trans | -73.7 | 97.6 | 177.7 | -76.6 | -43.3 | 0 | 0 | 0 | 107.7 | D207 A211 A271 Y294 T297 | D207-N209 VanDerWaalsContact C-N 3.3Å; D207-N209 VanDerWaalsContact O-CG 3.28Å; D207-N209 PolarHBondContact O-N 2.75Å; D207-N209 PolarHBondContact O-OD1 2.86Å; N209-A211 PolarHBondContact O-N 3.05Å; N209-A271 VanDerWaalsContact O-CB 3.3Å; N209-A271 WeakPolarHBondContact O-CB 3.26Å; N209-Y294 HydrophobicContact CB-CD1 3.83Å; N209-Y294 HydrophobicContact CB-CG 4.4Å; N209-T297 VanDerWaalsContact OD1-CG2 3.27Å; N209-T297 WeakPolarHBondContact OD1-CG2 3.3Å | ||
| 210 | N | 89 | Confident | 69.2 | Low | 53 Ų | 53 | 72 Ų | 72 | 28% | 0.283 | 41% | 0.413 | S | S | . | . | trans | -62.2 | -9.1 | 172 | -65 | -14.4 | 0 | 0 | 0 | 112.4 | V208 F265 P268 | V208-N210 PolarHBondContact O-N 2.76Å; V208-N210 PolarHBondContact O-OD1 2.92Å; N210-F265 WeakPolarHBondContact O-CB 3.31Å; N210-F265 PolarHBondContact O-N 3.48Å; N210-P268 WeakPolarHBondContact OD1-CA 3.24Å; N210-P268 WeakPolarHBondContact OD1-CB 3.39Å; N210-P268 WeakPolarHBondContact OD1-CD 2.96Å | ||
| 211 | A | 91.7 | Very high | 70.8 | Confident | 20 Ų | 20 | 65.7 Ų | 65.7 | 17% | 0.165 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.3 | 137.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | N209 L262 V263 A295 | N209-A211 PolarHBondContact O-N 3.05Å; A211-L262 HydrophobicContact CB-CD2 4.27Å; A211-V263 CarbonylContact C-O 3.5Å; A211-V263 VanDerWaalsContact CA-O 3.22Å; A211-V263 WeakPolarHBondContact CA-O 3.24Å; A211-A295 HydrophobicContact CB-CB 3.74Å; A211-A295 VanDerWaalsContact O-CB 3.25Å; A211-A295 WeakPolarHBondContact O-CB 3.36Å; A211-A295 PolarHBondContact O-N 2.96Å |
| 212 | I | 93.9 | Very high | 72.6 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 146.7 | 171.6 | 63.1 | 168.8 | 0 | 0 | 0 | 109.9 | I214 F230 L262 V263 F265 A271 A274 I275 V292 T293 | I212-I214 HydrophobicContact CD1-CD1 3.97Å; I212-I214 HydrophobicContact CD1-CG1 3.99Å; I212-I214 HydrophobicContact CG1-CD1 4.26Å; I212-I214 HydrophobicContact CG1-CG1 4.28Å; I212-F230 HydrophobicContact CD1-CD1 3.51Å; I212-F230 HydrophobicContact CD1-CE1 3.6Å; I212-F230 HydrophobicContact CD1-CG 4.32Å; I212-F230 HydrophobicContact CD1-CZ 4.49Å; I212-L262 WeakPolarHBondContact O-CA 3.44Å; I212-V263 HydrophobicContact CD1-CB 4.26Å; I212-V263 HydrophobicContact CG1-CB 3.82Å; I212-V263 PolarHBondContact N-O 2.93Å; I212-V263 PolarHBondContact O-N 2.93Å; I212-F265 HydrophobicContact CD1-CE2 3.6Å; I212-F265 HydrophobicContact CD1-CZ 4.07Å; I212-F265 HydrophobicContact CG1-CE2 3.75Å; I212-F265 HydrophobicContact CG2-CD2 4.46Å; I212-F265 HydrophobicContact CG2-CE2 4.08Å; I212-A271 HydrophobicContact CG2-CB 3.78Å; I212-A274 HydrophobicContact CD1-CB 3.96Å; I212-I275 HydrophobicContact CG2-CD1 4.15Å; I212-I275 HydrophobicContact CG2-CG1 4.02Å; I212-V292 HydrophobicContact CB-CG1 4.11Å; I212-V292 HydrophobicContact CD1-CG1 3.77Å; I212-V292 HydrophobicContact CG1-CG1 4.44Å; I212-T293 CarbonylContact C-O 3.57Å; I212-T293 WeakPolarHBondContact CA-O 3.11Å |
| 213 | F | 93.9 | Very high | 74.8 | Confident | 40 Ų | 40 | 57.1 Ų | 57.1 | 18% | 0.175 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 128.7 | 170.7 | -171.2 | -98.7 | 0 | 0 | 0 | 109.1 | Q215 Y249 E260 T293 A295 | F213-Q215 HydrophobicContact CD1-CG 3.91Å; F213-Q215 HydrophobicContact CE1-CG 3.48Å; F213-Q215 VanDerWaalsContact CE1-CG 3.48Å; F213-Y249 HydrophobicContact CD2-CE2 4.3Å; F213-Y249 HydrophobicContact CE2-CD2 4.02Å; F213-Y249 AromaticContact CE2-CE2 3.58Å; F213-Y249 HydrophobicContact CE2-CE2 3.58Å; F213-E260 HydrophobicContact CE1-CG 4.47Å; F213-E260 HydrophobicContact CZ-CB 3.93Å; F213-E260 HydrophobicContact CZ-CG 4.13Å; F213-T293 PolarHBondContact N-O 2.81Å; F213-T293 PolarHBondContact O-N 3.31Å; F213-T293 PolarHBondContact O-OG1 2.96Å; F213-A295 HydrophobicContact CB-CB 4.33Å |
| 214 | I | 93 | Very high | 76.9 | Confident | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 132.9 | -174.5 | -52.9 | 142.3 | 0 | 0 | 0 | 108.4 | I212 I217 V226 F230 E260 A261 V263 M290 K291 V292 | I212-I214 HydrophobicContact CD1-CD1 3.97Å; I212-I214 HydrophobicContact CD1-CG1 3.99Å; I212-I214 HydrophobicContact CG1-CD1 4.26Å; I212-I214 HydrophobicContact CG1-CG1 4.28Å; I214-I217 HydrophobicContact CB-CD1 3.85Å; I214-I217 HydrophobicContact CB-CG1 4.44Å; I214-I217 HydrophobicContact CD1-CD1 4.42Å; I214-I217 HydrophobicContact CG2-CD1 3.57Å; I214-I217 HydrophobicContact CG2-CG1 3.65Å; I214-V226 HydrophobicContact CD1-CG1 4.32Å; I214-F230 HydrophobicContact CB-CZ 4.36Å; I214-F230 HydrophobicContact CD1-CD1 4.33Å; I214-F230 HydrophobicContact CD1-CD2 3.77Å; I214-F230 HydrophobicContact CD1-CE1 3.89Å; I214-F230 HydrophobicContact CD1-CE2 3.29Å; I214-F230 HydrophobicContact CD1-CG 4.28Å; I214-F230 HydrophobicContact CD1-CZ 3.36Å; I214-F230 HydrophobicContact CG1-CE1 4.01Å; I214-F230 HydrophobicContact CG1-CE2 3.97Å; I214-F230 HydrophobicContact CG1-CZ 3.52Å; I214-F230 HydrophobicContact CG2-CE2 4.28Å; I214-F230 HydrophobicContact CG2-CZ 3.9Å; I214-E260 CarbonylContact O-C 3.58Å; I214-E260 VanDerWaalsContact O-CA 3.24Å; I214-E260 WeakPolarHBondContact O-CA 3.45Å; I214-A261 PolarHBondContact N-O 2.96Å; I214-A261 PolarHBondContact O-N 3.04Å; I214-V263 HydrophobicContact CD1-CB 4.26Å; I214-V263 HydrophobicContact CD1-CG2 3.49Å; I214-V263 VanDerWaalsContact CD1-CG2 3.49Å; I214-M290 HydrophobicContact CG2-CB 4.49Å; I214-M290 HydrophobicContact CG2-SD 4.16Å; I214-K291 CarbonylContact C-O 3.52Å; I214-K291 WeakPolarHBondContact CA-O 3.49Å; I214-V292 HydrophobicContact CG1-CG1 4.24Å; I214-V292 HydrophobicContact CG1-CG2 4.39Å; I214-V292 HydrophobicContact CG2-CG2 4.29Å |
| 215 | Q | 91.3 | Very high | 79.3 | Confident | 74 Ų | 74 | 54.8 Ų | 54.8 | 35% | 0.346 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 148.5 | 172.3 | -55.2 | 176.8 | -2.8 | 0 | 0 | 109.1 | F213 G259 E260 M290 K291 | F213-Q215 HydrophobicContact CD1-CG 3.91Å; F213-Q215 HydrophobicContact CE1-CG 3.48Å; F213-Q215 VanDerWaalsContact CE1-CG 3.48Å; Q215-G259 CarbonylContact C-O 3.54Å; Q215-E260 HydrophobicContact CG-CG 4.32Å; Q215-M290 CarbonylContact O-C 3.54Å; Q215-M290 WeakPolarHBondContact O-CA 3.41Å; Q215-K291 HydrophobicContact CB-CB 4.26Å; Q215-K291 PolarHBondContact N-O 3.49Å; Q215-K291 PolarHBondContact O-N 3Å |
| 216 | G | 88 | Confident | 81.7 | Confident | 20 Ų | 20 | 50.7 Ų | 50.7 | 21% | 0.206 | 29% | 0.285 | C | S | . | . | trans | 92.3 | 26.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | G259 | G216-G259 PolarHBondContact N-O 3.48Š| ||
| 217 | I | 88.6 | Confident | 83.9 | Confident | 10 Ų | 10 | 46.1 Ų | 46.1 | 5% | 0.051 | 25% | 0.253 | C | S | . | . | trans | -86.9 | 145.5 | 175.9 | -60.7 | 173.8 | 0 | 0 | 0 | 109.4 | I214 A221 V226 G259 A261 M290 | I214-I217 HydrophobicContact CB-CD1 3.85Å; I214-I217 HydrophobicContact CB-CG1 4.44Å; I214-I217 HydrophobicContact CD1-CD1 4.42Å; I214-I217 HydrophobicContact CG2-CD1 3.57Å; I214-I217 HydrophobicContact CG2-CG1 3.65Å; I217-A221 HydrophobicContact CG2-CB 3.16Å; I217-V226 HydrophobicContact CD1-CG1 4.44Å; I217-V226 HydrophobicContact CD1-CG2 4.21Å; I217-V226 HydrophobicContact CG2-CG2 4.15Å; I217-G259 PolarHBondContact N-O 2.9Å; I217-G259 WeakPolarHBondContact O-CA 3.14Å; I217-A261 HydrophobicContact CD1-CB 3.38Å; I217-M290 HydrophobicContact CG1-SD 4.49Å | ||
| 218 | P | 82.5 | Confident | 86 | Confident | 9 Ų | 9 | 44.9 Ų | 44.9 | 6% | 0.058 | 24% | 0.244 | C | C | . | . | trans | -66.7 | 159 | 177.8 | 17.9 | -23.1 | 0 | 0 | 0 | 113.3 | M220 A221 F283 C286 | P218-M220 HydrophobicContact CB-CG 3.84Å; P218-M220 HydrophobicContact CG-CG 4.23Å; P218-M220 PolarHBondContact O-N 3.44Å; P218-A221 HydrophobicContact CG-CB 4.13Å; P218-A221 WeakPolarHBondContact O-CB 3.37Å; P218-A221 PolarHBondContact O-N 3.47Å; P218-A221 VanDerWaalsContact O-N 3.12Å; P218-F283 HydrophobicContact CG-CD1 3.39Å; P218-F283 HydrophobicContact CG-CE1 3.8Å; P218-F283 HydrophobicContact CG-CG 4.34Å; P218-C286 WeakPolarHBondContact CA-SG 3.21Å; P218-C286 WeakPolarHBondContact CB-SG 3.34Å; P218-C286 WeakPolarHBondContact CD-SG 3.05Å; P218-C286 VanDerWaalsContact N-SG 3.36Å | ||
| 219 | D | 79 | Confident | 87.7 | Confident | 98 Ų | 98 | 42.1 Ų | 42.1 | 52% | 0.524 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -13.3 | 173.9 | 65 | -19.4 | 0 | 0 | 0 | 113.9 | P257 | D219-P257 VanDerWaalsContact O-CD 3.24Å; D219-P257 WeakPolarHBondContact O-CD 3.22Å; D219-P257 WeakPolarHBondContact O-CG 3.49Å |
| 220 | M | 74.8 | Confident | 88.6 | Confident | 94 Ų | 94 | 40.4 Ų | 40.4 | 46% | 0.463 | 21% | 0.214 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -3.7 | 172.5 | 56 | 179 | -77.6 | 0 | 0 | 114.2 | Y10 P218 D222 | Y10-M220 HydrophobicContact CD1-CE 4.36Å; Y10-M220 HydrophobicContact CD2-CE 4.35Å; Y10-M220 HydrophobicContact CE1-CE 4.3Å; Y10-M220 HydrophobicContact CE2-CE 4.28Å; Y10-M220 HydrophobicContact CG-CE 4.38Å; P218-M220 HydrophobicContact CB-CG 3.84Å; P218-M220 HydrophobicContact CG-CG 4.23Å; P218-M220 PolarHBondContact O-N 3.44Å; M220-D222 PolarHBondContact O-N 2.86Å |
| 221 | A | 78.2 | Confident | 88.8 | Confident | 2 Ų | 2 | 40.9 Ų | 40.9 | 2% | 0.017 | 22% | 0.221 | C | C | . | . | trans | -81.2 | 110 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | I217 P218 V226 F283 | I217-A221 HydrophobicContact CG2-CB 3.16Å; P218-A221 HydrophobicContact CG-CB 4.13Å; P218-A221 WeakPolarHBondContact O-CB 3.37Å; P218-A221 PolarHBondContact O-N 3.47Å; P218-A221 VanDerWaalsContact O-N 3.12Å; A221-V226 HydrophobicContact CB-CG2 4.03Å; A221-F283 HydrophobicContact CB-CE1 4.16Å; A221-F283 HydrophobicContact CB-CZ 4.34Å | ||
| 222 | D | 85.4 | Confident | 88.8 | Confident | 75 Ų | 75 | 44.5 Ų | 44.5 | 40% | 0.401 | 24% | 0.235 | S | C | . | . | trans | -80.9 | 162.5 | 168.2 | -83.9 | -35.3 | 0 | 0 | 0 | 112 | M220 Q224 I225 V226 | M220-D222 PolarHBondContact O-N 2.86Å; D222-Q224 PolarHBondContact O-N 3.5Å; D222-Q224 VanDerWaalsContact O-N 3.09Å; D222-I225 HydrophobicContact CB-CD1 4.45Å; D222-I225 HydrophobicContact CB-CG1 4.42Å; D222-I225 PolarHBondContact O-N 3.19Å; D222-V226 PolarHBondContact O-N 2.99Å; D222-V226 VanDerWaalsContact O-N 3.08Å | ||
| 223 | A | 89 | Confident | 88.7 | Confident | 35 Ų | 35 | 45.4 Ų | 45.4 | 29% | 0.289 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -54.2 | -31.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A227 V246 V248 | A223-A227 VanDerWaalsContact O-CB 3.28Å; A223-A227 WeakPolarHBondContact O-CB 3.45Å; A223-A227 PolarHBondContact O-N 2.98Å; A223-V246 HydrophobicContact CB-CB 4.22Å; A223-V246 HydrophobicContact CB-CG1 4.18Å; A223-V248 HydrophobicContact CB-CG2 4.13Å |
| 224 | Q | 89.9 | Confident | 88.6 | Confident | 152 Ų | 152 | 44.1 Ų | 44.1 | 71% | 0.71 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -71.2 | -41.4 | 176.9 | -65.2 | -162.4 | -72.8 | 0 | 0 | 112.9 | D222 V226 A227 E228 | D222-Q224 PolarHBondContact O-N 3.5Å; D222-Q224 VanDerWaalsContact O-N 3.09Å; Q224-V226 VanDerWaalsContact C-N 3.34Å; Q224-A227 WeakPolarHBondContact O-CB 3.19Å; Q224-A227 PolarHBondContact O-N 3.45Å; Q224-E228 WeakPolarHBondContact O-CB 3.38Å; Q224-E228 PolarHBondContact O-N 2.9Å |
| 225 | I | 90.3 | Very high | 88.6 | Confident | 26 Ų | 26 | 50.1 Ų | 50.1 | 13% | 0.133 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.3 | -43.4 | 179.5 | -51.5 | 178.1 | 0 | 0 | 0 | 109.4 | Y7 D222 A227 E228 Y229 F283 | Y7-I225 HydrophobicContact CD2-CD1 3.64Å; Y7-I225 HydrophobicContact CD2-CG1 4.2Å; Y7-I225 HydrophobicContact CE2-CB 4.33Å; Y7-I225 HydrophobicContact CE2-CD1 3.29Å; Y7-I225 HydrophobicContact CE2-CG1 3.43Å; Y7-I225 VanDerWaalsContact CE2-CG1 3.43Å; Y7-I225 HydrophobicContact CE2-CG2 4.02Å; D222-I225 HydrophobicContact CB-CD1 4.45Å; D222-I225 HydrophobicContact CB-CG1 4.42Å; D222-I225 PolarHBondContact O-N 3.19Å; I225-A227 VanDerWaalsContact C-N 3.32Å; I225-A227 PolarHBondContact O-N 2.65Å; I225-E228 PolarHBondContact O-N 3.45Å; I225-Y229 WeakPolarHBondContact O-CB 3.45Å; I225-Y229 PolarHBondContact O-N 2.84Å; I225-F283 HydrophobicContact CG2-CE1 4.22Å; I225-F283 HydrophobicContact CG2-CZ 3.9Å |
| 226 | V | 92.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.5 | -43 | 174 | 178.4 | 0 | 0 | 0 | 0 | 110.2 | I214 I217 A221 D222 Q224 Y229 F230 V246 V248 A261 V263 | I214-V226 HydrophobicContact CD1-CG1 4.32Å; I217-V226 HydrophobicContact CD1-CG1 4.44Å; I217-V226 HydrophobicContact CD1-CG2 4.21Å; I217-V226 HydrophobicContact CG2-CG2 4.15Å; A221-V226 HydrophobicContact CB-CG2 4.03Å; D222-V226 PolarHBondContact O-N 2.99Å; D222-V226 VanDerWaalsContact O-N 3.08Å; Q224-V226 VanDerWaalsContact C-N 3.34Å; V226-Y229 PolarHBondContact O-N 2.82Å; V226-F230 HydrophobicContact CG1-CD2 3.79Å; V226-F230 HydrophobicContact CG1-CE2 4.14Å; V226-F230 WeakPolarHBondContact O-CD2 3.25Å; V226-F230 PolarHBondContact O-N 3.37Å; V226-V246 HydrophobicContact CB-CG1 4.03Å; V226-V246 HydrophobicContact CG1-CG1 3.81Å; V226-V248 HydrophobicContact CG2-CG2 4.42Å; V226-A261 HydrophobicContact CG1-CB 4.29Å; V226-V263 HydrophobicContact CG1-CG2 3.71Å |
