| 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 | 69.3 | Low | 84.1 | Confident | 211 Ų | 211 | 89.7 Ų | 89.7 | 100% | 1.039 | 47% | 0.465 | S | S | * | . | 0 | 125.3 | 0 | -62.1 | -58.6 | -121.5 | 0 | 0 | 107.4 | |||||
| 2 | E | 89.4 | Confident | 81.9 | Confident | 124 Ų | 124 | 93.5 Ų | 93.5 | 58% | 0.579 | 49% | 0.485 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 122.5 | 174.3 | 172.7 | 167.2 | -160.3 | 0 | 0 | 106.6 | K91 V92 V93 | E2-K91 HydrophobicContact CG-CD 4.48Å; E2-K91 VanDerWaalsContact OE1-CD 3.24Å; E2-K91 WeakPolarHBondContact OE1-CD 3.3Å; E2-K91 IonicContact OE1-NZ 3.88Å; E2-K91 PolarHBondContact OE1-NZ 2.75Å; E2-V92 WeakPolarHBondContact CA-O 3.37Å; E2-V93 HydrophobicContact CB-CG2 4.17Å; E2-V93 HydrophobicContact CG-CG2 3.86Å |
| 3 | I | 92.5 | Very high | 79.5 | Confident | 61 Ų | 61 | 101.5 Ų | 101.5 | 31% | 0.313 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 111.2 | -177.5 | -55 | 173.1 | 0 | 0 | 0 | 107.4 | K91 V92 P129 | I3-K91 CarbonylContact O-C 3.55Å; I3-K91 WeakPolarHBondContact O-CA 3.25Å; I3-V92 HydrophobicContact CB-CB 4.31Å; I3-V92 PolarHBondContact N-O 2.83Å; I3-V92 PolarHBondContact O-N 2.97Å; I3-P129 HydrophobicContact CD1-CB 3.74Å |
| 4 | P | 94.2 | Very high | 77.1 | Confident | 104 Ų | 104 | 109.5 Ų | 109.5 | 68% | 0.675 | 53% | 0.527 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.3 | 134.2 | 173.6 | 28.9 | -32.8 | 0 | 0 | 0 | 109.8 | ||
| 5 | V | 93.1 | Very high | 74.6 | Confident | 8 Ų | 8 | 109.6 Ų | 109.6 | 5% | 0.048 | 55% | 0.553 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -107.2 | 116.1 | 176.1 | -178.1 | 0 | 0 | 0 | 0 | 107.8 | V7 V90 V92 V132 | V5-V7 PolarHBondContact O-N 3.39Å; V5-V90 HydrophobicContact CB-CB 4.09Å; V5-V90 HydrophobicContact CB-CG1 3.86Å; V5-V90 HydrophobicContact CG1-CG1 4.28Å; V5-V90 HydrophobicContact CG2-CG1 4.34Å; V5-V90 PolarHBondContact N-O 2.76Å; V5-V92 HydrophobicContact CG2-CG2 3.77Å; V5-V132 HydrophobicContact CG1-CG1 4.36Å; V5-V132 HydrophobicContact CG2-CB 4.33Å; V5-V132 HydrophobicContact CG2-CG1 4.08Å |
| 6 | P | 92.1 | Very high | 72.8 | Confident | 92 Ų | 92 | 108.9 Ų | 108.9 | 60% | 0.597 | 56% | 0.561 | S | S | * | * | trans | -67.4 | 134.1 | -179.2 | 27 | -33.3 | 0 | 0 | 0 | 110.8 | Q8 S134 | P6-Q8 PolarHBondContact O-N 3.22Å; P6-S134 PolarHBondContact O-OG 3.34Å | ||
| 7 | V | 90.7 | Very high | 71.3 | Confident | 28 Ų | 28 | 108.2 Ų | 108.2 | 17% | 0.17 | 58% | 0.575 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.1 | 100.8 | 172.1 | -178.4 | 0 | 0 | 0 | 0 | 108.3 | V5 P9 I88 V90 S134 L136 L142 | V5-V7 PolarHBondContact O-N 3.39Å; V7-P9 WeakPolarHBondContact O-CD 3.5Å; V7-I88 HydrophobicContact CG2-CG2 4.1Å; V7-V90 HydrophobicContact CG2-CG2 3.86Å; V7-S134 WeakPolarHBondContact CA-OG 3.49Å; V7-L136 HydrophobicContact CG1-CB 3.74Å; V7-L136 HydrophobicContact CG1-CD2 4.33Å; V7-L142 HydrophobicContact CG1-CD1 4.11Å |
| 8 | Q | 86.8 | Confident | 70 | Confident | 96 Ų | 96 | 109 Ų | 109 | 45% | 0.449 | 59% | 0.587 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -81.3 | 124.5 | -179.6 | -64.2 | -164.4 | -29.9 | 0 | 0 | 110.7 | P6 S10 S134 A135 L136 | P6-Q8 PolarHBondContact O-N 3.22Å; Q8-S10 PolarHBondContact O-N 2.94Å; Q8-S134 WeakPolarHBondContact CB-O 3.35Å; Q8-S134 PolarHBondContact N-O 2.88Å; Q8-S134 VanDerWaalsContact N-O 3.11Å; Q8-A135 CarbonylContact O-C 3.58Å; Q8-A135 WeakPolarHBondContact O-CA 3.03Å; Q8-L136 PolarHBondContact O-N 3.09Å |
| 9 | P | 79.4 | Confident | 68.6 | Low | 40 Ų | 40 | 110.6 Ų | 110.6 | 26% | 0.26 | 60% | 0.595 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -72 | 124.2 | 173.9 | -3.2 | 16.8 | 0 | 0 | 0 | 110.1 | V7 W11 L12 | V7-P9 WeakPolarHBondContact O-CD 3.5Å; P9-W11 VanDerWaalsContact C-N 3.31Å; P9-W11 HydrophobicContact CB-CG 4.37Å; P9-W11 PolarHBondContact O-N 2.85Å; P9-L12 HydrophobicContact CB-CD1 4.17Å; P9-L12 HydrophobicContact CB-CG 4.28Å; P9-L12 HydrophobicContact CG-CD1 3.66Å; P9-L12 HydrophobicContact CG-CG 4.3Å; P9-L12 PolarHBondContact O-N 2.95Å |
| 10 | S | 72.9 | Confident | 66.9 | Low | 43 Ų | 43 | 111.7 Ų | 111.7 | 30% | 0.301 | 61% | 0.608 | S | S | . | * | G | 310 helix | trans | -74 | -23.2 | -176.8 | 71.6 | 0 | 0 | 0 | 0 | 113.3 | Q8 L12 R13 L136 S137 P138 | Q8-S10 PolarHBondContact O-N 2.94Å; S10-L12 PolarHBondContact O-N 3.33Å; S10-R13 WeakPolarHBondContact O-CB 3.36Å; S10-R13 PolarHBondContact O-N 3.43Å; S10-L136 PolarHBondContact N-O 3.39Å; S10-L136 PolarHBondContact OG-O 3.26Å; S10-S137 WeakPolarHBondContact OG-CA 3.46Å; S10-P138 WeakPolarHBondContact OG-CD 3.04Å |
| 11 | W | 65.3 | Low | 65.9 | Low | 180 Ų | 180 | 109.9 Ų | 109.9 | 68% | 0.682 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -63.7 | -17.4 | 173.3 | 61.6 | -57.6 | 0 | 0 | 0 | 114.1 | P9 R13 P138 | P9-W11 VanDerWaalsContact C-N 3.31Å; P9-W11 HydrophobicContact CB-CG 4.37Å; P9-W11 PolarHBondContact O-N 2.85Å; W11-R13 PolarHBondContact O-N 2.91Å; W11-P138 HydrophobicContact CB-CG 4.32Å |
| 12 | L | 57.1 | Low | 64.3 | Low | 135 Ų | 135 | 109.2 Ų | 109.2 | 71% | 0.707 | 61% | 0.607 | S | S | * | * | G | 310 helix | trans | -73.4 | -4.8 | 170.3 | -69.3 | 174.1 | 0 | 0 | 0 | 113.4 | P9 S10 | P9-L12 HydrophobicContact CB-CD1 4.17Å; P9-L12 HydrophobicContact CB-CG 4.28Å; P9-L12 HydrophobicContact CG-CD1 3.66Å; P9-L12 HydrophobicContact CG-CG 4.3Å; P9-L12 PolarHBondContact O-N 2.95Å; S10-L12 PolarHBondContact O-N 3.33Å |
| 13 | R | 51.3 | Low | 62 | Low | 197 Ų | 197 | 108.7 Ų | 108.7 | 74% | 0.743 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -95 | 0.5 | 176.4 | -63.1 | -157.7 | -164.3 | -138.3 | 6 | 115.1 | S10 W11 | S10-R13 WeakPolarHBondContact O-CB 3.36Å; S10-R13 PolarHBondContact O-N 3.43Å; W11-R13 PolarHBondContact O-N 2.91Å |
| 14 | R | 45.9 | Very low | 59.9 | Low | 214 Ų | 214 | 109.9 Ų | 109.9 | 81% | 0.808 | 64% | 0.636 | S | S | * | * | trans | -155.6 | 110.5 | 172.5 | -153.9 | 175.7 | -72.2 | -146.3 | 1.3 | 111.7 | S16 | R14-S16 PolarHBondContact O-N 2.94Š| ||
| 15 | A | 39.5 | Very low | 57.2 | Low | 111 Ų | 111 | 110.5 Ų | 110.5 | 92% | 0.917 | 64% | 0.64 | S | S | * | * | trans | -78.9 | 103.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 16 | S | 45.6 | Very low | 54.9 | Low | 99 Ų | 99 | 113.9 Ų | 113.9 | 69% | 0.692 | 68% | 0.677 | S | S | * | * | trans | -156.3 | 116.1 | 149.8 | 54.9 | 0 | 0 | 0 | 0 | 107.7 | R14 | R14-S16 PolarHBondContact O-N 2.94Š| ||
| 17 | A | 46.8 | Very low | 52.6 | Low | 96 Ų | 96 | 120.9 Ų | 120.9 | 79% | 0.793 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 140.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 18 | P | 48.5 | Very low | 50.4 | Low | 123 Ų | 123 | 126.6 Ų | 126.6 | 80% | 0.799 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 141.2 | 171.1 | 28 | -30.2 | 0 | 0 | 0 | 110.2 | ||
| 19 | L | 43.7 | Very low | 48.1 | Very low | 139 Ų | 139 | 130.8 Ų | 130.8 | 73% | 0.728 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 146.7 | 174.7 | -71 | 167 | 0 | 0 | 0 | 110.6 | G21 | L19-G21 PolarHBondContact O-N 2.82Š|
| 20 | P | 34.8 | Very low | 46.2 | Very low | 132 Ų | 132 | 132.2 Ų | 132.2 | 86% | 0.857 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | 123 | 179 | 26.4 | -32.1 | 0 | 0 | 0 | 110.5 | ||
| 21 | G | 45 | Very low | 44.9 | Very low | 74 Ų | 74 | 138.7 Ų | 138.7 | 76% | 0.763 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 141.2 | -9.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | L19 S23 | L19-G21 PolarHBondContact O-N 2.82Å; G21-S23 PolarHBondContact O-N 2.97Å |
| 22 | F | 36.3 | Very low | 44.2 | Very low | 198 Ų | 198 | 135.6 Ų | 135.6 | 87% | 0.868 | 76% | 0.756 | S | S | * | * | trans | -93.7 | 75.4 | 178.8 | -72.9 | -82.9 | 0 | 0 | 0 | 111.7 | ||||
| 23 | S | 41 | Very low | 43.7 | Very low | 112 Ų | 112 | 132.3 Ų | 132.3 | 78% | 0.783 | 74% | 0.736 | S | S | * | * | trans | -88.6 | 104.8 | 157.3 | -175.2 | 0 | 0 | 0 | 0 | 107.4 | G21 | G21-S23 PolarHBondContact O-N 2.97Š| ||
| 24 | A | 46.9 | Very low | 43.6 | Very low | 86 Ų | 86 | 123.6 Ų | 123.6 | 71% | 0.711 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 132 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | G26 | A24-G26 PolarHBondContact O-N 3.14Š|
| 25 | P | 39 | Very low | 43.9 | Very low | 117 Ų | 117 | 118.8 Ų | 118.8 | 76% | 0.76 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 127.8 | -179.8 | 27 | -31.9 | 0 | 0 | 0 | 109.5 | R27 | P25-R27 PolarHBondContact O-N 2.98Š|
| 26 | G | 44.8 | Very low | 44.5 | Very low | 80 Ų | 80 | 115 Ų | 115 | 83% | 0.825 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 118.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110 | A24 | A24-G26 PolarHBondContact O-N 3.14Š|
| 27 | R | 42.8 | Very low | 44.7 | Very low | 239 Ų | 239 | 115.7 Ų | 115.7 | 90% | 0.902 | 66% | 0.661 | S | S | * | * | trans | -101.8 | 113 | 168.3 | -92.9 | -171.3 | 179 | -129.4 | 0.9 | 110.1 | P25 | P25-R27 PolarHBondContact O-N 2.98Š| ||
| 28 | L | 44 | Very low | 44.8 | Very low | 147 Ų | 147 | 117.5 Ų | 117.5 | 77% | 0.77 | 66% | 0.657 | S | S | * | * | trans | -0.4 | 122.8 | 143.5 | -108.7 | 83.9 | 0 | 0 | 0 | 115.6 | ||||
| 29 | F | 38.7 | Very low | 44.7 | Very low | 185 Ų | 185 | 119 Ų | 119 | 81% | 0.811 | 65% | 0.653 | S | S | * | * | trans | 49 | 100.3 | 151 | -85.8 | -91.9 | 0 | 0 | 0 | 117.2 | Q31 | F29-Q31 HydrophobicContact CD1-CG 4.37Š| ||
| 30 | D | 40.8 | Very low | 44.8 | Very low | 70 Ų | 70 | 116 Ų | 116 | 37% | 0.374 | 65% | 0.649 | S | S | . | * | trans | -122.2 | 109.4 | 150.5 | -149.6 | -33.5 | 0 | 0 | 0 | 108.2 | R32 | D30-R32 PolarHBondContact O-N 2.99Å; D30-R32 WeakPolarHBondContact OD1-CB 3.26Å; D30-R32 WeakPolarHBondContact OD1-CG 3.48Å; D30-R32 IonicContact OD1-CZ 3.17Å; D30-R32 PolarHBondContact OD1-N 2.82Å; D30-R32 IonicContact OD1-NE 2.96Å; D30-R32 PolarHBondContact OD1-NE 2.72Å; D30-R32 IonicContact OD1-NH2 3.89Å; D30-R32 IonicContact OD2-CZ 3.75Å; D30-R32 IonicContact OD2-NE 3.74Å; D30-R32 IonicContact OD2-NH2 3.76Å; D30-R32 PolarHBondContact OD2-NH2 3.24Å | ||
