| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.4 | Very low | 38.4 | Very low | 236 Ų | 236 | 136.6 Ų | 136.6 | 100% | 1.163 | 83% | 0.833 | S | S | * | * | 0 | 85 | 0 | -67.4 | 171.1 | 164.4 | 0 | 0 | 105.7 | |||||
| 2 | S | 37.4 | Very low | 38.1 | Very low | 129 Ų | 129 | 135.3 Ų | 135.3 | 90% | 0.902 | 83% | 0.825 | S | S | * | * | 80.3 | 130.1 | 81.2 | -67 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 3 | A | 40.8 | Very low | 38.3 | Very low | 102 Ų | 102 | 136.4 Ų | 136.4 | 84% | 0.843 | 82% | 0.821 | S | S | * | * | trans | -72.1 | 165.6 | -167.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 4 | A | 38.3 | Very low | 37.9 | Very low | 97 Ų | 97 | 133.2 Ų | 133.2 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | -178.5 | 129.2 | 121.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 5 | N | 39.3 | Very low | 38.2 | Very low | 158 Ų | 158 | 140.1 Ų | 140.1 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -80.6 | 159.7 | 153.7 | -100.3 | -33.1 | 0 | 0 | 0 | 108.9 | ||||
| 6 | P | 48.5 | Very low | 37.9 | Very low | 110 Ų | 110 | 141.9 Ų | 141.9 | 71% | 0.714 | 81% | 0.812 | S | S | * | * | -150.1 | 141 | 103.4 | 33.2 | -13 | 0 | 0 | 0 | 117.3 | |||||
| 7 | E | 33.1 | Very low | 38 | Very low | 174 Ų | 174 | 138.9 Ų | 138.9 | 81% | 0.813 | 81% | 0.808 | S | S | * | * | 45.5 | 114 | 125.6 | -65.9 | 178.9 | 97.7 | 0 | 0 | 124.3 | |||||
| 8 | T | 38.8 | Very low | 37.8 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 70% | 0.699 | 80% | 0.802 | S | S | * | * | trans | 55.9 | 158.1 | 131.6 | 36.6 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 9 | P | 45 | Very low | 38.1 | Very low | 120 Ų | 120 | 136.3 Ų | 136.3 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | cis | -144.8 | 168.6 | 36.5 | 38.4 | -15.1 | 0 | 0 | 0 | 120.7 | ||||
| 10 | N | 30.4 | Very low | 38.3 | Very low | 142 Ų | 142 | 138.4 Ų | 138.4 | 76% | 0.759 | 80% | 0.803 | S | S | * | * | trans | -57.7 | 142.3 | 176.7 | -65.7 | -41.1 | 0 | 0 | 0 | 114.9 | ||||
| 11 | S | 32.8 | Very low | 38.1 | Very low | 121 Ų | 121 | 136.5 Ų | 136.5 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | trans | -106.1 | 97.1 | 161.3 | -42.3 | 0 | 0 | 0 | 0 | 109.3 | I13 | S11-I13 PolarHBondContact O-N 3.1Š| ||
| 12 | T | 34.9 | Very low | 38.3 | Very low | 120 Ų | 120 | 131.4 Ų | 131.4 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | -64 | 122.3 | 174.3 | -59.1 | 0 | 0 | 0 | 0 | 110.5 | S14 | T12-S14 PolarHBondContact O-N 3.24Š| ||
| 13 | I | 40.2 | Very low | 38.5 | Very low | 150 Ų | 150 | 130 Ų | 130 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -71.5 | 107 | 165.9 | -73.6 | 164.2 | 0 | 0 | 0 | 108 | S11 R15 | S11-I13 PolarHBondContact O-N 3.1Å; I13-R15 HydrophobicContact CG2-CG 4.3Å | ||
| 14 | S | 32.1 | Very low | 38.9 | Very low | 92 Ų | 92 | 129.5 Ų | 129.5 | 64% | 0.643 | 77% | 0.771 | S | S | * | * | trans | -87.8 | 106.9 | 165.6 | -65.4 | 0 | 0 | 0 | 0 | 109 | T12 E16 | T12-S14 PolarHBondContact O-N 3.24Å; S14-E16 PolarHBondContact O-N 3.32Å | ||
| 15 | R | 43.8 | Very low | 39.4 | Very low | 236 Ų | 236 | 127.2 Ų | 127.2 | 89% | 0.891 | 75% | 0.753 | S | S | * | * | trans | -78.2 | 99.7 | 161.6 | -75.2 | 178.7 | 175 | 169.4 | -1.2 | 107.6 | I13 A17 | I13-R15 HydrophobicContact CG2-CG 4.3Å; R15-A17 PolarHBondContact O-N 3.49Å | ||
| 16 | E | 33.2 | Very low | 39.6 | Very low | 170 Ų | 170 | 125.1 Ų | 125.1 | 79% | 0.794 | 75% | 0.746 | S | S | * | * | trans | -90.3 | 98.2 | 173.3 | -59.6 | -173.5 | 112.7 | 0 | 0 | 108.8 | S14 S18 | S14-E16 PolarHBondContact O-N 3.32Å; E16-S18 PolarHBondContact O-N 3.36Å | ||
| 17 | A | 38.4 | Very low | 39.6 | Very low | 90 Ų | 90 | 121.6 Ų | 121.6 | 74% | 0.744 | 72% | 0.724 | S | S | * | * | trans | -60.9 | 101.2 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | R15 T19 | R15-A17 PolarHBondContact O-N 3.49Å; A17-T19 VanDerWaalsContact C-N 3.31Å; A17-T19 PolarHBondContact O-N 3.44Å | ||
| 18 | S | 35 | Very low | 40.4 | Very low | 100 Ų | 100 | 119 Ų | 119 | 70% | 0.699 | 71% | 0.712 | S | S | * | * | trans | -66.9 | 92.6 | 172.6 | -84.2 | 0 | 0 | 0 | 0 | 109.9 | E16 Q20 | E16-S18 PolarHBondContact O-N 3.36Å; S18-Q20 VanDerWaalsContact C-N 3.29Å; S18-Q20 PolarHBondContact O-N 3.21Å | ||
| 19 | T | 44.1 | Very low | 41.1 | Very low | 129 Ų | 129 | 117.4 Ų | 117.4 | 79% | 0.791 | 72% | 0.718 | S | S | * | * | trans | -75.6 | 86.8 | 157.5 | -49.4 | 0 | 0 | 0 | 0 | 106.1 | A17 S21 | A17-T19 VanDerWaalsContact C-N 3.31Å; A17-T19 PolarHBondContact O-N 3.44Å; T19-S21 PolarHBondContact O-N 3.32Å; T19-S21 VanDerWaalsContact O-N 3.14Å | ||
| 20 | Q | 40.9 | Very low | 41.4 | Very low | 177 Ų | 177 | 118.2 Ų | 118.2 | 83% | 0.827 | 71% | 0.706 | S | S | * | * | trans | -78.5 | 101.7 | 175.4 | -79.4 | -178.2 | -0.1 | 0 | 0 | 109.5 | S18 | S18-Q20 VanDerWaalsContact C-N 3.29Å; S18-Q20 PolarHBondContact O-N 3.21Å | ||
| 21 | S | 34.1 | Very low | 42.9 | Very low | 100 Ų | 100 | 117.8 Ų | 117.8 | 70% | 0.699 | 71% | 0.709 | S | S | * | * | trans | -46 | 141.1 | 163.1 | -71 | 0 | 0 | 0 | 0 | 111.9 | T19 S23 | T19-S21 PolarHBondContact O-N 3.32Å; T19-S21 VanDerWaalsContact O-N 3.14Å; S21-S23 PolarHBondContact O-N 3Å | ||
| 22 | S | 44.4 | Very low | 44.6 | Very low | 128 Ų | 128 | 113.7 Ų | 113.7 | 90% | 0.895 | 68% | 0.677 | S | S | * | * | trans | -51 | 95.4 | 169 | 48.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 23 | S | 40.6 | Very low | 46.4 | Very low | 101 Ų | 101 | 112.4 Ų | 112.4 | 71% | 0.706 | 67% | 0.671 | S | S | * | * | trans | -103.1 | 131.5 | 155.3 | 56.3 | 0 | 0 | 0 | 0 | 107.9 | S21 A25 | S21-S23 PolarHBondContact O-N 3Å; S23-A25 PolarHBondContact O-N 2.88Å | ||
| 24 | A | 49.7 | Very low | 48.2 | Very low | 90 Ų | 90 | 114.4 Ų | 114.4 | 74% | 0.744 | 68% | 0.677 | S | S | * | * | trans | -60.6 | 97.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | T26 | A24-T26 PolarHBondContact O-N 3.46Š| ||
| 25 | A | 49 | Very low | 50.7 | Low | 50 Ų | 50 | 111.8 Ų | 111.8 | 41% | 0.413 | 66% | 0.664 | S | S | . | * | trans | -75.2 | 93 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | S23 S27 L32 | S23-A25 PolarHBondContact O-N 2.88Å; A25-S27 PolarHBondContact O-N 3.47Å; A25-S27 VanDerWaalsContact O-N 3.1Å; A25-L32 HydrophobicContact CB-CD1 4.29Å; A25-L32 WeakPolarHBondContact O-CD1 3.45Å; A25-L32 WeakPolarHBondContact O-CG 3.37Å | ||
| 26 | T | 43.8 | Very low | 53 | Low | 114 Ų | 114 | 105.2 Ų | 105.2 | 70% | 0.699 | 64% | 0.642 | S | S | * | * | trans | -64.2 | 110.1 | 169.3 | 33 | 0 | 0 | 0 | 0 | 110 | A24 | A24-T26 PolarHBondContact O-N 3.46Š| ||
| 27 | S | 47.3 | Very low | 55.7 | Low | 36 Ų | 36 | 101.3 Ų | 101.3 | 25% | 0.252 | 63% | 0.626 | S | S | . | * | B | Isolated β-bridge | trans | -116.7 | 122.9 | 162.7 | 45.9 | 0 | 0 | 0 | 0 | 108.3 | A25 G29 | A25-S27 PolarHBondContact O-N 3.47Å; A25-S27 VanDerWaalsContact O-N 3.1Å; S27-G29 PolarHBondContact O-N 3.45Å |
| 28 | Q | 49.4 | Very low | 58.3 | Low | 120 Ų | 120 | 98.9 Ų | 98.9 | 56% | 0.561 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53 | 50.7 | -179.7 | -87.9 | 123.7 | -38.1 | 0 | 0 | 116.9 | Y30 | Q28-Y30 WeakPolarHBondContact O-CD2 3.41Å; Q28-Y30 PolarHBondContact O-N 3.29Å |
| 29 | G | 53.4 | Low | 61 | Low | 80 Ų | 80 | 98 Ų | 98 | 83% | 0.825 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.3 | 6.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | S27 | S27-G29 PolarHBondContact O-N 3.45Š|
| 30 | Y | 52.9 | Low | 63.3 | Low | 137 Ų | 137 | 93.4 Ų | 93.4 | 54% | 0.537 | 56% | 0.562 | S | S | . | * | B | Isolated β-bridge | trans | -98.8 | 122 | 172.7 | -68.6 | -72 | 0 | 0 | 0 | 109 | Q28 L32 K109 | Q28-Y30 WeakPolarHBondContact O-CD2 3.41Å; Q28-Y30 PolarHBondContact O-N 3.29Å; Y30-L32 PolarHBondContact O-N 3.14Å; Y30-L32 VanDerWaalsContact O-N 3.1Å; Y30-K109 PolarHBondContact OH-NZ 2.8Å |
| 31 | V | 61.5 | Low | 65.9 | Low | 133 Ų | 133 | 85.6 Ų | 85.6 | 81% | 0.806 | 53% | 0.526 | S | S | * | . | trans | -64.6 | 111.2 | 170 | -178.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 32 | L | 67.9 | Low | 68.8 | Low | 35 Ų | 35 | 80.8 Ų | 80.8 | 18% | 0.183 | 49% | 0.493 | C | S | . | . | P | Polyproline II helix | trans | -67.4 | 130.8 | 177.9 | -71.9 | -174.1 | 0 | 0 | 0 | 109.4 | A25 Y30 P112 I114 | A25-L32 HydrophobicContact CB-CD1 4.29Å; A25-L32 WeakPolarHBondContact O-CD1 3.45Å; A25-L32 WeakPolarHBondContact O-CG 3.37Å; Y30-L32 PolarHBondContact O-N 3.14Å; Y30-L32 VanDerWaalsContact O-N 3.1Å; L32-P112 HydrophobicContact CD1-CG 4.43Å; L32-I114 HydrophobicContact CB-CD1 3.56Å; L32-I114 HydrophobicContact CD1-CD1 3.91Å; L32-I114 HydrophobicContact CD2-CD1 3.75Å; L32-I114 HydrophobicContact CG-CD1 3.92Å |
| 33 | P | 73.2 | Confident | 71.3 | Confident | 93 Ų | 93 | 77.7 Ų | 77.7 | 60% | 0.604 | 46% | 0.463 | S | S | * | . | P | Polyproline II helix | trans | -58.6 | 145 | 175 | -21.3 | 30.7 | 0 | 0 | 0 | 111.4 | G35 | P33-G35 PolarHBondContact O-N 2.99Š|
| 34 | E | 76.8 | Confident | 73.9 | Confident | 191 Ų | 191 | 73 Ų | 73 | 89% | 0.893 | 43% | 0.43 | S | S | * | . | S | Bend | trans | -60.6 | 121.2 | 172.1 | -70.7 | -172.9 | 167.4 | 0 | 0 | 110.6 | ||
| 35 | G | 86.4 | Confident | 76 | Confident | 37 Ų | 37 | 68.8 Ų | 68.8 | 38% | 0.381 | 40% | 0.396 | S | S | . | . | S | Bend | trans | 173.4 | 176.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | P33 | P33-G35 PolarHBondContact O-N 2.99Š|
| 36 | K | 90.1 | Very high | 78.1 | Confident | 99 Ų | 99 | 68.2 Ų | 68.2 | 43% | 0.43 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 122.9 | 179 | 179.8 | 175.4 | -176.1 | -63 | 0 | 110 | M38 R115 Q117 | K36-M38 PolarHBondContact O-N 3.21Å; K36-R115 PolarHBondContact N-O 2.82Å; K36-R115 PolarHBondContact O-N 2.95Å; K36-Q117 HydrophobicContact CB-CG 4.07Å |
| 37 | I | 90.9 | Very high | 80.5 | Confident | 88 Ų | 88 | 63.3 Ų | 63.3 | 45% | 0.451 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.5 | 132 | 170.4 | -57.8 | 171.5 | 0 | 0 | 0 | 108.8 | P112 I114 | I37-P112 HydrophobicContact CG2-CB 4.42Å; I37-I114 HydrophobicContact CG1-CG1 4.26Å |
| 38 | M | 92 | Very high | 82.6 | Confident | 39 Ų | 39 | 63 Ų | 63 | 19% | 0.192 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 117.1 | 178.2 | -67.3 | -106.7 | 62.6 | 0 | 0 | 108.7 | K36 T41 A113 R115 | K36-M38 PolarHBondContact O-N 3.21Å; M38-T41 HydrophobicContact CB-CG2 4.36Å; M38-A113 HydrophobicContact CB-CB 4.04Å; M38-A113 WeakPolarHBondContact CB-O 3.5Å; M38-A113 PolarHBondContact N-O 3.43Å; M38-R115 HydrophobicContact CG-CB 3.95Å; M38-R115 HydrophobicContact SD-CB 4.04Å; M38-R115 PolarHBondContact SD-NE 3.5Å; M38-R115 PolarHBondContact SD-NH2 2.81Å |