| 227 | A | 92.9 | Very high | 88.9 | Confident | 10 Ų | 10 | 49.1 Ų | 49.1 | 8% | 0.083 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.4 | -45.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A223 Q224 I225 Y229 F230 S231 I236 P244 V246 | A223-A227 VanDerWaalsContact O-CB 3.28Å; A223-A227 WeakPolarHBondContact O-CB 3.45Å; A223-A227 PolarHBondContact O-N 2.98Å; Q224-A227 WeakPolarHBondContact O-CB 3.19Å; Q224-A227 PolarHBondContact O-N 3.45Å; I225-A227 VanDerWaalsContact C-N 3.32Å; I225-A227 PolarHBondContact O-N 2.65Å; A227-Y229 VanDerWaalsContact C-N 3.34Å; A227-Y229 PolarHBondContact O-N 3.2Å; A227-F230 PolarHBondContact O-N 3Å; A227-S231 WeakPolarHBondContact O-CB 3.15Å; A227-S231 PolarHBondContact O-N 3Å; A227-I236 HydrophobicContact CB-CD1 3.92Å; A227-I236 WeakPolarHBondContact O-CD1 3.12Å; A227-P244 HydrophobicContact CB-CB 3.61Å; A227-P244 HydrophobicContact CB-CG 3.49Å; A227-P244 VanDerWaalsContact CB-CG 3.49Å; A227-V246 HydrophobicContact CB-CG2 3.96Å |
| 228 | E | 92.1 | Very high | 89 | Confident | 90 Ų | 90 | 54.1 Ų | 54.1 | 42% | 0.421 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.8 | -44.8 | 178.2 | -172.6 | 176.6 | 179 | 0 | 0 | 111.1 | Y7 M11 Q224 I225 S231 | Y7-E228 PolarHBondContact OH-OE2 3.36Å; M11-E228 WeakPolarHBondContact CE-OE1 3.35Å; Q224-E228 WeakPolarHBondContact O-CB 3.38Å; Q224-E228 PolarHBondContact O-N 2.9Å; I225-E228 PolarHBondContact O-N 3.45Å; E228-S231 PolarHBondContact O-N 2.86Å; E228-S231 PolarHBondContact O-OG 3.17Å |
| 229 | Y | 91.8 | Very high | 89.3 | Confident | 41 Ų | 41 | 56.7 Ų | 56.7 | 16% | 0.161 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.8 | -48.8 | 179.2 | -171 | -100.4 | 0 | 0 | 0 | 112.8 | I225 V226 A227 S231 Q232 F278 F283 P284 M290 | I225-Y229 WeakPolarHBondContact O-CB 3.45Å; I225-Y229 PolarHBondContact O-N 2.84Å; V226-Y229 PolarHBondContact O-N 2.82Å; A227-Y229 VanDerWaalsContact C-N 3.34Å; A227-Y229 PolarHBondContact O-N 3.2Å; Y229-S231 VanDerWaalsContact C-N 3.3Å; Y229-S231 PolarHBondContact O-N 3.46Å; Y229-Q232 WeakPolarHBondContact O-CG 3.3Å; Y229-Q232 PolarHBondContact O-N 3.16Å; Y229-F278 HydrophobicContact CD1-CD1 4.35Å; Y229-F278 HydrophobicContact CD1-CE1 4.12Å; Y229-F278 HydrophobicContact CD1-CZ 4.43Å; Y229-F278 AromaticContact CE1-CD1 3.39Å; Y229-F278 HydrophobicContact CE1-CD1 3.39Å; Y229-F278 AromaticContact CE1-CE1 3.42Å; Y229-F278 HydrophobicContact CE1-CE1 3.42Å; Y229-F278 VanDerWaalsContact CE1-CE1 3.42Å; Y229-F278 HydrophobicContact CE1-CG 4.1Å; Y229-F278 HydrophobicContact CE1-CZ 4.14Å; Y229-F278 HydrophobicContact CE2-CE1 4.36Å; Y229-F278 AromaticContact CZ-CD1 3.72Å; Y229-F278 AromaticContact CZ-CE1 3.57Å; Y229-F283 HydrophobicContact CD1-CD2 4.07Å; Y229-F283 AromaticContact CD1-CE2 3.89Å; Y229-F283 HydrophobicContact CD1-CE2 3.89Å; Y229-F283 HydrophobicContact CD2-CE2 4.45Å; Y229-F283 HydrophobicContact CE1-CD2 4.28Å; Y229-F283 HydrophobicContact CG-CD2 4.31Å; Y229-F283 AromaticContact CG-CE2 3.83Å; Y229-F283 HydrophobicContact CG-CE2 3.83Å; Y229-P284 HydrophobicContact CD2-CG 4.46Å; Y229-M290 HydrophobicContact CE1-CE 3.68Å |
| 230 | F | 93.1 | Very high | 89.5 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -77.1 | -14.7 | -178.7 | -78 | -82.8 | 0 | 0 | 0 | 113.6 | I212 I214 V226 A227 Q232 A233 I236 V263 F265 A274 F278 M290 V292 | I212-F230 HydrophobicContact CD1-CD1 3.51Å; I212-F230 HydrophobicContact CD1-CE1 3.6Å; I212-F230 HydrophobicContact CD1-CG 4.32Å; I212-F230 HydrophobicContact CD1-CZ 4.49Å; I214-F230 HydrophobicContact CB-CZ 4.36Å; I214-F230 HydrophobicContact CD1-CD1 4.33Å; I214-F230 HydrophobicContact CD1-CD2 3.77Å; I214-F230 HydrophobicContact CD1-CE1 3.89Å; I214-F230 HydrophobicContact CD1-CE2 3.29Å; I214-F230 HydrophobicContact CD1-CG 4.28Å; I214-F230 HydrophobicContact CD1-CZ 3.36Å; I214-F230 HydrophobicContact CG1-CE1 4.01Å; I214-F230 HydrophobicContact CG1-CE2 3.97Å; I214-F230 HydrophobicContact CG1-CZ 3.52Å; I214-F230 HydrophobicContact CG2-CE2 4.28Å; I214-F230 HydrophobicContact CG2-CZ 3.9Å; V226-F230 HydrophobicContact CG1-CD2 3.79Å; V226-F230 HydrophobicContact CG1-CE2 4.14Å; V226-F230 WeakPolarHBondContact O-CD2 3.25Å; V226-F230 PolarHBondContact O-N 3.37Å; A227-F230 PolarHBondContact O-N 3Å; F230-Q232 PolarHBondContact O-N 2.87Å; F230-A233 PolarHBondContact O-N 3.32Å; F230-A233 VanDerWaalsContact O-N 3.16Å; F230-I236 HydrophobicContact CB-CD1 4.27Å; F230-V263 HydrophobicContact CB-CG1 4.36Å; F230-V263 HydrophobicContact CD2-CG2 4.36Å; F230-V263 HydrophobicContact CG-CG2 4.47Å; F230-F265 HydrophobicContact CB-CZ 4.25Å; F230-A274 HydrophobicContact CD1-CB 4.42Å; F230-F278 AromaticContact CD1-CD2 3.71Å; F230-F278 HydrophobicContact CD1-CD2 3.71Å; F230-F278 HydrophobicContact CD1-CE2 4.03Å; F230-F278 HydrophobicContact CD1-CG 4.43Å; F230-F278 HydrophobicContact CE1-CB 3.95Å; F230-F278 AromaticContact CE1-CD2 3.7Å; F230-F278 HydrophobicContact CE1-CD2 3.7Å; F230-F278 HydrophobicContact CE1-CE2 4.42Å; F230-F278 HydrophobicContact CE1-CG 4.01Å; F230-F278 HydrophobicContact CZ-CB 4.47Å; F230-M290 HydrophobicContact CZ-SD 4.45Å; F230-V292 HydrophobicContact CE1-CG1 4.43Å; F230-V292 HydrophobicContact CE1-CG2 4.23Å; F230-V292 HydrophobicContact CZ-CG2 4.27Å |
| 231 | S | 93.2 | Very high | 89.8 | Confident | 63 Ų | 63 | 66.4 Ų | 66.4 | 44% | 0.441 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -21.8 | 173.7 | 73.5 | 0 | 0 | 0 | 0 | 113.2 | A227 E228 Y229 A233 G234 | A227-S231 WeakPolarHBondContact O-CB 3.15Å; A227-S231 PolarHBondContact O-N 3Å; E228-S231 PolarHBondContact O-N 2.86Å; E228-S231 PolarHBondContact O-OG 3.17Å; Y229-S231 VanDerWaalsContact C-N 3.3Å; Y229-S231 PolarHBondContact O-N 3.46Å; S231-A233 PolarHBondContact O-N 2.83Å; S231-G234 WeakPolarHBondContact CA-O 3.2Å; S231-G234 PolarHBondContact O-N 2.93Å |
| 232 | Q | 91.7 | Very high | 90.2 | Very high | 96 Ų | 96 | 69.3 Ų | 69.3 | 45% | 0.449 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -21.8 | 176.8 | -57.4 | 178.5 | 11.1 | 0 | 0 | 113.5 | Y229 F230 F278 | Y229-Q232 WeakPolarHBondContact O-CG 3.3Å; Y229-Q232 PolarHBondContact O-N 3.16Å; F230-Q232 PolarHBondContact O-N 2.87Å; Q232-F278 HydrophobicContact CB-CZ 4.15Å |
| 233 | A | 91.1 | Very high | 90.3 | Very high | 18 Ų | 18 | 67.1 Ų | 67.1 | 15% | 0.149 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | -20.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | F230 S231 A274 F278 | F230-A233 PolarHBondContact O-N 3.32Å; F230-A233 VanDerWaalsContact O-N 3.16Å; S231-A233 PolarHBondContact O-N 2.83Å; A233-A274 HydrophobicContact CB-CB 3.64Å; A233-F278 HydrophobicContact CB-CD2 4.38Å; A233-F278 HydrophobicContact CB-CE2 3.72Å |
| 234 | G | 92.3 | Very high | 90.4 | Very high | 14 Ų | 14 | 67.7 Ų | 67.7 | 14% | 0.144 | 36% | 0.361 | C | S | . | . | S | Bend | trans | 160.3 | 179.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | S231 I236 | S231-G234 WeakPolarHBondContact CA-O 3.2Å; S231-G234 PolarHBondContact O-N 2.93Å; G234-I236 PolarHBondContact O-N 2.83Å |
| 235 | E | 93.4 | Very high | 90.5 | Very high | 125 Ų | 125 | 64.6 Ų | 64.6 | 58% | 0.584 | 35% | 0.345 | S | S | * | . | P | Polyproline II helix | trans | -74.6 | 125.3 | -173.6 | -158.8 | 176.2 | -165.4 | 0 | 0 | 111.9 | V266 Y270 | E235-V266 HydrophobicContact CB-CG2 4.14Å; E235-V266 HydrophobicContact CG-CG2 4.13Å; E235-V266 WeakPolarHBondContact O-CG2 3.48Å; E235-V266 PolarHBondContact O-N 3.38Å; E235-Y270 HydrophobicContact CB-CE2 4.1Å |
| 236 | I | 93.6 | Very high | 90.7 | Very high | 17 Ų | 17 | 64.4 Ų | 64.4 | 9% | 0.087 | 35% | 0.345 | C | S | . | . | B | Isolated β-bridge | trans | -85.6 | 134.2 | -179.7 | -59.2 | 177 | 0 | 0 | 0 | 108.9 | A227 F230 G234 P244 V246 V263 S264 F265 | A227-I236 HydrophobicContact CB-CD1 3.92Å; A227-I236 WeakPolarHBondContact O-CD1 3.12Å; F230-I236 HydrophobicContact CB-CD1 4.27Å; G234-I236 PolarHBondContact O-N 2.83Å; I236-P244 HydrophobicContact CG2-CB 4.03Å; I236-V246 HydrophobicContact CG2-CG2 4.19Å; I236-V263 HydrophobicContact CD1-CG1 3.96Å; I236-V263 HydrophobicContact CG1-CG1 4.11Å; I236-V263 HydrophobicContact CG2-CG1 4.13Å; I236-S264 VanDerWaalsContact CG2-O 3.3Å; I236-S264 WeakPolarHBondContact CG2-O 3.31Å; I236-F265 HydrophobicContact CG1-CD1 4.13Å; I236-F265 HydrophobicContact CG1-CE1 3.97Å |
| 237 | M | 92.1 | Very high | 90.6 | Very high | 57 Ų | 57 | 69.4 Ų | 69.4 | 28% | 0.281 | 37% | 0.368 | S | S | . | . | P | Polyproline II helix | trans | -58.3 | 142.5 | 176.5 | -176.2 | 176.5 | -67.8 | 0 | 0 | 110.3 | K245 S264 | M237-K245 HydrophobicContact CB-CB 4.14Å; M237-K245 HydrophobicContact CB-CD 4.18Å; M237-K245 HydrophobicContact CG-CB 4.44Å; M237-K245 HydrophobicContact CG-CD 3.87Å; M237-K245 WeakPolarHBondContact O-CA 3.47Å; M237-K245 WeakPolarHBondContact O-CB 3.37Å; M237-K245 PolarHBondContact O-N 2.99Å; M237-K245 HydrophobicContact SD-CD 3.51Å; M237-K245 VanDerWaalsContact SD-CD 3.51Å; M237-K245 PolarHBondContact SD-NZ 2.87Å; M237-S264 VanDerWaalsContact CB-O 3.31Å; M237-S264 WeakPolarHBondContact CB-O 3.48Å; M237-S264 PolarHBondContact N-O 3.07Å |
| 238 | I | 91.1 | Very high | 90.5 | Very high | 115 Ų | 115 | 70 Ų | 70 | 59% | 0.59 | 37% | 0.37 | S | S | * | . | B | Isolated β-bridge | trans | -91.3 | 133.3 | 177 | -57.5 | 175.6 | 0 | 0 | 0 | 108.8 | G242 G243 | I238-G242 VanDerWaalsContact CG2-C 3.48Å; I238-G243 CarbonylContact C-O 3.55Å; I238-G243 WeakPolarHBondContact CA-O 3.36Å |
| 239 | D | 88 | Confident | 90.4 | Very high | 62 Ų | 62 | 68.3 Ų | 68.3 | 33% | 0.332 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -74.5 | 166 | 173.1 | -172 | 24.1 | 0 | 0 | 0 | 110.9 | R241 G242 G243 K245 | D239-R241 PolarHBondContact O-N 2.82Å; D239-G242 PolarHBondContact O-N 3.04Å; D239-G243 PolarHBondContact N-O 3.05Å; D239-K245 HydrophobicContact CB-CB 4.43Å |
| 240 | N | 83.6 | Confident | 90.2 | Very high | 169 Ų | 169 | 72.2 Ų | 72.2 | 90% | 0.904 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | -12 | 178.8 | -63.9 | -40.6 | 0 | 0 | 0 | 113.9 | ||
| 241 | R | 82 | Confident | 89.7 | Confident | 228 Ų | 228 | 73.8 Ų | 73.8 | 86% | 0.86 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -1.1 | 177 | -57.4 | -179.3 | -173.4 | -172.5 | 1.4 | 113.7 | D239 G243 | D239-R241 PolarHBondContact O-N 2.82Å; R241-G243 VanDerWaalsContact C-N 3.27Å; R241-G243 PolarHBondContact O-N 2.83Å |
| 242 | G | 85.4 | Confident | 89 | Confident | 63 Ų | 63 | 80.8 Ų | 80.8 | 65% | 0.649 | 41% | 0.409 | S | S | * | . | S | Bend | trans | 79.9 | 1.8 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | I238 D239 | I238-G242 VanDerWaalsContact CG2-C 3.48Å; D239-G242 PolarHBondContact O-N 3.04Å |
| 243 | G | 87.8 | Confident | 88 | Confident | 28 Ų | 28 | 81.8 Ų | 81.8 | 29% | 0.289 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -94.5 | 165.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | I238 D239 R241 | I238-G243 CarbonylContact C-O 3.55Å; I238-G243 WeakPolarHBondContact CA-O 3.36Å; D239-G243 PolarHBondContact N-O 3.05Å; R241-G243 VanDerWaalsContact C-N 3.27Å; R241-G243 PolarHBondContact O-N 2.83Å |
| 244 | P | 91.7 | Very high | 87.3 | Confident | 48 Ų | 48 | 83.9 Ų | 83.9 | 31% | 0.312 | 43% | 0.429 | S | S | . | . | B | Isolated β-bridge | trans | -62.7 | 138.9 | 175.5 | 28.9 | -35.3 | 0 | 0 | 0 | 110.5 | A227 I236 V246 | A227-P244 HydrophobicContact CB-CB 3.61Å; A227-P244 HydrophobicContact CB-CG 3.49Å; A227-P244 VanDerWaalsContact CB-CG 3.49Å; I236-P244 HydrophobicContact CG2-CB 4.03Å; P244-V246 HydrophobicContact CB-CG2 4.18Å; P244-V246 PolarHBondContact O-N 2.82Å |
| 245 | K | 92.3 | Very high | 86.4 | Confident | 87 Ų | 87 | 85.7 Ų | 85.7 | 38% | 0.378 | 45% | 0.448 | S | S | . | . | trans | -76.8 | 71.3 | -178.4 | -169.7 | 173.1 | 174.9 | 176.4 | 0 | 110.4 | M237 D239 S264 | M237-K245 HydrophobicContact CB-CB 4.14Å; M237-K245 HydrophobicContact CB-CD 4.18Å; M237-K245 HydrophobicContact CG-CB 4.44Å; M237-K245 HydrophobicContact CG-CD 3.87Å; M237-K245 WeakPolarHBondContact O-CA 3.47Å; M237-K245 WeakPolarHBondContact O-CB 3.37Å; M237-K245 PolarHBondContact O-N 2.99Å; M237-K245 HydrophobicContact SD-CD 3.51Å; M237-K245 VanDerWaalsContact SD-CD 3.51Å; M237-K245 PolarHBondContact SD-NZ 2.87Å; D239-K245 HydrophobicContact CB-CB 4.43Å; K245-S264 PolarHBondContact O-N 2.96Å | ||
| 246 | V | 93 | Very high | 85.4 | Confident | 21 Ų | 21 | 87.6 Ų | 87.6 | 13% | 0.127 | 45% | 0.449 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 126.9 | 179.6 | -179.5 | 0 | 0 | 0 | 0 | 109.2 | A223 V226 A227 I236 P244 V248 L262 V263 | A223-V246 HydrophobicContact CB-CB 4.22Å; A223-V246 HydrophobicContact CB-CG1 4.18Å; V226-V246 HydrophobicContact CB-CG1 4.03Å; V226-V246 HydrophobicContact CG1-CG1 3.81Å; A227-V246 HydrophobicContact CB-CG2 3.96Å; I236-V246 HydrophobicContact CG2-CG2 4.19Å; P244-V246 HydrophobicContact CB-CG2 4.18Å; P244-V246 PolarHBondContact O-N 2.82Å; V246-V248 HydrophobicContact CG1-CG2 4.3Å; V246-L262 CarbonylContact C-O 3.5Å; V246-L262 VanDerWaalsContact CA-O 3.32Å; V246-L262 WeakPolarHBondContact CA-O 3.42Å; V246-V263 HydrophobicContact CG1-CG2 4.05Å; V246-V263 HydrophobicContact CG2-CG1 4.28Å; V246-V263 HydrophobicContact CG2-CG2 4.02Å |