| 31 | Q | 45.5 | Very low | 45.4 | Very low | 178 Ų | 178 | 114 Ų | 114 | 83% | 0.832 | 63% | 0.628 | S | S | * | * | trans | -77.4 | 8.5 | 176.6 | -77.6 | -144.1 | 67.9 | 0 | 0 | 112.7 | F29 F33 | F29-Q31 HydrophobicContact CD1-CG 4.37Å; Q31-F33 PolarHBondContact O-N 3.3Å; Q31-F33 VanDerWaalsContact O-N 3.17Å | ||
| 32 | R | 49.5 | Very low | 45.7 | Very low | 116 Ų | 116 | 115.8 Ų | 115.8 | 44% | 0.438 | 62% | 0.619 | S | S | . | * | trans | -87.8 | 40 | 176.6 | -64.8 | -178.1 | -75.8 | 177.9 | 2.1 | 112.3 | D30 G34 E35 E41 | D30-R32 PolarHBondContact O-N 2.99Å; D30-R32 WeakPolarHBondContact OD1-CB 3.26Å; D30-R32 WeakPolarHBondContact OD1-CG 3.48Å; D30-R32 IonicContact OD1-CZ 3.17Å; D30-R32 PolarHBondContact OD1-N 2.82Å; D30-R32 IonicContact OD1-NE 2.96Å; D30-R32 PolarHBondContact OD1-NE 2.72Å; D30-R32 IonicContact OD1-NH2 3.89Å; D30-R32 IonicContact OD2-CZ 3.75Å; D30-R32 IonicContact OD2-NE 3.74Å; D30-R32 IonicContact OD2-NH2 3.76Å; D30-R32 PolarHBondContact OD2-NH2 3.24Å; R32-G34 PolarHBondContact O-N 3.24Å; R32-E35 HydrophobicContact CB-CB 4.23Å; R32-E35 HydrophobicContact CB-CG 4.45Å; R32-E35 PolarHBondContact O-N 2.77Å; R32-E41 IonicContact CZ-OE1 3.71Å; R32-E41 IonicContact NH1-OE1 3.78Å; R32-E41 PolarHBondContact NH1-OE1 2.71Å; R32-E41 IonicContact NH2-OE1 3.01Å; R32-E41 PolarHBondContact NH2-OE1 2.85Å | ||
| 33 | F | 46.4 | Very low | 46.4 | Very low | 66 Ų | 66 | 109.5 Ų | 109.5 | 29% | 0.289 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.8 | 115.2 | -173.9 | -173.9 | -116.9 | 0 | 0 | 0 | 111 | Q31 H82 F83 R115 F117 | Q31-F33 PolarHBondContact O-N 3.3Å; Q31-F33 VanDerWaalsContact O-N 3.17Å; F33-H82 HydrophobicContact CE2-CB 4.35Å; F33-F83 AromaticContact CE1-CE2 3.87Å; F33-F83 HydrophobicContact CE1-CE2 3.87Å; F33-F83 AromaticContact CE1-CZ 3.69Å; F33-F83 HydrophobicContact CE1-CZ 3.69Å; F33-F83 HydrophobicContact CE2-CD2 4.18Å; F33-F83 AromaticContact CE2-CE2 3.29Å; F33-F83 HydrophobicContact CE2-CE2 3.29Å; F33-F83 AromaticContact CE2-CZ 3.89Å; F33-F83 HydrophobicContact CE2-CZ 3.89Å; F33-F83 HydrophobicContact CZ-CD2 4.13Å; F33-F83 HydrophobicContact CZ-CE1 4.2Å; F33-F83 AromaticContact CZ-CE2 2.94Å; F33-F83 HydrophobicContact CZ-CE2 2.94Å; F33-F83 AromaticContact CZ-CZ 3.03Å; F33-F83 HydrophobicContact CZ-CZ 3.03Å; F33-R115 HydrophobicContact CE1-CB 4.43Å; F33-R115 HydrophobicContact CZ-CB 3.96Å; F33-F117 HydrophobicContact CD1-CB 3.84Å; F33-F117 AromaticContact CD1-CD1 3.98Å; F33-F117 HydrophobicContact CD1-CD1 3.98Å; F33-F117 HydrophobicContact CD1-CG 4.32Å; F33-F117 HydrophobicContact CE1-CB 3.66Å; F33-F117 AromaticContact CE1-CD1 3.48Å; F33-F117 HydrophobicContact CE1-CD1 3.48Å; F33-F117 VanDerWaalsContact CE1-CD1 3.48Å; F33-F117 HydrophobicContact CE1-CG 4.04Å; F33-F117 HydrophobicContact CE2-CD1 4.27Å; F33-F117 AromaticContact CZ-CD1 3.75Å; F33-F117 HydrophobicContact CZ-CD1 3.75Å |
| 34 | G | 49.6 | Very low | 46.7 | Very low | 13 Ų | 13 | 108.6 Ų | 108.6 | 13% | 0.134 | 60% | 0.598 | C | S | . | * | T | Hydrogen-bonded Turn | trans | 57 | 59.2 | -164.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | R32 R119 | R32-G34 PolarHBondContact O-N 3.24Å; G34-R119 PolarHBondContact O-NE 2.77Å; G34-R119 PolarHBondContact O-NH1 3.1Å; G34-R119 PolarHBondContact O-NH2 2.92Å |
| 35 | E | 51.9 | Low | 46.7 | Very low | 113 Ų | 113 | 111.5 Ų | 111.5 | 53% | 0.528 | 60% | 0.601 | S | S | . | * | trans | -103.8 | 145.7 | 143.4 | -75.3 | -159 | 137.2 | 0 | 0 | 108.8 | R32 R119 | R32-E35 HydrophobicContact CB-CB 4.23Å; R32-E35 HydrophobicContact CB-CG 4.45Å; R32-E35 PolarHBondContact O-N 2.77Å; E35-R119 VanDerWaalsContact C-NH2 3.32Å; E35-R119 PolarHBondContact O-NH1 2.96Å | ||
| 36 | G | 53.2 | Low | 47.1 | Very low | 32 Ų | 32 | 110.2 Ų | 110.2 | 33% | 0.33 | 59% | 0.594 | S | S | . | * | B | Isolated β-bridge | trans | -71.5 | 147.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | L38 | G36-L38 PolarHBondContact O-N 3.35Å |
| 37 | L | 48.8 | Very low | 46.9 | Very low | 113 Ų | 113 | 112.2 Ų | 112.2 | 59% | 0.592 | 59% | 0.592 | S | S | * | * | trans | -62.1 | 91.5 | 169.1 | -79.1 | 164.4 | 0 | 0 | 0 | 108.4 | ||||
| 38 | L | 48.5 | Very low | 47.3 | Very low | 135 Ų | 135 | 105.7 Ų | 105.7 | 71% | 0.707 | 59% | 0.589 | S | S | * | * | trans | -71.7 | 141.7 | 170.5 | -102.6 | 153.8 | 0 | 0 | 0 | 108 | G36 A40 E41 | G36-L38 PolarHBondContact O-N 3.35Å; L38-A40 HydrophobicContact CB-CB 4.45Å; L38-A40 PolarHBondContact O-N 2.85Å; L38-E41 PolarHBondContact O-N 2.79Å; L38-E41 VanDerWaalsContact O-N 3.15Å | ||
| 39 | E | 47.2 | Very low | 47.4 | Very low | 153 Ų | 153 | 104.9 Ų | 104.9 | 72% | 0.715 | 59% | 0.591 | S | S | * | * | G | 310 helix | trans | -50.5 | -9.6 | 174.2 | -77.9 | -136.3 | 124.8 | 0 | 0 | 115.1 | E41 L42 | E39-E41 PolarHBondContact O-N 2.81Å; E39-L42 WeakPolarHBondContact O-CB 3.34Å; E39-L42 PolarHBondContact O-N 2.82Å |
| 40 | A | 46.1 | Very low | 47.9 | Very low | 77 Ų | 77 | 103.8 Ų | 103.8 | 64% | 0.636 | 59% | 0.591 | S | S | * | * | G | 310 helix | trans | -56 | -26.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L38 | L38-A40 HydrophobicContact CB-CB 4.45Å; L38-A40 PolarHBondContact O-N 2.85Å |
| 41 | E | 47.5 | Very low | 48 | Very low | 91 Ų | 91 | 103.9 Ų | 103.9 | 43% | 0.425 | 60% | 0.602 | S | S | . | * | G | 310 helix | trans | -78.8 | -20.7 | 172.5 | -72.2 | -89 | 151.6 | 0 | 0 | 112.8 | R32 L38 E39 A43 S44 | R32-E41 IonicContact CZ-OE1 3.71Å; R32-E41 IonicContact NH1-OE1 3.78Å; R32-E41 PolarHBondContact NH1-OE1 2.71Å; R32-E41 IonicContact NH2-OE1 3.01Å; R32-E41 PolarHBondContact NH2-OE1 2.85Å; L38-E41 PolarHBondContact O-N 2.79Å; L38-E41 VanDerWaalsContact O-N 3.15Å; E39-E41 PolarHBondContact O-N 2.81Å; E41-A43 VanDerWaalsContact C-N 3.27Å; E41-A43 PolarHBondContact O-N 2.79Å; E41-S44 VanDerWaalsContact O-CB 3.31Å; E41-S44 WeakPolarHBondContact O-CB 3.24Å; E41-S44 PolarHBondContact O-N 3.28Å; E41-S44 VanDerWaalsContact O-N 3.1Å |
| 42 | L | 51 | Low | 47.9 | Very low | 110 Ų | 110 | 100.8 Ų | 100.8 | 58% | 0.576 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -66.7 | -32.9 | 173.1 | -146.1 | 85.4 | 0 | 0 | 0 | 110.9 | E39 S44 L45 | E39-L42 WeakPolarHBondContact O-CB 3.34Å; E39-L42 PolarHBondContact O-N 2.82Å; L42-S44 PolarHBondContact O-N 2.86Å; L42-L45 PolarHBondContact O-N 3.01Å |
| 43 | A | 50.9 | Low | 47.6 | Very low | 66 Ų | 66 | 104.7 Ų | 104.7 | 55% | 0.545 | 61% | 0.613 | S | S | . | * | G | 310 helix | trans | -67.5 | -18.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113 | E41 L45 C46 | E41-A43 VanDerWaalsContact C-N 3.27Å; E41-A43 PolarHBondContact O-N 2.79Å; A43-L45 PolarHBondContact O-N 2.89Å; A43-C46 PolarHBondContact O-N 2.77Å |
| 44 | S | 47.5 | Very low | 47.7 | Very low | 94 Ų | 94 | 111.6 Ų | 111.6 | 66% | 0.657 | 64% | 0.639 | S | S | * | * | G | 310 helix | trans | -78.6 | -2.7 | 178.7 | -150.3 | 0 | 0 | 0 | 0 | 113.5 | E41 L42 C46 | E41-S44 VanDerWaalsContact O-CB 3.31Å; E41-S44 WeakPolarHBondContact O-CB 3.24Å; E41-S44 PolarHBondContact O-N 3.28Å; E41-S44 VanDerWaalsContact O-N 3.1Å; L42-S44 PolarHBondContact O-N 2.86Å; S44-C46 VanDerWaalsContact C-N 3.31Å |
| 45 | L | 47.1 | Very low | 47.6 | Very low | 146 Ų | 146 | 119.3 Ų | 119.3 | 76% | 0.764 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -82.9 | -4.5 | 168.4 | -67.9 | 168.8 | 0 | 0 | 0 | 113 | L42 A43 | L42-L45 PolarHBondContact O-N 3.01Å; A43-L45 PolarHBondContact O-N 2.89Å |
| 46 | C | 47.4 | Very low | 47.5 | Very low | 91 Ų | 91 | 125.7 Ų | 125.7 | 62% | 0.615 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -86.9 | 126 | 172.8 | -62.8 | 0 | 0 | 0 | 0 | 110 | A43 S44 A48 | A43-C46 PolarHBondContact O-N 2.77Å; S44-C46 VanDerWaalsContact C-N 3.31Å; C46-A48 PolarHBondContact O-N 3.45Å |
| 47 | P | 40.8 | Very low | 47 | Very low | 121 Ų | 121 | 127.9 Ų | 127.9 | 79% | 0.786 | 71% | 0.711 | S | S | * | * | trans | -65.2 | 114.1 | -178.2 | 15.5 | -16.4 | 0 | 0 | 0 | 110.6 | T49 | P47-T49 PolarHBondContact O-N 3.48Š| ||
| 48 | A | 50.4 | Low | 46.7 | Very low | 102 Ų | 102 | 127.6 Ų | 127.6 | 84% | 0.843 | 72% | 0.716 | S | S | * | * | trans | -68.4 | 109.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | C46 | C46-A48 PolarHBondContact O-N 3.45Š| ||
| 49 | T | 46 | Very low | 46.7 | Very low | 131 Ų | 131 | 127.3 Ų | 127.3 | 80% | 0.804 | 73% | 0.725 | S | S | * | * | trans | -121.5 | 3 | 169 | 50.4 | 0 | 0 | 0 | 0 | 114.7 | P47 | P47-T49 PolarHBondContact O-N 3.48Š| ||
| 50 | I | 50.5 | Low | 46.6 | Very low | 161 Ų | 161 | 125.6 Ų | 125.6 | 83% | 0.826 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -141.1 | 118.6 | 177.7 | -51.2 | 179.1 | 0 | 0 | 0 | 112.1 | ||
| 51 | A | 43 | Very low | 46.6 | Very low | 72 Ų | 72 | 126.4 Ų | 126.4 | 60% | 0.595 | 73% | 0.732 | S | S | * | * | trans | 91.6 | 103.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 52 | P | 41.6 | Very low | 46.4 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 74% | 0.74 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -89.6 | 8.8 | 175.5 | 27.4 | -19.2 | 0 | 0 | 0 | 115.7 | ||
| 53 | Y | 44.4 | Very low | 46 | Very low | 197 Ų | 197 | 129.4 Ų | 129.4 | 77% | 0.773 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -135 | 11.1 | -169.6 | -70.7 | -71.3 | 0 | 0 | 0 | 117.9 | ||
| 54 | Y | 48 | Very low | 45.7 | Very low | 211 Ų | 211 | 130.6 Ų | 130.6 | 83% | 0.827 | 77% | 0.766 | S | S | * | * | trans | -130.6 | 35.7 | -174.8 | -73.4 | -67.7 | 0 | 0 | 0 | 117.1 | ||||