| 39 | P | 91.9 | Very high | 84.4 | Confident | 82 Ų | 82 | 62.7 Ų | 62.7 | 53% | 0.532 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.5 | 150.9 | 175 | 29 | -34.7 | 0 | 0 | 0 | 109.8 | T41 | P39-T41 PolarHBondContact O-N 3.34Å; P39-T41 PolarHBondContact O-OG1 2.95Å; P39-T41 VanDerWaalsContact O-OG1 3.05Å |
| 40 | N | 94.1 | Very high | 86.1 | Confident | 31 Ų | 31 | 67.8 Ų | 67.8 | 17% | 0.166 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 52 | 29.7 | 175.8 | -55.4 | -27.7 | 0 | 0 | 0 | 113.1 | S86 F87 D90 V91 | N40-S86 WeakPolarHBondContact O-CA 3.33Å; N40-F87 HydrophobicContact CB-CB 4.47Å; N40-F87 PolarHBondContact O-N 3.16Å; N40-D90 PolarHBondContact ND2-OD1 2.92Å; N40-D90 WeakPolarHBondContact OD1-CA 3.4Å; N40-D90 PolarHBondContact OD1-OD1 3.22Å; N40-V91 HydrophobicContact CB-CG2 4.35Å; N40-V91 PolarHBondContact OD1-N 2.78Å |
| 41 | T | 94.9 | Very high | 87.7 | Confident | 13 Ų | 13 | 61.7 Ų | 61.7 | 8% | 0.08 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.4 | 130.3 | -179.6 | -51.9 | 0 | 0 | 0 | 0 | 109.8 | M38 P39 F84 V85 S86 A113 | M38-T41 HydrophobicContact CB-CG2 4.36Å; P39-T41 PolarHBondContact O-N 3.34Å; P39-T41 PolarHBondContact O-OG1 2.95Å; P39-T41 VanDerWaalsContact O-OG1 3.05Å; T41-F84 HydrophobicContact CG2-CB 4.2Å; T41-V85 CarbonylContact C-O 3.58Å; T41-V85 VanDerWaalsContact CA-O 3.26Å; T41-V85 WeakPolarHBondContact CA-O 3.09Å; T41-S86 WeakPolarHBondContact CG2-OG 3.27Å; T41-S86 PolarHBondContact OG1-OG 3.37Å; T41-S86 VanDerWaalsContact OG1-OG 3.08Å; T41-A113 HydrophobicContact CG2-CB 3.47Å; T41-A113 VanDerWaalsContact CG2-CB 3.47Å; T41-A113 VanDerWaalsContact O-CB 3.25Å; T41-A113 WeakPolarHBondContact O-CB 3.35Å; T41-A113 PolarHBondContact O-N 3.38Å |
| 42 | V | 95.5 | Very high | 89.2 | Confident | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 133.6 | -177.2 | -178.2 | 0 | 0 | 0 | 0 | 109 | V44 F84 V85 F87 V93 I96 V97 | V42-V44 HydrophobicContact CG1-CG2 4.45Å; V42-F84 WeakPolarHBondContact O-CA 3.36Å; V42-V85 PolarHBondContact N-O 3.03Å; V42-V85 PolarHBondContact O-N 3.23Å; V42-F87 HydrophobicContact CG2-CE2 3.88Å; V42-V93 HydrophobicContact CG2-CG1 4.23Å; V42-V93 HydrophobicContact CG2-CG2 4.33Å; V42-I96 HydrophobicContact CG1-CG2 4.15Å; V42-I96 HydrophobicContact CG2-CB 4.35Å; V42-I96 HydrophobicContact CG2-CD1 4.09Å; V42-I96 HydrophobicContact CG2-CG2 4.06Å; V42-V97 HydrophobicContact CG1-CG1 4.35Å |
| 43 | F | 95.6 | Very high | 90.3 | Very high | 63 Ų | 63 | 62.8 Ų | 62.8 | 28% | 0.276 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 133.4 | 168.7 | 168.2 | -95.9 | 0 | 0 | 0 | 109.5 | Y82 F84 L110 G111 | F43-Y82 AromaticContact CE2-CD2 3.78Å; F43-Y82 HydrophobicContact CE2-CD2 3.78Å; F43-Y82 AromaticContact CE2-CG 3.99Å; F43-Y82 HydrophobicContact CE2-CG 3.99Å; F43-Y82 HydrophobicContact CZ-CG 4.49Å; F43-F84 HydrophobicContact CB-CD1 4.42Å; F43-F84 HydrophobicContact CB-CE1 4.32Å; F43-F84 HydrophobicContact CD2-CD1 4.41Å; F43-F84 AromaticContact CD2-CE1 3.83Å; F43-F84 HydrophobicContact CD2-CE1 3.83Å; F43-F84 HydrophobicContact CD2-CZ 4.22Å; F43-L110 WeakPolarHBondContact O-CA 3.25Å; F43-G111 WeakPolarHBondContact CB-O 3.46Å; F43-G111 PolarHBondContact N-O 2.96Å; F43-G111 PolarHBondContact O-N 3.19Å; F43-G111 VanDerWaalsContact O-N 3.09Å |
| 44 | V | 95.3 | Very high | 91.3 | Very high | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.006 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 109.4 | 178.7 | -173.4 | 0 | 0 | 0 | 0 | 108.5 | V42 I47 F60 Y82 G83 V85 L108 L110 | V42-V44 HydrophobicContact CG1-CG2 4.45Å; V44-I47 HydrophobicContact CB-CD1 4.27Å; V44-I47 HydrophobicContact CG1-CD1 4.05Å; V44-I47 HydrophobicContact CG1-CG1 3.97Å; V44-I47 WeakPolarHBondContact O-CD1 3.43Å; V44-F60 HydrophobicContact CG2-CE2 3.95Å; V44-F60 HydrophobicContact CG2-CZ 3.83Å; V44-Y82 CarbonylContact O-C 3.49Å; V44-Y82 WeakPolarHBondContact O-CA 3.45Å; V44-Y82 WeakPolarHBondContact O-CB 3.28Å; V44-G83 PolarHBondContact N-O 3.07Å; V44-G83 PolarHBondContact O-N 3.46Å; V44-V85 HydrophobicContact CG2-CG2 3.76Å; V44-L108 HydrophobicContact CG1-CB 4.49Å; V44-L108 HydrophobicContact CG1-CD1 3.82Å; V44-L110 HydrophobicContact CB-CD2 4.32Å; V44-L110 HydrophobicContact CG1-CD2 4.04Å; V44-L110 HydrophobicContact CG2-CD2 4Å |
| 45 | G | 94.4 | Very high | 92.1 | Very high | 3 Ų | 3 | 57.6 Ų | 57.6 | 3% | 0.031 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 163.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I47 G81 L108 K109 | G45-I47 VanDerWaalsContact C-N 3.35Å; G45-G81 CarbonylContact C-O 3.44Å; G45-L108 CarbonylContact O-C 3.44Å; G45-L108 WeakPolarHBondContact O-CA 3.35Å; G45-K109 PolarHBondContact N-O 3.46Å; G45-K109 PolarHBondContact O-N 3.37Å |
| 46 | G | 93.1 | Very high | 92.4 | Very high | 37 Ų | 37 | 55.9 Ų | 55.9 | 38% | 0.381 | 29% | 0.292 | S | S | . | . | trans | 77.8 | 22 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | D48 G81 L108 | G46-D48 PolarHBondContact O-N 2.76Å; G46-G81 PolarHBondContact N-O 3Å; G46-L108 WeakPolarHBondContact O-CD2 3.41Å | ||
| 47 | I | 92.9 | Very high | 92.7 | Very high | 11 Ų | 11 | 57.1 Ų | 57.1 | 6% | 0.056 | 29% | 0.294 | C | S | . | . | trans | -69.1 | 124.7 | 176.4 | -57.2 | 175.9 | 0 | 0 | 0 | 108.2 | V44 G45 M51 I56 I71 G81 L108 | V44-I47 HydrophobicContact CB-CD1 4.27Å; V44-I47 HydrophobicContact CG1-CD1 4.05Å; V44-I47 HydrophobicContact CG1-CG1 3.97Å; V44-I47 WeakPolarHBondContact O-CD1 3.43Å; G45-I47 VanDerWaalsContact C-N 3.35Å; I47-M51 HydrophobicContact CG2-CB 3.59Å; I47-M51 HydrophobicContact CG2-CG 3.98Å; I47-I56 HydrophobicContact CD1-CD1 3.9Å; I47-I56 HydrophobicContact CG1-CD1 4.33Å; I47-I56 HydrophobicContact CG2-CD1 4.06Å; I47-I71 HydrophobicContact CD1-CG1 4.5Å; I47-G81 PolarHBondContact N-O 3.03Å; I47-G81 VanDerWaalsContact O-CA 3.3Å; I47-G81 WeakPolarHBondContact O-CA 3.43Å; I47-L108 HydrophobicContact CG1-CD2 4.47Å | ||
| 48 | D | 91.7 | Very high | 92.8 | Very high | 31 Ų | 31 | 56.8 Ų | 56.8 | 17% | 0.166 | 30% | 0.299 | C | S | . | . | trans | -74.4 | 153.4 | 175.6 | -159.3 | 33.4 | 0 | 0 | 0 | 111 | G46 R50 M51 K106 | G46-D48 PolarHBondContact O-N 2.76Å; D48-R50 PolarHBondContact O-N 2.85Å; D48-R50 VanDerWaalsContact O-N 3.08Å; D48-M51 HydrophobicContact CB-CE 4.47Å; D48-M51 HydrophobicContact CB-CG 3.93Å; D48-M51 WeakPolarHBondContact O-CB 3.48Å; D48-M51 PolarHBondContact O-N 2.87Å; D48-K106 HydrophobicContact CB-CD 4.48Å; D48-K106 IonicContact OD1-NZ 2.8Å; D48-K106 PolarHBondContact OD1-NZ 3.27Å | ||
| 49 | V | 88.2 | Confident | 92.9 | Very high | 113 Ų | 113 | 57.5 Ų | 57.5 | 69% | 0.685 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -20.5 | 178.3 | 67.6 | 0 | 0 | 0 | 0 | 112.9 | ||
| 50 | R | 87.8 | Confident | 92.9 | Very high | 186 Ų | 186 | 53.6 Ų | 53.6 | 70% | 0.702 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -9.1 | 179 | -55.2 | 179.9 | 68.2 | 178.8 | 1.4 | 113.4 | D48 | D48-R50 PolarHBondContact O-N 2.85Å; D48-R50 VanDerWaalsContact O-N 3.08Å |
| 51 | M | 88.3 | Confident | 92.9 | Very high | 9 Ų | 9 | 54.8 Ų | 54.8 | 4% | 0.044 | 29% | 0.29 | C | S | . | . | trans | -78.8 | 128.5 | 179.7 | -68 | -94.5 | 156.1 | 0 | 0 | 110.4 | I47 D48 F103 H104 | I47-M51 HydrophobicContact CG2-CB 3.59Å; I47-M51 HydrophobicContact CG2-CG 3.98Å; D48-M51 HydrophobicContact CB-CE 4.47Å; D48-M51 HydrophobicContact CB-CG 3.93Å; D48-M51 WeakPolarHBondContact O-CB 3.48Å; D48-M51 PolarHBondContact O-N 2.87Å; M51-F103 HydrophobicContact CE-CB 3.14Å; M51-F103 HydrophobicContact CE-CD1 3.55Å; M51-F103 HydrophobicContact CE-CG 3.57Å; M51-F103 HydrophobicContact SD-CB 3.77Å; M51-F103 HydrophobicContact SD-CD1 3.5Å; M51-F103 WeakPolarHBondContact SD-CD1 3.22Å; M51-F103 HydrophobicContact SD-CD2 4.35Å; M51-F103 HydrophobicContact SD-CE1 4.19Å; M51-F103 HydrophobicContact SD-CG 3.6Å; M51-F103 VanDerWaalsContact SD-CG 3.6Å; M51-H104 HydrophobicContact CE-CB 4.01Å; M51-H104 WeakPolarHBondContact CE-CD2 3.49Å | ||
| 52 | D | 91.3 | Very high | 92.8 | Very high | 101 Ų | 101 | 63 Ų | 63 | 54% | 0.54 | 32% | 0.32 | S | S | . | . | trans | -91.4 | 151.1 | 173 | -70.1 | -40 | 0 | 0 | 0 | 112.1 | T54 E55 I56 | D52-T54 PolarHBondContact O-N 3.22Å; D52-E55 HydrophobicContact CB-CG 4.46Å; D52-E55 PolarHBondContact O-N 2.87Å; D52-I56 PolarHBondContact O-N 3.46Å | ||
| 53 | E | 92.8 | Very high | 92.7 | Very high | 90 Ų | 90 | 65.8 Ų | 65.8 | 42% | 0.421 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -54.1 | -37.5 | 172.6 | -168.4 | -170.9 | 140.8 | 0 | 0 | 111.8 | E55 I56 R57 V69 I71 | E53-E55 PolarHBondContact O-N 3.38Å; E53-I56 PolarHBondContact O-N 3.48Å; E53-R57 VanDerWaalsContact O-CB 3.28Å; E53-R57 WeakPolarHBondContact O-CB 3.21Å; E53-R57 PolarHBondContact O-N 3.18Å; E53-V69 HydrophobicContact CG-CB 3.43Å; E53-V69 VanDerWaalsContact CG-CB 3.43Å; E53-V69 HydrophobicContact CG-CG1 3.53Å; E53-V69 HydrophobicContact CG-CG2 4.38Å; E53-V69 VanDerWaalsContact OE1-O 3.11Å; E53-I71 HydrophobicContact CB-CD1 4.35Å |
| 54 | T | 93.8 | Very high | 92.5 | Very high | 99 Ų | 99 | 63.5 Ų | 63.5 | 61% | 0.607 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -64.8 | -38.2 | -178.4 | -45.2 | 0 | 0 | 0 | 0 | 112.6 | D52 S58 | D52-T54 PolarHBondContact O-N 3.22Å; T54-S58 WeakPolarHBondContact O-CB 3.4Å; T54-S58 PolarHBondContact O-N 3.29Å; T54-S58 PolarHBondContact O-OG 3.34Å |
| 55 | E | 92.9 | Very high | 92.6 | Very high | 76 Ų | 76 | 66.4 Ų | 66.4 | 36% | 0.355 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -67.7 | -46.2 | 177.6 | -65.6 | -170.5 | 163.2 | 0 | 0 | 110.5 | D52 E53 R57 S58 F59 F103 | D52-E55 HydrophobicContact CB-CG 4.46Å; D52-E55 PolarHBondContact O-N 2.87Å; E53-E55 PolarHBondContact O-N 3.38Å; E55-R57 PolarHBondContact O-N 3.02Å; E55-S58 PolarHBondContact O-N 3.37Å; E55-F59 PolarHBondContact O-N 3.48Å; E55-F103 HydrophobicContact CB-CE1 4.4Å |
| 56 | I | 93.6 | Very high | 92.7 | Very high | 2 Ų | 2 | 66.6 Ų | 66.6 | 1% | 0.01 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -58.4 | -50.7 | 175.3 | -62.8 | 173.5 | 0 | 0 | 0 | 109.2 | I47 D52 E53 S58 F59 F60 V69 I71 V85 | I47-I56 HydrophobicContact CD1-CD1 3.9Å; I47-I56 HydrophobicContact CG1-CD1 4.33Å; I47-I56 HydrophobicContact CG2-CD1 4.06Å; D52-I56 PolarHBondContact O-N 3.46Å; E53-I56 PolarHBondContact O-N 3.48Å; I56-S58 VanDerWaalsContact C-N 3.32Å; I56-S58 PolarHBondContact O-N 3.39Å; I56-F59 PolarHBondContact O-N 3.2Å; I56-F60 HydrophobicContact CG2-CD2 3.64Å; I56-F60 HydrophobicContact CG2-CE2 3.79Å; I56-F60 VanDerWaalsContact O-CD2 3.22Å; I56-F60 WeakPolarHBondContact O-CD2 3.26Å; I56-F60 PolarHBondContact O-N 3.29Å; I56-V69 HydrophobicContact CB-CG1 4.31Å; I56-V69 HydrophobicContact CG2-CG1 3.87Å; I56-I71 HydrophobicContact CD1-CD1 4.14Å; I56-I71 HydrophobicContact CD1-CG1 4.48Å; I56-V85 HydrophobicContact CG2-CG2 3.85Å |