| 247 | H | 90.9 | Very high | 84.7 | Confident | 105 Ų | 105 | 88 Ų | 88 | 49% | 0.486 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 107.4 | 177 | -171.4 | 81.5 | 0 | 0 | 0 | 110.2 | Y249 A261 L262 | H247-Y249 AromaticContact CD2-CD1 3.82Å; H247-Y249 AromaticContact CD2-CE1 3.52Å; H247-Y249 AromaticContact CD2-CE2 3.89Å; H247-Y249 AromaticContact CD2-CZ 3.57Å; H247-Y249 AromaticContact NE2-CD1 3.8Å; H247-Y249 AromaticContact NE2-CE1 3.63Å; H247-A261 CarbonylContact O-C 3.56Å; H247-A261 VanDerWaalsContact O-CA 3.26Å; H247-A261 WeakPolarHBondContact O-CA 3.4Å; H247-L262 HydrophobicContact CB-CB 4.38Å; H247-L262 PolarHBondContact N-O 2.83Å; H247-L262 PolarHBondContact O-N 3.46Å |
| 248 | V | 91.2 | Very high | 84.2 | Confident | 22 Ų | 22 | 91.1 Ų | 91.1 | 13% | 0.133 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 120.1 | 175.4 | -177.3 | 0 | 0 | 0 | 0 | 109.2 | A223 V226 V246 K250 P257 A261 | A223-V248 HydrophobicContact CB-CG2 4.13Å; V226-V248 HydrophobicContact CG2-CG2 4.42Å; V246-V248 HydrophobicContact CG1-CG2 4.3Å; V248-K250 PolarHBondContact O-N 3.32Å; V248-P257 HydrophobicContact CG1-CB 4.18Å; V248-A261 HydrophobicContact CG2-CB 4.24Å |
| 249 | Y | 89.8 | Confident | 84 | Confident | 56 Ų | 56 | 86 Ų | 86 | 22% | 0.22 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.6 | 123.3 | 178.2 | -69 | -80.6 | 0 | 0 | 0 | 110.2 | F213 H247 K258 E260 L262 | F213-Y249 HydrophobicContact CD2-CE2 4.3Å; F213-Y249 HydrophobicContact CE2-CD2 4.02Å; F213-Y249 AromaticContact CE2-CE2 3.58Å; F213-Y249 HydrophobicContact CE2-CE2 3.58Å; H247-Y249 AromaticContact CD2-CD1 3.82Å; H247-Y249 AromaticContact CD2-CE1 3.52Å; H247-Y249 AromaticContact CD2-CE2 3.89Å; H247-Y249 AromaticContact CD2-CZ 3.57Å; H247-Y249 AromaticContact NE2-CD1 3.8Å; H247-Y249 AromaticContact NE2-CE1 3.63Å; Y249-K258 PolarHBondContact O-N 3.02Å; Y249-E260 WeakPolarHBondContact CB-O 3.44Å; Y249-E260 HydrophobicContact CD2-CB 4.11Å; Y249-E260 PolarHBondContact N-O 3.35Å; Y249-L262 HydrophobicContact CE2-CB 4.16Å |
| 250 | K | 87.1 | Confident | 84.2 | Confident | 122 Ų | 122 | 85.1 Ų | 85.1 | 53% | 0.53 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 137.7 | 174.3 | -56.3 | -175.7 | -178 | -169.2 | 0 | 109.1 | V248 K252 R256 | V248-K250 PolarHBondContact O-N 3.32Å; K250-K252 PolarHBondContact O-N 3.48Å; K250-R256 WeakPolarHBondContact CA-O 3.44Å |
| 251 | D | 81.7 | Confident | 84.6 | Confident | 34 Ų | 34 | 77 Ų | 77 | 18% | 0.182 | 39% | 0.392 | C | S | . | . | trans | -64.7 | 125.1 | 172.6 | 174.9 | 20.5 | 0 | 0 | 0 | 108.7 | M253 S254 G255 R256 | D251-M253 PolarHBondContact O-N 3.21Å; D251-M253 PolarHBondContact OD1-N 3.12Å; D251-S254 WeakPolarHBondContact CB-OG 3.33Å; D251-S254 WeakPolarHBondContact OD2-CB 3.46Å; D251-S254 PolarHBondContact OD2-N 3.26Å; D251-S254 PolarHBondContact OD2-OG 2.96Å; D251-G255 VanDerWaalsContact O-CA 3.25Å; D251-G255 WeakPolarHBondContact O-CA 3.17Å; D251-G255 PolarHBondContact O-N 2.73Å; D251-R256 PolarHBondContact N-O 2.83Å | ||
| 252 | K | 79.5 | Confident | 85.1 | Confident | 210 Ų | 210 | 68.1 Ų | 68.1 | 91% | 0.913 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -23.8 | -175.9 | -64.8 | 177.9 | -180 | -115.2 | 0 | 112 | K250 | K250-K252 PolarHBondContact O-N 3.48Š|
| 253 | M | 70.8 | Confident | 85.5 | Confident | 116 Ų | 116 | 65.1 Ų | 65.1 | 57% | 0.571 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -44 | -176.3 | -57.7 | -170 | 70.9 | 0 | 0 | 111.7 | D251 V379 | D251-M253 PolarHBondContact O-N 3.21Å; D251-M253 PolarHBondContact OD1-N 3.12Å; M253-V379 HydrophobicContact CE-CB 4.34Å; M253-V379 HydrophobicContact CE-CG1 3.88Å; M253-V379 HydrophobicContact CE-CG2 3.48Å; M253-V379 VanDerWaalsContact CE-CG2 3.48Å; M253-V379 HydrophobicContact SD-CG1 4.35Å |
| 254 | S | 75.8 | Confident | 85.8 | Confident | 62 Ų | 62 | 64.3 Ų | 64.3 | 43% | 0.434 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97 | -16.2 | -177.3 | 61.9 | 0 | 0 | 0 | 0 | 114.2 | D251 R256 | D251-S254 WeakPolarHBondContact CB-OG 3.33Å; D251-S254 WeakPolarHBondContact OD2-CB 3.46Å; D251-S254 PolarHBondContact OD2-N 3.26Å; D251-S254 PolarHBondContact OD2-OG 2.96Å; S254-R256 PolarHBondContact O-N 3.35Å; S254-R256 VanDerWaalsContact O-N 3.1Å; S254-R256 PolarHBondContact OG-N 3.08Å |
| 255 | G | 74.3 | Confident | 85.9 | Confident | 52 Ų | 52 | 62 Ų | 62 | 54% | 0.536 | 31% | 0.305 | S | S | . | . | trans | 70.5 | -7.3 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | D251 | D251-G255 VanDerWaalsContact O-CA 3.25Å; D251-G255 WeakPolarHBondContact O-CA 3.17Å; D251-G255 PolarHBondContact O-N 2.73Å | ||
| 256 | R | 72.6 | Confident | 85.9 | Confident | 165 Ų | 165 | 60.7 Ų | 60.7 | 62% | 0.623 | 30% | 0.304 | S | S | * | . | S | Bend | trans | -77.2 | 147.2 | 179.4 | -61.6 | -172.9 | -179 | -156.8 | 1.6 | 110.1 | K250 D251 S254 K258 | K250-R256 WeakPolarHBondContact CA-O 3.44Å; D251-R256 PolarHBondContact N-O 2.83Å; S254-R256 PolarHBondContact O-N 3.35Å; S254-R256 VanDerWaalsContact O-N 3.1Å; S254-R256 PolarHBondContact OG-N 3.08Å; R256-K258 PolarHBondContact O-N 3.03Å |
| 257 | P | 77.2 | Confident | 85.7 | Confident | 27 Ų | 27 | 62.6 Ų | 62.6 | 18% | 0.175 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.6 | 132.4 | 172.3 | -21.4 | 34.7 | 0 | 0 | 0 | 109.5 | D219 V248 G259 | D219-P257 VanDerWaalsContact O-CD 3.24Å; D219-P257 WeakPolarHBondContact O-CD 3.22Å; D219-P257 WeakPolarHBondContact O-CG 3.49Å; V248-P257 HydrophobicContact CG1-CB 4.18Å; P257-G259 PolarHBondContact O-N 3.48Å; P257-G259 VanDerWaalsContact O-N 3.11Å |
| 258 | K | 82.9 | Confident | 85.7 | Confident | 121 Ų | 121 | 59.3 Ų | 59.3 | 53% | 0.526 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | -3 | 178.9 | -167.5 | -179.4 | 167.3 | -137.9 | 0 | 111.9 | Y249 R256 E260 | Y249-K258 PolarHBondContact O-N 3.02Å; R256-K258 PolarHBondContact O-N 3.03Å; K258-E260 VanDerWaalsContact C-N 3.32Å; K258-E260 WeakPolarHBondContact CE-OE1 3.2Å; K258-E260 IonicContact NZ-OE1 2.77Å; K258-E260 PolarHBondContact NZ-OE1 3.34Å; K258-E260 IonicContact NZ-OE2 2.78Å; K258-E260 PolarHBondContact NZ-OE2 2.94Å |
| 259 | G | 87.3 | Confident | 85.8 | Confident | 9 Ų | 9 | 65.4 Ų | 65.4 | 9% | 0.093 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 72.5 | 26 | -171 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q215 G216 I217 P257 | Q215-G259 CarbonylContact C-O 3.54Å; G216-G259 PolarHBondContact N-O 3.48Å; I217-G259 PolarHBondContact N-O 2.9Å; I217-G259 WeakPolarHBondContact O-CA 3.14Å; P257-G259 PolarHBondContact O-N 3.48Å; P257-G259 VanDerWaalsContact O-N 3.11Å |
| 260 | E | 90.8 | Very high | 86 | Confident | 42 Ų | 42 | 66.2 Ų | 66.2 | 20% | 0.196 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 136.5 | 176.8 | -64.3 | 173.8 | 179.8 | 0 | 0 | 109.7 | F213 I214 Q215 Y249 K258 | F213-E260 HydrophobicContact CE1-CG 4.47Å; F213-E260 HydrophobicContact CZ-CB 3.93Å; F213-E260 HydrophobicContact CZ-CG 4.13Å; I214-E260 CarbonylContact O-C 3.58Å; I214-E260 VanDerWaalsContact O-CA 3.24Å; I214-E260 WeakPolarHBondContact O-CA 3.45Å; Q215-E260 HydrophobicContact CG-CG 4.32Å; Y249-E260 WeakPolarHBondContact CB-O 3.44Å; Y249-E260 HydrophobicContact CD2-CB 4.11Å; Y249-E260 PolarHBondContact N-O 3.35Å; K258-E260 VanDerWaalsContact C-N 3.32Å; K258-E260 WeakPolarHBondContact CE-OE1 3.2Å; K258-E260 IonicContact NZ-OE1 2.77Å; K258-E260 PolarHBondContact NZ-OE1 3.34Å; K258-E260 IonicContact NZ-OE2 2.78Å; K258-E260 PolarHBondContact NZ-OE2 2.94Å |
| 261 | A | 92.3 | Very high | 86.3 | Confident | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.8 | 156.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | I214 I217 V226 H247 V248 | I214-A261 PolarHBondContact N-O 2.96Å; I214-A261 PolarHBondContact O-N 3.04Å; I217-A261 HydrophobicContact CD1-CB 3.38Å; V226-A261 HydrophobicContact CG1-CB 4.29Å; H247-A261 CarbonylContact O-C 3.56Å; H247-A261 VanDerWaalsContact O-CA 3.26Å; H247-A261 WeakPolarHBondContact O-CA 3.4Å; V248-A261 HydrophobicContact CG2-CB 4.24Å |
| 262 | L | 93.2 | Very high | 86.8 | Confident | 40 Ų | 40 | 61.3 Ų | 61.3 | 21% | 0.209 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 126.2 | 172.9 | -175.6 | 150.1 | 0 | 0 | 0 | 109.1 | A211 I212 V246 H247 Y249 A295 | A211-L262 HydrophobicContact CB-CD2 4.27Å; I212-L262 WeakPolarHBondContact O-CA 3.44Å; V246-L262 CarbonylContact C-O 3.5Å; V246-L262 VanDerWaalsContact CA-O 3.32Å; V246-L262 WeakPolarHBondContact CA-O 3.42Å; H247-L262 HydrophobicContact CB-CB 4.38Å; H247-L262 PolarHBondContact N-O 2.83Å; H247-L262 PolarHBondContact O-N 3.46Å; Y249-L262 HydrophobicContact CE2-CB 4.16Å; L262-A295 HydrophobicContact CD1-CB 4.08Å; L262-A295 HydrophobicContact CG-CB 4.47Å |
| 263 | V | 93.7 | Very high | 87.4 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 127.5 | 179.7 | 176.1 | 0 | 0 | 0 | 0 | 108.3 | A211 I212 I214 V226 F230 I236 V246 F265 | A211-V263 CarbonylContact C-O 3.5Å; A211-V263 VanDerWaalsContact CA-O 3.22Å; A211-V263 WeakPolarHBondContact CA-O 3.24Å; I212-V263 HydrophobicContact CD1-CB 4.26Å; I212-V263 HydrophobicContact CG1-CB 3.82Å; I212-V263 PolarHBondContact N-O 2.93Å; I212-V263 PolarHBondContact O-N 2.93Å; I214-V263 HydrophobicContact CD1-CB 4.26Å; I214-V263 HydrophobicContact CD1-CG2 3.49Å; I214-V263 VanDerWaalsContact CD1-CG2 3.49Å; V226-V263 HydrophobicContact CG1-CG2 3.71Å; F230-V263 HydrophobicContact CB-CG1 4.36Å; F230-V263 HydrophobicContact CD2-CG2 4.36Å; F230-V263 HydrophobicContact CG-CG2 4.47Å; I236-V263 HydrophobicContact CD1-CG1 3.96Å; I236-V263 HydrophobicContact CG1-CG1 4.11Å; I236-V263 HydrophobicContact CG2-CG1 4.13Å; V246-V263 HydrophobicContact CG1-CG2 4.05Å; V246-V263 HydrophobicContact CG2-CG1 4.28Å; V246-V263 HydrophobicContact CG2-CG2 4.02Å; V263-F265 HydrophobicContact CG1-CE1 4.49Å; V263-F265 HydrophobicContact CG1-CE2 4.11Å; V263-F265 HydrophobicContact CG1-CZ 4.08Å |
| 264 | S | 92.9 | Very high | 88.6 | Confident | 11 Ų | 11 | 47.9 Ų | 47.9 | 8% | 0.077 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 120.2 | 175.6 | -56.6 | 0 | 0 | 0 | 0 | 110.7 | I236 M237 K245 | I236-S264 VanDerWaalsContact CG2-O 3.3Å; I236-S264 WeakPolarHBondContact CG2-O 3.31Å; M237-S264 VanDerWaalsContact CB-O 3.31Å; M237-S264 WeakPolarHBondContact CB-O 3.48Å; M237-S264 PolarHBondContact N-O 3.07Å; K245-S264 PolarHBondContact O-N 2.96Å |
| 265 | F | 94.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | B | Isolated β-bridge | trans | -86.7 | 160.9 | 174.6 | -67.7 | -80.2 | 0 | 0 | 0 | 112.3 | N210 I212 F230 I236 V263 N267 A271 A274 | N210-F265 WeakPolarHBondContact O-CB 3.31Å; N210-F265 PolarHBondContact O-N 3.48Å; I212-F265 HydrophobicContact CD1-CE2 3.6Å; I212-F265 HydrophobicContact CD1-CZ 4.07Å; I212-F265 HydrophobicContact CG1-CE2 3.75Å; I212-F265 HydrophobicContact CG2-CD2 4.46Å; I212-F265 HydrophobicContact CG2-CE2 4.08Å; F230-F265 HydrophobicContact CB-CZ 4.25Å; I236-F265 HydrophobicContact CG1-CD1 4.13Å; I236-F265 HydrophobicContact CG1-CE1 3.97Å; V263-F265 HydrophobicContact CG1-CE1 4.49Å; V263-F265 HydrophobicContact CG1-CE2 4.11Å; V263-F265 HydrophobicContact CG1-CZ 4.08Å; F265-N267 WeakPolarHBondContact CB-O 3.34Å; F265-A271 HydrophobicContact CD2-CB 3.9Å; F265-A271 HydrophobicContact CE2-CB 4.49Å; F265-A274 HydrophobicContact CE2-CB 3.78Å; F265-A274 HydrophobicContact CZ-CB 3.66Å |
| 266 | V | 92 | Very high | 90.3 | Very high | 59 Ų | 59 | 49.5 Ų | 49.5 | 36% | 0.358 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -67.6 | -43.4 | 171.8 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | E235 | E235-V266 HydrophobicContact CB-CG2 4.14Å; E235-V266 HydrophobicContact CG-CG2 4.13Å; E235-V266 WeakPolarHBondContact O-CG2 3.48Å; E235-V266 PolarHBondContact O-N 3.38Å |
| 267 | N | 90.5 | Very high | 91.2 | Very high | 61 Ų | 61 | 48.4 Ų | 48.4 | 33% | 0.326 | 25% | 0.247 | S | C | . | . | S | Bend | trans | -116.8 | 147.9 | -177.4 | -64.4 | -24.2 | 0 | 0 | 0 | 111.9 | F265 Q269 Y270 | F265-N267 WeakPolarHBondContact CB-O 3.34Å; N267-Q269 VanDerWaalsContact C-N 3.3Å; N267-Q269 PolarHBondContact O-N 3.45Å; N267-Y270 HydrophobicContact CB-CD2 3.65Å; N267-Y270 HydrophobicContact CB-CE2 3.8Å; N267-Y270 HydrophobicContact CB-CG 4.18Å; N267-Y270 WeakPolarHBondContact ND2-CE2 3.27Å; N267-Y270 PolarHBondContact O-N 3.12Å |
| 268 | P | 90.7 | Very high | 92 | Very high | 37 Ų | 37 | 47.4 Ų | 47.4 | 24% | 0.24 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -69.3 | -28.8 | 177.3 | 23.5 | -29.7 | 0 | 0 | 0 | 113 | V208 N210 Y270 A271 T272 | V208-P268 HydrophobicContact CB-CB 3.56Å; V208-P268 HydrophobicContact CB-CG 3.85Å; V208-P268 HydrophobicContact CG1-CB 3.63Å; V208-P268 HydrophobicContact CG1-CG 3.71Å; N210-P268 WeakPolarHBondContact OD1-CA 3.24Å; N210-P268 WeakPolarHBondContact OD1-CB 3.39Å; N210-P268 WeakPolarHBondContact OD1-CD 2.96Å; P268-Y270 VanDerWaalsContact C-N 3.25Å; P268-Y270 PolarHBondContact O-N 3.31Å; P268-A271 WeakPolarHBondContact O-CB 3.22Å; P268-A271 PolarHBondContact O-N 2.83Å; P268-A271 VanDerWaalsContact O-N 3.09Å; P268-T272 PolarHBondContact O-N 2.77Å; P268-T272 VanDerWaalsContact O-N 3.14Å; P268-T272 PolarHBondContact O-OG1 3.43Å |
| 269 | Q | 91.9 | Very high | 92.5 | Very high | 149 Ų | 149 | 45.5 Ų | 45.5 | 70% | 0.696 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -61.1 | -36.4 | 176.6 | -66.5 | 179.6 | -26 | 0 | 0 | 111.7 | N267 A271 T272 A273 | N267-Q269 VanDerWaalsContact C-N 3.3Å; N267-Q269 PolarHBondContact O-N 3.45Å; Q269-A271 VanDerWaalsContact C-N 3.33Å; Q269-T272 PolarHBondContact O-N 2.78Å; Q269-A273 PolarHBondContact O-N 2.83Å |