| 55 | L | 48.1 | Very low | 45.3 | Very low | 176 Ų | 176 | 130.5 Ų | 130.5 | 92% | 0.921 | 77% | 0.771 | S | S | * | * | trans | -136.1 | 65.5 | 165.2 | -71.9 | 174.3 | 0 | 0 | 0 | 112.2 | ||||
| 56 | R | 48.9 | Very low | 45.1 | Very low | 246 Ų | 246 | 132.3 Ų | 132.3 | 93% | 0.928 | 78% | 0.776 | S | S | * | * | trans | -112.3 | 80.6 | 149.8 | -169.8 | 168.7 | -176.3 | 171.2 | 0.7 | 108 | ||||
| 57 | A | 43.4 | Very low | 45.1 | Very low | 78 Ų | 78 | 133.7 Ų | 133.7 | 65% | 0.645 | 78% | 0.781 | S | S | * | * | trans | -70.3 | 134.5 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | S59 | A57-S59 PolarHBondContact O-N 3.03Š| ||
| 58 | P | 41.4 | Very low | 45.2 | Very low | 108 Ų | 108 | 133.4 Ų | 133.4 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | -63.2 | 133.4 | 167.3 | 28.2 | -31 | 0 | 0 | 0 | 107.5 | V60 | P58-V60 PolarHBondContact O-N 2.93Š| ||
| 59 | S | 50.5 | Low | 45.3 | Very low | 128 Ų | 128 | 131.3 Ų | 131.3 | 90% | 0.895 | 76% | 0.762 | S | S | * | * | trans | -64 | 81.2 | 177.4 | -56.4 | 0 | 0 | 0 | 0 | 110.2 | A57 A61 | A57-S59 PolarHBondContact O-N 3.03Å; S59-A61 PolarHBondContact O-N 2.71Å | ||
| 60 | V | 43.7 | Very low | 45.8 | Very low | 117 Ų | 117 | 130.8 Ų | 130.8 | 71% | 0.709 | 75% | 0.754 | S | S | * | * | trans | -65.5 | 117.2 | 153.6 | 179.2 | 0 | 0 | 0 | 0 | 104.1 | P58 L62 | P58-V60 PolarHBondContact O-N 2.93Å; V60-L62 PolarHBondContact O-N 3.43Å | ||
| 61 | A | 45.9 | Very low | 46.2 | Very low | 95 Ų | 95 | 129.4 Ų | 129.4 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | trans | -60.1 | 88.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | S59 | S59-A61 PolarHBondContact O-N 2.71Š| ||
| 62 | L | 44.8 | Very low | 47.4 | Very low | 148 Ų | 148 | 126.2 Ų | 126.2 | 78% | 0.775 | 73% | 0.73 | S | S | * | * | trans | -58.9 | 128.7 | 162.6 | -73.6 | 165.8 | 0 | 0 | 0 | 105.2 | V60 A64 | V60-L62 PolarHBondContact O-N 3.43Å; L62-A64 PolarHBondContact O-N 2.62Å | ||
| 63 | P | 41.3 | Very low | 49.2 | Very low | 116 Ų | 116 | 125.3 Ų | 125.3 | 75% | 0.753 | 71% | 0.712 | S | S | * | * | trans | -53.1 | 121 | 170.9 | 22.6 | -30.2 | 0 | 0 | 0 | 106 | A65 | P63-A65 PolarHBondContact O-N 2.84Š| ||
| 64 | A | 45.7 | Very low | 51.3 | Low | 90 Ų | 90 | 116.6 Ų | 116.6 | 74% | 0.744 | 68% | 0.678 | S | S | * | * | trans | -48.5 | 109.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 106.7 | L62 Q66 | L62-A64 PolarHBondContact O-N 2.62Å; A64-Q66 VanDerWaalsContact C-N 3.25Å; A64-Q66 PolarHBondContact O-N 2.8Å | ||
| 65 | A | 39.2 | Very low | 53.3 | Low | 92 Ų | 92 | 109 Ų | 109 | 76% | 0.76 | 66% | 0.657 | S | S | * | * | trans | -60.7 | 100.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 104.8 | P63 V67 | P63-A65 PolarHBondContact O-N 2.84Å; A65-V67 PolarHBondContact O-N 3.45Å | ||
| 66 | Q | 42.8 | Very low | 55.4 | Low | 185 Ų | 185 | 101.6 Ų | 101.6 | 86% | 0.864 | 62% | 0.618 | S | S | * | * | trans | -63.5 | 99 | 168.7 | -65.1 | -177.5 | 30.7 | 0 | 0 | 103.5 | A64 | A64-Q66 VanDerWaalsContact C-N 3.25Å; A64-Q66 PolarHBondContact O-N 2.8Å | ||
| 67 | V | 46.9 | Very low | 57.5 | Low | 120 Ų | 120 | 93.4 Ų | 93.4 | 73% | 0.727 | 59% | 0.592 | S | S | * | * | trans | -43.8 | 128.9 | 164.1 | 178.4 | 0 | 0 | 0 | 0 | 105.1 | A65 A69 | A65-V67 PolarHBondContact O-N 3.45Å; V67-A69 VanDerWaalsContact C-N 3.28Å; V67-A69 PolarHBondContact O-N 3.16Å | ||
| 68 | P | 43.3 | Very low | 59.8 | Low | 114 Ų | 114 | 89.7 Ų | 89.7 | 74% | 0.74 | 56% | 0.562 | S | S | * | * | trans | -53.7 | 102.1 | 175.7 | -19.7 | 29.8 | 0 | 0 | 0 | 106.6 | D70 | P68-D70 PolarHBondContact O-N 3.2Š| ||
| 69 | A | 51.2 | Low | 62.1 | Low | 58 Ų | 58 | 87 Ų | 87 | 48% | 0.479 | 54% | 0.541 | S | S | . | . | trans | -65.2 | 114.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 104 | V67 P71 P124 | V67-A69 VanDerWaalsContact C-N 3.28Å; V67-A69 PolarHBondContact O-N 3.16Å; A69-P71 VanDerWaalsContact O-N 3.15Å; A69-P124 HydrophobicContact CB-CG 4.32Å | ||
| 70 | D | 56.4 | Low | 64.2 | Low | 121 Ų | 121 | 80.9 Ų | 80.9 | 65% | 0.647 | 50% | 0.499 | S | S | * | . | trans | -46.7 | 127.8 | 170.9 | -74.7 | -42.3 | 0 | 0 | 0 | 107.5 | P68 G72 Y73 | P68-D70 PolarHBondContact O-N 3.2Å; D70-G72 PolarHBondContact O-N 3.46Å; D70-Y73 PolarHBondContact O-N 3.06Å | ||
| 71 | P | 60.6 | Low | 66.5 | Low | 131 Ų | 131 | 80 Ų | 80 | 85% | 0.851 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | 108.1 | -168.8 | 20.7 | -31.4 | 0 | 0 | 0 | 109.6 | A69 | A69-P71 VanDerWaalsContact O-N 3.15Š|
| 72 | G | 67.6 | Low | 68.6 | Low | 6 Ų | 6 | 78.8 Ų | 78.8 | 6% | 0.062 | 46% | 0.464 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 105.9 | 1.1 | 178 | 0 | 0 | 0 | 0 | 0 | 116.7 | D70 P148 | D70-G72 PolarHBondContact O-N 3.46Å; G72-P148 VanDerWaalsContact O-CA 3.27Å; G72-P148 WeakPolarHBondContact O-CA 3.46Å; G72-P148 WeakPolarHBondContact O-CD 3.48Å; G72-P148 VanDerWaalsContact O-CG 3.27Å; G72-P148 WeakPolarHBondContact O-CG 3.33Å; G72-P148 VanDerWaalsContact O-N 3.15Å |
| 73 | Y | 79.1 | Confident | 70.8 | Confident | 94 Ų | 94 | 72.5 Ų | 72.5 | 37% | 0.369 | 43% | 0.43 | S | S | . | . | trans | -109.3 | 134.5 | 174.1 | -176 | -110.3 | 0 | 0 | 0 | 112 | D70 S75 Q145 A146 | D70-Y73 PolarHBondContact O-N 3.06Å; Y73-S75 VanDerWaalsContact CE1-CB 3.41Å; Y73-S75 WeakPolarHBondContact OH-CB 3.34Å; Y73-S75 PolarHBondContact OH-OG 2.89Å; Y73-Q145 PolarHBondContact OH-NE2 3.22Å; Y73-A146 WeakPolarHBondContact CD2-O 3.45Å | ||
| 74 | F | 88.3 | Confident | 73.2 | Confident | 14 Ų | 14 | 68.2 Ų | 68.2 | 6% | 0.061 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 132.4 | 173.5 | 175.4 | -98.6 | 0 | 0 | 0 | 108.9 | V76 V97 Y121 L123 P124 V127 I144 Q145 A146 | F74-V76 HydrophobicContact CE1-CG2 3.99Å; F74-V76 HydrophobicContact CE2-CG2 3.87Å; F74-V76 HydrophobicContact CZ-CB 4.48Å; F74-V76 HydrophobicContact CZ-CG2 3.46Å; F74-V76 VanDerWaalsContact CZ-CG2 3.46Å; F74-V97 HydrophobicContact CE1-CB 4.37Å; F74-V97 HydrophobicContact CE1-CG2 3.68Å; F74-V97 HydrophobicContact CZ-CB 4.11Å; F74-V97 HydrophobicContact CZ-CG2 3.71Å; F74-Y121 HydrophobicContact CZ-CG 4.38Å; F74-L123 HydrophobicContact CB-CD2 4.45Å; F74-L123 HydrophobicContact CD1-CD2 4.12Å; F74-L123 HydrophobicContact CD2-CD2 4.08Å; F74-L123 HydrophobicContact CE1-CD2 4.38Å; F74-L123 HydrophobicContact CE2-CD2 4.31Å; F74-L123 HydrophobicContact CG-CD2 3.96Å; F74-L123 HydrophobicContact CZ-CD2 4.46Å; F74-P124 HydrophobicContact CD2-CG 4.35Å; F74-V127 HydrophobicContact CB-CG2 4.38Å; F74-I144 HydrophobicContact CE1-CB 4.42Å; F74-I144 HydrophobicContact CE1-CG2 3.91Å; F74-Q145 CarbonylContact O-C 3.56Å; F74-Q145 WeakPolarHBondContact O-CA 3.17Å; F74-A146 HydrophobicContact CB-CB 3.97Å; F74-A146 PolarHBondContact N-O 3Å; F74-A146 PolarHBondContact O-N 3.49Å |
| 75 | S | 91.1 | Very high | 75.4 | Confident | 53 Ų | 53 | 66.4 Ų | 66.4 | 37% | 0.371 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.7 | 130 | 176.8 | -171.8 | 0 | 0 | 0 | 0 | 111.2 | Y73 I144 Q145 | Y73-S75 VanDerWaalsContact CE1-CB 3.41Å; Y73-S75 WeakPolarHBondContact OH-CB 3.34Å; Y73-S75 PolarHBondContact OH-OG 2.89Å; S75-I144 CarbonylContact C-O 3.54Å; S75-I144 VanDerWaalsContact CA-O 3.3Å; S75-I144 WeakPolarHBondContact CA-O 3.25Å; S75-Q145 PolarHBondContact OG-NE2 3Å |
| 76 | V | 90.9 | Very high | 78 | Confident | 19 Ų | 19 | 69.1 Ų | 69.1 | 12% | 0.115 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.4 | 137.3 | 177.7 | 179.4 | 0 | 0 | 0 | 0 | 109.1 | F74 L78 Y121 S143 I144 | F74-V76 HydrophobicContact CE1-CG2 3.99Å; F74-V76 HydrophobicContact CE2-CG2 3.87Å; F74-V76 HydrophobicContact CZ-CB 4.48Å; F74-V76 HydrophobicContact CZ-CG2 3.46Å; F74-V76 VanDerWaalsContact CZ-CG2 3.46Å; V76-L78 HydrophobicContact CG1-CD2 4.18Å; V76-L78 HydrophobicContact CG1-CG 4.05Å; V76-Y121 HydrophobicContact CG1-CD1 4.48Å; V76-Y121 HydrophobicContact CG1-CD2 4.38Å; V76-Y121 HydrophobicContact CG1-CE1 3.97Å; V76-Y121 HydrophobicContact CG1-CE2 3.87Å; V76-Y121 HydrophobicContact CG2-CD1 4.07Å; V76-Y121 HydrophobicContact CG2-CD2 4.44Å; V76-Y121 HydrophobicContact CG2-CE1 4.33Å; V76-Y121 HydrophobicContact CG2-CG 4.14Å; V76-S143 WeakPolarHBondContact O-CA 3.45Å; V76-I144 PolarHBondContact N-O 3.37Å; V76-I144 PolarHBondContact O-N 3.49Å |
| 77 | L | 92.7 | Very high | 80.5 | Confident | 74 Ų | 74 | 61.3 Ų | 61.3 | 39% | 0.387 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 134.7 | 171.8 | -60.4 | 179.5 | 0 | 0 | 0 | 110 | V141 L142 | L77-V141 HydrophobicContact CB-CG1 4.36Å; L77-V141 HydrophobicContact CD2-CG1 4.41Å; L77-L142 CarbonylContact C-O 3.54Å; L77-L142 WeakPolarHBondContact CA-O 3.45Å |
| 78 | L | 92.3 | Very high | 82.8 | Confident | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.005 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.2 | 126.7 | -174.8 | -67.1 | 178.1 | 0 | 0 | 0 | 110.6 | V76 V80 V99 Y121 V141 L142 I144 | V76-L78 HydrophobicContact CG1-CD2 4.18Å; V76-L78 HydrophobicContact CG1-CG 4.05Å; L78-V80 HydrophobicContact CB-CG1 4.05Å; L78-V80 PolarHBondContact O-N 2.86Å; L78-V99 HydrophobicContact CD1-CB 4.2Å; L78-V99 HydrophobicContact CD1-CG1 3.99Å; L78-V99 HydrophobicContact CD1-CG2 3.84Å; L78-Y121 HydrophobicContact CD1-CE2 4.44Å; L78-Y121 HydrophobicContact CD2-CE2 4.47Å; L78-Y121 VanDerWaalsContact CD2-OH 3.3Å; L78-Y121 WeakPolarHBondContact CD2-OH 3.36Å; L78-V141 CarbonylContact O-C 3.41Å; L78-V141 WeakPolarHBondContact O-CA 3.42Å; L78-L142 HydrophobicContact CB-CB 4.11Å; L78-L142 HydrophobicContact CD1-CD2 3.97Å; L78-L142 PolarHBondContact N-O 2.97Å; L78-L142 PolarHBondContact O-N 2.83Å; L78-I144 HydrophobicContact CD1-CD1 4.17Å |