| 57 | R | 94.9 | Very high | 92.8 | Very high | 124 Ų | 124 | 70.6 Ų | 70.6 | 47% | 0.468 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -56.1 | -46.1 | 178.6 | -174.5 | 176.1 | -175.9 | 171.6 | 3.7 | 112.1 | E53 E55 F59 F60 A61 V66 V69 | E53-R57 VanDerWaalsContact O-CB 3.28Å; E53-R57 WeakPolarHBondContact O-CB 3.21Å; E53-R57 PolarHBondContact O-N 3.18Å; E55-R57 PolarHBondContact O-N 3.02Å; R57-F59 VanDerWaalsContact C-N 3.34Å; R57-F59 PolarHBondContact O-N 2.82Å; R57-F60 PolarHBondContact O-N 3.5Å; R57-A61 WeakPolarHBondContact O-CB 3.44Å; R57-A61 PolarHBondContact O-N 3.39Å; R57-V66 HydrophobicContact CG-CB 4.04Å; R57-V66 HydrophobicContact CG-CG1 4Å; R57-V66 HydrophobicContact CG-CG2 4.38Å; R57-V69 HydrophobicContact CB-CG2 3.95Å; R57-V69 HydrophobicContact CG-CG2 4.36Å |
| 58 | S | 94.2 | Very high | 92.9 | Very high | 81 Ų | 81 | 75.1 Ų | 75.1 | 57% | 0.566 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -64.6 | -39.8 | -179.1 | -61.9 | 0 | 0 | 0 | 0 | 111.7 | T54 E55 I56 A61 | T54-S58 WeakPolarHBondContact O-CB 3.4Å; T54-S58 PolarHBondContact O-N 3.29Å; T54-S58 PolarHBondContact O-OG 3.34Å; E55-S58 PolarHBondContact O-N 3.37Å; I56-S58 VanDerWaalsContact C-N 3.32Å; I56-S58 PolarHBondContact O-N 3.39Å; S58-A61 WeakPolarHBondContact O-CB 3.36Å |
| 59 | F | 92.8 | Very high | 93.1 | Very high | 55 Ų | 55 | 74 Ų | 74 | 24% | 0.241 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -65 | -47 | 175.8 | -174.2 | -86 | 0 | 0 | 0 | 111.8 | E55 I56 R57 A61 R62 Y63 I101 F103 | E55-F59 PolarHBondContact O-N 3.48Å; I56-F59 PolarHBondContact O-N 3.2Å; R57-F59 VanDerWaalsContact C-N 3.34Å; R57-F59 PolarHBondContact O-N 2.82Å; F59-A61 VanDerWaalsContact C-N 3.28Å; F59-A61 PolarHBondContact O-N 2.97Å; F59-R62 WeakPolarHBondContact O-CD 3.38Å; F59-R62 VanDerWaalsContact O-CG 3.25Å; F59-R62 WeakPolarHBondContact O-CG 3.25Å; F59-R62 PolarHBondContact O-N 2.9Å; F59-Y63 HydrophobicContact CD1-CE2 4.36Å; F59-Y63 AromaticContact CE1-CE2 3.87Å; F59-Y63 HydrophobicContact CE1-CE2 3.87Å; F59-I101 HydrophobicContact CD1-CD1 3.63Å; F59-I101 HydrophobicContact CD1-CG1 4.29Å; F59-I101 HydrophobicContact CD1-CG2 4.21Å; F59-I101 HydrophobicContact CD2-CG2 4.25Å; F59-I101 HydrophobicContact CE1-CB 4.31Å; F59-I101 HydrophobicContact CE1-CD1 3.14Å; F59-I101 HydrophobicContact CE1-CG1 3.43Å; F59-I101 VanDerWaalsContact CE1-CG1 3.43Å; F59-I101 HydrophobicContact CE1-CG2 3.88Å; F59-I101 HydrophobicContact CE2-CG2 3.89Å; F59-I101 HydrophobicContact CG-CG2 4.4Å; F59-I101 HydrophobicContact CZ-CB 4.24Å; F59-I101 HydrophobicContact CZ-CD1 3.9Å; F59-I101 HydrophobicContact CZ-CG1 3.63Å; F59-I101 HydrophobicContact CZ-CG2 3.69Å; F59-F103 HydrophobicContact CB-CE2 4.17Å; F59-F103 HydrophobicContact CB-CZ 4.02Å; F59-F103 HydrophobicContact CD2-CE2 4.28Å; F59-F103 HydrophobicContact CD2-CZ 4.34Å; F59-F103 HydrophobicContact CG-CE2 4.13Å; F59-F103 HydrophobicContact CG-CZ 4.32Å |
| 60 | F | 93.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -74.2 | -17.5 | -177 | -78.2 | -76.4 | 0 | 0 | 0 | 113.7 | V44 I56 R57 R62 Y63 V66 V85 F87 I96 I101 L110 | V44-F60 HydrophobicContact CG2-CE2 3.95Å; V44-F60 HydrophobicContact CG2-CZ 3.83Å; I56-F60 HydrophobicContact CG2-CD2 3.64Å; I56-F60 HydrophobicContact CG2-CE2 3.79Å; I56-F60 VanDerWaalsContact O-CD2 3.22Å; I56-F60 WeakPolarHBondContact O-CD2 3.26Å; I56-F60 PolarHBondContact O-N 3.29Å; R57-F60 PolarHBondContact O-N 3.5Å; F60-R62 PolarHBondContact O-N 3.3Å; F60-Y63 AromaticContact CD1-CD2 3.95Å; F60-Y63 HydrophobicContact CD1-CD2 3.95Å; F60-Y63 HydrophobicContact CD1-CE2 4.15Å; F60-Y63 PolarHBondContact O-N 2.93Å; F60-V66 HydrophobicContact CB-CG2 4.02Å; F60-V85 HydrophobicContact CB-CG1 4.09Å; F60-V85 HydrophobicContact CD2-CG1 4.49Å; F60-V85 HydrophobicContact CD2-CG2 3.99Å; F60-V85 HydrophobicContact CE2-CG2 4.2Å; F60-V85 HydrophobicContact CG-CG1 4.19Å; F60-V85 HydrophobicContact CG-CG2 4.44Å; F60-F87 HydrophobicContact CB-CE1 4.17Å; F60-F87 HydrophobicContact CB-CZ 3.93Å; F60-F87 HydrophobicContact CD1-CZ 4Å; F60-F87 HydrophobicContact CG-CZ 4.3Å; F60-I96 HydrophobicContact CD1-CG2 4.11Å; F60-I96 HydrophobicContact CE1-CG2 3.64Å; F60-I101 HydrophobicContact CE1-CD1 4.03Å; F60-I101 HydrophobicContact CE2-CD1 4.2Å; F60-I101 HydrophobicContact CZ-CD1 3.56Å; F60-L110 HydrophobicContact CZ-CD2 3.89Å |
| 61 | A | 93.5 | Very high | 93.7 | Very high | 56 Ų | 56 | 67.1 Ų | 67.1 | 46% | 0.463 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -22.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | R57 S58 F59 Y63 G64 | R57-A61 WeakPolarHBondContact O-CB 3.44Å; R57-A61 PolarHBondContact O-N 3.39Å; S58-A61 WeakPolarHBondContact O-CB 3.36Å; F59-A61 VanDerWaalsContact C-N 3.28Å; F59-A61 PolarHBondContact O-N 2.97Å; A61-Y63 VanDerWaalsContact C-N 3.25Å; A61-Y63 PolarHBondContact O-N 3.32Å; A61-G64 WeakPolarHBondContact CA-O 3.29Å; A61-G64 PolarHBondContact O-N 3.04Å |
| 62 | R | 93.1 | Very high | 94 | Very high | 184 Ų | 184 | 68.5 Ų | 68.5 | 69% | 0.694 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -23.9 | 175.9 | 78.2 | -173.2 | -61.1 | -177.4 | 2.2 | 114.1 | F59 F60 | F59-R62 WeakPolarHBondContact O-CD 3.38Å; F59-R62 VanDerWaalsContact O-CG 3.25Å; F59-R62 WeakPolarHBondContact O-CG 3.25Å; F59-R62 PolarHBondContact O-N 2.9Å; F60-R62 PolarHBondContact O-N 3.3Å |
| 63 | Y | 91.9 | Very high | 94.1 | Very high | 60 Ų | 60 | 67.3 Ų | 67.3 | 24% | 0.235 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -22.5 | -178.7 | -57.9 | -78.9 | 0 | 0 | 0 | 112.1 | F59 F60 A61 I96 S99 | F59-Y63 HydrophobicContact CD1-CE2 4.36Å; F59-Y63 AromaticContact CE1-CE2 3.87Å; F59-Y63 HydrophobicContact CE1-CE2 3.87Å; F60-Y63 AromaticContact CD1-CD2 3.95Å; F60-Y63 HydrophobicContact CD1-CD2 3.95Å; F60-Y63 HydrophobicContact CD1-CE2 4.15Å; F60-Y63 PolarHBondContact O-N 2.93Å; A61-Y63 VanDerWaalsContact C-N 3.25Å; A61-Y63 PolarHBondContact O-N 3.32Å; Y63-I96 HydrophobicContact CD1-CG1 3.78Å; Y63-I96 HydrophobicContact CD2-CG1 4.36Å; Y63-I96 HydrophobicContact CE1-CG1 4.26Å; Y63-I96 HydrophobicContact CE2-CG2 4.5Å; Y63-I96 HydrophobicContact CG-CD1 4.19Å; Y63-I96 HydrophobicContact CG-CG1 3.82Å; Y63-S99 WeakPolarHBondContact OH-CB 3.46Å; Y63-S99 PolarHBondContact OH-OG 3.28Å |
| 64 | G | 93 | Very high | 94.2 | Very high | 14 Ų | 14 | 66.5 Ų | 66.5 | 14% | 0.144 | 34% | 0.337 | C | S | . | . | S | Bend | trans | 168.8 | 177.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | A61 V66 | A61-G64 WeakPolarHBondContact CA-O 3.29Å; A61-G64 PolarHBondContact O-N 3.04Å; G64-V66 PolarHBondContact O-N 3.2Å |
| 65 | S | 96 | Very high | 94.3 | Very high | 63 Ų | 63 | 72.9 Ų | 72.9 | 44% | 0.441 | 35% | 0.35 | S | S | . | . | trans | -70.4 | 112.6 | 177.2 | -173.5 | 0 | 0 | 0 | 0 | 110.5 | K67 F87 F88 N89 | S65-K67 PolarHBondContact O-N 3.08Å; S65-F87 WeakPolarHBondContact O-CA 3.5Å; S65-F88 PolarHBondContact O-N 2.93Å; S65-N89 PolarHBondContact N-ND2 2.8Å | ||
| 66 | V | 96.4 | Very high | 94.3 | Very high | 6 Ų | 6 | 74 Ų | 74 | 4% | 0.036 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 122 | -179.8 | -178.3 | 0 | 0 | 0 | 0 | 109.6 | R57 F60 G64 V69 V85 F87 | R57-V66 HydrophobicContact CG-CB 4.04Å; R57-V66 HydrophobicContact CG-CG1 4Å; R57-V66 HydrophobicContact CG-CG2 4.38Å; F60-V66 HydrophobicContact CB-CG2 4.02Å; G64-V66 PolarHBondContact O-N 3.2Å; V66-V69 HydrophobicContact CG1-CG2 3.6Å; V66-V85 HydrophobicContact CG1-CG1 3.9Å; V66-V85 HydrophobicContact CG2-CG1 4.43Å; V66-F87 HydrophobicContact CG2-CD1 4.12Å; V66-F87 HydrophobicContact CG2-CE1 3.77Å |
| 67 | K | 95.3 | Very high | 94.1 | Very high | 122 Ų | 122 | 76.5 Ų | 76.5 | 53% | 0.53 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.6 | -53.3 | 177.4 | 173.7 | 176.3 | 179.7 | -178.2 | 0 | 112.3 | S65 S86 F88 | S65-K67 PolarHBondContact O-N 3.08Å; K67-S86 WeakPolarHBondContact CA-O 3.32Å; K67-S86 WeakPolarHBondContact CB-O 3.26Å; K67-S86 PolarHBondContact N-O 2.87Å; K67-F88 HydrophobicContact CB-CD1 4.07Å; K67-F88 HydrophobicContact CB-CD2 3.65Å; K67-F88 HydrophobicContact CB-CE1 4.04Å; K67-F88 HydrophobicContact CB-CE2 3.66Å; K67-F88 HydrophobicContact CB-CG 3.88Å; K67-F88 HydrophobicContact CB-CZ 3.84Å; K67-F88 HydrophobicContact CD-CD1 4.05Å; K67-F88 HydrophobicContact CD-CE1 3.84Å; K67-F88 HydrophobicContact CD-CZ 4.3Å; K67-F88 HydrophobicContact CG-CD1 4.1Å; K67-F88 HydrophobicContact CG-CD2 4.34Å; K67-F88 HydrophobicContact CG-CE1 3.68Å; K67-F88 HydrophobicContact CG-CE2 3.97Å; K67-F88 HydrophobicContact CG-CG 4.41Å; K67-F88 HydrophobicContact CG-CZ 3.6Å |
| 68 | E | 94.9 | Very high | 93.9 | Very high | 106 Ų | 106 | 74.8 Ų | 74.8 | 50% | 0.495 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.8 | 140.6 | -174.7 | -176.5 | 179.4 | -154.8 | 0 | 0 | 108.3 | S86 | E68-S86 PolarHBondContact N-O 3.43Å; E68-S86 PolarHBondContact O-N 3.35Å |
| 69 | V | 96.3 | Very high | 93.8 | Very high | 7 Ų | 7 | 72.5 Ų | 72.5 | 4% | 0.042 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 125.2 | 167 | 179.5 | 0 | 0 | 0 | 0 | 106.4 | E53 I56 R57 V66 F84 V85 | E53-V69 HydrophobicContact CG-CB 3.43Å; E53-V69 VanDerWaalsContact CG-CB 3.43Å; E53-V69 HydrophobicContact CG-CG1 3.53Å; E53-V69 HydrophobicContact CG-CG2 4.38Å; E53-V69 VanDerWaalsContact OE1-O 3.11Å; I56-V69 HydrophobicContact CB-CG1 4.31Å; I56-V69 HydrophobicContact CG2-CG1 3.87Å; R57-V69 HydrophobicContact CB-CG2 3.95Å; R57-V69 HydrophobicContact CG-CG2 4.36Å; V66-V69 HydrophobicContact CG1-CG2 3.6Å; V69-F84 CarbonylContact C-O 3.59Å; V69-F84 WeakPolarHBondContact CA-O 3.17Å; V69-V85 HydrophobicContact CG1-CG2 4.16Å; V69-V85 HydrophobicContact CG2-CG1 4.2Å; V69-V85 HydrophobicContact CG2-CG2 4.21Å |
| 70 | K | 94.8 | Very high | 93.9 | Very high | 114 Ų | 114 | 75.4 Ų | 75.4 | 50% | 0.496 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 101.6 | -175.7 | -174.1 | 171.3 | -175.9 | 163.5 | 0 | 110.1 | I72 G83 F84 | K70-I72 HydrophobicContact CD-CD1 4.32Å; K70-I72 HydrophobicContact CG-CD1 4.06Å; K70-G83 CarbonylContact O-C 3.56Å; K70-G83 WeakPolarHBondContact O-CA 3.49Å; K70-F84 PolarHBondContact N-O 2.98Å; K70-F84 PolarHBondContact O-N 3.05Å |
| 71 | I | 94.8 | Very high | 93.8 | Very high | 41 Ų | 41 | 76.3 Ų | 76.3 | 21% | 0.21 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 128 | 171.7 | -57.8 | 176.5 | 0 | 0 | 0 | 108.1 | I47 E53 I56 S79 | I47-I71 HydrophobicContact CD1-CG1 4.5Å; E53-I71 HydrophobicContact CB-CD1 4.35Å; I56-I71 HydrophobicContact CD1-CD1 4.14Å; I56-I71 HydrophobicContact CD1-CG1 4.48Å; I71-S79 WeakPolarHBondContact CG2-OG 3.19Å |