| 270 | Y | 94.1 | Very high | 92.7 | Very high | 74 Ų | 74 | 47.1 Ų | 47.1 | 29% | 0.29 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -67.4 | -34.5 | 175.4 | -58.6 | -33.3 | 0 | 0 | 0 | 111.9 | E235 N267 P268 A273 A274 | E235-Y270 HydrophobicContact CB-CE2 4.1Å; N267-Y270 HydrophobicContact CB-CD2 3.65Å; N267-Y270 HydrophobicContact CB-CE2 3.8Å; N267-Y270 HydrophobicContact CB-CG 4.18Å; N267-Y270 WeakPolarHBondContact ND2-CE2 3.27Å; N267-Y270 PolarHBondContact O-N 3.12Å; P268-Y270 VanDerWaalsContact C-N 3.25Å; P268-Y270 PolarHBondContact O-N 3.31Å; Y270-A273 PolarHBondContact O-N 3.11Å; Y270-A274 VanDerWaalsContact O-CB 3.24Å; Y270-A274 WeakPolarHBondContact O-CB 3.32Å; Y270-A274 PolarHBondContact O-N 3.29Å |
| 271 | A | 93.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | N209 I212 F265 P268 Q269 A274 I275 Y294 | N209-A271 VanDerWaalsContact O-CB 3.3Å; N209-A271 WeakPolarHBondContact O-CB 3.26Å; I212-A271 HydrophobicContact CG2-CB 3.78Å; F265-A271 HydrophobicContact CD2-CB 3.9Å; F265-A271 HydrophobicContact CE2-CB 4.49Å; P268-A271 WeakPolarHBondContact O-CB 3.22Å; P268-A271 PolarHBondContact O-N 2.83Å; P268-A271 VanDerWaalsContact O-N 3.09Å; Q269-A271 VanDerWaalsContact C-N 3.33Å; A271-A274 PolarHBondContact O-N 2.91Å; A271-I275 WeakPolarHBondContact O-CG1 3.31Å; A271-I275 PolarHBondContact O-N 2.86Å; A271-I275 VanDerWaalsContact O-N 3.09Å; A271-Y294 HydrophobicContact CB-CE1 4.31Å |
| 272 | T | 92.4 | Very high | 92.4 | Very high | 52 Ų | 52 | 56.2 Ų | 56.2 | 32% | 0.319 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.8 | -50.7 | 174.2 | -50.7 | 0 | 0 | 0 | 0 | 111.5 | P268 Q269 A274 I275 D276 Y294 | P268-T272 PolarHBondContact O-N 2.77Å; P268-T272 VanDerWaalsContact O-N 3.14Å; P268-T272 PolarHBondContact O-OG1 3.43Å; Q269-T272 PolarHBondContact O-N 2.78Å; T272-A274 PolarHBondContact O-N 2.98Å; T272-I275 PolarHBondContact O-N 2.83Å; T272-I275 VanDerWaalsContact O-N 3.08Å; T272-D276 PolarHBondContact O-N 3.29Å; T272-Y294 WeakPolarHBondContact CB-OH 3.24Å; T272-Y294 WeakPolarHBondContact CG2-OH 3.44Å; T272-Y294 PolarHBondContact OG1-OH 3.49Å |
| 273 | A | 93.7 | Very high | 92.1 | Very high | 44 Ų | 44 | 54.6 Ų | 54.6 | 36% | 0.364 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60 | -35.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q269 Y270 R277 | Q269-A273 PolarHBondContact O-N 2.83Å; Y270-A273 PolarHBondContact O-N 3.11Å; A273-R277 VanDerWaalsContact O-CB 3.27Å; A273-R277 WeakPolarHBondContact O-CB 3.3Å; A273-R277 PolarHBondContact O-N 3.09Å |
| 274 | A | 94.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.6 | -39.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I212 F230 A233 F265 Y270 A271 T272 F278 | I212-A274 HydrophobicContact CD1-CB 3.96Å; F230-A274 HydrophobicContact CD1-CB 4.42Å; A233-A274 HydrophobicContact CB-CB 3.64Å; F265-A274 HydrophobicContact CE2-CB 3.78Å; F265-A274 HydrophobicContact CZ-CB 3.66Å; Y270-A274 VanDerWaalsContact O-CB 3.24Å; Y270-A274 WeakPolarHBondContact O-CB 3.32Å; Y270-A274 PolarHBondContact O-N 3.29Å; A271-A274 PolarHBondContact O-N 2.91Å; T272-A274 PolarHBondContact O-N 2.98Å; A274-F278 HydrophobicContact CB-CD2 4.28Å; A274-F278 VanDerWaalsContact O-CB 3.31Å; A274-F278 WeakPolarHBondContact O-CB 3.43Å; A274-F278 WeakPolarHBondContact O-CD2 3.28Å; A274-F278 PolarHBondContact O-N 3.44Å |
| 275 | I | 93.5 | Very high | 90.8 | Very high | 20 Ų | 20 | 58.6 Ų | 58.6 | 10% | 0.103 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.4 | -50.9 | 175.3 | -68.1 | 161.4 | 0 | 0 | 0 | 109.6 | I212 A271 T272 R277 N279 V292 Y294 | I212-I275 HydrophobicContact CG2-CD1 4.15Å; I212-I275 HydrophobicContact CG2-CG1 4.02Å; A271-I275 WeakPolarHBondContact O-CG1 3.31Å; A271-I275 PolarHBondContact O-N 2.86Å; A271-I275 VanDerWaalsContact O-N 3.09Å; T272-I275 PolarHBondContact O-N 2.83Å; T272-I275 VanDerWaalsContact O-N 3.08Å; I275-R277 VanDerWaalsContact C-N 3.3Å; I275-R277 PolarHBondContact O-N 2.81Å; I275-N279 HydrophobicContact CG2-CB 4.36Å; I275-N279 WeakPolarHBondContact O-CB 3.06Å; I275-N279 PolarHBondContact O-N 2.78Å; I275-V292 HydrophobicContact CG1-CG1 3.88Å; I275-Y294 HydrophobicContact CD1-CD1 3.6Å; I275-Y294 HydrophobicContact CD1-CD2 3.61Å; I275-Y294 HydrophobicContact CD1-CE1 3.53Å; I275-Y294 HydrophobicContact CD1-CE2 3.53Å; I275-Y294 HydrophobicContact CD1-CG 3.64Å; I275-Y294 VanDerWaalsContact CD1-CZ 3.5Å |
| 276 | D | 93.3 | Very high | 89.9 | Confident | 128 Ų | 128 | 60 Ų | 60 | 68% | 0.684 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.5 | -35.7 | -176.1 | -66.1 | -22.2 | 0 | 0 | 0 | 112.8 | T272 | T272-D276 PolarHBondContact O-N 3.29Å |
| 277 | R | 92.2 | Very high | 89.3 | Confident | 143 Ų | 143 | 66 Ų | 66 | 54% | 0.54 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -81.7 | -40.4 | -177.8 | -169 | -177.8 | -120.4 | -135.7 | 2.8 | 113.4 | A273 I275 Q281 | A273-R277 VanDerWaalsContact O-CB 3.27Å; A273-R277 WeakPolarHBondContact O-CB 3.3Å; A273-R277 PolarHBondContact O-N 3.09Å; I275-R277 VanDerWaalsContact C-N 3.3Å; I275-R277 PolarHBondContact O-N 2.81Å; R277-Q281 WeakPolarHBondContact O-CG 3.37Å |
| 278 | F | 93.3 | Very high | 89 | Confident | 5 Ų | 5 | 67.2 Ų | 67.2 | 2% | 0.022 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -107.7 | -15.5 | -167.9 | -62.3 | -62.5 | 0 | 0 | 0 | 114.7 | Y229 F230 Q232 A233 A274 G280 Q281 V292 | Y229-F278 HydrophobicContact CD1-CD1 4.35Å; Y229-F278 HydrophobicContact CD1-CE1 4.12Å; Y229-F278 HydrophobicContact CD1-CZ 4.43Å; Y229-F278 AromaticContact CE1-CD1 3.39Å; Y229-F278 HydrophobicContact CE1-CD1 3.39Å; Y229-F278 AromaticContact CE1-CE1 3.42Å; Y229-F278 HydrophobicContact CE1-CE1 3.42Å; Y229-F278 VanDerWaalsContact CE1-CE1 3.42Å; Y229-F278 HydrophobicContact CE1-CG 4.1Å; Y229-F278 HydrophobicContact CE1-CZ 4.14Å; Y229-F278 HydrophobicContact CE2-CE1 4.36Å; Y229-F278 AromaticContact CZ-CD1 3.72Å; Y229-F278 AromaticContact CZ-CE1 3.57Å; F230-F278 AromaticContact CD1-CD2 3.71Å; F230-F278 HydrophobicContact CD1-CD2 3.71Å; F230-F278 HydrophobicContact CD1-CE2 4.03Å; F230-F278 HydrophobicContact CD1-CG 4.43Å; F230-F278 HydrophobicContact CE1-CB 3.95Å; F230-F278 AromaticContact CE1-CD2 3.7Å; F230-F278 HydrophobicContact CE1-CD2 3.7Å; F230-F278 HydrophobicContact CE1-CE2 4.42Å; F230-F278 HydrophobicContact CE1-CG 4.01Å; F230-F278 HydrophobicContact CZ-CB 4.47Å; Q232-F278 HydrophobicContact CB-CZ 4.15Å; A233-F278 HydrophobicContact CB-CD2 4.38Å; A233-F278 HydrophobicContact CB-CE2 3.72Å; A274-F278 HydrophobicContact CB-CD2 4.28Å; A274-F278 VanDerWaalsContact O-CB 3.31Å; A274-F278 WeakPolarHBondContact O-CB 3.43Å; A274-F278 WeakPolarHBondContact O-CD2 3.28Å; A274-F278 PolarHBondContact O-N 3.44Å; F278-G280 PolarHBondContact O-N 3.21Å; F278-Q281 WeakPolarHBondContact O-CB 3.46Å; F278-Q281 PolarHBondContact O-N 3.21Å; F278-V292 HydrophobicContact CB-CG2 4Å |
| 279 | N | 93.1 | Very high | 88.9 | Confident | 81 Ų | 81 | 68.6 Ų | 68.6 | 43% | 0.433 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | 121.3 | 175.7 | -171.4 | 32.5 | 0 | 0 | 0 | 110.1 | I275 V292 | I275-N279 HydrophobicContact CG2-CB 4.36Å; I275-N279 WeakPolarHBondContact O-CB 3.06Å; I275-N279 PolarHBondContact O-N 2.78Å; N279-V292 HydrophobicContact CB-CB 4.07Å; N279-V292 PolarHBondContact OD1-N 3.44Å; N279-V292 PolarHBondContact OD1-O 2.97Å |
| 280 | G | 90.8 | Very high | 88.9 | Confident | 43 Ų | 43 | 61.6 Ų | 61.6 | 44% | 0.443 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.2 | -5.4 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | F278 M290 | F278-G280 PolarHBondContact O-N 3.21Å; G280-M290 WeakPolarHBondContact CA-O 3.47Å; G280-M290 PolarHBondContact N-O 2.9Å |
| 281 | Q | 89.8 | Confident | 88.9 | Confident | 99 Ų | 99 | 63.4 Ų | 63.4 | 46% | 0.463 | 35% | 0.346 | S | S | . | . | P | Polyproline II helix | trans | -80.9 | 156.5 | 176.2 | -64.1 | -61.2 | -26 | 0 | 0 | 111.9 | R277 F278 M290 | R277-Q281 WeakPolarHBondContact O-CG 3.37Å; F278-Q281 WeakPolarHBondContact O-CB 3.46Å; F278-Q281 PolarHBondContact O-N 3.21Å; Q281-M290 HydrophobicContact CB-CE 4.35Å; Q281-M290 WeakPolarHBondContact O-CB 3.49Å; Q281-M290 WeakPolarHBondContact O-CE 3.25Å; Q281-M290 PolarHBondContact O-N 3.38Å |
| 282 | Y | 88.5 | Confident | 88.9 | Confident | 135 Ų | 135 | 63.4 Ų | 63.4 | 53% | 0.529 | 35% | 0.346 | S | S | . | . | B | Isolated β-bridge | trans | -85.9 | 131.5 | 175.3 | -63.5 | -88.8 | 0 | 0 | 0 | 110.3 | E287 P289 | Y282-E287 VanDerWaalsContact CE1-O 3.28Å; Y282-E287 WeakPolarHBondContact CE1-O 3.38Å; Y282-P289 HydrophobicContact CD1-CB 4.49Å; Y282-P289 HydrophobicContact CE1-CB 4.11Å; Y282-P289 HydrophobicContact CE1-CG 4.48Å |
| 283 | F | 85.7 | Confident | 88.9 | Confident | 5 Ų | 5 | 63.2 Ų | 63.2 | 2% | 0.022 | 34% | 0.344 | C | S | . | . | P | Polyproline II helix | trans | -70 | 139.7 | 168 | -160.9 | -95.4 | 0 | 0 | 0 | 108.1 | P218 A221 I225 Y229 G285 C286 M290 | P218-F283 HydrophobicContact CG-CD1 3.39Å; P218-F283 HydrophobicContact CG-CE1 3.8Å; P218-F283 HydrophobicContact CG-CG 4.34Å; A221-F283 HydrophobicContact CB-CE1 4.16Å; A221-F283 HydrophobicContact CB-CZ 4.34Å; I225-F283 HydrophobicContact CG2-CE1 4.22Å; I225-F283 HydrophobicContact CG2-CZ 3.9Å; Y229-F283 HydrophobicContact CD1-CD2 4.07Å; Y229-F283 AromaticContact CD1-CE2 3.89Å; Y229-F283 HydrophobicContact CD1-CE2 3.89Å; Y229-F283 HydrophobicContact CD2-CE2 4.45Å; Y229-F283 HydrophobicContact CE1-CD2 4.28Å; Y229-F283 HydrophobicContact CG-CD2 4.31Å; Y229-F283 AromaticContact CG-CE2 3.83Å; Y229-F283 HydrophobicContact CG-CE2 3.83Å; F283-G285 PolarHBondContact O-N 3.32Å; F283-C286 HydrophobicContact CB-CB 4.27Å; F283-C286 PolarHBondContact O-N 3.13Å; F283-M290 HydrophobicContact CB-CE 4.01Å; F283-M290 HydrophobicContact CB-CG 3.98Å; F283-M290 HydrophobicContact CB-SD 3.58Å; F283-M290 VanDerWaalsContact CB-SD 3.58Å; F283-M290 HydrophobicContact CD2-CE 4.1Å; F283-M290 HydrophobicContact CD2-SD 3.51Å; F283-M290 VanDerWaalsContact CD2-SD 3.51Å; F283-M290 HydrophobicContact CG-SD 3.99Å |
| 284 | P | 83.2 | Confident | 88.9 | Confident | 42 Ų | 42 | 65.8 Ų | 65.8 | 27% | 0.273 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.7 | 120.3 | 177.4 | 21.8 | -34.2 | 0 | 0 | 0 | 110 | Y10 Y229 | Y10-P284 PolarHBondContact OH-O 3.19Å; Y229-P284 HydrophobicContact CD2-CG 4.46Å |
| 285 | G | 76.5 | Confident | 88.6 | Confident | 53 Ų | 53 | 66 Ų | 66 | 55% | 0.546 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93.1 | 1.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115 | Y10 F283 | Y10-G285 WeakPolarHBondContact OH-CA 3.42Å; Y10-G285 PolarHBondContact OH-N 2.74Å; F283-G285 PolarHBondContact O-N 3.32Å |
| 286 | C | 75.8 | Confident | 87.9 | Confident | 30 Ų | 30 | 71 Ų | 71 | 20% | 0.203 | 38% | 0.379 | C | S | . | . | trans | -111.2 | 139.1 | 172 | -92.5 | 0 | 0 | 0 | 0 | 112.2 | P218 F283 V288 | P218-C286 WeakPolarHBondContact CA-SG 3.21Å; P218-C286 WeakPolarHBondContact CB-SG 3.34Å; P218-C286 WeakPolarHBondContact CD-SG 3.05Å; P218-C286 VanDerWaalsContact N-SG 3.36Å; F283-C286 HydrophobicContact CB-CB 4.27Å; F283-C286 PolarHBondContact O-N 3.13Å; C286-V288 VanDerWaalsContact C-N 3.34Å | ||
| 287 | E | 77.8 | Confident | 86.2 | Confident | 184 Ų | 184 | 69.6 Ų | 69.6 | 86% | 0.86 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -87 | -8.1 | 170.3 | -61.3 | -179.8 | 178.6 | 0 | 0 | 112.6 | Y282 | Y282-E287 VanDerWaalsContact CE1-O 3.28Å; Y282-E287 WeakPolarHBondContact CE1-O 3.38Å |
| 288 | V | 84.7 | Confident | 84.4 | Confident | 88 Ų | 88 | 72.4 Ų | 72.4 | 53% | 0.533 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -95.4 | 127.3 | -179.6 | -177.5 | 0 | 0 | 0 | 0 | 109.1 | C286 M290 | C286-V288 VanDerWaalsContact C-N 3.34Å; V288-M290 PolarHBondContact O-N 3.37Å |
| 289 | P | 89 | Confident | 81.8 | Confident | 65 Ų | 65 | 75 Ų | 75 | 42% | 0.422 | 41% | 0.405 | S | S | . | . | B | Isolated β-bridge | trans | -65.9 | 135.4 | 175.5 | 27.8 | -33.7 | 0 | 0 | 0 | 109.9 | Y282 | Y282-P289 HydrophobicContact CD1-CB 4.49Å; Y282-P289 HydrophobicContact CE1-CB 4.11Å; Y282-P289 HydrophobicContact CE1-CG 4.48Å |
| 290 | M | 91.8 | Very high | 79.4 | Confident | 2 Ų | 2 | 77.8 Ų | 77.8 | 1% | 0.01 | 42% | 0.424 | C | S | . | . | P | Polyproline II helix | trans | -72.3 | 142.1 | 177.2 | -68.1 | -177.6 | -70.3 | 0 | 0 | 110.9 | I214 Q215 I217 Y229 F230 G280 Q281 F283 V288 | I214-M290 HydrophobicContact CG2-CB 4.49Å; I214-M290 HydrophobicContact CG2-SD 4.16Å; Q215-M290 CarbonylContact O-C 3.54Å; Q215-M290 WeakPolarHBondContact O-CA 3.41Å; I217-M290 HydrophobicContact CG1-SD 4.49Å; Y229-M290 HydrophobicContact CE1-CE 3.68Å; F230-M290 HydrophobicContact CZ-SD 4.45Å; G280-M290 WeakPolarHBondContact CA-O 3.47Å; G280-M290 PolarHBondContact N-O 2.9Å; Q281-M290 HydrophobicContact CB-CE 4.35Å; Q281-M290 WeakPolarHBondContact O-CB 3.49Å; Q281-M290 WeakPolarHBondContact O-CE 3.25Å; Q281-M290 PolarHBondContact O-N 3.38Å; F283-M290 HydrophobicContact CB-CE 4.01Å; F283-M290 HydrophobicContact CB-CG 3.98Å; F283-M290 HydrophobicContact CB-SD 3.58Å; F283-M290 VanDerWaalsContact CB-SD 3.58Å; F283-M290 HydrophobicContact CD2-CE 4.1Å; F283-M290 HydrophobicContact CD2-SD 3.51Å; F283-M290 VanDerWaalsContact CD2-SD 3.51Å; F283-M290 HydrophobicContact CG-SD 3.99Å; V288-M290 PolarHBondContact O-N 3.37Å |