| 79 | D | 90.9 | Very high | 85.4 | Confident | 50 Ų | 50 | 53.6 Ų | 53.6 | 27% | 0.267 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.4 | 115.9 | 164.8 | -175.4 | -1.4 | 0 | 0 | 0 | 109.1 | K81 | D79-K81 WeakPolarHBondContact OD1-CB 3.33Å; D79-K81 WeakPolarHBondContact OD1-CD 3.36Å; D79-K81 VanDerWaalsContact OD1-CG 3.25Å; D79-K81 WeakPolarHBondContact OD1-CG 3.48Å; D79-K81 PolarHBondContact OD1-N 2.75Å; D79-K81 WeakPolarHBondContact OD2-CE 3.09Å; D79-K81 IonicContact OD2-NZ 3.2Å; D79-K81 PolarHBondContact OD2-NZ 2.87Å |
| 80 | V | 93.4 | Very high | 87.6 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.006 | 28% | 0.275 | C | S | . | . | trans | -128.9 | 21.9 | 179.5 | -59.1 | 0 | 0 | 0 | 0 | 111.5 | L78 H82 F83 I88 F117 L136 G140 L142 | L78-V80 HydrophobicContact CB-CG1 4.05Å; L78-V80 PolarHBondContact O-N 2.86Å; V80-H82 PolarHBondContact O-N 2.9Å; V80-F83 HydrophobicContact CB-CD2 4.15Å; V80-F83 PolarHBondContact O-N 2.79Å; V80-I88 HydrophobicContact CB-CD1 3.99Å; V80-I88 HydrophobicContact CG2-CD1 3.71Å; V80-F117 HydrophobicContact CG1-CE1 3.84Å; V80-F117 HydrophobicContact CG1-CZ 3.7Å; V80-L136 HydrophobicContact CG2-CD1 3.44Å; V80-L136 VanDerWaalsContact CG2-CD1 3.44Å; V80-G140 CarbonylContact C-O 3.52Å; V80-G140 VanDerWaalsContact CG2-O 3.29Å; V80-G140 WeakPolarHBondContact CG2-O 3.45Å; V80-G140 PolarHBondContact N-O 2.89Å; V80-L142 HydrophobicContact CG1-CB 4.1Å; V80-L142 HydrophobicContact CG1-CD2 4.44Å; V80-L142 HydrophobicContact CG2-CB 3.74Å | ||
| 81 | K | 91.4 | Very high | 89.5 | Confident | 97 Ų | 97 | 48 Ų | 48 | 42% | 0.422 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -16.6 | -174.7 | 72.1 | -167 | 173.3 | -140.3 | 0 | 116.1 | D79 G140 | D79-K81 WeakPolarHBondContact OD1-CB 3.33Å; D79-K81 WeakPolarHBondContact OD1-CD 3.36Å; D79-K81 VanDerWaalsContact OD1-CG 3.25Å; D79-K81 WeakPolarHBondContact OD1-CG 3.48Å; D79-K81 PolarHBondContact OD1-N 2.75Å; D79-K81 WeakPolarHBondContact OD2-CE 3.09Å; D79-K81 IonicContact OD2-NZ 3.2Å; D79-K81 PolarHBondContact OD2-NZ 2.87Å; K81-G140 PolarHBondContact N-O 2.84Å |
| 82 | H | 90.6 | Very high | 91.2 | Very high | 71 Ų | 71 | 42 Ų | 42 | 33% | 0.329 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92.3 | 3.5 | 178 | -59.6 | -59.1 | 0 | 0 | 0 | 113.8 | F33 V80 | F33-H82 HydrophobicContact CE2-CB 4.35Å; V80-H82 PolarHBondContact O-N 2.9Å |
| 83 | F | 92 | Very high | 92.5 | Very high | 15 Ų | 15 | 43.7 Ų | 43.7 | 7% | 0.066 | 23% | 0.226 | C | C | . | . | S | Bend | trans | -120.9 | 145.5 | 177.3 | -58.7 | -83.4 | 0 | 0 | 0 | 110.9 | F33 V80 E87 I88 A101 H103 R115 F117 | F33-F83 AromaticContact CE1-CE2 3.87Å; F33-F83 HydrophobicContact CE1-CE2 3.87Å; F33-F83 AromaticContact CE1-CZ 3.69Å; F33-F83 HydrophobicContact CE1-CZ 3.69Å; F33-F83 HydrophobicContact CE2-CD2 4.18Å; F33-F83 AromaticContact CE2-CE2 3.29Å; F33-F83 HydrophobicContact CE2-CE2 3.29Å; F33-F83 AromaticContact CE2-CZ 3.89Å; F33-F83 HydrophobicContact CE2-CZ 3.89Å; F33-F83 HydrophobicContact CZ-CD2 4.13Å; F33-F83 HydrophobicContact CZ-CE1 4.2Å; F33-F83 AromaticContact CZ-CE2 2.94Å; F33-F83 HydrophobicContact CZ-CE2 2.94Å; F33-F83 AromaticContact CZ-CZ 3.03Å; F33-F83 HydrophobicContact CZ-CZ 3.03Å; V80-F83 HydrophobicContact CB-CD2 4.15Å; V80-F83 PolarHBondContact O-N 2.79Å; F83-E87 WeakPolarHBondContact CA-OE2 3.37Å; F83-E87 HydrophobicContact CB-CB 4.14Å; F83-E87 HydrophobicContact CD1-CB 4.14Å; F83-I88 HydrophobicContact CB-CD1 4Å; F83-I88 HydrophobicContact CB-CG1 3.8Å; F83-I88 HydrophobicContact CG-CG1 4.45Å; F83-A101 HydrophobicContact CD1-CB 3.8Å; F83-A101 HydrophobicContact CD2-CB 3.77Å; F83-A101 HydrophobicContact CE1-CB 3.62Å; F83-A101 WeakPolarHBondContact CE1-O 3.46Å; F83-A101 HydrophobicContact CE2-CB 3.56Å; F83-A101 HydrophobicContact CG-CB 3.82Å; F83-A101 HydrophobicContact CZ-CB 3.42Å; F83-A101 VanDerWaalsContact CZ-CB 3.42Å; F83-A101 WeakPolarHBondContact CZ-O 3.27Å; F83-H103 HydrophobicContact CD1-CB 3.85Å; F83-H103 HydrophobicContact CE1-CB 3.88Å; F83-R115 HydrophobicContact CE1-CB 4.33Å; F83-R115 HydrophobicContact CZ-CB 4.34Å; F83-F117 HydrophobicContact CD2-CD1 4.44Å; F83-F117 HydrophobicContact CD2-CE1 4Å; F83-F117 AromaticContact CE2-CD1 3.35Å; F83-F117 HydrophobicContact CE2-CD1 3.35Å; F83-F117 AromaticContact CE2-CE1 3.29Å; F83-F117 HydrophobicContact CE2-CE1 3.29Å; F83-F117 AromaticContact CZ-CD1 3.56Å; F83-F117 HydrophobicContact CZ-CD1 3.56Å; F83-F117 AromaticContact CZ-CE1 3.9Å; F83-F117 HydrophobicContact CZ-CE1 3.9Å |
| 84 | S | 90.9 | Very high | 93 | Very high | 27 Ų | 27 | 42.3 Ų | 42.3 | 19% | 0.189 | 24% | 0.241 | C | C | . | . | trans | -79.8 | 159.8 | 165.7 | 59.6 | 0 | 0 | 0 | 0 | 111.2 | E86 E87 | S84-E86 WeakPolarHBondContact CB-OE1 3.27Å; S84-E86 WeakPolarHBondContact CB-OE2 3.48Å; S84-E86 PolarHBondContact O-N 3.24Å; S84-E86 VanDerWaalsContact O-N 3.17Å; S84-E86 WeakPolarHBondContact OG-CG 3.49Å; S84-E86 PolarHBondContact OG-OE1 3.45Å; S84-E86 PolarHBondContact OG-OE2 3.27Å; S84-E87 PolarHBondContact N-OE2 3.19Å; S84-E87 VanDerWaalsContact N-OE2 3.14Å; S84-E87 WeakPolarHBondContact O-CB 3.25Å; S84-E87 PolarHBondContact O-N 3.01Å; S84-E87 VanDerWaalsContact OG-CG 3.27Å; S84-E87 WeakPolarHBondContact OG-CG 3.45Å | ||
| 85 | P | 92.2 | Very high | 93.1 | Very high | 52 Ų | 52 | 43.4 Ų | 43.4 | 34% | 0.338 | 26% | 0.256 | S | S | . | . | G | 310 helix | trans | -54.5 | -35.2 | 180 | -22.1 | 29.9 | 0 | 0 | 0 | 113.6 | E87 I88 L136 | P85-E87 VanDerWaalsContact C-N 3.3Å; P85-E87 PolarHBondContact O-N 3.22Å; P85-I88 PolarHBondContact O-N 2.98Å; P85-L136 HydrophobicContact CB-CD2 3.96Å; P85-L136 HydrophobicContact CG-CD2 3.76Å |
| 86 | E | 93.3 | Very high | 93.2 | Very high | 148 Ų | 148 | 43.2 Ų | 43.2 | 69% | 0.692 | 25% | 0.249 | S | C | * | . | G | 310 helix | trans | -73 | -19 | 178.2 | 64 | -82.9 | -175.9 | 0 | 0 | 114.3 | S84 I88 | S84-E86 WeakPolarHBondContact CB-OE1 3.27Å; S84-E86 WeakPolarHBondContact CB-OE2 3.48Å; S84-E86 PolarHBondContact O-N 3.24Å; S84-E86 VanDerWaalsContact O-N 3.17Å; S84-E86 WeakPolarHBondContact OG-CG 3.49Å; S84-E86 PolarHBondContact OG-OE1 3.45Å; S84-E86 PolarHBondContact OG-OE2 3.27Å; E86-I88 VanDerWaalsContact C-N 3.28Å |
| 87 | E | 94.8 | Very high | 93.4 | Very high | 22 Ų | 22 | 42.3 Ų | 42.3 | 10% | 0.103 | 24% | 0.243 | C | C | . | . | G | 310 helix | trans | -84.4 | -5.8 | 176 | -71 | 170.9 | 177.2 | 0 | 0 | 112.3 | F83 S84 P85 A101 R102 H103 R106 | F83-E87 WeakPolarHBondContact CA-OE2 3.37Å; F83-E87 HydrophobicContact CB-CB 4.14Å; F83-E87 HydrophobicContact CD1-CB 4.14Å; S84-E87 PolarHBondContact N-OE2 3.19Å; S84-E87 VanDerWaalsContact N-OE2 3.14Å; S84-E87 WeakPolarHBondContact O-CB 3.25Å; S84-E87 PolarHBondContact O-N 3.01Å; S84-E87 VanDerWaalsContact OG-CG 3.27Å; S84-E87 WeakPolarHBondContact OG-CG 3.45Å; P85-E87 VanDerWaalsContact C-N 3.3Å; P85-E87 PolarHBondContact O-N 3.22Å; E87-A101 CarbonylContact O-C 3.49Å; E87-A101 VanDerWaalsContact O-CA 3.26Å; E87-A101 WeakPolarHBondContact O-CA 3.46Å; E87-R102 WeakPolarHBondContact CB-O 3.42Å; E87-R102 WeakPolarHBondContact CG-O 3.38Å; E87-R102 PolarHBondContact O-N 3.36Å; E87-H103 IonicContact OE1-CE1 2.74Å; E87-H103 IonicContact OE1-ND1 3.07Å; E87-H103 PolarHBondContact OE1-ND1 3.14Å; E87-H103 IonicContact OE2-CG 3.83Å; E87-H103 IonicContact OE2-ND1 2.71Å; E87-H103 PolarHBondContact OE2-ND1 2.98Å; E87-R106 IonicContact OE1-CZ 3.51Å; E87-R106 IonicContact OE1-NH1 2.76Å; E87-R106 PolarHBondContact OE1-NH1 3.17Å; E87-R106 IonicContact OE1-NH2 2.79Å; E87-R106 PolarHBondContact OE1-NH2 2.91Å |
| 88 | I | 96.1 | Very high | 93.6 | Very high | 13 Ų | 13 | 41 Ų | 41 | 7% | 0.067 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 128 | -175.1 | -58.2 | 161.9 | 0 | 0 | 0 | 110.1 | V7 V80 F83 P85 E86 V90 V99 A101 L136 L142 | V7-I88 HydrophobicContact CG2-CG2 4.1Å; V80-I88 HydrophobicContact CB-CD1 3.99Å; V80-I88 HydrophobicContact CG2-CD1 3.71Å; F83-I88 HydrophobicContact CB-CD1 4Å; F83-I88 HydrophobicContact CB-CG1 3.8Å; F83-I88 HydrophobicContact CG-CG1 4.45Å; P85-I88 PolarHBondContact O-N 2.98Å; E86-I88 VanDerWaalsContact C-N 3.28Å; I88-V90 HydrophobicContact CG2-CG2 4.33Å; I88-V99 HydrophobicContact CG2-CG1 4.48Å; I88-A101 HydrophobicContact CG1-CB 4.09Å; I88-L136 HydrophobicContact CD1-CD2 3.97Å; I88-L142 HydrophobicContact CG2-CD2 3.97Å |
| 89 | S | 97.1 | Very high | 93.8 | Very high | 58 Ų | 58 | 41.1 Ų | 41.1 | 41% | 0.406 | 24% | 0.236 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 128.3 | 173 | -172.9 | 0 | 0 | 0 | 0 | 110.1 | V99 H100 | S89-V99 WeakPolarHBondContact O-CA 3.18Å; S89-H100 PolarHBondContact N-O 2.71Å; S89-H100 PolarHBondContact O-N 2.74Å |
| 90 | V | 97.3 | Very high | 94.1 | Very high | 3 Ų | 3 | 41.6 Ų | 41.6 | 2% | 0.018 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118 | 132.1 | 172.4 | -174.6 | 0 | 0 | 0 | 0 | 108.1 | V5 V7 I88 V97 E98 V99 L142 I144 | V5-V90 HydrophobicContact CB-CB 4.09Å; V5-V90 HydrophobicContact CB-CG1 3.86Å; V5-V90 HydrophobicContact CG1-CG1 4.28Å; V5-V90 HydrophobicContact CG2-CG1 4.34Å; V5-V90 PolarHBondContact N-O 2.76Å; V7-V90 HydrophobicContact CG2-CG2 3.86Å; I88-V90 HydrophobicContact CG2-CG2 4.33Å; V90-V97 HydrophobicContact CG1-CG1 3.99Å; V90-E98 WeakPolarHBondContact CA-O 3.45Å; V90-V99 HydrophobicContact CG1-CG2 4.42Å; V90-V99 HydrophobicContact CG2-CG1 4.35Å; V90-V99 HydrophobicContact CG2-CG2 4.36Å; V90-L142 HydrophobicContact CG2-CD2 3.99Å; V90-I144 HydrophobicContact CG1-CD1 3.93Å; V90-I144 HydrophobicContact CG2-CD1 4.29Å |