| 72 | I | 94.1 | Very high | 93.9 | Very high | 37 Ų | 37 | 76.8 Ų | 76.8 | 19% | 0.19 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 118 | -179.8 | -55.7 | -57.8 | 0 | 0 | 0 | 109.1 | K70 K80 Y82 F84 | K70-I72 HydrophobicContact CD-CD1 4.32Å; K70-I72 HydrophobicContact CG-CD1 4.06Å; I72-K80 HydrophobicContact CG2-CD 3.82Å; I72-K80 HydrophobicContact CG2-CG 4.39Å; I72-K80 WeakPolarHBondContact O-CB 3.44Å; I72-K80 PolarHBondContact O-N 3.33Å; I72-Y82 HydrophobicContact CB-CD2 4.16Å; I72-Y82 HydrophobicContact CB-CE2 3.71Å; I72-Y82 HydrophobicContact CG1-CD2 3.97Å; I72-Y82 HydrophobicContact CG1-CE2 3.56Å; I72-Y82 HydrophobicContact CG2-CE2 4.07Å; I72-Y82 PolarHBondContact N-O 3.08Å; I72-F84 HydrophobicContact CD1-CD2 4.15Å; I72-F84 HydrophobicContact CD1-CE2 4.12Å; I72-F84 HydrophobicContact CG1-CD2 4.1Å; I72-F84 HydrophobicContact CG1-CE2 3.84Å |
| 73 | T | 94.2 | Very high | 94 | Very high | 77 Ų | 77 | 68.1 Ų | 68.1 | 47% | 0.472 | 36% | 0.356 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 154.7 | 173.1 | 59.2 | 0 | 0 | 0 | 0 | 110.7 | V78 | T73-V78 CarbonylContact C-O 3.59Å; T73-V78 VanDerWaalsContact CA-O 3.27Å; T73-V78 WeakPolarHBondContact CA-O 3.49Å |
| 74 | D | 94.3 | Very high | 94.2 | Very high | 72 Ų | 72 | 67.9 Ų | 67.9 | 39% | 0.385 | 36% | 0.356 | S | S | . | . | P | Polyproline II helix | trans | -75.3 | 173.1 | 169.1 | -167.5 | 21.2 | 0 | 0 | 0 | 111 | T76 G77 V78 K80 | D74-T76 PolarHBondContact O-N 3.06Å; D74-T76 VanDerWaalsContact O-N 3.1Å; D74-G77 PolarHBondContact O-N 3.1Å; D74-V78 PolarHBondContact N-O 2.87Å; D74-K80 HydrophobicContact CB-CG 4.35Å |
| 75 | R | 94.7 | Very high | 94.3 | Very high | 234 Ų | 234 | 67.3 Ų | 67.3 | 88% | 0.883 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -23.6 | 176.3 | 71.6 | -179.1 | 85.2 | -173.2 | 6 | 113.6 | G77 | R75-G77 VanDerWaalsContact C-N 3.28Š|
| 76 | T | 93.3 | Very high | 94.3 | Very high | 100 Ų | 100 | 65.5 Ų | 65.5 | 61% | 0.613 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -3.7 | 178 | 58.5 | 0 | 0 | 0 | 0 | 113 | D74 V78 | D74-T76 PolarHBondContact O-N 3.06Å; D74-T76 VanDerWaalsContact O-N 3.1Å; T76-V78 VanDerWaalsContact C-N 3.3Å |
| 77 | G | 90.3 | Very high | 94.3 | Very high | 53 Ų | 53 | 65.7 Ų | 65.7 | 55% | 0.546 | 34% | 0.337 | S | S | . | . | S | Bend | trans | 84.9 | -3.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | D74 R75 | D74-G77 PolarHBondContact O-N 3.1Å; R75-G77 VanDerWaalsContact C-N 3.28Å |
| 78 | V | 90.4 | Very high | 94.3 | Very high | 89 Ų | 89 | 66.2 Ų | 66.2 | 54% | 0.539 | 34% | 0.34 | S | S | . | . | trans | -77.8 | 132.5 | 178.7 | -178.7 | 0 | 0 | 0 | 0 | 110.4 | T73 D74 T76 K80 | T73-V78 CarbonylContact C-O 3.59Å; T73-V78 VanDerWaalsContact CA-O 3.27Å; T73-V78 WeakPolarHBondContact CA-O 3.49Å; D74-V78 PolarHBondContact N-O 2.87Å; T76-V78 VanDerWaalsContact C-N 3.3Å; V78-K80 PolarHBondContact O-N 3.41Å | ||
| 79 | S | 92.8 | Very high | 94.2 | Very high | 33 Ų | 33 | 65.3 Ų | 65.3 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60 | 133.7 | 175.5 | -179.9 | 0 | 0 | 0 | 0 | 111.5 | I71 G81 | I71-S79 WeakPolarHBondContact CG2-OG 3.19Å; S79-G81 PolarHBondContact O-N 3.19Å; S79-G81 PolarHBondContact OG-N 3.48Å; S79-G81 VanDerWaalsContact OG-N 3.14Å |
| 80 | K | 93.1 | Very high | 94 | Very high | 115 Ų | 115 | 72 Ų | 72 | 50% | 0.5 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.5 | 2.2 | 173 | -57 | -172.7 | 80.2 | -176.4 | 0 | 112.4 | I72 D74 V78 Y82 | I72-K80 HydrophobicContact CG2-CD 3.82Å; I72-K80 HydrophobicContact CG2-CG 4.39Å; I72-K80 WeakPolarHBondContact O-CB 3.44Å; I72-K80 PolarHBondContact O-N 3.33Å; D74-K80 HydrophobicContact CB-CG 4.35Å; V78-K80 PolarHBondContact O-N 3.41Å; K80-Y82 VanDerWaalsContact C-N 3.33Å; K80-Y82 HydrophobicContact CB-CD1 3.74Å; K80-Y82 HydrophobicContact CB-CE1 3.4Å; K80-Y82 HydrophobicContact CD-CE1 4Å; K80-Y82 HydrophobicContact CG-CE1 4.32Å; K80-Y82 WeakPolarHBondContact O-CD1 3.18Å |
| 81 | G | 93.1 | Very high | 93.8 | Very high | 19 Ų | 19 | 67.4 Ų | 67.4 | 20% | 0.196 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 75.6 | 19 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | G45 G46 I47 S79 | G45-G81 CarbonylContact C-O 3.44Å; G46-G81 PolarHBondContact N-O 3Å; I47-G81 PolarHBondContact N-O 3.03Å; I47-G81 VanDerWaalsContact O-CA 3.3Å; I47-G81 WeakPolarHBondContact O-CA 3.43Å; S79-G81 PolarHBondContact O-N 3.19Å; S79-G81 PolarHBondContact OG-N 3.48Å; S79-G81 VanDerWaalsContact OG-N 3.14Å |
| 82 | Y | 94.8 | Very high | 93.7 | Very high | 67 Ų | 67 | 70.2 Ų | 70.2 | 26% | 0.263 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 160.3 | 173 | 69.9 | -89.2 | 0 | 0 | 0 | 112 | F43 V44 I72 K80 F84 | F43-Y82 AromaticContact CE2-CD2 3.78Å; F43-Y82 HydrophobicContact CE2-CD2 3.78Å; F43-Y82 AromaticContact CE2-CG 3.99Å; F43-Y82 HydrophobicContact CE2-CG 3.99Å; F43-Y82 HydrophobicContact CZ-CG 4.49Å; V44-Y82 CarbonylContact O-C 3.49Å; V44-Y82 WeakPolarHBondContact O-CA 3.45Å; V44-Y82 WeakPolarHBondContact O-CB 3.28Å; I72-Y82 HydrophobicContact CB-CD2 4.16Å; I72-Y82 HydrophobicContact CB-CE2 3.71Å; I72-Y82 HydrophobicContact CG1-CD2 3.97Å; I72-Y82 HydrophobicContact CG1-CE2 3.56Å; I72-Y82 HydrophobicContact CG2-CE2 4.07Å; I72-Y82 PolarHBondContact N-O 3.08Å; K80-Y82 VanDerWaalsContact C-N 3.33Å; K80-Y82 HydrophobicContact CB-CD1 3.74Å; K80-Y82 HydrophobicContact CB-CE1 3.4Å; K80-Y82 HydrophobicContact CD-CE1 4Å; K80-Y82 HydrophobicContact CG-CE1 4.32Å; K80-Y82 WeakPolarHBondContact O-CD1 3.18Å; Y82-F84 HydrophobicContact CD2-CE2 4.36Å; Y82-F84 HydrophobicContact CE2-CE2 4.21Å; Y82-F84 HydrophobicContact CE2-CZ 4.46Å |
| 83 | G | 95.1 | Very high | 93.6 | Very high | 2 Ų | 2 | 69.7 Ų | 69.7 | 2% | 0.021 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.9 | -178.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V44 K70 | V44-G83 PolarHBondContact N-O 3.07Å; V44-G83 PolarHBondContact O-N 3.46Å; K70-G83 CarbonylContact O-C 3.56Å; K70-G83 WeakPolarHBondContact O-CA 3.49Å |
| 84 | F | 96 | Very high | 93.4 | Very high | 55 Ų | 55 | 72.3 Ų | 72.3 | 24% | 0.241 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 138 | 179.9 | -59.1 | -82.6 | 0 | 0 | 0 | 109.9 | T41 V42 F43 V69 K70 I72 Y82 A113 | T41-F84 HydrophobicContact CG2-CB 4.2Å; V42-F84 WeakPolarHBondContact O-CA 3.36Å; F43-F84 HydrophobicContact CB-CD1 4.42Å; F43-F84 HydrophobicContact CB-CE1 4.32Å; F43-F84 HydrophobicContact CD2-CD1 4.41Å; F43-F84 AromaticContact CD2-CE1 3.83Å; F43-F84 HydrophobicContact CD2-CE1 3.83Å; F43-F84 HydrophobicContact CD2-CZ 4.22Å; V69-F84 CarbonylContact C-O 3.59Å; V69-F84 WeakPolarHBondContact CA-O 3.17Å; K70-F84 PolarHBondContact N-O 2.98Å; K70-F84 PolarHBondContact O-N 3.05Å; I72-F84 HydrophobicContact CD1-CD2 4.15Å; I72-F84 HydrophobicContact CD1-CE2 4.12Å; I72-F84 HydrophobicContact CG1-CD2 4.1Å; I72-F84 HydrophobicContact CG1-CE2 3.84Å; Y82-F84 HydrophobicContact CD2-CE2 4.36Å; Y82-F84 HydrophobicContact CE2-CE2 4.21Å; Y82-F84 HydrophobicContact CE2-CZ 4.46Å; F84-A113 HydrophobicContact CD1-CB 3.82Å; F84-A113 HydrophobicContact CE1-CB 4.2Å |
| 85 | V | 96.5 | Very high | 93.3 | Very high | 1 Ų | 1 | 75.4 Ų | 75.4 | 1% | 0.006 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 116.2 | 175 | -179.3 | 0 | 0 | 0 | 0 | 107.8 | T41 V42 V44 I56 F60 V66 V69 F87 | T41-V85 CarbonylContact C-O 3.58Å; T41-V85 VanDerWaalsContact CA-O 3.26Å; T41-V85 WeakPolarHBondContact CA-O 3.09Å; V42-V85 PolarHBondContact N-O 3.03Å; V42-V85 PolarHBondContact O-N 3.23Å; V44-V85 HydrophobicContact CG2-CG2 3.76Å; I56-V85 HydrophobicContact CG2-CG2 3.85Å; F60-V85 HydrophobicContact CB-CG1 4.09Å; F60-V85 HydrophobicContact CD2-CG1 4.49Å; F60-V85 HydrophobicContact CD2-CG2 3.99Å; F60-V85 HydrophobicContact CE2-CG2 4.2Å; F60-V85 HydrophobicContact CG-CG1 4.19Å; F60-V85 HydrophobicContact CG-CG2 4.44Å; V66-V85 HydrophobicContact CG1-CG1 3.9Å; V66-V85 HydrophobicContact CG2-CG1 4.43Å; V69-V85 HydrophobicContact CG1-CG2 4.16Å; V69-V85 HydrophobicContact CG2-CG1 4.2Å; V69-V85 HydrophobicContact CG2-CG2 4.21Å; V85-F87 HydrophobicContact CB-CE2 4.36Å; V85-F87 HydrophobicContact CG1-CD2 4.43Å; V85-F87 HydrophobicContact CG1-CE1 4.34Å; V85-F87 HydrophobicContact CG1-CE2 3.74Å; V85-F87 HydrophobicContact CG1-CZ 3.69Å |
| 86 | S | 95.6 | Very high | 93.2 | Very high | 26 Ų | 26 | 64.4 Ų | 64.4 | 18% | 0.182 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 142 | 175.3 | -70.3 | 0 | 0 | 0 | 0 | 110.6 | N40 T41 K67 E68 | N40-S86 WeakPolarHBondContact O-CA 3.33Å; T41-S86 WeakPolarHBondContact CG2-OG 3.27Å; T41-S86 PolarHBondContact OG1-OG 3.37Å; T41-S86 VanDerWaalsContact OG1-OG 3.08Å; K67-S86 WeakPolarHBondContact CA-O 3.32Å; K67-S86 WeakPolarHBondContact CB-O 3.26Å; K67-S86 PolarHBondContact N-O 2.87Å; E68-S86 PolarHBondContact N-O 3.43Å; E68-S86 PolarHBondContact O-N 3.35Å |
| 87 | F | 96.9 | Very high | 93.1 | Very high | 10 Ų | 10 | 60 Ų | 60 | 4% | 0.044 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 153.5 | 179.8 | -62.2 | -92.8 | 0 | 0 | 0 | 111.3 | N40 V42 F60 S65 V66 V85 V91 I96 | N40-F87 HydrophobicContact CB-CB 4.47Å; N40-F87 PolarHBondContact O-N 3.16Å; V42-F87 HydrophobicContact CG2-CE2 3.88Å; F60-F87 HydrophobicContact CB-CE1 4.17Å; F60-F87 HydrophobicContact CB-CZ 3.93Å; F60-F87 HydrophobicContact CD1-CZ 4Å; F60-F87 HydrophobicContact CG-CZ 4.3Å; S65-F87 WeakPolarHBondContact O-CA 3.5Å; V66-F87 HydrophobicContact CG2-CD1 4.12Å; V66-F87 HydrophobicContact CG2-CE1 3.77Å; V85-F87 HydrophobicContact CB-CE2 4.36Å; V85-F87 HydrophobicContact CG1-CD2 4.43Å; V85-F87 HydrophobicContact CG1-CE1 4.34Å; V85-F87 HydrophobicContact CG1-CE2 3.74Å; V85-F87 HydrophobicContact CG1-CZ 3.69Å; F87-V91 HydrophobicContact CB-CG1 4.01Å; F87-V91 HydrophobicContact CB-CG2 3.97Å; F87-V91 HydrophobicContact CD1-CG1 4.06Å; F87-V91 HydrophobicContact CD2-CG1 4.47Å; F87-V91 HydrophobicContact CD2-CG2 3.56Å; F87-V91 HydrophobicContact CE2-CG2 4.17Å; F87-V91 HydrophobicContact CG-CG1 3.93Å; F87-V91 HydrophobicContact CG-CG2 3.79Å; F87-I96 HydrophobicContact CE2-CD1 4.21Å; F87-I96 HydrophobicContact CZ-CD1 4.23Å |
| 88 | F | 94.6 | Very high | 93.2 | Very high | 132 Ų | 132 | 63.2 Ų | 63.2 | 58% | 0.579 | 32% | 0.319 | S | S | * | . | S | Bend | trans | -79.9 | -35.4 | 169.9 | -76.7 | -70.6 | 0 | 0 | 0 | 112.2 | S65 K67 | S65-F88 PolarHBondContact O-N 2.93Å; K67-F88 HydrophobicContact CB-CD1 4.07Å; K67-F88 HydrophobicContact CB-CD2 3.65Å; K67-F88 HydrophobicContact CB-CE1 4.04Å; K67-F88 HydrophobicContact CB-CE2 3.66Å; K67-F88 HydrophobicContact CB-CG 3.88Å; K67-F88 HydrophobicContact CB-CZ 3.84Å; K67-F88 HydrophobicContact CD-CD1 4.05Å; K67-F88 HydrophobicContact CD-CE1 3.84Å; K67-F88 HydrophobicContact CD-CZ 4.3Å; K67-F88 HydrophobicContact CG-CD1 4.1Å; K67-F88 HydrophobicContact CG-CD2 4.34Å; K67-F88 HydrophobicContact CG-CE1 3.68Å; K67-F88 HydrophobicContact CG-CE2 3.97Å; K67-F88 HydrophobicContact CG-CG 4.41Å; K67-F88 HydrophobicContact CG-CZ 3.6Å |