| 291 | K | 93.6 | Very high | 76.9 | Confident | 112 Ų | 112 | 81.4 Ų | 81.4 | 49% | 0.487 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 119.5 | 168.8 | -177.7 | 176.9 | -179 | 175.3 | 0 | 109 | I214 Q215 T293 | I214-K291 CarbonylContact C-O 3.52Å; I214-K291 WeakPolarHBondContact CA-O 3.49Å; Q215-K291 HydrophobicContact CB-CB 4.26Å; Q215-K291 PolarHBondContact N-O 3.49Å; Q215-K291 PolarHBondContact O-N 3Å; K291-T293 HydrophobicContact CG-CG2 4.19Å |
| 292 | V | 93.8 | Very high | 74.4 | Confident | 0 Ų | 0 | 87.2 Ų | 87.2 | 0% | 0 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.5 | 122.7 | 179.6 | -169.6 | 0 | 0 | 0 | 0 | 108.3 | I212 I214 F230 I275 F278 N279 | I212-V292 HydrophobicContact CB-CG1 4.11Å; I212-V292 HydrophobicContact CD1-CG1 3.77Å; I212-V292 HydrophobicContact CG1-CG1 4.44Å; I214-V292 HydrophobicContact CG1-CG1 4.24Å; I214-V292 HydrophobicContact CG1-CG2 4.39Å; I214-V292 HydrophobicContact CG2-CG2 4.29Å; F230-V292 HydrophobicContact CE1-CG1 4.43Å; F230-V292 HydrophobicContact CE1-CG2 4.23Å; F230-V292 HydrophobicContact CZ-CG2 4.27Å; I275-V292 HydrophobicContact CG1-CG1 3.88Å; F278-V292 HydrophobicContact CB-CG2 4Å; N279-V292 HydrophobicContact CB-CB 4.07Å; N279-V292 PolarHBondContact OD1-N 3.44Å; N279-V292 PolarHBondContact OD1-O 2.97Å |
| 293 | T | 93.1 | Very high | 72.2 | Confident | 48 Ų | 48 | 83.8 Ų | 83.8 | 29% | 0.294 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.9 | 156.8 | -178.7 | 51.8 | 0 | 0 | 0 | 0 | 110 | I212 F213 K291 A295 | I212-T293 CarbonylContact C-O 3.57Å; I212-T293 WeakPolarHBondContact CA-O 3.11Å; F213-T293 PolarHBondContact N-O 2.81Å; F213-T293 PolarHBondContact O-N 3.31Å; F213-T293 PolarHBondContact O-OG1 2.96Å; K291-T293 HydrophobicContact CG-CG2 4.19Å; T293-A295 PolarHBondContact O-N 3.31Å |
| 294 | Y | 92.7 | Very high | 70 | Confident | 98 Ų | 98 | 92.5 Ų | 92.5 | 38% | 0.384 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -54.9 | 134.5 | 167.9 | -71.3 | -71.5 | 0 | 0 | 0 | 110.2 | N209 A271 T272 I275 T296 | N209-Y294 HydrophobicContact CB-CD1 3.83Å; N209-Y294 HydrophobicContact CB-CG 4.4Å; A271-Y294 HydrophobicContact CB-CE1 4.31Å; T272-Y294 WeakPolarHBondContact CB-OH 3.24Å; T272-Y294 WeakPolarHBondContact CG2-OH 3.44Å; T272-Y294 PolarHBondContact OG1-OH 3.49Å; I275-Y294 HydrophobicContact CD1-CD1 3.6Å; I275-Y294 HydrophobicContact CD1-CD2 3.61Å; I275-Y294 HydrophobicContact CD1-CE1 3.53Å; I275-Y294 HydrophobicContact CD1-CE2 3.53Å; I275-Y294 HydrophobicContact CD1-CG 3.64Å; I275-Y294 VanDerWaalsContact CD1-CZ 3.5Å; Y294-T296 PolarHBondContact O-N 2.81Å |
| 295 | A | 88 | Confident | 67.9 | Low | 5 Ų | 5 | 93.4 Ų | 93.4 | 4% | 0.041 | 52% | 0.519 | C | S | . | . | trans | -66.7 | 120.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | A211 F213 L262 T293 T297 | A211-A295 HydrophobicContact CB-CB 3.74Å; A211-A295 VanDerWaalsContact O-CB 3.25Å; A211-A295 WeakPolarHBondContact O-CB 3.36Å; A211-A295 PolarHBondContact O-N 2.96Å; F213-A295 HydrophobicContact CB-CB 4.33Å; L262-A295 HydrophobicContact CD1-CB 4.08Å; L262-A295 HydrophobicContact CG-CB 4.47Å; T293-A295 PolarHBondContact O-N 3.31Å; A295-T297 PolarHBondContact O-N 2.83Å | ||
| 296 | T | 78.5 | Confident | 65.9 | Low | 124 Ų | 124 | 94.7 Ų | 94.7 | 76% | 0.761 | 53% | 0.532 | S | S | * | . | trans | -61.6 | 112.1 | 165.8 | 58 | 0 | 0 | 0 | 0 | 106 | Y294 R298 | Y294-T296 PolarHBondContact O-N 2.81Å; T296-R298 PolarHBondContact O-N 3.28Å | ||
| 297 | T | 57.9 | Low | 64 | Low | 100 Ų | 100 | 97.4 Ų | 97.4 | 61% | 0.613 | 57% | 0.565 | S | S | * | * | trans | -54 | 119.5 | 170.8 | 50.4 | 0 | 0 | 0 | 0 | 106.1 | N209 A295 S299 | N209-T297 VanDerWaalsContact OD1-CG2 3.27Å; N209-T297 WeakPolarHBondContact OD1-CG2 3.3Å; A295-T297 PolarHBondContact O-N 2.83Å; T297-S299 PolarHBondContact O-N 3.38Å | ||
| 298 | R | 54.2 | Low | 62.2 | Low | 202 Ų | 202 | 91.4 Ų | 91.4 | 76% | 0.762 | 55% | 0.553 | S | S | * | * | trans | -70.6 | 86.2 | 156.3 | -62.2 | -175.7 | -173.5 | -173.8 | 2.4 | 102.4 | T296 T300 | T296-R298 PolarHBondContact O-N 3.28Å; R298-T300 PolarHBondContact O-N 3.35Å; R298-T300 PolarHBondContact O-OG1 3.38Å | ||
| 299 | S | 39.9 | Very low | 60.1 | Low | 60 Ų | 60 | 99 Ų | 99 | 42% | 0.42 | 57% | 0.572 | S | S | . | * | trans | -43.3 | 112.6 | 175 | 170.1 | 0 | 0 | 0 | 0 | 106.1 | T297 D301 | T297-S299 PolarHBondContact O-N 3.38Å; S299-D301 PolarHBondContact O-N 3.18Å; S299-D301 WeakPolarHBondContact OG-CA 3.32Å; S299-D301 WeakPolarHBondContact OG-CB 3.17Å; S299-D301 PolarHBondContact OG-N 3.02Å; S299-D301 VanDerWaalsContact OG-N 3.12Å; S299-D301 PolarHBondContact OG-O 3.46Å; S299-D301 PolarHBondContact OG-OD2 2.75Å | ||
| 300 | T | 42.5 | Very low | 58 | Low | 138 Ų | 138 | 102.7 Ų | 102.7 | 85% | 0.847 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -73.9 | 0.4 | 170.9 | -57.3 | 0 | 0 | 0 | 0 | 108.7 | R298 Y302 | R298-T300 PolarHBondContact O-N 3.35Å; R298-T300 PolarHBondContact O-OG1 3.38Å; T300-Y302 PolarHBondContact O-N 3.46Å |
| 301 | D | 37.9 | Very low | 55.9 | Low | 119 Ų | 119 | 111.9 Ų | 111.9 | 64% | 0.636 | 63% | 0.633 | S | S | * | * | trans | -71.3 | 74 | 152.7 | -39.5 | -84.4 | 0 | 0 | 0 | 110.4 | S299 G303 | S299-D301 PolarHBondContact O-N 3.18Å; S299-D301 WeakPolarHBondContact OG-CA 3.32Å; S299-D301 WeakPolarHBondContact OG-CB 3.17Å; S299-D301 PolarHBondContact OG-N 3.02Å; S299-D301 VanDerWaalsContact OG-N 3.12Å; S299-D301 PolarHBondContact OG-O 3.46Å; S299-D301 PolarHBondContact OG-OD2 2.75Å; D301-G303 PolarHBondContact O-N 2.83Å | ||
| 302 | Y | 38.3 | Very low | 53.5 | Low | 222 Ų | 222 | 109.7 Ų | 109.7 | 87% | 0.871 | 64% | 0.643 | S | S | * | * | S | Bend | -61.2 | 88 | 125.1 | -84.7 | -87.4 | 0 | 0 | 0 | 106.6 | T300 M304 | T300-Y302 PolarHBondContact O-N 3.46Å; Y302-M304 VanDerWaalsContact C-N 3.32Å; Y302-M304 PolarHBondContact O-N 3.1Å | |
| 303 | G | 40.6 | Very low | 50.8 | Low | 63 Ų | 63 | 113.9 Ų | 113.9 | 65% | 0.649 | 69% | 0.686 | S | S | * | * | S | Bend | trans | 15.1 | 64.1 | 162.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | D301 | D301-G303 PolarHBondContact O-N 2.83Š|
| 304 | M | 40 | Very low | 48.3 | Very low | 187 Ų | 187 | 115.6 Ų | 115.6 | 92% | 0.921 | 71% | 0.713 | S | S | * | * | trans | -92.8 | 24.2 | 155.1 | -95.4 | -80.9 | -178.9 | 0 | 0 | 110.2 | Y302 | Y302-M304 VanDerWaalsContact C-N 3.32Å; Y302-M304 PolarHBondContact O-N 3.1Å | ||
| 305 | G | 38.6 | Very low | 45.7 | Very low | 61 Ų | 61 | 113.9 Ų | 113.9 | 63% | 0.629 | 73% | 0.725 | S | S | * | * | trans | -85.6 | 123.3 | 145.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 306 | G | 36.4 | Very low | 43.2 | Very low | 80 Ų | 80 | 117.7 Ų | 117.7 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | cis | 104.3 | 98.7 | 39.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 307 | G | 35.3 | Very low | 41.6 | Very low | 88 Ų | 88 | 122.1 Ų | 122.1 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | trans | 98 | 123.9 | 168 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 308 | G | 39.5 | Very low | 40.9 | Very low | 58 Ų | 58 | 120.9 Ų | 120.9 | 60% | 0.598 | 78% | 0.777 | S | S | * | * | trans | 120.3 | 45 | 170.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | D310 | G308-D310 VanDerWaalsContact CA-OD2 3.3Å; G308-D310 WeakPolarHBondContact CA-OD2 3.43Å; G308-D310 PolarHBondContact O-N 3.48Å | ||
| 309 | R | 40.5 | Very low | 40.5 | Very low | 246 Ų | 246 | 123.1 Ų | 123.1 | 93% | 0.928 | 79% | 0.785 | S | S | * | * | trans | -71.1 | 70.9 | 156 | -69.1 | 179.2 | -174.8 | 167.5 | 1.4 | 107.9 | ||||
| 310 | D | 44.9 | Very low | 40.6 | Very low | 143 Ų | 143 | 124.2 Ų | 124.2 | 77% | 0.765 | 81% | 0.806 | S | S | * | * | trans | -108.5 | 48.5 | 170.3 | -55.4 | -65.7 | 0 | 0 | 0 | 108.9 | G308 | G308-D310 VanDerWaalsContact CA-OD2 3.3Å; G308-D310 WeakPolarHBondContact CA-OD2 3.43Å; G308-D310 PolarHBondContact O-N 3.48Å | ||
| 311 | M | 47.5 | Very low | 40.7 | Very low | 195 Ų | 195 | 121.3 Ų | 121.3 | 96% | 0.961 | 80% | 0.803 | S | S | * | * | trans | -114.7 | 50.4 | 148.9 | -89.4 | -88.1 | 179 | 0 | 0 | 106.5 | ||||
| 312 | G | 43.3 | Very low | 41.2 | Very low | 66 Ų | 66 | 121.8 Ų | 121.8 | 68% | 0.68 | 81% | 0.813 | S | S | * | * | trans | -71.6 | 137.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 313 | G | 38.3 | Very low | 41.5 | Very low | 88 Ų | 88 | 117.1 Ų | 117.1 | 91% | 0.907 | 81% | 0.81 | S | S | * | * | trans | -59.4 | 153.8 | -172.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 314 | G | 38.7 | Very low | 41.8 | Very low | 85 Ų | 85 | 117.5 Ų | 117.5 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | trans | 165.5 | 102.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 315 | G | 38.5 | Very low | 41.9 | Very low | 61 Ų | 61 | 117.8 Ų | 117.8 | 63% | 0.629 | 80% | 0.804 | S | S | * | * | cis | 151.2 | 132.2 | 36.6 | 0 | 0 | 0 | 0 | 0 | 102.7 | ||||
| 316 | G | 36.5 | Very low | 42.3 | Very low | 85 Ų | 85 | 123.6 Ų | 123.6 | 88% | 0.876 | 81% | 0.809 | S | S | * | * | trans | -59.2 | 142.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 317 | Y | 43.8 | Very low | 42.8 | Very low | 217 Ų | 217 | 127.3 Ų | 127.3 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | trans | -150.7 | 100.3 | 142.3 | 45.4 | -87.1 | 0 | 0 | 0 | 107.5 | ||||
| 318 | G | 43.2 | Very low | 43.2 | Very low | 75 Ų | 75 | 126.6 Ų | 126.6 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | -66.5 | 135.1 | 159 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 319 | R | 45.8 | Very low | 43.4 | Very low | 249 Ų | 249 | 127.1 Ų | 127.1 | 94% | 0.94 | 81% | 0.807 | S | S | * | * | trans | -158.2 | 118.1 | 150.4 | -88.6 | -149 | -168.7 | -104.7 | 3.2 | 110.9 | ||||
| 320 | G | 42.7 | Very low | 43.6 | Very low | 83 Ų | 83 | 127.4 Ų | 127.4 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | trans | 75.7 | 106.1 | 151.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 321 | G | 43.9 | Very low | 43.6 | Very low | 76 Ų | 76 | 124.3 Ų | 124.3 | 78% | 0.784 | 81% | 0.81 | S | S | * | * | 114.5 | 162.8 | 59.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 322 | P | 50.1 | Low | 43.5 | Very low | 130 Ų | 130 | 126.8 Ų | 126.8 | 84% | 0.844 | 81% | 0.809 | S | S | * | * | cis | -129.2 | 168.8 | 11 | 24.7 | -0.2 | 0 | 0 | 0 | 116.2 | ||||
| 323 | P | 44.3 | Very low | 43.9 | Very low | 124 Ų | 124 | 129.1 Ų | 129.1 | 81% | 0.805 | 81% | 0.812 | S | S | * | * | trans | -100.7 | 146.4 | -164.8 | 36.5 | -30.9 | 0 | 0 | 0 | 116.2 | ||||
| 324 | G | 45.5 | Very low | 44.1 | Very low | 71 Ų | 71 | 128.1 Ų | 128.1 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | trans | 73.3 | 148.4 | 160.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 325 | R | 43.5 | Very low | 44.1 | Very low | 192 Ų | 192 | 126.9 Ų | 126.9 | 73% | 0.725 | 79% | 0.789 | S | S | * | * | -175.6 | 156 | 51 | -62.8 | -115.2 | -117.5 | -147.9 | -3.6 | 112.4 | |||||
| 326 | Y | 46.7 | Very low | 44.3 | Very low | 184 Ų | 184 | 134.9 Ų | 134.9 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | 46.6 | 124.8 | 156.4 | 25.1 | -114.1 | 0 | 0 | 0 | 118.9 | ||||
| 327 | D | 46.1 | Very low | 44.6 | Very low | 157 Ų | 157 | 134.6 Ų | 134.6 | 84% | 0.84 | 80% | 0.799 | S | S | * | * | -169.5 | 122.9 | 69.2 | -164.7 | -98.4 | 0 | 0 | 0 | 108.2 | |||||
| 328 | G | 43.9 | Very low | 44.5 | Very low | 73 Ų | 73 | 128.1 Ų | 128.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | 84.3 | 119.2 | 93.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 329 | G | 44.8 | Very low | 44.3 | Very low | 69 Ų | 69 | 136.6 Ų | 136.6 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | cis | 174.3 | 168.7 | 2.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 330 | R | 44.3 | Very low | 44.1 | Very low | 252 Ų | 252 | 128.2 Ų | 128.2 | 95% | 0.951 | 80% | 0.798 | S | S | * | * | trans | 65.3 | 113.5 | 156.7 | -50 | -165.1 | -160.1 | -141.8 | 8 | 117.5 | ||||
| 331 | G | 43.9 | Very low | 43.8 | Very low | 78 Ų | 78 | 130.5 Ų | 130.5 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | 88.4 | 124.3 | 67.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 332 | R | 46.7 | Very low | 43.5 | Very low | 248 Ų | 248 | 136 Ų | 136 | 94% | 0.936 | 79% | 0.793 | S | S | * | * | cis | -172.3 | 171.5 | 49.7 | -119.6 | -161.4 | 163.8 | -117.1 | 2.2 | 110.7 | ||||
| 333 | P | 50.1 | Low | 43.1 | Very low | 114 Ų | 114 | 133.5 Ų | 133.5 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | trans | -114.6 | 175.4 | -156.6 | 44.1 | -37.2 | 0 | 0 | 0 | 116.3 | ||||
| 334 | G | 43.2 | Very low | 42.8 | Very low | 67 Ų | 67 | 131.2 Ų | 131.2 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | trans | 153 | 114.2 | 160.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 335 | G | 39.8 | Very low | 42.8 | Very low | 59 Ų | 59 | 133.7 Ų | 133.7 | 61% | 0.608 | 79% | 0.794 | S | S | * | * | 86 | 132.5 | 95.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 336 | Y | 42.5 | Very low | 43 | Very low | 229 Ų | 229 | 130.7 Ų | 130.7 | 90% | 0.898 | 80% | 0.799 | S | S | * | * | cis | -169.2 | 149.9 | 35.5 | -57.6 | -90 | 0 | 0 | 0 | 110.9 | ||||