| 91 | K | 97 | Very high | 94.3 | Very high | 60 Ų | 60 | 41.6 Ų | 41.6 | 26% | 0.261 | 24% | 0.236 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -146.8 | 154.2 | 179.2 | 63.1 | -175.6 | -167.3 | 170.8 | 0 | 111.9 | E2 I3 V93 V97 E98 | E2-K91 HydrophobicContact CG-CD 4.48Å; E2-K91 VanDerWaalsContact OE1-CD 3.24Å; E2-K91 WeakPolarHBondContact OE1-CD 3.3Å; E2-K91 IonicContact OE1-NZ 3.88Å; E2-K91 PolarHBondContact OE1-NZ 2.75Å; I3-K91 CarbonylContact O-C 3.55Å; I3-K91 WeakPolarHBondContact O-CA 3.25Å; K91-V93 HydrophobicContact CD-CG2 3.93Å; K91-V93 HydrophobicContact CG-CG2 3.98Å; K91-V97 CarbonylContact O-C 3.5Å; K91-V97 WeakPolarHBondContact O-CA 3.39Å; K91-E98 WeakPolarHBondContact CE-OE2 3.39Å; K91-E98 HydrophobicContact CG-CB 3.83Å; K91-E98 PolarHBondContact N-O 3.39Å; K91-E98 IonicContact NZ-OE2 3.75Å; K91-E98 PolarHBondContact O-N 3.44Å |
| 92 | V | 95.9 | Very high | 94.5 | Very high | 4 Ų | 4 | 43.1 Ų | 43.1 | 2% | 0.024 | 24% | 0.24 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 118.6 | 171.6 | -170.8 | 0 | 0 | 0 | 0 | 109 | E2 I3 V5 H96 V97 L123 P129 V132 | E2-V92 WeakPolarHBondContact CA-O 3.37Å; I3-V92 HydrophobicContact CB-CB 4.31Å; I3-V92 PolarHBondContact N-O 2.83Å; I3-V92 PolarHBondContact O-N 2.97Å; V5-V92 HydrophobicContact CG2-CG2 3.77Å; V92-H96 CarbonylContact C-O 3.52Å; V92-H96 VanDerWaalsContact CA-O 3.26Å; V92-H96 WeakPolarHBondContact CA-O 3.2Å; V92-H96 WeakPolarHBondContact CG1-O 3.3Å; V92-V97 HydrophobicContact CG2-CG2 4.39Å; V92-L123 HydrophobicContact CG1-CD1 3.51Å; V92-P129 HydrophobicContact CG1-CB 3.98Å; V92-V132 HydrophobicContact CG2-CB 4.07Å; V92-V132 HydrophobicContact CG2-CG1 4.24Å; V92-V132 HydrophobicContact CG2-CG2 3.99Å |
| 93 | V | 94.8 | Very high | 94.7 | Very high | 41 Ų | 41 | 40.9 Ų | 40.9 | 25% | 0.248 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 122.8 | -178.7 | -177.3 | 0 | 0 | 0 | 0 | 109.2 | E2 K91 G95 H96 | E2-V93 HydrophobicContact CB-CG2 4.17Å; E2-V93 HydrophobicContact CG-CG2 3.86Å; K91-V93 HydrophobicContact CD-CG2 3.93Å; K91-V93 HydrophobicContact CG-CG2 3.98Å; V93-G95 VanDerWaalsContact C-N 3.33Å; V93-G95 PolarHBondContact O-N 2.88Å; V93-H96 PolarHBondContact N-O 2.8Å; V93-H96 WeakPolarHBondContact O-CB 3.39Å; V93-H96 PolarHBondContact O-N 3.12Å |
| 94 | G | 89.4 | Confident | 94.8 | Very high | 66 Ų | 66 | 46 Ų | 46 | 68% | 0.68 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.9 | 43.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | H96 | G94-H96 VanDerWaalsContact C-N 3.27Å; G94-H96 PolarHBondContact O-N 2.8Å; G94-H96 PolarHBondContact O-ND1 3.41Å |
| 95 | G | 90.1 | Very high | 94.9 | Very high | 37 Ų | 37 | 51.4 Ų | 51.4 | 38% | 0.381 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | 13.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | V93 L123 | V93-G95 VanDerWaalsContact C-N 3.33Å; V93-G95 PolarHBondContact O-N 2.88Å; G95-L123 WeakPolarHBondContact O-CB 3.26Å; G95-L123 PolarHBondContact O-N 2.87Å |
| 96 | H | 94.1 | Very high | 94.8 | Very high | 48 Ų | 48 | 54.1 Ų | 54.1 | 22% | 0.222 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 144.8 | 175.3 | -60.9 | 74.1 | 0 | 0 | 0 | 111.2 | V92 V93 G94 R120 Y121 | V92-H96 CarbonylContact C-O 3.52Å; V92-H96 VanDerWaalsContact CA-O 3.26Å; V92-H96 WeakPolarHBondContact CA-O 3.2Å; V92-H96 WeakPolarHBondContact CG1-O 3.3Å; V93-H96 PolarHBondContact N-O 2.8Å; V93-H96 WeakPolarHBondContact O-CB 3.39Å; V93-H96 PolarHBondContact O-N 3.12Å; G94-H96 VanDerWaalsContact C-N 3.27Å; G94-H96 PolarHBondContact O-N 2.8Å; G94-H96 PolarHBondContact O-ND1 3.41Å; H96-R120 HydrophobicContact CB-CG 3.53Å; H96-Y121 CarbonylContact C-O 3.55Å; H96-Y121 WeakPolarHBondContact CA-O 3.18Å; H96-Y121 WeakPolarHBondContact CB-O 3.39Å |
| 97 | V | 95.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86 | 118.1 | 162.3 | -178.8 | 0 | 0 | 0 | 0 | 107.9 | F74 V90 K91 V92 V99 R120 Y121 L123 V132 I144 | F74-V97 HydrophobicContact CE1-CB 4.37Å; F74-V97 HydrophobicContact CE1-CG2 3.68Å; F74-V97 HydrophobicContact CZ-CB 4.11Å; F74-V97 HydrophobicContact CZ-CG2 3.71Å; V90-V97 HydrophobicContact CG1-CG1 3.99Å; K91-V97 CarbonylContact O-C 3.5Å; K91-V97 WeakPolarHBondContact O-CA 3.39Å; V92-V97 HydrophobicContact CG2-CG2 4.39Å; V97-V99 HydrophobicContact CG1-CG2 4.39Å; V97-R120 CarbonylContact O-C 3.6Å; V97-R120 WeakPolarHBondContact O-CA 3.35Å; V97-Y121 PolarHBondContact N-O 3.25Å; V97-Y121 PolarHBondContact O-N 2.92Å; V97-L123 HydrophobicContact CG2-CD1 4.29Å; V97-L123 HydrophobicContact CG2-CD2 3.64Å; V97-L123 HydrophobicContact CG2-CG 3.9Å; V97-V132 HydrophobicContact CG2-CG1 4.32Å; V97-I144 HydrophobicContact CG1-CD1 4.06Å; V97-I144 HydrophobicContact CG1-CG2 4.1Å |
| 98 | E | 96.7 | Very high | 94.3 | Very high | 48 Ų | 48 | 53.9 Ų | 53.9 | 22% | 0.224 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.4 | 130.8 | 174.1 | -69.2 | -178.9 | 175.7 | 0 | 0 | 109.5 | V90 K91 R119 R120 | V90-E98 WeakPolarHBondContact CA-O 3.45Å; K91-E98 WeakPolarHBondContact CE-OE2 3.39Å; K91-E98 HydrophobicContact CG-CB 3.83Å; K91-E98 PolarHBondContact N-O 3.39Å; K91-E98 IonicContact NZ-OE2 3.75Å; K91-E98 PolarHBondContact O-N 3.44Å; E98-R119 CarbonylContact C-O 3.6Å; E98-R119 WeakPolarHBondContact CA-O 3.48Å; E98-R120 HydrophobicContact CG-CB 4.25Å; E98-R120 HydrophobicContact CG-CG 3.68Å; E98-R120 VanDerWaalsContact OE1-CD 3.25Å; E98-R120 WeakPolarHBondContact OE1-CD 3.32Å; E98-R120 IonicContact OE1-NH1 3.98Å |
| 99 | V | 97 | Very high | 93.9 | Very high | 3 Ų | 3 | 61.6 Ų | 61.6 | 2% | 0.018 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.2 | 121.1 | 175 | -173.7 | 0 | 0 | 0 | 0 | 107.6 | L78 I88 S89 V90 V97 F117 H118 R119 L142 I144 | L78-V99 HydrophobicContact CD1-CB 4.2Å; L78-V99 HydrophobicContact CD1-CG1 3.99Å; L78-V99 HydrophobicContact CD1-CG2 3.84Å; I88-V99 HydrophobicContact CG2-CG1 4.48Å; S89-V99 WeakPolarHBondContact O-CA 3.18Å; V90-V99 HydrophobicContact CG1-CG2 4.42Å; V90-V99 HydrophobicContact CG2-CG1 4.35Å; V90-V99 HydrophobicContact CG2-CG2 4.36Å; V97-V99 HydrophobicContact CG1-CG2 4.39Å; V99-F117 HydrophobicContact CB-CE2 4.2Å; V99-F117 HydrophobicContact CG1-CE2 3.7Å; V99-F117 HydrophobicContact CG1-CZ 3.95Å; V99-H118 CarbonylContact O-C 3.54Å; V99-H118 WeakPolarHBondContact O-CA 3.47Å; V99-R119 HydrophobicContact CB-CB 4.45Å; V99-R119 PolarHBondContact N-O 3.31Å; V99-R119 PolarHBondContact O-N 3.06Å; V99-L142 HydrophobicContact CG1-CD2 3.98Å; V99-I144 HydrophobicContact CG2-CD1 3.41Å; V99-I144 VanDerWaalsContact CG2-CD1 3.41Å |
| 100 | H | 97.5 | Very high | 93.4 | Very high | 60 Ų | 60 | 66.1 Ų | 66.1 | 28% | 0.278 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 127.1 | 173.6 | 177.7 | -142 | 0 | 0 | 0 | 108.2 | S89 E116 F117 H118 | S89-H100 PolarHBondContact N-O 2.71Å; S89-H100 PolarHBondContact O-N 2.74Å; H100-E116 IonicContact CD2-OE1 3.67Å; H100-E116 IonicContact CE1-OE1 3.4Å; H100-E116 IonicContact NE2-OE1 2.87Å; H100-E116 PolarHBondContact NE2-OE1 2.72Å; H100-F117 WeakPolarHBondContact CA-O 3.21Å; H100-F117 PolarHBondContact CD2-O 3.2Å; H100-H118 AromaticContact CD2-CD2 3.86Å; H100-H118 AromaticContact CD2-CE1 2.92Å; H100-H118 PolarHBondContact CD2-CE1 2.96Å; H100-H118 AromaticContact CD2-CG 3.9Å; H100-H118 AromaticContact CD2-ND1 3.35Å; H100-H118 PolarHBondContact CD2-ND1 2.92Å; H100-H118 VanDerWaalsContact CD2-ND1 3.35Å; H100-H118 AromaticContact CD2-NE2 3.24Å; H100-H118 PolarHBondContact CD2-NE2 2.8Å; H100-H118 AromaticContact CE1-CE1 3.9Å; H100-H118 AromaticContact CG-CE1 3.65Å; H100-H118 AromaticContact CG-ND1 3.89Å; H100-H118 AromaticContact NE2-CE1 3.1Å; H100-H118 PolarHBondContact NE2-CE1 2.85Å; H100-H118 AromaticContact NE2-ND1 3.99Å; H100-H118 AromaticContact NE2-NE2 3.24Å; H100-H118 PolarHBondContact NE2-NE2 3.39Å |
| 101 | A | 96.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 67.6 Ų | 67.6 | 0% | 0 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 128.3 | 173 | 0 | 0 | 0 | 0 | 0 | 109.2 | F83 E87 I88 E116 F117 | F83-A101 HydrophobicContact CD1-CB 3.8Å; F83-A101 HydrophobicContact CD2-CB 3.77Å; F83-A101 HydrophobicContact CE1-CB 3.62Å; F83-A101 WeakPolarHBondContact CE1-O 3.46Å; F83-A101 HydrophobicContact CE2-CB 3.56Å; F83-A101 HydrophobicContact CG-CB 3.82Å; F83-A101 HydrophobicContact CZ-CB 3.42Å; F83-A101 VanDerWaalsContact CZ-CB 3.42Å; F83-A101 WeakPolarHBondContact CZ-O 3.27Å; E87-A101 CarbonylContact O-C 3.49Å; E87-A101 VanDerWaalsContact O-CA 3.26Å; E87-A101 WeakPolarHBondContact O-CA 3.46Å; I88-A101 HydrophobicContact CG1-CB 4.09Å; A101-E116 CarbonylContact O-C 3.57Å; A101-E116 VanDerWaalsContact O-CA 3.25Å; A101-E116 WeakPolarHBondContact O-CA 3.43Å; A101-F117 HydrophobicContact CB-CD1 3.75Å; A101-F117 HydrophobicContact CB-CE1 3.34Å; A101-F117 HydrophobicContact CB-CE2 4.32Å; A101-F117 HydrophobicContact CB-CG 4.4Å; A101-F117 HydrophobicContact CB-CZ 3.65Å; A101-F117 PolarHBondContact N-O 2.78Å; A101-F117 PolarHBondContact O-N 3.15Å |
| 102 | R | 96.3 | Very high | 92.8 | Very high | 130 Ų | 130 | 72.6 Ų | 72.6 | 49% | 0.491 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.7 | 116.6 | -175.4 | -174.6 | 176.7 | 176.2 | -165.6 | -4.8 | 111.7 | E87 E116 | E87-R102 WeakPolarHBondContact CB-O 3.42Å; E87-R102 WeakPolarHBondContact CG-O 3.38Å; E87-R102 PolarHBondContact O-N 3.36Å; R102-E116 HydrophobicContact CB-CG 4.12Å; R102-E116 HydrophobicContact CG-CB 4.36Å; R102-E116 HydrophobicContact CG-CG 4.12Å; R102-E116 IonicContact NE-OE2 2.72Å |
| 103 | H | 94.3 | Very high | 92.4 | Very high | 24 Ų | 24 | 74.6 Ų | 74.6 | 11% | 0.111 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 115 | 172.6 | -172.5 | 82.9 | 0 | 0 | 0 | 108.3 | F83 E87 R106 A114 R115 | F83-H103 HydrophobicContact CD1-CB 3.85Å; F83-H103 HydrophobicContact CE1-CB 3.88Å; E87-H103 IonicContact OE1-CE1 2.74Å; E87-H103 IonicContact OE1-ND1 3.07Å; E87-H103 PolarHBondContact OE1-ND1 3.14Å; E87-H103 IonicContact OE2-CG 3.83Å; E87-H103 IonicContact OE2-ND1 2.71Å; E87-H103 PolarHBondContact OE2-ND1 2.98Å; H103-R106 PolarHBondContact CE1-NH1 3.49Å; H103-R106 VanDerWaalsContact CE1-NH1 3.31Å; H103-A114 WeakPolarHBondContact O-CA 3.27Å; H103-R115 HydrophobicContact CB-CB 4.12Å; H103-R115 PolarHBondContact N-O 2.87Å; H103-R115 PolarHBondContact O-N 3.3Å |