| 89 | N | 92 | Very high | 93.2 | Very high | 87 Ų | 87 | 60.5 Ų | 60.5 | 47% | 0.465 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -87.8 | 155.2 | -178.4 | -56.9 | -19.4 | 0 | 0 | 0 | 110.1 | S65 V91 | S65-N89 PolarHBondContact N-ND2 2.8Å; N89-V91 PolarHBondContact O-N 2.89Å |
| 90 | D | 91.9 | Very high | 93 | Very high | 147 Ų | 147 | 65.3 Ų | 65.3 | 79% | 0.786 | 32% | 0.323 | S | S | * | . | trans | -64.8 | 114.9 | 164.4 | -82.2 | -68.6 | 0 | 0 | 0 | 109.1 | N40 | N40-D90 PolarHBondContact ND2-OD1 2.92Å; N40-D90 WeakPolarHBondContact OD1-CA 3.4Å; N40-D90 PolarHBondContact OD1-OD1 3.22Å | ||
| 91 | V | 91.6 | Very high | 92.8 | Very high | 18 Ų | 18 | 60 Ų | 60 | 11% | 0.109 | 30% | 0.3 | C | S | . | . | trans | -117.4 | 140.4 | -178.9 | -67.2 | 0 | 0 | 0 | 0 | 109.3 | N40 F87 N89 V93 I96 | N40-V91 HydrophobicContact CB-CG2 4.35Å; N40-V91 PolarHBondContact OD1-N 2.78Å; F87-V91 HydrophobicContact CB-CG1 4.01Å; F87-V91 HydrophobicContact CB-CG2 3.97Å; F87-V91 HydrophobicContact CD1-CG1 4.06Å; F87-V91 HydrophobicContact CD2-CG1 4.47Å; F87-V91 HydrophobicContact CD2-CG2 3.56Å; F87-V91 HydrophobicContact CE2-CG2 4.17Å; F87-V91 HydrophobicContact CG-CG1 3.93Å; F87-V91 HydrophobicContact CG-CG2 3.79Å; N89-V91 PolarHBondContact O-N 2.89Å; V91-V93 VanDerWaalsContact C-N 3.35Å; V91-V93 HydrophobicContact CG2-CG2 4.44Å; V91-V93 PolarHBondContact O-N 2.92Å; V91-I96 HydrophobicContact CB-CD1 3.99Å; V91-I96 HydrophobicContact CG2-CD1 3.99Å | ||
| 92 | D | 91.8 | Very high | 92.6 | Very high | 101 Ų | 101 | 64 Ų | 64 | 54% | 0.54 | 32% | 0.316 | S | S | . | . | trans | -72.9 | 93.5 | 172.5 | -173.4 | -7.5 | 0 | 0 | 0 | 109.5 | Q94 K95 I96 | D92-Q94 PolarHBondContact O-N 3.09Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.02Å; D92-Q94 PolarHBondContact OD1-N 3.21Å; D92-K95 HydrophobicContact CB-CB 4.05Å; D92-K95 PolarHBondContact O-N 2.94Å; D92-K95 PolarHBondContact OD1-N 3.35Å; D92-I96 WeakPolarHBondContact O-CG1 3.39Å; D92-I96 PolarHBondContact O-N 3.26Å | ||
| 93 | V | 91.8 | Very high | 92.2 | Very high | 26 Ų | 26 | 62.4 Ų | 62.4 | 16% | 0.158 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -57.1 | -35.8 | 178.4 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | V42 V91 I96 V97 P112 | V42-V93 HydrophobicContact CG2-CG1 4.23Å; V42-V93 HydrophobicContact CG2-CG2 4.33Å; V91-V93 VanDerWaalsContact C-N 3.35Å; V91-V93 HydrophobicContact CG2-CG2 4.44Å; V91-V93 PolarHBondContact O-N 2.92Å; V93-I96 PolarHBondContact O-N 2.87Å; V93-V97 HydrophobicContact CG1-CG1 4.14Å; V93-V97 WeakPolarHBondContact O-CG1 3.39Å; V93-V97 PolarHBondContact O-N 3.38Å; V93-P112 HydrophobicContact CG1-CB 4.5Å |
| 94 | Q | 90.8 | Very high | 91.7 | Very high | 132 Ų | 132 | 67 Ų | 67 | 62% | 0.617 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -64.9 | -45.3 | -177.7 | -166.7 | 170.7 | -9.6 | 0 | 0 | 111.1 | D92 I96 V97 E98 | D92-Q94 PolarHBondContact O-N 3.09Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.02Å; D92-Q94 PolarHBondContact OD1-N 3.21Å; Q94-I96 VanDerWaalsContact C-N 3.28Å; Q94-I96 PolarHBondContact O-N 3.46Å; Q94-V97 WeakPolarHBondContact O-CG2 3.12Å; Q94-V97 PolarHBondContact O-N 2.82Å; Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 2.79Å; Q94-E98 VanDerWaalsContact O-N 3.16Å |
| 95 | K | 92.1 | Very high | 91.3 | Very high | 136 Ų | 136 | 68.4 Ų | 68.4 | 59% | 0.591 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -62.1 | -35.7 | 174.6 | -173 | 178.6 | -177.3 | 179.4 | 0 | 113 | D92 S99 | D92-K95 HydrophobicContact CB-CB 4.05Å; D92-K95 PolarHBondContact O-N 2.94Å; D92-K95 PolarHBondContact OD1-N 3.35Å; K95-S99 PolarHBondContact O-OG 2.88Å |
| 96 | I | 92.4 | Very high | 90.9 | Very high | 3 Ų | 3 | 73.6 Ų | 73.6 | 2% | 0.015 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -69.5 | -43.3 | 177.7 | -62 | 167 | 0 | 0 | 0 | 110.3 | V42 F60 Y63 F87 V91 D92 V93 Q94 E98 S99 L110 | V42-I96 HydrophobicContact CG1-CG2 4.15Å; V42-I96 HydrophobicContact CG2-CB 4.35Å; V42-I96 HydrophobicContact CG2-CD1 4.09Å; V42-I96 HydrophobicContact CG2-CG2 4.06Å; F60-I96 HydrophobicContact CD1-CG2 4.11Å; F60-I96 HydrophobicContact CE1-CG2 3.64Å; Y63-I96 HydrophobicContact CD1-CG1 3.78Å; Y63-I96 HydrophobicContact CD2-CG1 4.36Å; Y63-I96 HydrophobicContact CE1-CG1 4.26Å; Y63-I96 HydrophobicContact CE2-CG2 4.5Å; Y63-I96 HydrophobicContact CG-CD1 4.19Å; Y63-I96 HydrophobicContact CG-CG1 3.82Å; F87-I96 HydrophobicContact CE2-CD1 4.21Å; F87-I96 HydrophobicContact CZ-CD1 4.23Å; V91-I96 HydrophobicContact CB-CD1 3.99Å; V91-I96 HydrophobicContact CG2-CD1 3.99Å; D92-I96 WeakPolarHBondContact O-CG1 3.39Å; D92-I96 PolarHBondContact O-N 3.26Å; V93-I96 PolarHBondContact O-N 2.87Å; Q94-I96 VanDerWaalsContact C-N 3.28Å; Q94-I96 PolarHBondContact O-N 3.46Å; I96-E98 VanDerWaalsContact C-N 3.27Å; I96-E98 PolarHBondContact O-N 3.44Å; I96-S99 WeakPolarHBondContact O-CB 3.35Å; I96-S99 PolarHBondContact O-N 2.97Å; I96-S99 PolarHBondContact O-OG 3.14Å; I96-L110 HydrophobicContact CG2-CD1 4.45Å; I96-L110 WeakPolarHBondContact O-CD1 3.39Å |
| 97 | V | 92.2 | Very high | 90.8 | Very high | 7 Ų | 7 | 78.2 Ų | 78.2 | 4% | 0.042 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -69.5 | -25.3 | -177.8 | -59.1 | 0 | 0 | 0 | 0 | 113.4 | V42 V93 Q94 S99 L110 G111 | V42-V97 HydrophobicContact CG1-CG1 4.35Å; V93-V97 HydrophobicContact CG1-CG1 4.14Å; V93-V97 WeakPolarHBondContact O-CG1 3.39Å; V93-V97 PolarHBondContact O-N 3.38Å; Q94-V97 WeakPolarHBondContact O-CG2 3.12Å; Q94-V97 PolarHBondContact O-N 2.82Å; V97-S99 PolarHBondContact O-N 3.14Å; V97-L110 HydrophobicContact CB-CB 4.12Å; V97-L110 HydrophobicContact CG1-CB 4.19Å; V97-G111 VanDerWaalsContact CG1-CA 3.45Å |
| 98 | E | 91.1 | Very high | 90.6 | Very high | 122 Ų | 122 | 78.1 Ų | 78.1 | 57% | 0.57 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -17.8 | 171.6 | -71.6 | 172.5 | -169.3 | 0 | 0 | 112.8 | Q94 I96 Q100 | Q94-E98 WeakPolarHBondContact O-CG 3.41Å; Q94-E98 PolarHBondContact O-N 2.79Å; Q94-E98 VanDerWaalsContact O-N 3.16Å; I96-E98 VanDerWaalsContact C-N 3.27Å; I96-E98 PolarHBondContact O-N 3.44Å; E98-Q100 PolarHBondContact O-N 3.47Å |
| 99 | S | 90 | Very high | 90.5 | Very high | 32 Ų | 32 | 77.1 Ų | 77.1 | 22% | 0.224 | 40% | 0.396 | C | S | . | . | trans | -72.1 | 125.4 | 179.2 | -61.1 | 0 | 0 | 0 | 0 | 111.2 | Y63 K95 I96 V97 L110 | Y63-S99 WeakPolarHBondContact OH-CB 3.46Å; Y63-S99 PolarHBondContact OH-OG 3.28Å; K95-S99 PolarHBondContact O-OG 2.88Å; I96-S99 WeakPolarHBondContact O-CB 3.35Å; I96-S99 PolarHBondContact O-N 2.97Å; I96-S99 PolarHBondContact O-OG 3.14Å; V97-S99 PolarHBondContact O-N 3.14Å; S99-L110 VanDerWaalsContact O-CD1 3.26Å; S99-L110 WeakPolarHBondContact O-CD1 3.42Å | ||
| 100 | Q | 89.1 | Confident | 90.6 | Very high | 134 Ų | 134 | 74.3 Ų | 74.3 | 63% | 0.626 | 38% | 0.381 | S | S | * | . | trans | -87.2 | 115.3 | 173.8 | 176.9 | 162.7 | -25.8 | 0 | 0 | 110.6 | E98 K107 | E98-Q100 PolarHBondContact O-N 3.47Å; Q100-K107 VanDerWaalsContact CD-CD 3.49Å; Q100-K107 HydrophobicContact CG-CD 3.62Å; Q100-K107 HydrophobicContact CG-CG 4.16Å | ||
| 101 | I | 89.1 | Confident | 90.7 | Very high | 4 Ų | 4 | 67.8 Ų | 67.8 | 2% | 0.021 | 35% | 0.348 | C | S | . | . | trans | -114.6 | 126.2 | -179.7 | -45 | 170.6 | 0 | 0 | 0 | 109.4 | F59 F60 F103 K107 L108 L110 | F59-I101 HydrophobicContact CD1-CD1 3.63Å; F59-I101 HydrophobicContact CD1-CG1 4.29Å; F59-I101 HydrophobicContact CD1-CG2 4.21Å; F59-I101 HydrophobicContact CD2-CG2 4.25Å; F59-I101 HydrophobicContact CE1-CB 4.31Å; F59-I101 HydrophobicContact CE1-CD1 3.14Å; F59-I101 HydrophobicContact CE1-CG1 3.43Å; F59-I101 VanDerWaalsContact CE1-CG1 3.43Å; F59-I101 HydrophobicContact CE1-CG2 3.88Å; F59-I101 HydrophobicContact CE2-CG2 3.89Å; F59-I101 HydrophobicContact CG-CG2 4.4Å; F59-I101 HydrophobicContact CZ-CB 4.24Å; F59-I101 HydrophobicContact CZ-CD1 3.9Å; F59-I101 HydrophobicContact CZ-CG1 3.63Å; F59-I101 HydrophobicContact CZ-CG2 3.69Å; F60-I101 HydrophobicContact CE1-CD1 4.03Å; F60-I101 HydrophobicContact CE2-CD1 4.2Å; F60-I101 HydrophobicContact CZ-CD1 3.56Å; I101-F103 HydrophobicContact CG2-CD2 3.37Å; I101-F103 HydrophobicContact CG2-CE2 3.49Å; I101-F103 VanDerWaalsContact CG2-CE2 3.49Å; I101-F103 HydrophobicContact CG2-CG 4.48Å; I101-K107 WeakPolarHBondContact O-CA 3.3Å; I101-L108 HydrophobicContact CB-CB 4.42Å; I101-L108 HydrophobicContact CB-CD1 4.36Å; I101-L108 HydrophobicContact CG2-CD1 4.25Å; I101-L108 PolarHBondContact O-N 3.22Å; I101-L110 HydrophobicContact CD1-CD1 3.65Å; I101-L110 HydrophobicContact CD1-CD2 4.22Å; I101-L110 HydrophobicContact CD1-CG 4.41Å; I101-L110 HydrophobicContact CG1-CD1 4.12Å | ||
| 102 | N | 89.3 | Confident | 90.8 | Very high | 101 Ų | 101 | 68 Ų | 68 | 54% | 0.54 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 133.2 | 178.7 | -56.8 | -22.2 | 0 | 0 | 0 | 109.7 | K106 | N102-K106 WeakPolarHBondContact CA-O 3.46Å |
| 103 | F | 87 | Confident | 91 | Very high | 35 Ų | 35 | 63.3 Ų | 63.3 | 15% | 0.154 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.6 | 115.8 | -162 | -113.8 | -48.4 | 0 | 0 | 0 | 106.4 | M51 E55 F59 I101 G105 K106 L108 | M51-F103 HydrophobicContact CE-CB 3.14Å; M51-F103 HydrophobicContact CE-CD1 3.55Å; M51-F103 HydrophobicContact CE-CG 3.57Å; M51-F103 HydrophobicContact SD-CB 3.77Å; M51-F103 HydrophobicContact SD-CD1 3.5Å; M51-F103 WeakPolarHBondContact SD-CD1 3.22Å; M51-F103 HydrophobicContact SD-CD2 4.35Å; M51-F103 HydrophobicContact SD-CE1 4.19Å; M51-F103 HydrophobicContact SD-CG 3.6Å; M51-F103 VanDerWaalsContact SD-CG 3.6Å; E55-F103 HydrophobicContact CB-CE1 4.4Å; F59-F103 HydrophobicContact CB-CE2 4.17Å; F59-F103 HydrophobicContact CB-CZ 4.02Å; F59-F103 HydrophobicContact CD2-CE2 4.28Å; F59-F103 HydrophobicContact CD2-CZ 4.34Å; F59-F103 HydrophobicContact CG-CE2 4.13Å; F59-F103 HydrophobicContact CG-CZ 4.32Å; I101-F103 HydrophobicContact CG2-CD2 3.37Å; I101-F103 HydrophobicContact CG2-CE2 3.49Å; I101-F103 VanDerWaalsContact CG2-CE2 3.49Å; I101-F103 HydrophobicContact CG2-CG 4.48Å; F103-G105 PolarHBondContact O-N 3.19Å; F103-K106 PolarHBondContact N-O 3.23Å; F103-K106 PolarHBondContact O-N 3.32Å; F103-K106 VanDerWaalsContact O-O 3.09Å; F103-L108 HydrophobicContact CB-CD1 4.46Å; F103-L108 HydrophobicContact CB-CD2 4.42Å; F103-L108 HydrophobicContact CB-CG 4.24Å; F103-L108 HydrophobicContact CD2-CD1 3.47Å; F103-L108 VanDerWaalsContact CD2-CD1 3.47Å; F103-L108 HydrophobicContact CD2-CG 4.08Å; F103-L108 HydrophobicContact CE2-CD1 4.11Å; F103-L108 HydrophobicContact CG-CD1 4.38Å |