| 337 | G | 42.3 | Very low | 42.9 | Very low | 79 Ų | 79 | 133.8 Ų | 133.8 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | 67.9 | 118.8 | 145.5 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 338 | G | 40.3 | Very low | 42.6 | Very low | 82 Ų | 82 | 129.9 Ų | 129.9 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | 85.2 | 134.5 | 66.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 339 | R | 41 | Very low | 42.3 | Very low | 253 Ų | 253 | 137.9 Ų | 137.9 | 96% | 0.955 | 81% | 0.814 | S | S | * | * | cis | 180 | 145.2 | 19.6 | -157 | -159 | -137.4 | -102.7 | 8.2 | 106.7 | ||||
| 340 | G | 40.5 | Very low | 42 | Very low | 73 Ų | 73 | 139.8 Ų | 139.8 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | 61.3 | 122.4 | 150.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 341 | N | 36.8 | Very low | 41.8 | Very low | 131 Ų | 131 | 137.2 Ų | 137.2 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | 92.8 | 132.4 | 70.8 | -157.4 | 18.1 | 0 | 0 | 0 | 113.7 | |||||
| 342 | F | 38.4 | Very low | 41.5 | Very low | 190 Ų | 190 | 137.2 Ų | 137.2 | 83% | 0.833 | 82% | 0.815 | S | S | * | * | trans | 85.5 | 124.6 | 166 | -54.9 | -72.8 | 0 | 0 | 0 | 121.1 | ||||
| 343 | G | 41.4 | Very low | 41 | Very low | 78 Ų | 78 | 128.4 Ų | 128.4 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | 128.4 | 110.8 | 147.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 344 | G | 36.9 | Very low | 40.6 | Very low | 77 Ų | 77 | 133.8 Ų | 133.8 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -65.4 | -172.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 345 | P | 45.7 | Very low | 40.4 | Very low | 123 Ų | 123 | 138.5 Ų | 138.5 | 80% | 0.799 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -102.8 | 163.1 | -135.1 | 38.4 | -35.6 | 0 | 0 | 0 | 114.9 | ||
| 346 | P | 48 | Very low | 40.5 | Very low | 129 Ų | 129 | 147.4 Ų | 147.4 | 84% | 0.838 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -101 | 127 | 159.2 | 24.1 | -8.2 | 0 | 0 | 0 | 111.9 | ||
| 347 | R | 43.5 | Very low | 40.3 | Very low | 248 Ų | 248 | 140.3 Ų | 140.3 | 94% | 0.936 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 149.3 | 168.3 | -65.9 | 174.1 | 172.7 | 162.5 | -2.6 | 112 | ||
| 348 | G | 40.1 | Very low | 40 | Very low | 76 Ų | 76 | 139.7 Ų | 139.7 | 78% | 0.784 | 82% | 0.824 | S | S | * | * | trans | 112.5 | 105.8 | 143.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 349 | R | 38.9 | Very low | 39.8 | Very low | 241 Ų | 241 | 144.2 Ų | 144.2 | 91% | 0.909 | 83% | 0.826 | S | S | * | * | 158.3 | 110.9 | 94 | -168.1 | 167.4 | -155.1 | -111.8 | 4.4 | 110.2 | |||||
| 350 | S | 38.8 | Very low | 39.9 | Very low | 108 Ų | 108 | 138.7 Ų | 138.7 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | trans | 46.1 | 123.5 | 145.1 | -92.1 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 351 | Q | 39.2 | Very low | 40.1 | Very low | 198 Ų | 198 | 141.9 Ų | 141.9 | 93% | 0.925 | 82% | 0.82 | S | S | * | * | trans | 98.6 | 99.2 | 131.9 | -150.5 | 164.5 | 34.9 | 0 | 0 | 116.6 | ||||
| 352 | G | 36.8 | Very low | 40.3 | Very low | 78 Ų | 78 | 146.7 Ų | 146.7 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | 141.9 | 103.9 | 164.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 353 | G | 36.3 | Very low | 40 | Very low | 64 Ų | 64 | 140.1 Ų | 140.1 | 66% | 0.66 | 81% | 0.814 | S | S | * | * | trans | -59.3 | 147.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | D355 | G353-D355 PolarHBondContact O-N 2.87Š| ||
| 354 | Y | 42.2 | Very low | 40.2 | Very low | 227 Ų | 227 | 143 Ų | 143 | 89% | 0.89 | 81% | 0.81 | S | S | * | * | trans | -56.5 | 90.5 | -179.8 | 39.7 | -88 | 0 | 0 | 0 | 113.7 | R356 | Y354-R356 PolarHBondContact O-N 2.9Š| ||
| 355 | D | 39.6 | Very low | 40.2 | Very low | 165 Ų | 165 | 151.4 Ų | 151.4 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | trans | -71.1 | 104.9 | 135.5 | -79.5 | -68.9 | 0 | 0 | 0 | 107.7 | G353 | G353-D355 PolarHBondContact O-N 2.87Š| ||
| 356 | R | 42 | Very low | 40.4 | Very low | 246 Ų | 246 | 151.5 Ų | 151.5 | 93% | 0.928 | 81% | 0.81 | S | S | * | * | trans | 153.7 | 91.1 | 148.6 | -174.4 | 176.4 | -88.3 | 168.4 | -8.2 | 111.7 | Y354 | Y354-R356 PolarHBondContact O-N 2.9Š| ||
| 357 | G | 37.8 | Very low | 40.1 | Very low | 81 Ų | 81 | 152.2 Ų | 152.2 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | 174.1 | 96.2 | 164.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 358 | G | 35.2 | Very low | 39.8 | Very low | 66 Ų | 66 | 143 Ų | 143 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | cis | 109.8 | 95.4 | 32.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 359 | M | 37.6 | Very low | 40.1 | Very low | 177 Ų | 177 | 142.9 Ų | 142.9 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | 71.7 | 93.8 | 155.5 | -60.8 | 136.4 | 161.9 | 0 | 0 | 117.7 | ||||
| 360 | N | 43.1 | Very low | 40.5 | Very low | 136 Ų | 136 | 137.2 Ų | 137.2 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | 179.8 | 38.8 | 121.9 | -85 | -26 | 0 | 0 | 0 | 113.6 | R362 | N360-R362 PolarHBondContact O-N 3.41Š| |||
| 361 | T | 44 | Very low | 41.2 | Very low | 141 Ų | 141 | 137.3 Ų | 137.3 | 87% | 0.865 | 76% | 0.764 | S | S | * | * | trans | -75.8 | 60.7 | 171.8 | -30.3 | 0 | 0 | 0 | 0 | 111.5 | G363 | T361-G363 PolarHBondContact O-N 3.2Š| ||
| 362 | R | 39.8 | Very low | 42.1 | Very low | 232 Ų | 232 | 135.6 Ų | 135.6 | 88% | 0.875 | 76% | 0.756 | S | S | * | * | trans | -86.7 | 62.6 | 163.8 | -73.2 | -171.8 | 178.8 | 106.7 | -3.3 | 108.6 | N360 | N360-R362 PolarHBondContact O-N 3.41Š| ||
| 363 | G | 33.6 | Very low | 42.9 | Very low | 52 Ų | 52 | 136.4 Ų | 136.4 | 54% | 0.536 | 76% | 0.755 | S | S | . | * | trans | -143.1 | 102.3 | -168.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | T361 | T361-G363 PolarHBondContact O-N 3.2Š| ||
| 364 | I | 46.1 | Very low | 44.2 | Very low | 139 Ų | 139 | 140.2 Ų | 140.2 | 71% | 0.713 | 75% | 0.75 | S | S | * | * | trans | 75.6 | 94.6 | 164.4 | -37.4 | -164.9 | 0 | 0 | 0 | 116.4 | L366 | I364-L366 HydrophobicContact CB-CG 4.34Å; I364-L366 HydrophobicContact CG2-CB 4.46Å; I364-L366 HydrophobicContact CG2-CD2 3.79Å; I364-L366 HydrophobicContact CG2-CG 3.6Å; I364-L366 PolarHBondContact O-N 2.93Å | ||
| 365 | R | 36.4 | Very low | 45.3 | Very low | 253 Ų | 253 | 135.8 Ų | 135.8 | 96% | 0.955 | 75% | 0.752 | S | S | * | * | trans | -64 | 86.7 | 148.2 | -68.4 | -155.1 | -167.7 | -144.8 | 8.2 | 108 | T367 | R365-T367 PolarHBondContact O-N 2.89Å; R365-T367 VanDerWaalsContact O-N 3.13Å | ||
| 366 | L | 48.6 | Very low | 47.1 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 65% | 0.649 | 75% | 0.746 | S | S | * | * | trans | -68.3 | 101.8 | 163.6 | -73.5 | 162.3 | 0 | 0 | 0 | 106.4 | I364 G368 A369 | I364-L366 HydrophobicContact CB-CG 4.34Å; I364-L366 HydrophobicContact CG2-CB 4.46Å; I364-L366 HydrophobicContact CG2-CD2 3.79Å; I364-L366 HydrophobicContact CG2-CG 3.6Å; I364-L366 PolarHBondContact O-N 2.93Å; L366-G368 VanDerWaalsContact C-N 3.31Å; L366-G368 PolarHBondContact O-N 3.05Å; L366-A369 HydrophobicContact CB-CB 4.32Å; L366-A369 HydrophobicContact CD1-CB 4.31Å | ||
| 367 | T | 42.9 | Very low | 49.4 | Very low | 145 Ų | 145 | 128.6 Ų | 128.6 | 89% | 0.89 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -55.5 | 101.1 | 155.1 | 41.4 | 0 | 0 | 0 | 0 | 107.9 | R365 | R365-T367 PolarHBondContact O-N 2.89Å; R365-T367 VanDerWaalsContact O-N 3.13Å |
| 368 | G | 37.6 | Very low | 51.9 | Low | 53 Ų | 53 | 125.1 Ų | 125.1 | 55% | 0.546 | 68% | 0.678 | S | S | . | * | S | Bend | trans | 100.3 | 9 | 153.5 | 0 | 0 | 0 | 0 | 0 | 120.2 | L366 N370 | L366-G368 VanDerWaalsContact C-N 3.31Å; L366-G368 PolarHBondContact O-N 3.05Å; G368-N370 PolarHBondContact O-N 2.78Å |
| 369 | A | 46.7 | Very low | 54.5 | Low | 75 Ų | 75 | 124.8 Ų | 124.8 | 62% | 0.62 | 66% | 0.663 | S | S | * | * | trans | -97.7 | 30.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | L366 | L366-A369 HydrophobicContact CB-CB 4.32Å; L366-A369 HydrophobicContact CD1-CB 4.31Å | ||
| 370 | N | 45.8 | Very low | 57.1 | Low | 122 Ų | 122 | 116.4 Ų | 116.4 | 65% | 0.652 | 62% | 0.621 | S | S | * | * | trans | -95.9 | 78.5 | 162.2 | -174 | -21.3 | 0 | 0 | 0 | 108.1 | G368 | G368-N370 PolarHBondContact O-N 2.78Š| ||
| 371 | M | 52.9 | Low | 59.2 | Low | 110 Ų | 110 | 116.9 Ų | 116.9 | 54% | 0.542 | 62% | 0.621 | S | S | . | * | trans | -129.8 | 67.5 | 174.2 | -59.5 | -153.6 | -163.2 | 0 | 0 | 109 | A373 F388 | M371-A373 PolarHBondContact O-N 3.14Å; M371-F388 HydrophobicContact CE-CE1 4.4Å; M371-F388 HydrophobicContact CE-CZ 4.4Å | ||
| 372 | E | 58.6 | Low | 61.3 | Low | 162 Ų | 162 | 117 Ų | 117 | 76% | 0.757 | 61% | 0.611 | S | S | * | * | trans | -44.3 | 126.6 | 142.5 | -130.5 | 94.9 | 179.8 | 0 | 0 | 106 | R374 | E372-R374 VanDerWaalsContact C-N 3.34Å; E372-R374 PolarHBondContact O-N 3.34Å | ||
| 373 | A | 55 | Low | 63.8 | Low | 94 Ų | 94 | 107.9 Ų | 107.9 | 78% | 0.777 | 58% | 0.583 | S | S | * | * | trans | -55.5 | 100.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | M371 S375 | M371-A373 PolarHBondContact O-N 3.14Å; A373-S375 PolarHBondContact O-N 2.89Å | ||
| 374 | R | 63.6 | Low | 66.4 | Low | 145 Ų | 145 | 109.3 Ų | 109.3 | 55% | 0.547 | 58% | 0.578 | S | S | . | * | trans | -67.6 | 133.1 | 175.3 | -67.5 | -175.6 | 175.4 | 95.4 | 3.7 | 105.5 | E372 R376 D377 | E372-R374 VanDerWaalsContact C-N 3.34Å; E372-R374 PolarHBondContact O-N 3.34Å; R374-R376 PolarHBondContact O-N 2.93Å; R374-D377 PolarHBondContact O-N 2.88Å | ||
| 375 | S | 63.9 | Low | 68.5 | Low | 134 Ų | 134 | 104.8 Ų | 104.8 | 94% | 0.937 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | 3.6 | -173.8 | -52.6 | 0 | 0 | 0 | 0 | 116.3 | A373 | A373-S375 PolarHBondContact O-N 2.89Š|
| 376 | R | 78.5 | Confident | 71.1 | Confident | 204 Ų | 204 | 95.9 Ų | 95.9 | 77% | 0.77 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110 | -17.5 | 175.5 | -69.7 | -172.9 | 177.8 | -155.1 | -0.6 | 113.9 | R374 G389 | R374-R376 PolarHBondContact O-N 2.93Å; R376-G389 WeakPolarHBondContact O-CA 3.37Å |
| 377 | D | 89.3 | Confident | 73.1 | Confident | 55 Ų | 55 | 90.1 Ų | 90.1 | 29% | 0.294 | 51% | 0.506 | S | S | . | . | trans | -71.2 | 137.8 | -177.5 | -64.4 | -23.6 | 0 | 0 | 0 | 110.7 | R374 N387 F388 G389 | R374-D377 PolarHBondContact O-N 2.88Å; D377-N387 WeakPolarHBondContact CA-O 3.19Å; D377-N387 WeakPolarHBondContact CB-O 3.5Å; D377-F388 VanDerWaalsContact OD1-CA 3.28Å; D377-F388 WeakPolarHBondContact OD1-CA 3.5Å; D377-G389 PolarHBondContact OD1-N 3.27Å | ||
| 378 | W | 90.4 | Very high | 75.3 | Confident | 9 Ų | 9 | 87.2 Ų | 87.2 | 3% | 0.034 | 48% | 0.481 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 148.3 | -176 | 66.3 | -86.3 | 0 | 0 | 0 | 111.6 | C380 N387 R391 C394 R401 | W378-C380 HydrophobicContact CH2-CB 4.45Å; W378-C380 HydrophobicContact CZ3-CB 3.86Å; W378-N387 HydrophobicContact CD2-CB 3.98Å; W378-N387 HydrophobicContact CG-CB 4.35Å; W378-N387 HydrophobicContact CZ2-CB 3.79Å; W378-N387 PolarHBondContact N-O 2.98Å; W378-N387 PolarHBondContact O-N 3.25Å; W378-R391 PolarHBondContact NE1-O 2.96Å; W378-C394 HydrophobicContact CH2-CB 3.99Å; W378-R401 HydrophobicContact CD2-CB 4.21Å; W378-R401 HydrophobicContact CD2-CG 3.86Å; W378-R401 HydrophobicContact CE3-CB 4.38Å; W378-R401 HydrophobicContact CE3-CG 4.21Å; W378-R401 HydrophobicContact CG-CG 4.07Å; W378-R401 HydrophobicContact CH2-CB 4.08Å; W378-R401 HydrophobicContact CZ2-CB 3.9Å; W378-R401 HydrophobicContact CZ2-CG 4.43Å; W378-R401 HydrophobicContact CZ3-CB 4.31Å |
| 379 | V | 90.4 | Very high | 77.7 | Confident | 59 Ų | 59 | 85.3 Ų | 85.3 | 36% | 0.358 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 126.9 | -179.3 | -174.8 | 0 | 0 | 0 | 0 | 109 | M253 M381 | M253-V379 HydrophobicContact CE-CB 4.34Å; M253-V379 HydrophobicContact CE-CG1 3.88Å; M253-V379 HydrophobicContact CE-CG2 3.48Å; M253-V379 VanDerWaalsContact CE-CG2 3.48Å; M253-V379 HydrophobicContact SD-CG1 4.35Å; V379-M381 PolarHBondContact O-N 2.82Å |
| 380 | C | 91.7 | Very high | 79.6 | Confident | 0 Ų | 0 | 89.1 Ų | 89.1 | 0% | 0 | 46% | 0.464 | C | S | . | . | trans | -69.2 | 123.9 | 178.3 | 173.1 | 0 | 0 | 0 | 0 | 111.9 | W378 H382 N384 N385 N387 C394 C397 | W378-C380 HydrophobicContact CH2-CB 4.45Å; W378-C380 HydrophobicContact CZ3-CB 3.86Å; C380-H382 PolarHBondContact O-N 3.08Å; C380-H382 PolarHBondContact SG-N 3.01Å; C380-H382 VanDerWaalsContact SG-N 3.38Å; C380-N384 WeakPolarHBondContact O-CA 3.44Å; C380-N384 PolarHBondContact O-N 3.29Å; C380-N384 PolarHBondContact O-OD1 3.48Å; C380-N385 PolarHBondContact N-O 2.84Å; C380-N387 WeakPolarHBondContact CB-ND2 3.37Å; C380-C394 HydrophobicContact CB-CB 3.78Å; C380-C394 WeakPolarHBondContact CB-SG 2.8Å; C380-C394 VanDerWaalsContact SG-SG 3.66Å; C380-C397 PolarHBondContact SG-SG 2.88Å | ||
| 381 | M | 88.6 | Confident | 81.6 | Confident | 147 Ų | 147 | 86.4 Ų | 86.4 | 72% | 0.724 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | -17.6 | -179.5 | -56.3 | -120.3 | 79.9 | 0 | 0 | 114 | V379 P402 | V379-M381 PolarHBondContact O-N 2.82Å; M381-P402 HydrophobicContact CG-CB 4.32Å; M381-P402 HydrophobicContact CG-CG 4.11Å |