| 104 | E | 94 | Very high | 92.4 | Very high | 122 Ų | 122 | 75.5 Ų | 75.5 | 57% | 0.57 | 40% | 0.395 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.1 | 166.3 | 175.6 | -63.2 | -167.7 | 153.7 | 0 | 0 | 111.7 | R106 | E104-R106 PolarHBondContact O-N 3.17Å; E104-R106 VanDerWaalsContact O-N 3.12Å |
| 105 | E | 94.3 | Very high | 92.5 | Very high | 141 Ų | 141 | 75.6 Ų | 75.6 | 66% | 0.659 | 38% | 0.375 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -61.1 | 116.5 | 178.5 | -170.8 | 175.4 | 108 | 0 | 0 | 110.8 | Y112 I113 A114 | E105-Y112 HydrophobicContact CG-CD1 4.23Å; E105-Y112 HydrophobicContact CG-CG 4.39Å; E105-I113 WeakPolarHBondContact CA-O 3.37Å; E105-A114 HydrophobicContact CB-CB 4.2Å |
| 106 | R | 89.8 | Confident | 92.7 | Very high | 108 Ų | 108 | 78.2 Ų | 78.2 | 41% | 0.408 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 149.1 | 176.3 | -67.4 | -173.6 | -173.2 | 144 | 13.3 | 110.8 | E87 H103 E104 D108 Y112 I113 | E87-R106 IonicContact OE1-CZ 3.51Å; E87-R106 IonicContact OE1-NH1 2.76Å; E87-R106 PolarHBondContact OE1-NH1 3.17Å; E87-R106 IonicContact OE1-NH2 2.79Å; E87-R106 PolarHBondContact OE1-NH2 2.91Å; H103-R106 PolarHBondContact CE1-NH1 3.49Å; H103-R106 VanDerWaalsContact CE1-NH1 3.31Å; E104-R106 PolarHBondContact O-N 3.17Å; E104-R106 VanDerWaalsContact O-N 3.12Å; R106-D108 PolarHBondContact O-N 2.86Å; R106-Y112 CarbonylContact O-C 3.48Å; R106-Y112 WeakPolarHBondContact O-CA 3.29Å; R106-I113 PolarHBondContact N-O 3.3Å; R106-I113 PolarHBondContact O-N 3.31Å |
| 107 | P | 90.4 | Very high | 92.7 | Very high | 100 Ų | 100 | 76.6 Ų | 76.6 | 65% | 0.649 | 37% | 0.37 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -63.3 | 136.5 | 174.5 | 26.3 | -32.8 | 0 | 0 | 0 | 110.6 | G111 Y112 | P107-G111 CarbonylContact C-O 3.53Å; P107-G111 VanDerWaalsContact CA-O 3.25Å; P107-G111 WeakPolarHBondContact CA-O 3.35Å; P107-Y112 HydrophobicContact CB-CD1 4.26Å; P107-Y112 HydrophobicContact CB-CE1 4.11Å |
| 108 | D | 86.4 | Confident | 92.7 | Very high | 65 Ų | 65 | 82.7 Ų | 82.7 | 35% | 0.348 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | -172.5 | 173 | 78.3 | 3.6 | 0 | 0 | 0 | 111.1 | R106 H110 G111 I113 | R106-D108 PolarHBondContact O-N 2.86Å; D108-H110 PolarHBondContact O-N 2.85Å; D108-H110 PolarHBondContact OD1-N 3.36Å; D108-G111 PolarHBondContact N-O 3.22Å; D108-G111 PolarHBondContact OD1-N 3.11Å; D108-I113 HydrophobicContact CB-CG2 3.83Å; D108-I113 WeakPolarHBondContact OD2-CG2 3.45Å |
| 109 | E | 87.4 | Confident | 92.5 | Very high | 175 Ų | 175 | 82.8 Ų | 82.8 | 82% | 0.818 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -27.3 | -178.9 | -175.4 | -179.9 | -178 | 0 | 0 | 113.6 | ||
| 110 | H | 86.8 | Confident | 92.4 | Very high | 153 Ų | 153 | 90.4 Ų | 90.4 | 71% | 0.708 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.2 | 3.1 | -170.4 | -59 | 92.2 | 0 | 0 | 0 | 113.8 | D108 | D108-H110 PolarHBondContact O-N 2.85Å; D108-H110 PolarHBondContact OD1-N 3.36Å |
| 111 | G | 90.5 | Very high | 92.2 | Very high | 34 Ų | 34 | 89.8 Ų | 89.8 | 35% | 0.351 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 150 | -123.2 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | P107 D108 | P107-G111 CarbonylContact C-O 3.53Å; P107-G111 VanDerWaalsContact CA-O 3.25Å; P107-G111 WeakPolarHBondContact CA-O 3.35Å; D108-G111 PolarHBondContact N-O 3.22Å; D108-G111 PolarHBondContact OD1-N 3.11Å |
| 112 | Y | 90.4 | Very high | 92.1 | Very high | 165 Ų | 165 | 95.7 Ų | 95.7 | 65% | 0.647 | 45% | 0.451 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 144 | 178.7 | -66.9 | -95 | 0 | 0 | 0 | 109.4 | E105 R106 P107 | E105-Y112 HydrophobicContact CG-CD1 4.23Å; E105-Y112 HydrophobicContact CG-CG 4.39Å; R106-Y112 CarbonylContact O-C 3.48Å; R106-Y112 WeakPolarHBondContact O-CA 3.29Å; P107-Y112 HydrophobicContact CB-CD1 4.26Å; P107-Y112 HydrophobicContact CB-CE1 4.11Å |
| 113 | I | 89.6 | Confident | 91.8 | Very high | 46 Ų | 46 | 90.3 Ų | 90.3 | 24% | 0.236 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 133.9 | -179.5 | -164.8 | 142.9 | 0 | 0 | 0 | 112.1 | E105 R106 D108 R115 | E105-I113 WeakPolarHBondContact CA-O 3.37Å; R106-I113 PolarHBondContact N-O 3.3Å; R106-I113 PolarHBondContact O-N 3.31Å; D108-I113 HydrophobicContact CB-CG2 3.83Å; D108-I113 WeakPolarHBondContact OD2-CG2 3.45Å; I113-R115 HydrophobicContact CG1-CG 4.2Å; I113-R115 VanDerWaalsContact CG2-NH1 3.29Å |
| 114 | A | 92.8 | Very high | 91.5 | Very high | 61 Ų | 61 | 90.4 Ų | 90.4 | 50% | 0.504 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 145.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | H103 E105 | H103-A114 WeakPolarHBondContact O-CA 3.27Å; E105-A114 HydrophobicContact CB-CB 4.2Å |
| 115 | R | 92.1 | Very high | 91 | Very high | 67 Ų | 67 | 90.6 Ų | 90.6 | 25% | 0.253 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 140.9 | 179 | -58.5 | -178.8 | -179.8 | 80.3 | -3 | 110.1 | F33 F83 H103 I113 | F33-R115 HydrophobicContact CE1-CB 4.43Å; F33-R115 HydrophobicContact CZ-CB 3.96Å; F83-R115 HydrophobicContact CE1-CB 4.33Å; F83-R115 HydrophobicContact CZ-CB 4.34Å; H103-R115 HydrophobicContact CB-CB 4.12Å; H103-R115 PolarHBondContact N-O 2.87Å; H103-R115 PolarHBondContact O-N 3.3Å; I113-R115 HydrophobicContact CG1-CG 4.2Å; I113-R115 VanDerWaalsContact CG2-NH1 3.29Å |
| 116 | E | 95.2 | Very high | 90.5 | Very high | 92 Ų | 92 | 87 Ų | 87 | 43% | 0.43 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.7 | 136.6 | 175.1 | -173.8 | 170.4 | 179.8 | 0 | 0 | 109.9 | H100 A101 R102 H118 | H100-E116 IonicContact CD2-OE1 3.67Å; H100-E116 IonicContact CE1-OE1 3.4Å; H100-E116 IonicContact NE2-OE1 2.87Å; H100-E116 PolarHBondContact NE2-OE1 2.72Å; A101-E116 CarbonylContact O-C 3.57Å; A101-E116 VanDerWaalsContact O-CA 3.25Å; A101-E116 WeakPolarHBondContact O-CA 3.43Å; R102-E116 HydrophobicContact CB-CG 4.12Å; R102-E116 HydrophobicContact CG-CB 4.36Å; R102-E116 HydrophobicContact CG-CG 4.12Å; R102-E116 IonicContact NE-OE2 2.72Å; E116-H118 IonicContact OE1-CD2 3.56Å; E116-H118 IonicContact OE1-CE1 2.77Å; E116-H118 IonicContact OE1-NE2 2.91Å; E116-H118 PolarHBondContact OE1-NE2 2.76Å |
| 117 | F | 93.7 | Very high | 90.3 | Very high | 14 Ų | 14 | 82.5 Ų | 82.5 | 6% | 0.061 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 151.9 | 167.4 | 79.3 | -103.8 | 0 | 0 | 0 | 112.4 | F33 V80 F83 V99 H100 A101 R119 | F33-F117 HydrophobicContact CD1-CB 3.84Å; F33-F117 AromaticContact CD1-CD1 3.98Å; F33-F117 HydrophobicContact CD1-CD1 3.98Å; F33-F117 HydrophobicContact CD1-CG 4.32Å; F33-F117 HydrophobicContact CE1-CB 3.66Å; F33-F117 AromaticContact CE1-CD1 3.48Å; F33-F117 HydrophobicContact CE1-CD1 3.48Å; F33-F117 VanDerWaalsContact CE1-CD1 3.48Å; F33-F117 HydrophobicContact CE1-CG 4.04Å; F33-F117 HydrophobicContact CE2-CD1 4.27Å; F33-F117 AromaticContact CZ-CD1 3.75Å; F33-F117 HydrophobicContact CZ-CD1 3.75Å; V80-F117 HydrophobicContact CG1-CE1 3.84Å; V80-F117 HydrophobicContact CG1-CZ 3.7Å; F83-F117 HydrophobicContact CD2-CD1 4.44Å; F83-F117 HydrophobicContact CD2-CE1 4Å; F83-F117 AromaticContact CE2-CD1 3.35Å; F83-F117 HydrophobicContact CE2-CD1 3.35Å; F83-F117 AromaticContact CE2-CE1 3.29Å; F83-F117 HydrophobicContact CE2-CE1 3.29Å; F83-F117 AromaticContact CZ-CD1 3.56Å; F83-F117 HydrophobicContact CZ-CD1 3.56Å; F83-F117 AromaticContact CZ-CE1 3.9Å; F83-F117 HydrophobicContact CZ-CE1 3.9Å; V99-F117 HydrophobicContact CB-CE2 4.2Å; V99-F117 HydrophobicContact CG1-CE2 3.7Å; V99-F117 HydrophobicContact CG1-CZ 3.95Å; H100-F117 WeakPolarHBondContact CA-O 3.21Å; H100-F117 PolarHBondContact CD2-O 3.2Å; A101-F117 HydrophobicContact CB-CD1 3.75Å; A101-F117 HydrophobicContact CB-CE1 3.34Å; A101-F117 HydrophobicContact CB-CE2 4.32Å; A101-F117 HydrophobicContact CB-CG 4.4Å; A101-F117 HydrophobicContact CB-CZ 3.65Å; A101-F117 PolarHBondContact N-O 2.78Å; A101-F117 PolarHBondContact O-N 3.15Å; F117-R119 HydrophobicContact CD2-CB 4.33Å; F117-R119 HydrophobicContact CD2-CG 3.8Å; F117-R119 HydrophobicContact CE2-CB 4.34Å; F117-R119 HydrophobicContact CE2-CG 4.09Å |
| 118 | H | 94.8 | Very high | 90.2 | Very high | 128 Ų | 128 | 81.3 Ų | 81.3 | 59% | 0.593 | 42% | 0.42 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129 | 121.7 | 174.6 | -65.6 | -99.5 | 0 | 0 | 0 | 108.6 | V99 H100 E116 | V99-H118 CarbonylContact O-C 3.54Å; V99-H118 WeakPolarHBondContact O-CA 3.47Å; H100-H118 AromaticContact CD2-CD2 3.86Å; H100-H118 AromaticContact CD2-CE1 2.92Å; H100-H118 PolarHBondContact CD2-CE1 2.96Å; H100-H118 AromaticContact CD2-CG 3.9Å; H100-H118 AromaticContact CD2-ND1 3.35Å; H100-H118 PolarHBondContact CD2-ND1 2.92Å; H100-H118 VanDerWaalsContact CD2-ND1 3.35Å; H100-H118 AromaticContact CD2-NE2 3.24Å; H100-H118 PolarHBondContact CD2-NE2 2.8Å; H100-H118 AromaticContact CE1-CE1 3.9Å; H100-H118 AromaticContact CG-CE1 3.65Å; H100-H118 AromaticContact CG-ND1 3.89Å; H100-H118 AromaticContact NE2-CE1 3.1Å; H100-H118 PolarHBondContact NE2-CE1 2.85Å; H100-H118 AromaticContact NE2-ND1 3.99Å; H100-H118 AromaticContact NE2-NE2 3.24Å; H100-H118 PolarHBondContact NE2-NE2 3.39Å; E116-H118 IonicContact OE1-CD2 3.56Å; E116-H118 IonicContact OE1-CE1 2.77Å; E116-H118 IonicContact OE1-NE2 2.91Å; E116-H118 PolarHBondContact OE1-NE2 2.76Å |