| 104 | H | 84.8 | Confident | 91 | Very high | 99 Ų | 99 | 63.5 Ų | 63.5 | 46% | 0.458 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 48.1 | 40.6 | -167.4 | -58.4 | -35.8 | 0 | 0 | 0 | 114.6 | M51 K106 | M51-H104 HydrophobicContact CE-CB 4.01Å; M51-H104 WeakPolarHBondContact CE-CD2 3.49Å; H104-K106 PolarHBondContact O-N 3.36Å |
| 105 | G | 86.9 | Confident | 91 | Very high | 84 Ų | 84 | 64.9 Ų | 64.9 | 87% | 0.866 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.9 | 0.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | F103 | F103-G105 PolarHBondContact O-N 3.19Š|
| 106 | K | 88.8 | Confident | 90.8 | Very high | 109 Ų | 109 | 66 Ų | 66 | 47% | 0.474 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 132.8 | 173.8 | -63 | 179.9 | -177 | 177.5 | 0 | 109.8 | D48 N102 F103 H104 | D48-K106 HydrophobicContact CB-CD 4.48Å; D48-K106 IonicContact OD1-NZ 2.8Å; D48-K106 PolarHBondContact OD1-NZ 3.27Å; N102-K106 WeakPolarHBondContact CA-O 3.46Å; F103-K106 PolarHBondContact N-O 3.23Å; F103-K106 PolarHBondContact O-N 3.32Å; F103-K106 VanDerWaalsContact O-O 3.09Å; H104-K106 PolarHBondContact O-N 3.36Å |
| 107 | K | 91.7 | Very high | 90.1 | Very high | 123 Ų | 123 | 71 Ų | 71 | 54% | 0.535 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 126.7 | 173.8 | -178 | 171.1 | 70.5 | 175 | 0 | 109.8 | Q100 I101 | Q100-K107 VanDerWaalsContact CD-CD 3.49Å; Q100-K107 HydrophobicContact CG-CD 3.62Å; Q100-K107 HydrophobicContact CG-CG 4.16Å; I101-K107 WeakPolarHBondContact O-CA 3.3Å |
| 108 | L | 93.4 | Very high | 88.8 | Confident | 8 Ų | 8 | 76.3 Ų | 76.3 | 4% | 0.042 | 38% | 0.381 | C | S | . | . | P | Polyproline II helix | trans | -72.3 | 144.4 | 172.7 | -61.2 | -173.1 | 0 | 0 | 0 | 110.6 | V44 G45 G46 I47 I101 F103 L110 | V44-L108 HydrophobicContact CG1-CB 4.49Å; V44-L108 HydrophobicContact CG1-CD1 3.82Å; G45-L108 CarbonylContact O-C 3.44Å; G45-L108 WeakPolarHBondContact O-CA 3.35Å; G46-L108 WeakPolarHBondContact O-CD2 3.41Å; I47-L108 HydrophobicContact CG1-CD2 4.47Å; I101-L108 HydrophobicContact CB-CB 4.42Å; I101-L108 HydrophobicContact CB-CD1 4.36Å; I101-L108 HydrophobicContact CG2-CD1 4.25Å; I101-L108 PolarHBondContact O-N 3.22Å; F103-L108 HydrophobicContact CB-CD1 4.46Å; F103-L108 HydrophobicContact CB-CD2 4.42Å; F103-L108 HydrophobicContact CB-CG 4.24Å; F103-L108 HydrophobicContact CD2-CD1 3.47Å; F103-L108 VanDerWaalsContact CD2-CD1 3.47Å; F103-L108 HydrophobicContact CD2-CG 4.08Å; F103-L108 HydrophobicContact CE2-CD1 4.11Å; F103-L108 HydrophobicContact CG-CD1 4.38Å; L108-L110 HydrophobicContact CB-CD2 4.42Å |
| 109 | K | 93.3 | Very high | 87.3 | Confident | 112 Ų | 112 | 78.3 Ų | 78.3 | 49% | 0.487 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 112 | 175 | -61.7 | -173.1 | -179.9 | -171.1 | 0 | 108.6 | Y30 G45 | Y30-K109 PolarHBondContact OH-NZ 2.8Å; G45-K109 PolarHBondContact N-O 3.46Å; G45-K109 PolarHBondContact O-N 3.37Å |
| 110 | L | 94.3 | Very high | 85.5 | Confident | 27 Ų | 27 | 82.2 Ų | 82.2 | 14% | 0.141 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 146.3 | 178.3 | -53.9 | -177.2 | 0 | 0 | 0 | 110.2 | F43 V44 F60 I96 V97 S99 I101 L108 | F43-L110 WeakPolarHBondContact O-CA 3.25Å; V44-L110 HydrophobicContact CB-CD2 4.32Å; V44-L110 HydrophobicContact CG1-CD2 4.04Å; V44-L110 HydrophobicContact CG2-CD2 4Å; F60-L110 HydrophobicContact CZ-CD2 3.89Å; I96-L110 HydrophobicContact CG2-CD1 4.45Å; I96-L110 WeakPolarHBondContact O-CD1 3.39Å; V97-L110 HydrophobicContact CB-CB 4.12Å; V97-L110 HydrophobicContact CG1-CB 4.19Å; S99-L110 VanDerWaalsContact O-CD1 3.26Å; S99-L110 WeakPolarHBondContact O-CD1 3.42Å; I101-L110 HydrophobicContact CD1-CD1 3.65Å; I101-L110 HydrophobicContact CD1-CD2 4.22Å; I101-L110 HydrophobicContact CD1-CG 4.41Å; I101-L110 HydrophobicContact CG1-CD1 4.12Å; L108-L110 HydrophobicContact CB-CD2 4.42Å |
| 111 | G | 93.7 | Very high | 83.9 | Confident | 10 Ų | 10 | 79 Ų | 79 | 10% | 0.103 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -160.3 | 169.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | F43 V97 A113 | F43-G111 WeakPolarHBondContact CB-O 3.46Å; F43-G111 PolarHBondContact N-O 2.96Å; F43-G111 PolarHBondContact O-N 3.19Å; F43-G111 VanDerWaalsContact O-N 3.09Å; V97-G111 VanDerWaalsContact CG1-CA 3.45Å; G111-A113 PolarHBondContact O-N 2.84Å |
| 112 | P | 93.6 | Very high | 82 | Confident | 24 Ų | 24 | 89.5 Ų | 89.5 | 16% | 0.156 | 46% | 0.458 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.2 | 135.1 | 169.4 | -21.6 | 33.3 | 0 | 0 | 0 | 110.4 | L32 I37 V93 I114 | L32-P112 HydrophobicContact CD1-CG 4.43Å; I37-P112 HydrophobicContact CG2-CB 4.42Å; V93-P112 HydrophobicContact CG1-CB 4.5Å; P112-I114 PolarHBondContact O-N 2.83Å |
| 113 | A | 94.8 | Very high | 80.4 | Confident | 1 Ų | 1 | 91.7 Ų | 91.7 | 1% | 0.008 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 123.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | M38 T41 F84 G111 | M38-A113 HydrophobicContact CB-CB 4.04Å; M38-A113 WeakPolarHBondContact CB-O 3.5Å; M38-A113 PolarHBondContact N-O 3.43Å; T41-A113 HydrophobicContact CG2-CB 3.47Å; T41-A113 VanDerWaalsContact CG2-CB 3.47Å; T41-A113 VanDerWaalsContact O-CB 3.25Å; T41-A113 WeakPolarHBondContact O-CB 3.35Å; T41-A113 PolarHBondContact O-N 3.38Å; F84-A113 HydrophobicContact CD1-CB 3.82Å; F84-A113 HydrophobicContact CE1-CB 4.2Å; G111-A113 PolarHBondContact O-N 2.84Å |
| 114 | I | 93.1 | Very high | 78.5 | Confident | 31 Ų | 31 | 96.8 Ų | 96.8 | 16% | 0.159 | 50% | 0.499 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 122.6 | 179 | -62.1 | 164.2 | 0 | 0 | 0 | 109.1 | L32 I37 P112 | L32-I114 HydrophobicContact CB-CD1 3.56Å; L32-I114 HydrophobicContact CD1-CD1 3.91Å; L32-I114 HydrophobicContact CD2-CD1 3.75Å; L32-I114 HydrophobicContact CG-CD1 3.92Å; I37-I114 HydrophobicContact CG1-CG1 4.26Å; P112-I114 PolarHBondContact O-N 2.83Å |
| 115 | R | 90.4 | Very high | 76.8 | Confident | 161 Ų | 161 | 98 Ų | 98 | 61% | 0.608 | 51% | 0.505 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92 | 112.8 | 171 | -159.7 | -175 | -64 | -147.5 | 1.5 | 108.1 | K36 M38 Q117 | K36-R115 PolarHBondContact N-O 2.82Å; K36-R115 PolarHBondContact O-N 2.95Å; M38-R115 HydrophobicContact CG-CB 3.95Å; M38-R115 HydrophobicContact SD-CB 4.04Å; M38-R115 PolarHBondContact SD-NE 3.5Å; M38-R115 PolarHBondContact SD-NH2 2.81Å; R115-Q117 PolarHBondContact O-N 2.84Å; R115-Q117 VanDerWaalsContact O-N 3.14Å |
| 116 | K | 87.1 | Confident | 75.1 | Confident | 158 Ų | 158 | 99.4 Ų | 99.4 | 69% | 0.687 | 50% | 0.498 | S | S | * | . | trans | -59 | 118.6 | 170.6 | -173.7 | 175.6 | 179.6 | 177.3 | 0 | 108.4 | ||||
| 117 | Q | 78.2 | Confident | 73.2 | Confident | 109 Ų | 109 | 104.7 Ų | 104.7 | 51% | 0.509 | 52% | 0.515 | S | S | . | . | trans | -90 | 121.4 | 171.7 | -68.6 | -174.2 | -24.2 | 0 | 0 | 107.5 | K36 R115 L119 | K36-Q117 HydrophobicContact CB-CG 4.07Å; R115-Q117 PolarHBondContact O-N 2.84Å; R115-Q117 VanDerWaalsContact O-N 3.14Å; Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 3.47Å; Q117-L119 VanDerWaalsContact O-N 3.09Å | ||
| 118 | N | 64.9 | Low | 71.5 | Confident | 118 Ų | 118 | 104 Ų | 104 | 63% | 0.631 | 52% | 0.524 | S | S | * | . | trans | -77 | 92.6 | 165.7 | -70.1 | -48.8 | 0 | 0 | 0 | 106.8 | C120 | N118-C120 PolarHBondContact O-N 3.14Š| ||
| 119 | L | 61 | Low | 69.7 | Low | 164 Ų | 164 | 111.2 Ų | 111.2 | 86% | 0.859 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 46.2 | 177.2 | -152.2 | 82.8 | 0 | 0 | 0 | 111.3 | Q117 | Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 3.47Å; Q117-L119 VanDerWaalsContact O-N 3.09Å |
| 120 | C | 51.8 | Low | 68.1 | Low | 114 Ų | 114 | 111.5 Ų | 111.5 | 77% | 0.77 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.4 | 7.8 | 178.4 | 46.5 | 0 | 0 | 0 | 0 | 113.3 | N118 | N118-C120 PolarHBondContact O-N 3.14Š|
| 121 | A | 54.7 | Low | 66.1 | Low | 67 Ų | 67 | 118 Ų | 118 | 55% | 0.554 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -111.9 | -3.4 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 122 | Y | 48.9 | Very low | 64.2 | Low | 224 Ų | 224 | 124.1 Ų | 124.1 | 88% | 0.878 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -138.8 | 121.9 | -178.6 | -62 | -74.2 | 0 | 0 | 0 | 113.4 | ||
| 123 | H | 55.2 | Low | 62.4 | Low | 148 Ų | 148 | 130.3 Ų | 130.3 | 69% | 0.685 | 66% | 0.656 | S | S | * | * | trans | 92.3 | 64.3 | 157.8 | -137 | -120.3 | 0 | 0 | 0 | 118.3 | Q125 | H123-Q125 WeakPolarHBondContact CE1-CG 3.43Å; H123-Q125 PolarHBondContact CE1-NE2 2.85Å; H123-Q125 VanDerWaalsContact CE1-NE2 3.32Å; H123-Q125 WeakPolarHBondContact ND1-CG 2.87Å; H123-Q125 VanDerWaalsContact NE2-CD 3.27Å; H123-Q125 PolarHBondContact NE2-OE1 2.77Å; H123-Q125 PolarHBondContact O-N 3.31Å | ||
| 124 | V | 47.8 | Very low | 60.6 | Low | 142 Ų | 142 | 135.5 Ų | 135.5 | 86% | 0.861 | 69% | 0.69 | S | S | * | * | trans | -78.5 | 97.9 | 144 | -178.1 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 125 | Q | 48.7 | Very low | 59 | Low | 125 Ų | 125 | 139.4 Ų | 139.4 | 58% | 0.584 | 72% | 0.717 | S | S | * | * | trans | -62.6 | 129.5 | 162.2 | -72.3 | -74.3 | 55 | 0 | 0 | 107.3 | H123 R127 | H123-Q125 WeakPolarHBondContact CE1-CG 3.43Å; H123-Q125 PolarHBondContact CE1-NE2 2.85Å; H123-Q125 VanDerWaalsContact CE1-NE2 3.32Å; H123-Q125 WeakPolarHBondContact ND1-CG 2.87Å; H123-Q125 VanDerWaalsContact NE2-CD 3.27Å; H123-Q125 PolarHBondContact NE2-OE1 2.77Å; H123-Q125 PolarHBondContact O-N 3.31Å; Q125-R127 VanDerWaalsContact C-N 3.28Å; Q125-R127 PolarHBondContact O-N 2.78Å | ||
| 126 | P | 51.7 | Low | 57.3 | Low | 113 Ų | 113 | 136.4 Ų | 136.4 | 73% | 0.734 | 72% | 0.719 | S | S | * | * | trans | -63.7 | 100.3 | 162.7 | 25.7 | -28.1 | 0 | 0 | 0 | 106.6 | P128 | P126-P128 WeakPolarHBondContact O-CD 3.29Š| ||
| 127 | R | 48.6 | Very low | 55.5 | Low | 219 Ų | 219 | 133.8 Ų | 133.8 | 83% | 0.826 | 72% | 0.718 | S | S | * | * | trans | -63.4 | 122.4 | 170.4 | -158.4 | 178.4 | -164.7 | 168.2 | 3.6 | 106.1 | Q125 L129 | Q125-R127 VanDerWaalsContact C-N 3.28Å; Q125-R127 PolarHBondContact O-N 2.78Å; R127-L129 PolarHBondContact O-N 2.93Å | ||
| 128 | P | 56 | Low | 54.1 | Low | 110 Ų | 110 | 137 Ų | 137 | 71% | 0.714 | 73% | 0.733 | S | S | * | * | trans | -60 | 116.1 | 170 | -17.8 | 30.2 | 0 | 0 | 0 | 107.3 | P126 V130 | P126-P128 WeakPolarHBondContact O-CD 3.29Å; P128-V130 VanDerWaalsContact C-N 3.3Å; P128-V130 PolarHBondContact O-N 2.85Å | ||
| 129 | L | 55.4 | Low | 53.2 | Low | 159 Ų | 159 | 140 Ų | 140 | 83% | 0.832 | 74% | 0.74 | S | S | * | * | trans | -72.7 | 92 | 171.1 | -68 | 176.5 | 0 | 0 | 0 | 107.1 | R127 F131 | R127-L129 PolarHBondContact O-N 2.93Å; L129-F131 PolarHBondContact O-N 3.1Å | ||