| 382 | H | 87.9 | Confident | 83.3 | Confident | 143 Ų | 143 | 86.8 Ų | 86.8 | 66% | 0.662 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -28.8 | -179.2 | -67.4 | -93.8 | 0 | 0 | 0 | 113.9 | C380 A399 | C380-H382 PolarHBondContact O-N 3.08Å; C380-H382 PolarHBondContact SG-N 3.01Å; C380-H382 VanDerWaalsContact SG-N 3.38Å; H382-A399 HydrophobicContact CB-CB 3.94Å; H382-A399 WeakPolarHBondContact CD2-CB 3.37Å |
| 383 | C | 91.6 | Very high | 84.9 | Confident | 40 Ų | 40 | 84.8 Ų | 84.8 | 27% | 0.27 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -141.4 | 9.2 | -173.6 | 80.5 | 0 | 0 | 0 | 0 | 114.7 | N385 C394 C397 | C383-N385 PolarHBondContact O-N 3.33Å; C383-N385 VanDerWaalsContact SG-CB 3.56Å; C383-C394 PolarHBondContact SG-SG 3.5Å; C383-C397 HydrophobicContact CB-CB 3.96Å; C383-C397 PolarHBondContact SG-SG 3.25Å |
| 384 | N | 88.3 | Confident | 86.7 | Confident | 83 Ų | 83 | 80.5 Ų | 80.5 | 44% | 0.444 | 40% | 0.4 | S | S | . | . | trans | 50.5 | 28.7 | -179.7 | -67.6 | -14.3 | 0 | 0 | 0 | 115 | C380 | C380-N384 WeakPolarHBondContact O-CA 3.44Å; C380-N384 PolarHBondContact O-N 3.29Å; C380-N384 PolarHBondContact O-OD1 3.48Å | ||
| 385 | N | 90.8 | Very high | 88.1 | Confident | 44 Ų | 44 | 78.6 Ų | 78.6 | 24% | 0.235 | 40% | 0.4 | C | S | . | . | trans | -83.5 | 129.6 | 173.9 | -175 | 70.4 | 0 | 0 | 0 | 110.2 | C380 C383 N387 K396 | C380-N385 PolarHBondContact N-O 2.84Å; C383-N385 PolarHBondContact O-N 3.33Å; C383-N385 VanDerWaalsContact SG-CB 3.56Å; N385-N387 PolarHBondContact ND2-OD1 3.13Å; N385-N387 PolarHBondContact O-N 2.88Å; N385-N387 PolarHBondContact O-ND2 2.92Å; N385-K396 HydrophobicContact CB-CB 3.79Å; N385-K396 HydrophobicContact CB-CD 4.06Å | ||
| 386 | A | 90.6 | Very high | 89.3 | Confident | 66 Ų | 66 | 79.6 Ų | 79.6 | 55% | 0.545 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.8 | 125.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 387 | N | 89.4 | Confident | 90.1 | Very high | 2 Ų | 2 | 72.3 Ų | 72.3 | 1% | 0.011 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 141.8 | -179.8 | -55.6 | -67 | 0 | 0 | 0 | 109.5 | D377 W378 C380 N385 C394 N395 | D377-N387 WeakPolarHBondContact CA-O 3.19Å; D377-N387 WeakPolarHBondContact CB-O 3.5Å; W378-N387 HydrophobicContact CD2-CB 3.98Å; W378-N387 HydrophobicContact CG-CB 4.35Å; W378-N387 HydrophobicContact CZ2-CB 3.79Å; W378-N387 PolarHBondContact N-O 2.98Å; W378-N387 PolarHBondContact O-N 3.25Å; C380-N387 WeakPolarHBondContact CB-ND2 3.37Å; N385-N387 PolarHBondContact ND2-OD1 3.13Å; N385-N387 PolarHBondContact O-N 2.88Å; N385-N387 PolarHBondContact O-ND2 2.92Å; N387-C394 WeakPolarHBondContact OD1-CA 3.28Å; N387-N395 PolarHBondContact OD1-N 2.86Å |
| 388 | F | 89.1 | Confident | 90.2 | Very high | 85 Ų | 85 | 79.3 Ų | 79.3 | 37% | 0.373 | 39% | 0.39 | S | S | . | . | trans | -58.9 | 141.2 | 173.5 | -63.5 | -71.8 | 0 | 0 | 0 | 111.1 | M371 D377 F390 R391 | M371-F388 HydrophobicContact CE-CE1 4.4Å; M371-F388 HydrophobicContact CE-CZ 4.4Å; D377-F388 VanDerWaalsContact OD1-CA 3.28Å; D377-F388 WeakPolarHBondContact OD1-CA 3.5Å; F388-F390 HydrophobicContact CB-CD1 3.51Å; F388-F390 HydrophobicContact CB-CE1 3.24Å; F388-F390 HydrophobicContact CB-CG 4.48Å; F388-F390 HydrophobicContact CB-CZ 4.03Å; F388-F390 HydrophobicContact CD2-CE1 4.03Å; F388-F390 HydrophobicContact CD2-CZ 4.3Å; F388-F390 HydrophobicContact CG-CD1 4.41Å; F388-F390 AromaticContact CG-CE1 3.72Å; F388-F390 HydrophobicContact CG-CE1 3.72Å; F388-F390 HydrophobicContact CG-CZ 4.42Å; F388-F390 PolarHBondContact O-N 2.74Å; F388-R391 HydrophobicContact CB-CG 4.43Å; F388-R391 WeakPolarHBondContact O-CB 3.49Å; F388-R391 PolarHBondContact O-N 2.85Å | ||
| 389 | G | 88.2 | Confident | 90.2 | Very high | 12 Ų | 12 | 79.4 Ų | 79.4 | 12% | 0.124 | 39% | 0.392 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -17.4 | -173.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | R376 D377 R401 | R376-G389 WeakPolarHBondContact O-CA 3.37Å; D377-G389 PolarHBondContact OD1-N 3.27Å; G389-R401 PolarHBondContact O-NH1 2.87Å |
| 390 | F | 86 | Confident | 90.2 | Very high | 155 Ų | 155 | 80.9 Ų | 80.9 | 68% | 0.68 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -14.7 | 174.6 | 70.9 | -96.2 | 0 | 0 | 0 | 113.4 | F388 | F388-F390 HydrophobicContact CB-CD1 3.51Å; F388-F390 HydrophobicContact CB-CE1 3.24Å; F388-F390 HydrophobicContact CB-CG 4.48Å; F388-F390 HydrophobicContact CB-CZ 4.03Å; F388-F390 HydrophobicContact CD2-CE1 4.03Å; F388-F390 HydrophobicContact CD2-CZ 4.3Å; F388-F390 HydrophobicContact CG-CD1 4.41Å; F388-F390 AromaticContact CG-CE1 3.72Å; F388-F390 HydrophobicContact CG-CE1 3.72Å; F388-F390 HydrophobicContact CG-CZ 4.42Å; F388-F390 PolarHBondContact O-N 2.74Å |
| 391 | R | 88.3 | Confident | 90 | Very high | 66 Ų | 66 | 82.3 Ų | 82.3 | 25% | 0.249 | 41% | 0.409 | C | S | . | . | trans | -80.2 | 132.7 | -176.2 | -69.9 | -176.9 | 153.2 | 171.6 | -16.9 | 110.6 | W378 F388 N395 | W378-R391 PolarHBondContact NE1-O 2.96Å; F388-R391 HydrophobicContact CB-CG 4.43Å; F388-R391 WeakPolarHBondContact O-CB 3.49Å; F388-R391 PolarHBondContact O-N 2.85Å; R391-N395 PolarHBondContact NH1-ND2 2.97Å; R391-N395 VanDerWaalsContact NH1-ND2 3.14Å; R391-N395 PolarHBondContact NH1-OD1 2.96Å; R391-N395 PolarHBondContact NH2-OD1 3.45Å | ||
| 392 | Q | 89 | Confident | 89.8 | Confident | 118 Ų | 118 | 77.3 Ų | 77.3 | 55% | 0.551 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -90.3 | -11.3 | 172.3 | -57.9 | -60.9 | -3.4 | 0 | 0 | 113.1 | R401 | Q392-R401 PolarHBondContact O-N 2.75Š|
| 393 | Q | 92.1 | Very high | 88.9 | Confident | 120 Ų | 120 | 78.9 Ų | 78.9 | 56% | 0.561 | 40% | 0.4 | S | S | * | . | B | Isolated β-bridge | trans | -135.7 | 149.4 | -179.4 | -65.4 | 173.9 | 26.4 | 0 | 0 | 110.4 | N395 A399 | Q393-N395 PolarHBondContact O-N 3.4Å; Q393-A399 CarbonylContact C-O 3.52Å; Q393-A399 VanDerWaalsContact CA-O 3.32Å; Q393-A399 WeakPolarHBondContact CA-O 3.25Å |
| 394 | C | 93.3 | Very high | 87.4 | Confident | 4 Ų | 4 | 80.5 Ų | 80.5 | 3% | 0.027 | 42% | 0.424 | C | S | . | . | trans | -66.3 | 133 | 179.6 | -179 | 0 | 0 | 0 | 0 | 111.2 | W378 C380 C383 N387 K396 C397 R398 A399 | W378-C394 HydrophobicContact CH2-CB 3.99Å; C380-C394 HydrophobicContact CB-CB 3.78Å; C380-C394 WeakPolarHBondContact CB-SG 2.8Å; C380-C394 VanDerWaalsContact SG-SG 3.66Å; C383-C394 PolarHBondContact SG-SG 3.5Å; N387-C394 WeakPolarHBondContact OD1-CA 3.28Å; C394-K396 PolarHBondContact O-N 2.73Å; C394-K396 VanDerWaalsContact O-N 3.13Å; C394-K396 PolarHBondContact SG-N 3.43Å; C394-K396 VanDerWaalsContact SG-N 3.37Å; C394-C397 VanDerWaalsContact CB-SG 3.57Å; C394-C397 VanDerWaalsContact SG-SG 3.6Å; C394-R398 WeakPolarHBondContact O-CA 3.49Å; C394-R398 PolarHBondContact O-N 2.95Å; C394-A399 HydrophobicContact CB-CB 4.41Å; C394-A399 PolarHBondContact N-O 3.43Å | ||
| 395 | N | 92.2 | Very high | 86 | Confident | 104 Ų | 104 | 82.7 Ų | 82.7 | 56% | 0.556 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -21.2 | 177.1 | -162.9 | 32.5 | 0 | 0 | 0 | 113.9 | N387 R391 Q393 | N387-N395 PolarHBondContact OD1-N 2.86Å; R391-N395 PolarHBondContact NH1-ND2 2.97Å; R391-N395 VanDerWaalsContact NH1-ND2 3.14Å; R391-N395 PolarHBondContact NH1-OD1 2.96Å; R391-N395 PolarHBondContact NH2-OD1 3.45Å; Q393-N395 PolarHBondContact O-N 3.4Å |
| 396 | K | 90.3 | Very high | 84 | Confident | 155 Ų | 155 | 82.4 Ų | 82.4 | 67% | 0.674 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.7 | -47.7 | -171.2 | -167.9 | 171.5 | -161.9 | -74.6 | 0 | 112.6 | N385 C394 | N385-K396 HydrophobicContact CB-CB 3.79Å; N385-K396 HydrophobicContact CB-CD 4.06Å; C394-K396 PolarHBondContact O-N 2.73Å; C394-K396 VanDerWaalsContact O-N 3.13Å; C394-K396 PolarHBondContact SG-N 3.43Å; C394-K396 VanDerWaalsContact SG-N 3.37Å |
| 397 | C | 93.4 | Very high | 81.7 | Confident | 52 Ų | 52 | 83.1 Ų | 83.1 | 35% | 0.351 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.6 | -0.4 | -176.4 | 66.7 | 0 | 0 | 0 | 0 | 114.2 | C380 C383 C394 A399 | C380-C397 PolarHBondContact SG-SG 2.88Å; C383-C397 HydrophobicContact CB-CB 3.96Å; C383-C397 PolarHBondContact SG-SG 3.25Å; C394-C397 VanDerWaalsContact CB-SG 3.57Å; C394-C397 VanDerWaalsContact SG-SG 3.6Å; C397-A399 PolarHBondContact O-N 2.68Å; C397-A399 VanDerWaalsContact SG-CB 3.5Å |
| 398 | R | 91.6 | Very high | 79.6 | Confident | 202 Ų | 202 | 91.9 Ų | 91.9 | 76% | 0.762 | 50% | 0.498 | S | S | * | . | trans | 60.7 | 9.1 | -176.9 | -51.7 | -179.4 | -179.3 | -170.8 | -0.6 | 115.7 | C394 | C394-R398 WeakPolarHBondContact O-CA 3.49Å; C394-R398 PolarHBondContact O-N 2.95Å | ||
| 399 | A | 90.8 | Very high | 77.3 | Confident | 10 Ų | 10 | 96.8 Ų | 96.8 | 8% | 0.083 | 52% | 0.524 | C | S | . | . | P | Polyproline II helix | trans | -59 | 145.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | H382 Q393 C394 C397 | H382-A399 HydrophobicContact CB-CB 3.94Å; H382-A399 WeakPolarHBondContact CD2-CB 3.37Å; Q393-A399 CarbonylContact C-O 3.52Å; Q393-A399 VanDerWaalsContact CA-O 3.32Å; Q393-A399 WeakPolarHBondContact CA-O 3.25Å; C394-A399 HydrophobicContact CB-CB 4.41Å; C394-A399 PolarHBondContact N-O 3.43Å; C397-A399 PolarHBondContact O-N 2.68Å; C397-A399 VanDerWaalsContact SG-CB 3.5Å |
| 400 | P | 90.6 | Very high | 75.1 | Confident | 90 Ų | 90 | 99 Ų | 99 | 58% | 0.584 | 55% | 0.548 | S | S | * | . | B | Isolated β-bridge | trans | -63.8 | 152.4 | 178.4 | 28.2 | -34.5 | 0 | 0 | 0 | 111 | ||
| 401 | R | 87.9 | Confident | 72.9 | Confident | 31 Ų | 31 | 97 Ų | 97 | 12% | 0.117 | 55% | 0.553 | C | S | . | * | P | Polyproline II helix | trans | -60.1 | 133.9 | 166.3 | -178.4 | -177.1 | -174.4 | 153.8 | 9.1 | 108.6 | W378 G389 Q392 D403 D405 G406 | W378-R401 HydrophobicContact CD2-CB 4.21Å; W378-R401 HydrophobicContact CD2-CG 3.86Å; W378-R401 HydrophobicContact CE3-CB 4.38Å; W378-R401 HydrophobicContact CE3-CG 4.21Å; W378-R401 HydrophobicContact CG-CG 4.07Å; W378-R401 HydrophobicContact CH2-CB 4.08Å; W378-R401 HydrophobicContact CZ2-CB 3.9Å; W378-R401 HydrophobicContact CZ2-CG 4.43Å; W378-R401 HydrophobicContact CZ3-CB 4.31Å; G389-R401 PolarHBondContact O-NH1 2.87Å; Q392-R401 PolarHBondContact O-N 2.75Å; R401-D403 PolarHBondContact O-N 3.23Å; R401-D405 PolarHBondContact NH2-O 2.96Å; R401-G406 VanDerWaalsContact CZ-CA 3.45Å |
| 402 | P | 83.6 | Confident | 70.9 | Confident | 41 Ų | 41 | 98.2 Ų | 98.2 | 27% | 0.266 | 57% | 0.571 | S | S | . | * | P | Polyproline II helix | trans | -63 | 127.9 | 174.2 | 25 | -31.7 | 0 | 0 | 0 | 110.1 | M381 G404 | M381-P402 HydrophobicContact CG-CB 4.32Å; M381-P402 HydrophobicContact CG-CG 4.11Å; P402-G404 PolarHBondContact O-N 2.83Å; P402-G404 VanDerWaalsContact O-N 3.08Å |
| 403 | D | 69.7 | Low | 68.9 | Low | 176 Ų | 176 | 100 Ų | 100 | 94% | 0.941 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 106.7 | 176.7 | -63.6 | -55.4 | 0 | 0 | 0 | 109.1 | R401 | R401-D403 PolarHBondContact O-N 3.23Š|
| 404 | G | 60.8 | Low | 67 | Low | 75 Ų | 75 | 101 Ų | 101 | 77% | 0.773 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 153.2 | -28.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | P402 | P402-G404 PolarHBondContact O-N 2.83Å; P402-G404 VanDerWaalsContact O-N 3.08Å |
| 405 | D | 57.9 | Low | 64.9 | Low | 129 Ų | 129 | 108.5 Ų | 108.5 | 69% | 0.69 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -102.8 | 7.2 | 179 | -80.8 | -56.7 | 0 | 0 | 0 | 113.4 | R401 | R401-D405 PolarHBondContact NH2-O 2.96Š|
| 406 | G | 49.2 | Very low | 62.6 | Low | 38 Ų | 38 | 115.1 Ų | 115.1 | 39% | 0.392 | 65% | 0.653 | S | S | . | * | trans | -108.4 | 90.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R401 Q408 | R401-G406 VanDerWaalsContact CZ-CA 3.45Å; G406-Q408 PolarHBondContact O-N 3.17Å | ||
| 407 | G | 42.6 | Very low | 60.3 | Low | 81 Ų | 81 | 110.7 Ų | 110.7 | 84% | 0.835 | 65% | 0.65 | S | S | * | * | trans | -45.7 | 128.8 | 164.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | M409 | G407-M409 PolarHBondContact O-N 3.37Š| ||
| 408 | Q | 44.5 | Very low | 58.1 | Low | 186 Ų | 186 | 112.6 Ų | 112.6 | 87% | 0.869 | 66% | 0.662 | S | S | * | * | trans | -33.1 | 127.9 | -173.9 | -73.9 | 158.3 | 17.4 | 0 | 0 | 113.3 | G406 G410 | G406-Q408 PolarHBondContact O-N 3.17Å; Q408-G410 PolarHBondContact O-N 2.97Å | ||
| 409 | M | 41.6 | Very low | 55.7 | Low | 187 Ų | 187 | 109.3 Ų | 109.3 | 92% | 0.921 | 67% | 0.667 | S | S | * | * | trans | -53.6 | 71.9 | 151.2 | 51.1 | -168.3 | 174.2 | 0 | 0 | 110.2 | G407 | G407-M409 PolarHBondContact O-N 3.37Š| ||
| 410 | G | 40.6 | Very low | 53.4 | Low | 60 Ų | 60 | 116.5 Ų | 116.5 | 62% | 0.619 | 70% | 0.697 | S | S | * | * | trans | -93.1 | 97.5 | 168.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | Q408 S412 | Q408-G410 PolarHBondContact O-N 2.97Å; G410-S412 PolarHBondContact O-N 3.4Å | ||
| 411 | S | 40.9 | Very low | 51.2 | Low | 113 Ų | 113 | 118.7 Ų | 118.7 | 79% | 0.79 | 71% | 0.708 | S | S | * | * | trans | -42.3 | 98.9 | 160.7 | 178.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 412 | S | 47.1 | Very low | 49.1 | Very low | 90 Ų | 90 | 121.5 Ų | 121.5 | 63% | 0.629 | 74% | 0.738 | S | S | * | * | trans | -166.1 | 68.2 | 164.9 | -74.9 | 0 | 0 | 0 | 0 | 108.7 | G410 N414 | G410-S412 PolarHBondContact O-N 3.4Å; S412-N414 PolarHBondContact O-N 3.44Å | ||