| 119 | R | 93.8 | Very high | 90.4 | Very high | 50 Ų | 50 | 80.5 Ų | 80.5 | 19% | 0.189 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 139.8 | 177.8 | -74.4 | -177.5 | 129.7 | -156.9 | -22.3 | 110.6 | G34 E35 E98 V99 F117 Y121 | G34-R119 PolarHBondContact O-NE 2.77Å; G34-R119 PolarHBondContact O-NH1 3.1Å; G34-R119 PolarHBondContact O-NH2 2.92Å; E35-R119 VanDerWaalsContact C-NH2 3.32Å; E35-R119 PolarHBondContact O-NH1 2.96Å; E98-R119 CarbonylContact C-O 3.6Å; E98-R119 WeakPolarHBondContact CA-O 3.48Å; V99-R119 HydrophobicContact CB-CB 4.45Å; V99-R119 PolarHBondContact N-O 3.31Å; V99-R119 PolarHBondContact O-N 3.06Å; F117-R119 HydrophobicContact CD2-CB 4.33Å; F117-R119 HydrophobicContact CD2-CG 3.8Å; F117-R119 HydrophobicContact CE2-CB 4.34Å; F117-R119 HydrophobicContact CE2-CG 4.09Å; R119-Y121 HydrophobicContact CB-CE2 3.91Å; R119-Y121 WeakPolarHBondContact CD-OH 3.37Å; R119-Y121 PolarHBondContact NE-OH 3.17Å; R119-Y121 PolarHBondContact NH1-OH 2.92Å; R119-Y121 VanDerWaalsContact NH1-OH 3.16Å |
| 120 | R | 94.8 | Very high | 90.5 | Very high | 163 Ų | 163 | 75.5 Ų | 75.5 | 62% | 0.615 | 41% | 0.407 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 127 | -179.6 | -168.5 | 170.2 | 72.4 | -179.7 | 2.4 | 110.6 | H96 V97 E98 | H96-R120 HydrophobicContact CB-CG 3.53Å; V97-R120 CarbonylContact O-C 3.6Å; V97-R120 WeakPolarHBondContact O-CA 3.35Å; E98-R120 HydrophobicContact CG-CB 4.25Å; E98-R120 HydrophobicContact CG-CG 3.68Å; E98-R120 VanDerWaalsContact OE1-CD 3.25Å; E98-R120 WeakPolarHBondContact OE1-CD 3.32Å; E98-R120 IonicContact OE1-NH1 3.98Å |
| 121 | Y | 93.6 | Very high | 90.6 | Very high | 47 Ų | 47 | 69.4 Ų | 69.4 | 18% | 0.184 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 130.5 | -179.6 | -61.2 | -79.3 | 0 | 0 | 0 | 109.9 | F74 V76 L78 H96 V97 R119 | F74-Y121 HydrophobicContact CZ-CG 4.38Å; V76-Y121 HydrophobicContact CG1-CD1 4.48Å; V76-Y121 HydrophobicContact CG1-CD2 4.38Å; V76-Y121 HydrophobicContact CG1-CE1 3.97Å; V76-Y121 HydrophobicContact CG1-CE2 3.87Å; V76-Y121 HydrophobicContact CG2-CD1 4.07Å; V76-Y121 HydrophobicContact CG2-CD2 4.44Å; V76-Y121 HydrophobicContact CG2-CE1 4.33Å; V76-Y121 HydrophobicContact CG2-CG 4.14Å; L78-Y121 HydrophobicContact CD1-CE2 4.44Å; L78-Y121 HydrophobicContact CD2-CE2 4.47Å; L78-Y121 VanDerWaalsContact CD2-OH 3.3Å; L78-Y121 WeakPolarHBondContact CD2-OH 3.36Å; H96-Y121 CarbonylContact C-O 3.55Å; H96-Y121 WeakPolarHBondContact CA-O 3.18Å; H96-Y121 WeakPolarHBondContact CB-O 3.39Å; V97-Y121 PolarHBondContact N-O 3.25Å; V97-Y121 PolarHBondContact O-N 2.92Å; R119-Y121 HydrophobicContact CB-CE2 3.91Å; R119-Y121 WeakPolarHBondContact CD-OH 3.37Å; R119-Y121 PolarHBondContact NE-OH 3.17Å; R119-Y121 PolarHBondContact NH1-OH 2.92Å; R119-Y121 VanDerWaalsContact NH1-OH 3.16Å |
| 122 | L | 92.3 | Very high | 90.7 | Very high | 125 Ų | 125 | 68.3 Ų | 68.3 | 65% | 0.654 | 37% | 0.37 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 130 | 172.7 | -176 | 68 | 0 | 0 | 0 | 109.4 | ||
| 123 | L | 90.6 | Very high | 90.9 | Very high | 16 Ų | 16 | 64.4 Ų | 64.4 | 8% | 0.084 | 36% | 0.363 | C | S | . | . | P | Polyproline II helix | trans | -75.1 | 132.5 | 171.7 | -76.7 | 168.3 | 0 | 0 | 0 | 110 | F74 V92 G95 V97 V127 V132 | F74-L123 HydrophobicContact CB-CD2 4.45Å; F74-L123 HydrophobicContact CD1-CD2 4.12Å; F74-L123 HydrophobicContact CD2-CD2 4.08Å; F74-L123 HydrophobicContact CE1-CD2 4.38Å; F74-L123 HydrophobicContact CE2-CD2 4.31Å; F74-L123 HydrophobicContact CG-CD2 3.96Å; F74-L123 HydrophobicContact CZ-CD2 4.46Å; V92-L123 HydrophobicContact CG1-CD1 3.51Å; G95-L123 WeakPolarHBondContact O-CB 3.26Å; G95-L123 PolarHBondContact O-N 2.87Å; V97-L123 HydrophobicContact CG2-CD1 4.29Å; V97-L123 HydrophobicContact CG2-CD2 3.64Å; V97-L123 HydrophobicContact CG2-CG 3.9Å; L123-V127 HydrophobicContact CD2-CG1 4.02Å; L123-V132 HydrophobicContact CD1-CG2 4.46Å; L123-V132 HydrophobicContact CD2-CG2 4.1Å |
| 124 | P | 89.4 | Confident | 91.1 | Very high | 27 Ų | 27 | 62.4 Ų | 62.4 | 18% | 0.175 | 35% | 0.354 | C | S | . | . | P | Polyproline II helix | trans | -58.1 | 149.1 | 171.8 | -23.8 | 32.8 | 0 | 0 | 0 | 112 | A69 F74 G126 V127 | A69-P124 HydrophobicContact CB-CG 4.32Å; F74-P124 HydrophobicContact CD2-CG 4.35Å; P124-G126 PolarHBondContact O-N 3.19Å; P124-V127 HydrophobicContact CB-CG2 4.09Å; P124-V127 HydrophobicContact CG-CG2 4.31Å; P124-V127 PolarHBondContact O-N 3.29Å |
| 125 | P | 83.5 | Confident | 91.2 | Very high | 125 Ų | 125 | 60.8 Ų | 60.8 | 81% | 0.812 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | 135.7 | 173.8 | 26.7 | -33.6 | 0 | 0 | 0 | 110.5 | ||
| 126 | G | 82.3 | Confident | 91.3 | Very high | 67 Ų | 67 | 58.3 Ų | 58.3 | 69% | 0.691 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.4 | -5.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | P124 | P124-G126 PolarHBondContact O-N 3.19Š|
| 127 | V | 86 | Confident | 91.1 | Very high | 12 Ų | 12 | 55.2 Ų | 55.2 | 7% | 0.073 | 32% | 0.32 | C | S | . | . | trans | -78.6 | 126.8 | 167.8 | 176.1 | 0 | 0 | 0 | 0 | 109.2 | F74 L123 P124 P129 A146 | F74-V127 HydrophobicContact CB-CG2 4.38Å; L123-V127 HydrophobicContact CD2-CG1 4.02Å; P124-V127 HydrophobicContact CB-CG2 4.09Å; P124-V127 HydrophobicContact CG-CG2 4.31Å; P124-V127 PolarHBondContact O-N 3.29Å; V127-P129 WeakPolarHBondContact O-CD 3.43Å; V127-A146 HydrophobicContact CG1-CB 3.35Å | ||
| 128 | D | 87.9 | Confident | 90.8 | Very high | 75 Ų | 75 | 58.9 Ų | 58.9 | 40% | 0.401 | 35% | 0.346 | S | S | . | . | trans | -73 | 121.1 | 172.6 | 179.2 | 9.1 | 0 | 0 | 0 | 109.9 | A130 A131 | D128-A130 PolarHBondContact O-N 2.72Å; D128-A130 VanDerWaalsContact O-N 3.14Å; D128-A130 PolarHBondContact OD1-N 3.46Å; D128-A131 HydrophobicContact CB-CB 3.97Å; D128-A131 WeakPolarHBondContact O-CB 3.48Å; D128-A131 PolarHBondContact O-N 2.61Å | ||
| 129 | P | 90.9 | Very high | 90.6 | Very high | 49 Ų | 49 | 59.3 Ų | 59.3 | 32% | 0.318 | 35% | 0.348 | S | S | . | . | G | 310 helix | trans | -52.2 | -31.5 | 173.3 | -29.9 | 38.6 | 0 | 0 | 0 | 114.3 | I3 V92 V127 A131 V132 | I3-P129 HydrophobicContact CD1-CB 3.74Å; V92-P129 HydrophobicContact CG1-CB 3.98Å; V127-P129 WeakPolarHBondContact O-CD 3.43Å; P129-A131 VanDerWaalsContact C-N 3.32Å; P129-V132 WeakPolarHBondContact O-CG2 3.25Å |
| 130 | A | 89.9 | Confident | 90.4 | Very high | 70 Ų | 70 | 57.4 Ų | 57.4 | 58% | 0.579 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -77.7 | -17.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | D128 V132 | D128-A130 PolarHBondContact O-N 2.72Å; D128-A130 VanDerWaalsContact O-N 3.14Å; D128-A130 PolarHBondContact OD1-N 3.46Å; A130-V132 VanDerWaalsContact C-N 3.3Å |
| 131 | A | 89.2 | Confident | 90.3 | Very high | 25 Ų | 25 | 51.6 Ų | 51.6 | 21% | 0.207 | 33% | 0.326 | C | S | . | . | G | 310 helix | trans | -85.6 | -1.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | D128 P129 T133 | D128-A131 HydrophobicContact CB-CB 3.97Å; D128-A131 WeakPolarHBondContact O-CB 3.48Å; D128-A131 PolarHBondContact O-N 2.61Å; P129-A131 VanDerWaalsContact C-N 3.32Å; A131-T133 PolarHBondContact O-N 2.95Å |
| 132 | V | 92.7 | Very high | 90.3 | Very high | 10 Ų | 10 | 49.4 Ų | 49.4 | 6% | 0.061 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 126.3 | 176.1 | -177.7 | 0 | 0 | 0 | 0 | 109.6 | V5 V92 V97 L123 P129 A130 I144 Q145 A146 | V5-V132 HydrophobicContact CG1-CG1 4.36Å; V5-V132 HydrophobicContact CG2-CB 4.33Å; V5-V132 HydrophobicContact CG2-CG1 4.08Å; V92-V132 HydrophobicContact CG2-CB 4.07Å; V92-V132 HydrophobicContact CG2-CG1 4.24Å; V92-V132 HydrophobicContact CG2-CG2 3.99Å; V97-V132 HydrophobicContact CG2-CG1 4.32Å; L123-V132 HydrophobicContact CD1-CG2 4.46Å; L123-V132 HydrophobicContact CD2-CG2 4.1Å; P129-V132 WeakPolarHBondContact O-CG2 3.25Å; A130-V132 VanDerWaalsContact C-N 3.3Å; V132-I144 HydrophobicContact CG1-CG2 3.72Å; V132-Q145 WeakPolarHBondContact CA-O 3.39Å; V132-A146 HydrophobicContact CG2-CB 4.01Å |
| 133 | T | 93.7 | Very high | 90.4 | Very high | 83 Ų | 83 | 44.9 Ų | 44.9 | 51% | 0.509 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 155 | 177.5 | 59.7 | 0 | 0 | 0 | 0 | 110 | A131 I144 Q145 | A131-T133 PolarHBondContact O-N 2.95Å; T133-I144 WeakPolarHBondContact O-CA 3.31Å; T133-Q145 PolarHBondContact N-O 3.15Å; T133-Q145 PolarHBondContact O-N 3.43Å; T133-Q145 PolarHBondContact OG1-O 3.06Å |
| 134 | S | 94.8 | Very high | 90.5 | Very high | 5 Ų | 5 | 44.1 Ų | 44.1 | 4% | 0.035 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.9 | 144.7 | 176.4 | 76.9 | 0 | 0 | 0 | 0 | 112.3 | P6 V7 Q8 S143 | P6-S134 PolarHBondContact O-OG 3.34Å; V7-S134 WeakPolarHBondContact CA-OG 3.49Å; Q8-S134 WeakPolarHBondContact CB-O 3.35Å; Q8-S134 PolarHBondContact N-O 2.88Å; Q8-S134 VanDerWaalsContact N-O 3.11Å; S134-S143 CarbonylContact C-O 3.58Å; S134-S143 WeakPolarHBondContact CA-O 3.38Å |
| 135 | A | 93.9 | Very high | 90.7 | Very high | 27 Ų | 27 | 46.4 Ų | 46.4 | 22% | 0.223 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.1 | 135.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q8 S143 | Q8-A135 CarbonylContact O-C 3.58Å; Q8-A135 WeakPolarHBondContact O-CA 3.03Å; A135-S143 PolarHBondContact N-O 2.87Å; A135-S143 PolarHBondContact O-N 2.89Å; A135-S143 PolarHBondContact O-OG 3.19Å |
| 136 | L | 94.2 | Very high | 91 | Very high | 15 Ų | 15 | 40.4 Ų | 40.4 | 8% | 0.079 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 125.5 | 178 | 178.1 | 58.1 | 0 | 0 | 0 | 110.4 | V7 Q8 S10 V80 P85 I88 L142 | V7-L136 HydrophobicContact CG1-CB 3.74Å; V7-L136 HydrophobicContact CG1-CD2 4.33Å; Q8-L136 PolarHBondContact O-N 3.09Å; S10-L136 PolarHBondContact N-O 3.39Å; S10-L136 PolarHBondContact OG-O 3.26Å; V80-L136 HydrophobicContact CG2-CD1 3.44Å; V80-L136 VanDerWaalsContact CG2-CD1 3.44Å; P85-L136 HydrophobicContact CB-CD2 3.96Å; P85-L136 HydrophobicContact CG-CD2 3.76Å; I88-L136 HydrophobicContact CD1-CD2 3.97Å; L136-L142 HydrophobicContact CD1-CB 4.26Å |