| 130 | V | 59.4 | Low | 52.2 | Low | 117 Ų | 117 | 140.8 Ų | 140.8 | 71% | 0.709 | 74% | 0.74 | S | S | * | * | trans | -72.7 | 108.4 | 163.3 | -177.2 | 0 | 0 | 0 | 0 | 106.4 | P128 N132 | P128-V130 VanDerWaalsContact C-N 3.3Å; P128-V130 PolarHBondContact O-N 2.85Å; V130-N132 VanDerWaalsContact C-N 3.25Å; V130-N132 VanDerWaalsContact CG1-OD1 3.27Å; V130-N132 WeakPolarHBondContact CG1-OD1 3.27Å; V130-N132 PolarHBondContact O-N 3.19Å | ||
| 131 | F | 53 | Low | 51.7 | Low | 165 Ų | 165 | 142.5 Ų | 142.5 | 72% | 0.724 | 74% | 0.741 | S | S | * | * | trans | -76.4 | 78.5 | 176.5 | -143.6 | -89.5 | 0 | 0 | 0 | 108.5 | L129 H133 | L129-F131 PolarHBondContact O-N 3.1Å; F131-H133 PolarHBondContact O-N 2.95Å; F131-H133 VanDerWaalsContact O-N 3.15Å | ||
| 132 | N | 54.2 | Low | 51 | Low | 137 Ų | 137 | 145.6 Ų | 145.6 | 73% | 0.733 | 75% | 0.753 | S | S | * | * | trans | -71.6 | 107 | 164.2 | -88.9 | 48.2 | 0 | 0 | 0 | 107.3 | V130 | V130-N132 VanDerWaalsContact C-N 3.25Å; V130-N132 VanDerWaalsContact CG1-OD1 3.27Å; V130-N132 WeakPolarHBondContact CG1-OD1 3.27Å; V130-N132 PolarHBondContact O-N 3.19Å | ||
| 133 | H | 55 | Low | 50.7 | Low | 155 Ų | 155 | 146.2 Ų | 146.2 | 72% | 0.718 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127 | 170.6 | -48.3 | -83.1 | 0 | 0 | 0 | 109.1 | F131 | F131-H133 PolarHBondContact O-N 2.95Å; F131-H133 VanDerWaalsContact O-N 3.15Å |
| 134 | P | 57.1 | Low | 49.9 | Very low | 110 Ų | 110 | 145 Ų | 145 | 71% | 0.714 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 140.7 | 170 | 26.4 | -31 | 0 | 0 | 0 | 109.1 | ||
| 135 | P | 60.6 | Low | 49.3 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 147 | 170.9 | 25.6 | -31.8 | 0 | 0 | 0 | 109.7 | ||
| 136 | P | 54.2 | Low | 49.2 | Very low | 98 Ų | 98 | 143.6 Ų | 143.6 | 64% | 0.636 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 139.1 | -179.2 | 23.6 | -32.7 | 0 | 0 | 0 | 110.5 | Q138 | P136-Q138 PolarHBondContact O-N 3.09Å; P136-Q138 VanDerWaalsContact O-N 3.14Å |
| 137 | P | 49.5 | Very low | 48.9 | Very low | 102 Ų | 102 | 145.3 Ų | 145.3 | 66% | 0.662 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 117.9 | 178.8 | 25.1 | -32.2 | 0 | 0 | 0 | 109.8 | F139 | P137-F139 HydrophobicContact CB-CD2 4.35Å; P137-F139 HydrophobicContact CB-CE2 4.03Å; P137-F139 HydrophobicContact CG-CE2 3.96Å; P137-F139 PolarHBondContact O-N 2.87Å |
| 138 | Q | 48.6 | Very low | 48.6 | Very low | 178 Ų | 178 | 141.2 Ų | 141.2 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | -78.5 | 100.4 | 167.7 | -65.3 | -75.5 | -26.3 | 0 | 0 | 107 | P136 Q140 | P136-Q138 PolarHBondContact O-N 3.09Å; P136-Q138 VanDerWaalsContact O-N 3.14Å; Q138-Q140 PolarHBondContact O-N 3.03Å | ||
| 139 | F | 45.8 | Very low | 47.8 | Very low | 179 Ų | 179 | 145 Ų | 145 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | -73.5 | 108.5 | 172 | -79 | -87.2 | 0 | 0 | 0 | 109 | P137 N141 | P137-F139 HydrophobicContact CB-CD2 4.35Å; P137-F139 HydrophobicContact CB-CE2 4.03Å; P137-F139 HydrophobicContact CG-CE2 3.96Å; P137-F139 PolarHBondContact O-N 2.87Å; F139-N141 PolarHBondContact O-N 2.84Å | ||
| 140 | Q | 41.1 | Very low | 47.3 | Very low | 181 Ų | 181 | 143.3 Ų | 143.3 | 85% | 0.846 | 76% | 0.761 | S | S | * | * | trans | -75.5 | 114.8 | 169.9 | -160.5 | 161.9 | -11.7 | 0 | 0 | 107.6 | Q138 V142 | Q138-Q140 PolarHBondContact O-N 3.03Å; Q140-V142 PolarHBondContact O-N 3.23Å | ||
| 141 | N | 40.5 | Very low | 46.2 | Very low | 151 Ų | 151 | 147.8 Ų | 147.8 | 81% | 0.807 | 77% | 0.767 | S | S | * | * | trans | -61.4 | 96.6 | 176.9 | -71 | -41.4 | 0 | 0 | 0 | 109.8 | F139 W143 | F139-N141 PolarHBondContact O-N 2.84Å; N141-W143 PolarHBondContact O-N 2.98Å | ||
| 142 | V | 40.3 | Very low | 45.5 | Very low | 131 Ų | 131 | 147.1 Ų | 147.1 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -81.5 | 68 | 165.2 | -173.5 | 0 | 0 | 0 | 0 | 107.4 | Q140 T144 | Q140-V142 PolarHBondContact O-N 3.23Å; V142-T144 VanDerWaalsContact C-N 3.28Å; V142-T144 PolarHBondContact O-N 3.31Å | ||
| 143 | W | 42.5 | Very low | 44.7 | Very low | 238 Ų | 238 | 148.7 Ų | 148.7 | 90% | 0.902 | 77% | 0.771 | S | S | * | * | trans | -91.8 | 68.2 | 166.6 | -129.7 | 93.9 | 0 | 0 | 0 | 108.5 | N141 | N141-W143 PolarHBondContact O-N 2.98Š| ||
| 144 | T | 37.8 | Very low | 43.9 | Very low | 121 Ų | 121 | 146.7 Ų | 146.7 | 74% | 0.742 | 77% | 0.771 | S | S | * | * | trans | -163.8 | 91.1 | 156.8 | -10.8 | 0 | 0 | 0 | 0 | 109.7 | V142 | V142-T144 VanDerWaalsContact C-N 3.28Å; V142-T144 PolarHBondContact O-N 3.31Å | ||
| 145 | N | 35.5 | Very low | 43.2 | Very low | 133 Ų | 133 | 146.8 Ų | 146.8 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | -138.4 | 107.5 | 146.4 | -160.6 | -7.2 | 0 | 0 | 0 | 107.4 | N147 | N145-N147 VanDerWaalsContact C-N 3.31Å; N145-N147 PolarHBondContact O-N 3.41Å; N145-N147 VanDerWaalsContact O-N 3.1Å | ||
| 146 | P | 46.2 | Very low | 42.3 | Very low | 105 Ų | 105 | 148.4 Ų | 148.4 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | trans | -85 | 79.5 | 179.2 | 33.6 | -28.6 | 0 | 0 | 0 | 107.6 | ||||
| 147 | N | 46.7 | Very low | 41.5 | Very low | 150 Ų | 150 | 150.1 Ų | 150.1 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -178.5 | 84.8 | 161.2 | -87.6 | -38.5 | 0 | 0 | 0 | 109.4 | N145 | N145-N147 VanDerWaalsContact C-N 3.31Å; N145-N147 PolarHBondContact O-N 3.41Å; N145-N147 VanDerWaalsContact O-N 3.1Å | ||
| 148 | T | 40.4 | Very low | 41 | Very low | 132 Ų | 132 | 153.5 Ų | 153.5 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | -143.3 | 106.5 | 158.8 | 23.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 149 | E | 39.4 | Very low | 40.4 | Very low | 191 Ų | 191 | 151.4 Ų | 151.4 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | trans | -51.5 | 139.4 | 164 | -65.2 | -168.7 | 105.9 | 0 | 0 | 110 | Y151 | E149-Y151 PolarHBondContact O-N 3.49Š| ||
| 150 | T | 45.9 | Very low | 40.3 | Very low | 123 Ų | 123 | 148.7 Ų | 148.7 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | -50.2 | 86.4 | -176.9 | -51.4 | 0 | 0 | 0 | 0 | 113.1 | M152 | T150-M152 HydrophobicContact CG2-CG 3.84Å; T150-M152 PolarHBondContact O-N 2.91Å | ||
| 151 | Y | 35.6 | Very low | 40.1 | Very low | 210 Ų | 210 | 146.3 Ų | 146.3 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | trans | -90.7 | 86.3 | 158.4 | -152.2 | -91.1 | 0 | 0 | 0 | 108.6 | E149 Q153 | E149-Y151 PolarHBondContact O-N 3.49Å; Y151-Q153 PolarHBondContact O-N 3.1Å | ||
| 152 | M | 39.8 | Very low | 40.2 | Very low | 152 Ų | 152 | 145 Ų | 145 | 75% | 0.749 | 78% | 0.782 | S | S | * | * | trans | -59.3 | 115.6 | 167.1 | -79.4 | -84 | 101.8 | 0 | 0 | 108.8 | T150 | T150-M152 HydrophobicContact CG2-CG 3.84Å; T150-M152 PolarHBondContact O-N 2.91Å | ||
| 153 | Q | 37.3 | Very low | 40.2 | Very low | 170 Ų | 170 | 147 Ų | 147 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 130.5 | 164.3 | -74.9 | -175.5 | -11.8 | 0 | 0 | 108.8 | Y151 | Y151-Q153 PolarHBondContact O-N 3.1Š|
| 154 | P | 37.1 | Very low | 39.9 | Very low | 112 Ų | 112 | 145.6 Ų | 145.6 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 139.2 | 170.3 | 26.7 | -31.2 | 0 | 0 | 0 | 109.3 | T156 | P154-T156 PolarHBondContact O-N 3.1Š|
| 155 | P | 42 | Very low | 39.8 | Very low | 112 Ų | 112 | 145.8 Ų | 145.8 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 138.5 | -179.4 | 24 | -31.9 | 0 | 0 | 0 | 110.8 | T157 | P155-T157 PolarHBondContact O-N 3.04Å; P155-T157 PolarHBondContact O-OG1 3.5Å |
| 156 | T | 41.8 | Very low | 39.7 | Very low | 147 Ų | 147 | 145.3 Ų | 145.3 | 90% | 0.902 | 77% | 0.773 | S | S | * | * | trans | -52.9 | 100.9 | 168.9 | 21.2 | 0 | 0 | 0 | 0 | 109.6 | P154 M158 | P154-T156 PolarHBondContact O-N 3.1Å; T156-M158 PolarHBondContact O-N 2.97Å | ||
| 157 | T | 38.8 | Very low | 39.2 | Very low | 134 Ų | 134 | 144.6 Ų | 144.6 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | -78.9 | 105.8 | 170 | -30 | 0 | 0 | 0 | 0 | 106.5 | P155 N159 | P155-T157 PolarHBondContact O-N 3.04Å; P155-T157 PolarHBondContact O-OG1 3.5Å; T157-N159 PolarHBondContact O-N 3.39Å | ||
| 158 | M | 38.4 | Very low | 38.4 | Very low | 174 Ų | 174 | 146 Ų | 146 | 86% | 0.857 | 77% | 0.771 | S | S | * | * | trans | -58 | 120.4 | 169.7 | -94 | -150.6 | 92.6 | 0 | 0 | 108.8 | T156 | T156-M158 PolarHBondContact O-N 2.97Š| ||
| 159 | N | 35.3 | Very low | 38.4 | Very low | 133 Ų | 133 | 144.2 Ų | 144.2 | 71% | 0.711 | 76% | 0.762 | S | S | * | * | trans | -75.3 | 126.2 | 165.8 | -103.1 | -33.7 | 0 | 0 | 0 | 109.2 | T157 I161 | T157-N159 PolarHBondContact O-N 3.39Å; N159-I161 PolarHBondContact O-N 3.15Å; N159-I161 VanDerWaalsContact O-N 3.13Å | ||
| 160 | P | 45.2 | Very low | 38.4 | Very low | 123 Ų | 123 | 141.7 Ų | 141.7 | 80% | 0.799 | 76% | 0.76 | S | S | * | * | trans | -83.5 | 84.6 | 176.1 | 33.3 | -32.2 | 0 | 0 | 0 | 109.5 | ||||
| 161 | I | 36.5 | Very low | 37.9 | Very low | 131 Ų | 131 | 145.8 Ų | 145.8 | 67% | 0.672 | 76% | 0.763 | S | S | * | * | trans | -118.4 | 121.2 | 170.6 | -67.7 | 178.1 | 0 | 0 | 0 | 109.4 | N159 | N159-I161 PolarHBondContact O-N 3.15Å; N159-I161 VanDerWaalsContact O-N 3.13Å | ||
| 162 | T | 42.7 | Very low | 38.4 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | trans | 70.6 | 90.3 | 163.6 | 54.3 | 0 | 0 | 0 | 0 | 117.7 | Y164 | T162-Y164 VanDerWaalsContact C-N 3.34Å; T162-Y164 PolarHBondContact O-N 3.44Å | ||
| 163 | Q | 39.9 | Very low | 38.7 | Very low | 175 Ų | 175 | 141.3 Ų | 141.3 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -50.5 | 96.6 | 137.7 | -76.4 | -92.7 | 21.9 | 0 | 0 | 109.9 | ||||
| 164 | Y | 35.9 | Very low | 38.8 | Very low | 207 Ų | 207 | 137.6 Ų | 137.6 | 81% | 0.812 | 76% | 0.755 | S | S | * | * | trans | -144.6 | 73.3 | 151.4 | -124 | -85.7 | 0 | 0 | 0 | 108.5 | T162 Q166 | T162-Y164 VanDerWaalsContact C-N 3.34Å; T162-Y164 PolarHBondContact O-N 3.44Å; Y164-Q166 PolarHBondContact O-N 3.48Å | ||
| 165 | V | 35.3 | Very low | 39.2 | Very low | 125 Ų | 125 | 138.6 Ų | 138.6 | 76% | 0.758 | 76% | 0.762 | S | S | * | * | trans | -75.9 | 97.3 | 165.5 | 178.6 | 0 | 0 | 0 | 0 | 106.6 | A167 | V165-A167 PolarHBondContact O-N 3Š| ||
| 166 | Q | 34.7 | Very low | 39.3 | Very low | 123 Ų | 123 | 138.7 Ų | 138.7 | 58% | 0.575 | 76% | 0.76 | S | S | * | * | trans | -81.3 | 94.4 | 163.5 | -125.8 | -168.9 | -72.8 | 0 | 0 | 108 | Y164 Y168 | Y164-Q166 PolarHBondContact O-N 3.48Å; Q166-Y168 HydrophobicContact CB-CE2 4.36Å; Q166-Y168 HydrophobicContact CG-CE2 4.44Å; Q166-Y168 PolarHBondContact NE2-OH 3.28Å; Q166-Y168 PolarHBondContact O-N 3.48Å | ||