| 413 | D | 46.5 | Very low | 46.9 | Very low | 155 Ų | 155 | 127.6 Ų | 127.6 | 83% | 0.829 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | 86.1 | 158.4 | -65.3 | -78.4 | 0 | 0 | 0 | 109.2 | ||
| 414 | N | 50.9 | Low | 45.7 | Very low | 142 Ų | 142 | 130.7 Ų | 130.7 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -152.6 | -0.8 | 168.4 | -80.8 | -52 | 0 | 0 | 0 | 115.9 | S412 Y416 | S412-N414 PolarHBondContact O-N 3.44Å; N414-Y416 VanDerWaalsContact C-N 3.35Å; N414-Y416 PolarHBondContact O-N 3.02Å |
| 415 | D | 50.7 | Low | 44.7 | Very low | 161 Ų | 161 | 130.6 Ų | 130.6 | 86% | 0.861 | 77% | 0.766 | S | S | * | * | trans | -91.7 | 20.3 | -176.9 | -73.6 | -65.5 | 0 | 0 | 0 | 115.5 | ||||
| 416 | Y | 43.2 | Very low | 43.8 | Very low | 244 Ų | 244 | 127.9 Ų | 127.9 | 96% | 0.957 | 77% | 0.768 | S | S | * | * | trans | -105.2 | 60.9 | 159.8 | -98.8 | -87.7 | 0 | 0 | 0 | 109.5 | N414 | N414-Y416 VanDerWaalsContact C-N 3.35Å; N414-Y416 PolarHBondContact O-N 3.02Å | ||
| 417 | G | 42.1 | Very low | 43.9 | Very low | 61 Ų | 61 | 132.1 Ų | 132.1 | 63% | 0.629 | 79% | 0.789 | S | S | * | * | trans | -87.1 | 127.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 418 | P | 46.7 | Very low | 44 | Very low | 93 Ų | 93 | 134.5 Ų | 134.5 | 60% | 0.604 | 79% | 0.79 | S | S | * | * | trans | -68.1 | 160.5 | -174.9 | 27.6 | -32.5 | 0 | 0 | 0 | 112.5 | F420 | P418-F420 HydrophobicContact CG-CE1 4.19Å; P418-F420 VanDerWaalsContact O-CD1 3.32Å; P418-F420 WeakPolarHBondContact O-CD1 3.32Å; P418-F420 PolarHBondContact O-N 3.15Å; P418-F420 VanDerWaalsContact O-N 3.15Å | ||
| 419 | P | 41.4 | Very low | 44 | Very low | 132 Ų | 132 | 137.6 Ų | 137.6 | 86% | 0.857 | 79% | 0.793 | S | S | * | * | trans | -76.3 | 110 | -160.6 | 30.9 | -32.9 | 0 | 0 | 0 | 111 | ||||
| 420 | F | 42.7 | Very low | 43.9 | Very low | 161 Ų | 161 | 132 Ų | 132 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | trans | -156.6 | 117.1 | 161 | 53.6 | -88 | 0 | 0 | 0 | 113.1 | P418 | P418-F420 HydrophobicContact CG-CE1 4.19Å; P418-F420 VanDerWaalsContact O-CD1 3.32Å; P418-F420 WeakPolarHBondContact O-CD1 3.32Å; P418-F420 PolarHBondContact O-N 3.15Å; P418-F420 VanDerWaalsContact O-N 3.15Å | ||
| 421 | V | 44.9 | Very low | 43.8 | Very low | 137 Ų | 137 | 132 Ų | 132 | 83% | 0.83 | 78% | 0.783 | S | S | * | * | trans | 79.1 | 123.6 | 132.9 | -173.4 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 422 | A | 43.3 | Very low | 43.9 | Very low | 90 Ų | 90 | 136.8 Ų | 136.8 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | trans | 75.9 | 88.6 | 149.6 | 0 | 0 | 0 | 0 | 0 | 119.1 | R424 | A422-R424 PolarHBondContact O-N 3.48Š| ||
| 423 | N | 38.5 | Very low | 43.5 | Very low | 169 Ų | 169 | 135.8 Ų | 135.8 | 90% | 0.904 | 79% | 0.794 | S | S | * | * | trans | -80.1 | 104.1 | 149.2 | -153.3 | -7.2 | 0 | 0 | 0 | 108.6 | ||||
| 424 | R | 44.3 | Very low | 43.3 | Very low | 241 Ų | 241 | 140.5 Ų | 140.5 | 91% | 0.909 | 80% | 0.8 | S | S | * | * | trans | -146.5 | 100.2 | 152 | -157.6 | 172.4 | -143.3 | 166.6 | 6.6 | 109.2 | A422 | A422-R424 PolarHBondContact O-N 3.48Š| ||
| 425 | G | 38.3 | Very low | 42.7 | Very low | 73 Ų | 73 | 137.6 Ų | 137.6 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | -68.1 | 157.5 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 426 | G | 40.7 | Very low | 42.2 | Very low | 71 Ų | 71 | 133.4 Ų | 133.4 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | -147.4 | 132.6 | 153.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 427 | P | 50.4 | Low | 42.1 | Very low | 128 Ų | 128 | 133.7 Ų | 133.7 | 83% | 0.831 | 80% | 0.798 | S | S | * | * | trans | -93.1 | 159.4 | -177.1 | 35.2 | -31.7 | 0 | 0 | 0 | 112.9 | ||||
| 428 | P | 45.4 | Very low | 41.8 | Very low | 131 Ų | 131 | 133.9 Ų | 133.9 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | trans | -94.1 | 132 | -173.6 | 35.7 | -30.2 | 0 | 0 | 0 | 112.8 | ||||
| 429 | R | 45 | Very low | 41.6 | Very low | 251 Ų | 251 | 135 Ų | 135 | 95% | 0.947 | 80% | 0.801 | S | S | * | * | trans | -154.6 | 126.1 | 160 | -96.5 | -176.5 | 172.1 | -177.6 | -2.4 | 104.2 | ||||
| 430 | G | 39.1 | Very low | 41.7 | Very low | 69 Ų | 69 | 138.4 Ų | 138.4 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | cis | 129.6 | 116.5 | 28.4 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 431 | G | 37.8 | Very low | 41.6 | Very low | 60 Ų | 60 | 133.4 Ų | 133.4 | 62% | 0.619 | 79% | 0.792 | S | S | * | * | trans | 81.1 | 145.4 | 154.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 432 | F | 42.4 | Very low | 41.4 | Very low | 214 Ų | 214 | 133.6 Ų | 133.6 | 94% | 0.939 | 79% | 0.788 | S | S | * | * | trans | 73.4 | 121.6 | 161.6 | -33.2 | -74.2 | 0 | 0 | 0 | 114.2 | ||||
| 433 | G | 40.2 | Very low | 41.6 | Very low | 68 Ų | 68 | 136.4 Ų | 136.4 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | cis | 141.4 | 133.9 | 19.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 434 | R | 42.3 | Very low | 41.8 | Very low | 254 Ų | 254 | 139.5 Ų | 139.5 | 96% | 0.958 | 79% | 0.787 | S | S | * | * | trans | 55.7 | 111.9 | 155.7 | -59.2 | -167.6 | -168.6 | -98.3 | 4.9 | 119.1 | ||||
| 435 | G | 36.9 | Very low | 41.8 | Very low | 82 Ų | 82 | 132 Ų | 132 | 85% | 0.845 | 79% | 0.785 | S | S | * | * | 99.3 | 148.8 | 108.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 436 | G | 40.4 | Very low | 42 | Very low | 72 Ų | 72 | 132.2 Ų | 132.2 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | 100.8 | 90.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 437 | R | 40.6 | Very low | 42.1 | Very low | 251 Ų | 251 | 132.9 Ų | 132.9 | 95% | 0.947 | 79% | 0.793 | S | S | * | * | 71.1 | 126.2 | 81.2 | -84 | -146.3 | -168.5 | -85.7 | 2.6 | 113.9 | |||||
| 438 | G | 37.2 | Very low | 41.8 | Very low | 65 Ų | 65 | 131 Ų | 131 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | trans | 70 | 160 | 149.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 439 | D | 42.5 | Very low | 41.7 | Very low | 117 Ų | 117 | 127.6 Ų | 127.6 | 63% | 0.626 | 79% | 0.786 | S | S | * | * | cis | -179 | 136.6 | 23.8 | -120.8 | -173.2 | 0 | 0 | 0 | 106.8 | ||||
| 440 | Y | 42.8 | Very low | 41.9 | Very low | 203 Ų | 203 | 126.8 Ų | 126.8 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | trans | 63.1 | 129.1 | 159.4 | -41 | -63.3 | 0 | 0 | 0 | 117.9 | ||||
| 441 | G | 41.4 | Very low | 42.2 | Very low | 56 Ų | 56 | 126.5 Ų | 126.5 | 58% | 0.577 | 78% | 0.782 | S | S | * | * | cis | 106.2 | 132.8 | 42.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 442 | D | 40.8 | Very low | 42.6 | Very low | 141 Ų | 141 | 136 Ų | 136 | 75% | 0.754 | 80% | 0.799 | S | S | * | * | trans | 71.7 | 137.9 | 156.5 | -60.5 | -68.6 | 0 | 0 | 0 | 115.6 | ||||
| 443 | M | 47.4 | Very low | 42.8 | Very low | 148 Ų | 148 | 129.8 Ų | 129.8 | 73% | 0.729 | 80% | 0.796 | S | S | * | * | cis | -175.2 | 133 | 19.7 | -109.3 | 170.7 | -144 | 0 | 0 | 104.6 | ||||
| 444 | R | 42.6 | Very low | 42.9 | Very low | 234 Ų | 234 | 130.1 Ų | 130.1 | 88% | 0.883 | 80% | 0.799 | S | S | * | * | 85 | 113.5 | 104.8 | -158.9 | -176.5 | -157 | -174.4 | 5.4 | 116.4 | |||||
| 445 | G | 43.7 | Very low | 43.7 | Very low | 84 Ų | 84 | 123.5 Ų | 123.5 | 87% | 0.866 | 79% | 0.789 | S | S | * | * | trans | 87.3 | 139.4 | 150.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 446 | G | 42.6 | Very low | 44.4 | Very low | 78 Ų | 78 | 125.7 Ų | 125.7 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | cis | 165.2 | 157.5 | 7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 447 | G | 42.4 | Very low | 44.8 | Very low | 84 Ų | 84 | 134 Ų | 134 | 87% | 0.866 | 80% | 0.797 | S | S | * | * | trans | 80 | 118 | 166.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 448 | G | 44 | Very low | 44.9 | Very low | 89 Ų | 89 | 125.8 Ų | 125.8 | 92% | 0.918 | 79% | 0.791 | S | S | * | * | cis | 105.9 | 128.3 | 48 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 449 | G | 44.4 | Very low | 45.3 | Very low | 59 Ų | 59 | 126.6 Ų | 126.6 | 61% | 0.608 | 80% | 0.8 | S | S | * | * | cis | -171.9 | -177.9 | 1.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 450 | Y | 48.2 | Very low | 45.6 | Very low | 234 Ų | 234 | 132 Ų | 132 | 92% | 0.918 | 81% | 0.811 | S | S | * | * | trans | 38.6 | 135.7 | 153.9 | 69.4 | -90.5 | 0 | 0 | 0 | 120 | ||||
| 451 | G | 45.6 | Very low | 45.6 | Very low | 64 Ų | 64 | 128.4 Ų | 128.4 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | cis | 165.8 | 173.1 | 5.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 452 | R | 47 | Very low | 46 | Very low | 258 Ų | 258 | 131.4 Ų | 131.4 | 97% | 0.974 | 82% | 0.818 | S | S | * | * | trans | 61.7 | 128.1 | 160.2 | -56.3 | -168.9 | -168.3 | -119.8 | 6.6 | 116.4 | ||||
| 453 | G | 46.8 | Very low | 46.5 | Very low | 85 Ų | 85 | 134.1 Ų | 134.1 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | cis | 157.5 | 139.6 | 10.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 454 | G | 42 | Very low | 46.5 | Very low | 74 Ų | 74 | 131.2 Ų | 131.2 | 76% | 0.763 | 83% | 0.831 | S | S | * | * | trans | 158.4 | 100 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 455 | P | 58.7 | Low | 46.5 | Very low | 116 Ų | 116 | 123.5 Ų | 123.5 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | trans | -97.7 | 162.7 | -161.7 | 36.4 | -33.9 | 0 | 0 | 0 | 114.9 | ||||
| 456 | P | 50.9 | Low | 47.3 | Very low | 127 Ų | 127 | 125.1 Ų | 125.1 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -97.5 | 117.7 | 160.8 | 34.2 | -23.8 | 0 | 0 | 0 | 110.7 | ||||
| 457 | R | 49.7 | Very low | 47.7 | Very low | 246 Ų | 246 | 129.3 Ų | 129.3 | 93% | 0.928 | 82% | 0.82 | S | S | * | * | trans | -157.9 | 129.1 | 164.7 | -71.5 | -168.1 | 176.6 | 173.5 | -2.7 | 105.3 | ||||
| 458 | G | 41.5 | Very low | 48.2 | Very low | 80 Ų | 80 | 136.2 Ų | 136.2 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | cis | 120.3 | 136.8 | 43.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 459 | G | 46.3 | Very low | 48.6 | Very low | 82 Ų | 82 | 136.9 Ų | 136.9 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | trans | 96.4 | 147.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 460 | R | 48 | Very low | 48.9 | Very low | 231 Ų | 231 | 139.9 Ų | 139.9 | 87% | 0.872 | 81% | 0.813 | S | S | * | * | cis | -167 | 141.8 | 2.8 | 171.7 | -179.9 | -107.3 | -173.9 | -6.8 | 106.1 | ||||
| 461 | D | 43.9 | Very low | 49 | Very low | 126 Ų | 126 | 136.9 Ų | 136.9 | 67% | 0.674 | 81% | 0.807 | S | S | * | * | trans | -41.3 | 140.2 | 171.5 | -32.6 | -75.4 | 0 | 0 | 0 | 114.5 | F463 | D461-F463 HydrophobicContact CB-CD2 4.34Å; D461-F463 HydrophobicContact CB-CE2 4.3Å | ||
| 462 | S | 49.1 | Very low | 49.4 | Very low | 119 Ų | 119 | 137.7 Ų | 137.7 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | trans | -160.4 | 88.4 | 155.2 | -73.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 463 | F | 50.9 | Low | 49.7 | Very low | 199 Ų | 199 | 133 Ų | 133 | 87% | 0.873 | 85% | 0.847 | S | S | * | * | 55 | 118.8 | 90.4 | -78.5 | -82.2 | 0 | 0 | 0 | 115.4 | D461 | D461-F463 HydrophobicContact CB-CD2 4.34Å; D461-F463 HydrophobicContact CB-CE2 4.3Å | |||
| 464 | G | 47.4 | Very low | 49.9 | Very low | 86 Ų | 86 | 135.4 Ų | 135.4 | 89% | 0.887 | 85% | 0.845 | S | S | * | * | trans | 92.9 | 122.7 | 159.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 465 | G | 44.2 | Very low | 50.3 | Low | 72 Ų | 72 | 138.6 Ų | 138.6 | 74% | 0.742 | 85% | 0.85 | S | S | * | * | cis | 172.5 | 165.4 | 10.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 466 | P | 59.2 | Low | 49.8 | Very low | 118 Ų | 118 | 139.9 Ų | 139.9 | 77% | 0.766 | 86% | 0.855 | S | S | * | * | trans | -101.1 | -162.1 | -161.1 | 37.6 | -29.3 | 0 | 0 | 0 | 113.1 | ||||
| 467 | M | 51.5 | Low | 49.8 | Very low | 167 Ų | 167 | 140.6 Ų | 140.6 | 82% | 0.823 | 86% | 0.857 | S | S | * | * | trans | 112.9 | 98.6 | 161.8 | -42.6 | -122.9 | -169.8 | 0 | 0 | 112.4 | ||||
| 468 | R | 52.6 | Low | 49.8 | Very low | 229 Ų | 229 | 134.1 Ų | 134.1 | 86% | 0.864 | 85% | 0.852 | S | S | * | * | 75.9 | 120.5 | 82.8 | -83.7 | -172.7 | 174.6 | -122 | 0.2 | 114.4 | |||||
| 469 | S | 52.9 | Low | 50.3 | Low | 102 Ų | 102 | 137.7 Ų | 137.7 | 71% | 0.713 | 85% | 0.854 | S | S | * | * | trans | 86 | 113.5 | 132.9 | -62 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 470 | N | 50.8 | Low | 50.6 | Low | 123 Ų | 123 | 141.6 Ų | 141.6 | 66% | 0.658 | 86% | 0.855 | S | S | * | * | 91.2 | 140.5 | 113.7 | -158.2 | 31 | 0 | 0 | 0 | 120 | |||||
| 471 | H | 49.4 | Very low | 50.8 | Low | 171 Ų | 171 | 134.8 Ų | 134.8 | 79% | 0.792 | 85% | 0.854 | S | S | * | * | trans | 68.5 | 134.6 | 168.9 | -61.5 | -34.3 | 0 | 0 | 0 | 116 | ||||
| 472 | G | 53.9 | Low | 51.4 | Low | 81 Ų | 81 | 135.5 Ų | 135.5 | 84% | 0.835 | 87% | 0.869 | S | S | * | * | cis | 128 | 118.9 | 28.4 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 473 | G | 55 | Low | 51.6 | Low | 159 Ų | 159 | 137 Ų | 137 | 100% | 1.639 | 87% | 0.872 | S | S | * | * | trans | 154.2 | 0 | -176 | 0 | 0 | 0 | 0 | 0 | 111.8 |
Retrieved 473 of 473 residues in 85.3 ms
(Link to these results)