| 137 | S | 91.6 | Very high | 90.7 | Very high | 27 Ų | 27 | 40.6 Ų | 40.6 | 19% | 0.189 | 25% | 0.25 | C | S | . | . | trans | -82.1 | 156.4 | 177.3 | 93.1 | 0 | 0 | 0 | 0 | 112.7 | S10 E139 G140 V141 | S10-S137 WeakPolarHBondContact OG-CA 3.46Å; S137-E139 WeakPolarHBondContact CB-OE2 3.46Å; S137-E139 PolarHBondContact O-N 3.01Å; S137-E139 PolarHBondContact OG-N 3.34Å; S137-E139 PolarHBondContact OG-OE2 3.2Å; S137-G140 PolarHBondContact O-N 3.31Å; S137-V141 PolarHBondContact N-O 3.34Å; S137-V141 PolarHBondContact OG-N 3.45Å | ||
| 138 | P | 88 | Confident | 89.8 | Confident | 91 Ų | 91 | 41.8 Ų | 41.8 | 59% | 0.591 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -26.1 | 173.9 | -21.8 | 33.3 | 0 | 0 | 0 | 113.5 | S10 W11 G140 | S10-P138 WeakPolarHBondContact OG-CD 3.04Å; W11-P138 HydrophobicContact CB-CG 4.32Å; P138-G140 PolarHBondContact O-N 3.1Å |
| 139 | E | 88.8 | Confident | 88.4 | Confident | 137 Ų | 137 | 42 Ų | 42 | 64% | 0.64 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | 0.8 | 178.7 | -53.6 | 72 | -152.5 | 0 | 0 | 112.7 | S137 | S137-E139 WeakPolarHBondContact CB-OE2 3.46Å; S137-E139 PolarHBondContact O-N 3.01Å; S137-E139 PolarHBondContact OG-N 3.34Å; S137-E139 PolarHBondContact OG-OE2 3.2Å |
| 140 | G | 90.6 | Very high | 86.7 | Confident | 10 Ų | 10 | 45 Ų | 45 | 10% | 0.103 | 29% | 0.293 | C | S | . | . | S | Bend | trans | 83.4 | 24.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | V80 K81 S137 P138 | V80-G140 CarbonylContact C-O 3.52Å; V80-G140 VanDerWaalsContact CG2-O 3.29Å; V80-G140 WeakPolarHBondContact CG2-O 3.45Å; V80-G140 PolarHBondContact N-O 2.89Å; K81-G140 PolarHBondContact N-O 2.84Å; S137-G140 PolarHBondContact O-N 3.31Å; P138-G140 PolarHBondContact O-N 3.1Å |
| 141 | V | 93.8 | Very high | 84.9 | Confident | 41 Ų | 41 | 44.8 Ų | 44.8 | 25% | 0.248 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 116.6 | 175.9 | -175.1 | 0 | 0 | 0 | 0 | 110 | L77 L78 S137 | L77-V141 HydrophobicContact CB-CG1 4.36Å; L77-V141 HydrophobicContact CD2-CG1 4.41Å; L78-V141 CarbonylContact O-C 3.41Å; L78-V141 WeakPolarHBondContact O-CA 3.42Å; S137-V141 PolarHBondContact N-O 3.34Å; S137-V141 PolarHBondContact OG-N 3.45Å |
| 142 | L | 93.6 | Very high | 82.8 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 120.5 | 171.5 | 172.8 | 68.9 | 0 | 0 | 0 | 109.6 | V7 L77 L78 V80 I88 V90 V99 L136 I144 | V7-L142 HydrophobicContact CG1-CD1 4.11Å; L77-L142 CarbonylContact C-O 3.54Å; L77-L142 WeakPolarHBondContact CA-O 3.45Å; L78-L142 HydrophobicContact CB-CB 4.11Å; L78-L142 HydrophobicContact CD1-CD2 3.97Å; L78-L142 PolarHBondContact N-O 2.97Å; L78-L142 PolarHBondContact O-N 2.83Å; V80-L142 HydrophobicContact CG1-CB 4.1Å; V80-L142 HydrophobicContact CG1-CD2 4.44Å; V80-L142 HydrophobicContact CG2-CB 3.74Å; I88-L142 HydrophobicContact CG2-CD2 3.97Å; V90-L142 HydrophobicContact CG2-CD2 3.99Å; V99-L142 HydrophobicContact CG1-CD2 3.98Å; L136-L142 HydrophobicContact CD1-CB 4.26Å; L142-I144 HydrophobicContact CD1-CG1 4.5Å; L142-I144 HydrophobicContact CD2-CD1 4.22Å; L142-I144 HydrophobicContact CD2-CG1 4.41Å; L142-I144 HydrophobicContact CG-CD1 4.46Å; L142-I144 HydrophobicContact CG-CG1 4.14Å |
| 143 | S | 93.3 | Very high | 80.3 | Confident | 30 Ų | 30 | 55.4 Ų | 55.4 | 21% | 0.21 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 131.7 | 173.4 | 58.9 | 0 | 0 | 0 | 0 | 110 | V76 S134 A135 | V76-S143 WeakPolarHBondContact O-CA 3.45Å; S134-S143 CarbonylContact C-O 3.58Å; S134-S143 WeakPolarHBondContact CA-O 3.38Å; A135-S143 PolarHBondContact N-O 2.87Å; A135-S143 PolarHBondContact O-N 2.89Å; A135-S143 PolarHBondContact O-OG 3.19Å |
| 144 | I | 93.6 | Very high | 78 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 123.9 | 175.4 | -51.2 | 172.7 | 0 | 0 | 0 | 107.6 | F74 S75 V76 L78 V90 V97 V99 V132 T133 L142 | F74-I144 HydrophobicContact CE1-CB 4.42Å; F74-I144 HydrophobicContact CE1-CG2 3.91Å; S75-I144 CarbonylContact C-O 3.54Å; S75-I144 VanDerWaalsContact CA-O 3.3Å; S75-I144 WeakPolarHBondContact CA-O 3.25Å; V76-I144 PolarHBondContact N-O 3.37Å; V76-I144 PolarHBondContact O-N 3.49Å; L78-I144 HydrophobicContact CD1-CD1 4.17Å; V90-I144 HydrophobicContact CG1-CD1 3.93Å; V90-I144 HydrophobicContact CG2-CD1 4.29Å; V97-I144 HydrophobicContact CG1-CD1 4.06Å; V97-I144 HydrophobicContact CG1-CG2 4.1Å; V99-I144 HydrophobicContact CG2-CD1 3.41Å; V99-I144 VanDerWaalsContact CG2-CD1 3.41Å; V132-I144 HydrophobicContact CG1-CG2 3.72Å; T133-I144 WeakPolarHBondContact O-CA 3.31Å; L142-I144 HydrophobicContact CD1-CG1 4.5Å; L142-I144 HydrophobicContact CD2-CD1 4.22Å; L142-I144 HydrophobicContact CD2-CG1 4.41Å; L142-I144 HydrophobicContact CG-CD1 4.46Å; L142-I144 HydrophobicContact CG-CG1 4.14Å |
| 145 | Q | 93.2 | Very high | 76.1 | Confident | 75 Ų | 75 | 64.9 Ų | 64.9 | 35% | 0.35 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.5 | 150 | -174.2 | -62.2 | -173.4 | -15.8 | 0 | 0 | 111.7 | Y73 F74 S75 V132 T133 | Y73-Q145 PolarHBondContact OH-NE2 3.22Å; F74-Q145 CarbonylContact O-C 3.56Å; F74-Q145 WeakPolarHBondContact O-CA 3.17Å; S75-Q145 PolarHBondContact OG-NE2 3Å; V132-Q145 WeakPolarHBondContact CA-O 3.39Å; T133-Q145 PolarHBondContact N-O 3.15Å; T133-Q145 PolarHBondContact O-N 3.43Å; T133-Q145 PolarHBondContact OG1-O 3.06Å |
| 146 | A | 89.1 | Confident | 74.1 | Confident | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 128.7 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y73 F74 V127 V132 | Y73-A146 WeakPolarHBondContact CD2-O 3.45Å; F74-A146 HydrophobicContact CB-CB 3.97Å; F74-A146 PolarHBondContact N-O 3Å; F74-A146 PolarHBondContact O-N 3.49Å; V127-A146 HydrophobicContact CG1-CB 3.35Å; V132-A146 HydrophobicContact CG2-CB 4.01Å |
| 147 | T | 76.5 | Confident | 72.3 | Confident | 71 Ų | 71 | 73.4 Ų | 73.4 | 44% | 0.436 | 46% | 0.458 | S | S | . | . | trans | -82.7 | 146.6 | 174.2 | 52.4 | 0 | 0 | 0 | 0 | 110.4 | A149 | T147-A149 PolarHBondContact O-N 3.23Š| ||
| 148 | P | 66.8 | Low | 71.1 | Confident | 37 Ų | 37 | 77.6 Ų | 77.6 | 24% | 0.24 | 49% | 0.485 | C | S | . | . | trans | -56.4 | 140.6 | 169.9 | -15.6 | 23.8 | 0 | 0 | 0 | 110.3 | G72 S150 A151 | G72-P148 VanDerWaalsContact O-CA 3.27Å; G72-P148 WeakPolarHBondContact O-CA 3.46Å; G72-P148 WeakPolarHBondContact O-CD 3.48Å; G72-P148 VanDerWaalsContact O-CG 3.27Å; G72-P148 WeakPolarHBondContact O-CG 3.33Å; G72-P148 VanDerWaalsContact O-N 3.15Å; P148-S150 PolarHBondContact O-N 3.05Å; P148-A151 PolarHBondContact O-N 3.29Å | ||
| 149 | A | 59.2 | Low | 69.6 | Low | 80 Ų | 80 | 79.2 Ų | 79.2 | 66% | 0.661 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | -19.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114 | T147 | T147-A149 PolarHBondContact O-N 3.23Š|
| 150 | S | 54.5 | Low | 68 | Low | 112 Ų | 112 | 77.4 Ų | 77.4 | 78% | 0.783 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | -3.1 | 179.3 | 60.9 | 0 | 0 | 0 | 0 | 115.4 | P148 | P148-S150 PolarHBondContact O-N 3.05Š|
| 151 | A | 51.5 | Low | 66.3 | Low | 64 Ų | 64 | 81.9 Ų | 81.9 | 53% | 0.529 | 54% | 0.54 | S | S | . | . | trans | -92.9 | -8.4 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | P148 A153 | P148-A151 PolarHBondContact O-N 3.29Å; A151-A153 PolarHBondContact O-N 3.2Å | ||
| 152 | Q | 44.7 | Very low | 64.2 | Low | 177 Ų | 177 | 93.3 Ų | 93.3 | 83% | 0.827 | 59% | 0.586 | S | S | * | * | trans | -80.8 | 68.3 | 170.1 | -84.6 | -177.2 | -26.2 | 0 | 0 | 110.9 | ||||
| 153 | A | 41.3 | Very low | 62.7 | Low | 81 Ų | 81 | 98 Ų | 98 | 67% | 0.669 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 117.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | A151 L155 | A151-A153 PolarHBondContact O-N 3.2Å; A153-L155 PolarHBondContact O-N 3.34Å |
| 154 | P | 46.1 | Very low | 61.1 | Low | 123 Ų | 123 | 101.6 Ų | 101.6 | 80% | 0.799 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 125.2 | 173.7 | 24.4 | -31.3 | 0 | 0 | 0 | 108.7 | ||
| 155 | L | 53.9 | Low | 59.3 | Low | 165 Ų | 165 | 107.2 Ų | 107.2 | 86% | 0.864 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 126.9 | 170.9 | -74.3 | 162.9 | 0 | 0 | 0 | 108.6 | A153 S157 | A153-L155 PolarHBondContact O-N 3.34Å; L155-S157 PolarHBondContact O-N 3.29Å |
| 156 | P | 51.1 | Low | 57.3 | Low | 118 Ų | 118 | 109.1 Ų | 109.1 | 77% | 0.766 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 125.3 | 174.6 | 24.8 | -31.1 | 0 | 0 | 0 | 108.6 | ||
| 157 | S | 57.1 | Low | 55.3 | Low | 102 Ų | 102 | 115.9 Ų | 115.9 | 71% | 0.713 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 134.4 | 172.8 | 50.1 | 0 | 0 | 0 | 0 | 109.9 | L155 | L155-S157 PolarHBondContact O-N 3.29Š|
| 158 | P | 66 | Low | 53.9 | Low | 116 Ų | 116 | 118.9 Ų | 118.9 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 139.4 | 177.8 | 24.6 | -31.8 | 0 | 0 | 0 | 109.7 | A160 | P158-A160 PolarHBondContact O-N 3.27Š|
| 159 | P | 57.7 | Low | 53 | Low | 125 Ų | 125 | 124.8 Ų | 124.8 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 129.8 | 179.7 | 25.9 | -32.5 | 0 | 0 | 0 | 109.4 | A161 | P159-A161 PolarHBondContact O-N 3.26Å; P159-A161 VanDerWaalsContact O-N 3.09Å |
| 160 | A | 53.9 | Low | 52.5 | Low | 99 Ų | 99 | 128.2 Ų | 128.2 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -56.4 | 115.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | P158 K162 | P158-A160 PolarHBondContact O-N 3.27Å; A160-K162 PolarHBondContact O-N 3.29Å | ||
| 161 | A | 55.8 | Low | 52.3 | Low | 104 Ų | 104 | 129.6 Ų | 129.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -62.8 | 128.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | P159 | P159-A161 PolarHBondContact O-N 3.26Å; P159-A161 VanDerWaalsContact O-N 3.09Å | ||
| 162 | K | 48.7 | Very low | 52.4 | Low | 281 Ų | 281 | 135.5 Ų | 135.5 | 100% | 1.222 | 83% | 0.828 | S | S | * | * | trans | -87.2 | 0 | -179.2 | -134.5 | -179.5 | -172.4 | -179.1 | 0 | 110.6 | A160 | A160-K162 PolarHBondContact O-N 3.29Š|
Retrieved 162 of 162 residues in 39.2 ms
(Link to these results)