| 167 | A | 34.2 | Very low | 39.2 | Very low | 90 Ų | 90 | 140.3 Ų | 140.3 | 74% | 0.744 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 116.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109 | V165 | V165-A167 PolarHBondContact O-N 3Š|
| 168 | Y | 31.4 | Very low | 39.3 | Very low | 179 Ų | 179 | 139.5 Ų | 139.5 | 70% | 0.702 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -98.8 | 145.9 | 167.8 | -85 | -86.4 | 0 | 0 | 0 | 110 | Q166 | Q166-Y168 HydrophobicContact CB-CE2 4.36Å; Q166-Y168 HydrophobicContact CG-CE2 4.44Å; Q166-Y168 PolarHBondContact NE2-OH 3.28Å; Q166-Y168 PolarHBondContact O-N 3.48Å |
| 169 | P | 40.5 | Very low | 39.3 | Very low | 96 Ų | 96 | 138.9 Ų | 138.9 | 62% | 0.623 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 140.3 | -179.1 | 27.9 | -32.4 | 0 | 0 | 0 | 112.2 | Y171 | P169-Y171 PolarHBondContact O-N 3.13Š|
| 170 | T | 39.1 | Very low | 40 | Very low | 137 Ų | 137 | 137.9 Ų | 137.9 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 117.7 | 173.9 | -49.2 | 0 | 0 | 0 | 0 | 110.5 | ||
| 171 | Y | 34.6 | Very low | 39.5 | Very low | 210 Ų | 210 | 134.7 Ų | 134.7 | 82% | 0.824 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -93 | 127.4 | 165 | -79.7 | -86.2 | 0 | 0 | 0 | 110 | P169 | P169-Y171 PolarHBondContact O-N 3.13Š|
| 172 | P | 46.8 | Very low | 39.7 | Very low | 105 Ų | 105 | 138.9 Ų | 138.9 | 68% | 0.682 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 132.5 | 175.6 | 31.1 | -25.6 | 0 | 0 | 0 | 110.8 | ||
| 173 | N | 45.6 | Very low | 39.5 | Very low | 163 Ų | 163 | 141.8 Ų | 141.8 | 87% | 0.872 | 75% | 0.752 | S | S | * | * | trans | 90.9 | 91.7 | 163.9 | -53.5 | -39.4 | 0 | 0 | 0 | 119.3 | ||||
| 174 | S | 38.8 | Very low | 39.4 | Very low | 92 Ų | 92 | 140.7 Ų | 140.7 | 64% | 0.643 | 75% | 0.751 | S | S | * | * | trans | -163.9 | 134.8 | 144.5 | 177.9 | 0 | 0 | 0 | 0 | 110.1 | V176 | S174-V176 VanDerWaalsContact C-N 3.35Å; S174-V176 PolarHBondContact O-N 2.98Å | ||
| 175 | P | 45.3 | Very low | 39.5 | Very low | 133 Ų | 133 | 135.8 Ų | 135.8 | 86% | 0.864 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -88.2 | 22.6 | -171.1 | 35.3 | -34.3 | 0 | 0 | 0 | 115.4 | ||
| 176 | V | 43.8 | Very low | 39.7 | Very low | 114 Ų | 114 | 135.8 Ų | 135.8 | 69% | 0.691 | 75% | 0.745 | S | S | * | * | trans | -135.5 | 101.9 | 174.3 | -173.6 | 0 | 0 | 0 | 0 | 110.1 | S174 V178 | S174-V176 VanDerWaalsContact C-N 3.35Å; S174-V176 PolarHBondContact O-N 2.98Å; V176-V178 HydrophobicContact CG1-CG2 4.45Å | ||
| 177 | Q | 41.4 | Very low | 39.7 | Very low | 181 Ų | 181 | 139.6 Ų | 139.6 | 85% | 0.846 | 76% | 0.755 | S | S | * | * | trans | -99 | 106 | 168.5 | -61.7 | -135.3 | -22.5 | 0 | 0 | 109.2 | I179 | Q177-I179 PolarHBondContact O-N 3.35Š| ||
| 178 | V | 40.2 | Very low | 39.8 | Very low | 116 Ų | 116 | 142.2 Ų | 142.2 | 70% | 0.703 | 76% | 0.757 | S | S | * | * | trans | -74.8 | 111.6 | 163.6 | 173.7 | 0 | 0 | 0 | 0 | 107 | V176 T180 | V176-V178 HydrophobicContact CG1-CG2 4.45Å; V178-T180 VanDerWaalsContact C-N 3.34Å; V178-T180 HydrophobicContact CG1-CG2 4.36Å; V178-T180 PolarHBondContact O-N 3.28Å | ||
| 179 | I | 38.4 | Very low | 40 | Very low | 161 Ų | 161 | 143.7 Ų | 143.7 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -71.2 | 94.1 | 169.2 | -66.5 | 171.1 | 0 | 0 | 0 | 107.3 | Q177 G181 | Q177-I179 PolarHBondContact O-N 3.35Å; I179-G181 PolarHBondContact O-N 3.14Å | ||
| 180 | T | 49.2 | Very low | 39.9 | Very low | 113 Ų | 113 | 148 Ų | 148 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | trans | -91.4 | 85.9 | 161.1 | 140.3 | 0 | 0 | 0 | 0 | 106.6 | V178 | V178-T180 VanDerWaalsContact C-N 3.34Å; V178-T180 HydrophobicContact CG1-CG2 4.36Å; V178-T180 PolarHBondContact O-N 3.28Å | ||
| 181 | G | 36 | Very low | 40.1 | Very low | 55 Ų | 55 | 148.4 Ų | 148.4 | 57% | 0.567 | 77% | 0.77 | S | S | * | * | trans | -117.5 | 91.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | I179 Q183 | I179-G181 PolarHBondContact O-N 3.14Å; G181-Q183 PolarHBondContact O-N 3.29Å; G181-Q183 VanDerWaalsContact O-N 3.13Å | ||
| 182 | Y | 40.6 | Very low | 40.4 | Very low | 219 Ų | 219 | 143.3 Ų | 143.3 | 86% | 0.859 | 76% | 0.762 | S | S | * | * | trans | -72.1 | 98 | 163.8 | -77.8 | -90.5 | 0 | 0 | 0 | 108 | L184 | Y182-L184 PolarHBondContact O-N 3.25Š| ||
| 183 | Q | 37.8 | Very low | 40.1 | Very low | 184 Ų | 184 | 142.6 Ų | 142.6 | 86% | 0.86 | 76% | 0.758 | S | S | * | * | trans | -73.5 | 106.6 | 164.1 | -72.4 | -78.4 | 79.9 | 0 | 0 | 107.8 | G181 | G181-Q183 PolarHBondContact O-N 3.29Å; G181-Q183 VanDerWaalsContact O-N 3.13Å | ||
| 184 | L | 38.2 | Very low | 39.8 | Very low | 152 Ų | 152 | 143.7 Ų | 143.7 | 80% | 0.796 | 76% | 0.758 | S | S | * | * | trans | -68.3 | 129.2 | 166.8 | -77.5 | 161.2 | 0 | 0 | 0 | 108.5 | Y182 V186 | Y182-L184 PolarHBondContact O-N 3.25Å; L184-V186 PolarHBondContact O-N 3.11Å; L184-V186 VanDerWaalsContact O-N 3.13Å | ||
| 185 | P | 38.4 | Very low | 39.8 | Very low | 104 Ų | 104 | 149.3 Ų | 149.3 | 68% | 0.675 | 77% | 0.765 | S | S | * | * | trans | -66.5 | 116 | 168.6 | 25.3 | -28.5 | 0 | 0 | 0 | 108.5 | Y187 | P185-Y187 PolarHBondContact O-N 3.13Å; P185-Y187 VanDerWaalsContact O-N 3.11Å | ||
| 186 | V | 39.8 | Very low | 39.7 | Very low | 125 Ų | 125 | 148.6 Ų | 148.6 | 76% | 0.758 | 76% | 0.76 | S | S | * | * | trans | -65.9 | 107.7 | 166.7 | -179.3 | 0 | 0 | 0 | 0 | 106.7 | L184 N188 | L184-V186 PolarHBondContact O-N 3.11Å; L184-V186 VanDerWaalsContact O-N 3.13Å; V186-N188 PolarHBondContact O-N 3Å | ||
| 187 | Y | 33.3 | Very low | 39.5 | Very low | 202 Ų | 202 | 150.6 Ų | 150.6 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | trans | -62.2 | 105.2 | 168.9 | -92.8 | -92.6 | 0 | 0 | 0 | 108.3 | P185 Y189 | P185-Y187 PolarHBondContact O-N 3.13Å; P185-Y187 VanDerWaalsContact O-N 3.11Å; Y187-Y189 PolarHBondContact O-N 3.06Å; Y187-Y189 VanDerWaalsContact O-N 3.17Å | ||
| 188 | N | 36.9 | Very low | 39.9 | Very low | 146 Ų | 146 | 145.5 Ų | 145.5 | 78% | 0.781 | 77% | 0.769 | S | S | * | * | trans | -70.7 | 104.6 | 161 | -95.9 | -94.4 | 0 | 0 | 0 | 107.1 | V186 Q190 | V186-N188 PolarHBondContact O-N 3Å; N188-Q190 PolarHBondContact O-N 3.2Å | ||
| 189 | Y | 34.7 | Very low | 40 | Very low | 210 Ų | 210 | 148.2 Ų | 148.2 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -64.8 | 106 | 161.6 | -98 | -90.9 | 0 | 0 | 0 | 107.5 | Y187 I191 | Y187-Y189 PolarHBondContact O-N 3.06Å; Y187-Y189 VanDerWaalsContact O-N 3.17Å; Y189-I191 PolarHBondContact O-N 3.21Å; Y189-I191 VanDerWaalsContact O-N 3.1Å | ||
| 190 | Q | 39.6 | Very low | 40.1 | Very low | 186 Ų | 186 | 149.9 Ų | 149.9 | 87% | 0.869 | 78% | 0.778 | S | S | * | * | trans | -69.4 | 106.9 | 171.2 | -141.6 | 158.9 | 45.6 | 0 | 0 | 107.1 | N188 | N188-Q190 PolarHBondContact O-N 3.2Š| ||
| 191 | I | 43.1 | Very low | 39.7 | Very low | 145 Ų | 145 | 154.2 Ų | 154.2 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 128.3 | 173.7 | -46.3 | 155.5 | 0 | 0 | 0 | 106.1 | Y189 | Y189-I191 PolarHBondContact O-N 3.21Å; Y189-I191 VanDerWaalsContact O-N 3.1Å |
| 192 | P | 40.4 | Very low | 39.7 | Very low | 103 Ų | 103 | 157.5 Ų | 157.5 | 67% | 0.669 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 138.6 | 172.2 | -18.1 | 28.8 | 0 | 0 | 0 | 109.1 | Q194 | P192-Q194 PolarHBondContact O-N 3.38Š|
| 193 | P | 41.4 | Very low | 39.3 | Very low | 90 Ų | 90 | 157.1 Ų | 157.1 | 58% | 0.584 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 119.8 | 178 | 22.5 | -30.6 | 0 | 0 | 0 | 109.3 | W195 | P193-W195 HydrophobicContact CB-CZ2 4.43Å; P193-W195 HydrophobicContact CG-CZ2 4.05Å; P193-W195 PolarHBondContact O-N 3.41Å |
| 194 | Q | 39 | Very low | 39.3 | Very low | 186 Ų | 186 | 154.9 Ų | 154.9 | 87% | 0.869 | 79% | 0.793 | S | S | * | * | trans | -71.4 | 112.2 | 169.3 | 63.7 | -169.8 | 20.6 | 0 | 0 | 107.7 | P192 | P192-Q194 PolarHBondContact O-N 3.38Š| ||
| 195 | W | 38.4 | Very low | 39.4 | Very low | 211 Ų | 211 | 153.3 Ų | 153.3 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -79 | 134.4 | 174.5 | -60.5 | 104 | 0 | 0 | 0 | 109.2 | P193 V197 | P193-W195 HydrophobicContact CB-CZ2 4.43Å; P193-W195 HydrophobicContact CG-CZ2 4.05Å; P193-W195 PolarHBondContact O-N 3.41Å; W195-V197 PolarHBondContact O-N 3.36Å |
| 196 | P | 42.5 | Very low | 39.2 | Very low | 118 Ų | 118 | 153.4 Ų | 153.4 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 129.5 | 167.5 | -19.8 | 30.1 | 0 | 0 | 0 | 109.5 | G198 | P196-G198 PolarHBondContact O-N 3.17Š|
| 197 | V | 40.2 | Very low | 39.2 | Very low | 156 Ų | 156 | 152.9 Ų | 152.9 | 95% | 0.945 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 116.1 | 175.1 | 170.1 | 0 | 0 | 0 | 0 | 108.2 | W195 | W195-V197 PolarHBondContact O-N 3.36Š|
| 198 | G | 49.1 | Very low | 39.3 | Very low | 74 Ų | 74 | 147.9 Ų | 147.9 | 76% | 0.763 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 146.5 | 8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 120.1 | P196 | P196-G198 PolarHBondContact O-N 3.17Š|
| 199 | E | 43.6 | Very low | 39.1 | Very low | 172 Ų | 172 | 152.1 Ų | 152.1 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -112.9 | 124.2 | 173.5 | -82.7 | -164.6 | 159.2 | 0 | 0 | 113.5 | R201 | E199-R201 PolarHBondContact O-N 3.07Š| ||
| 200 | Q | 39.8 | Very low | 39.2 | Very low | 197 Ų | 197 | 147.3 Ų | 147.3 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -75.3 | 115.6 | 175.4 | -159.9 | -179.1 | 12.3 | 0 | 0 | 109.1 | ||||
| 201 | R | 40.8 | Very low | 38.9 | Very low | 204 Ų | 204 | 143.2 Ų | 143.2 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | trans | -121.8 | 123.8 | 166.3 | -85.1 | -174.1 | 179.6 | -177.2 | 0.4 | 110.8 | E199 Y203 | E199-R201 PolarHBondContact O-N 3.07Å; R201-Y203 PolarHBondContact O-N 2.89Å | ||
| 202 | S | 36 | Very low | 38.2 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 87% | 0.867 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 123.2 | 167 | -71.6 | 0 | 0 | 0 | 0 | 110.3 | ||
| 203 | Y | 32.8 | Very low | 37.8 | Very low | 210 Ų | 210 | 145.2 Ų | 145.2 | 82% | 0.824 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 119.9 | 164.2 | -83.6 | -89.8 | 0 | 0 | 0 | 109.1 | R201 | R201-Y203 PolarHBondContact O-N 2.89Š|
| 204 | V | 38.3 | Very low | 37.1 | Very low | 138 Ų | 138 | 151.6 Ų | 151.6 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 116.2 | 160.3 | 175.3 | 0 | 0 | 0 | 0 | 106.9 | ||
| 205 | V | 39.8 | Very low | 36.7 | Very low | 118 Ų | 118 | 150.2 Ų | 150.2 | 72% | 0.715 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 127 | 177.1 | 175.4 | 0 | 0 | 0 | 0 | 109.1 | ||
| 206 | P | 33.3 | Very low | 36 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 69% | 0.688 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 141.6 | 167.1 | -10.1 | 25.4 | 0 | 0 | 0 | 110 | A208 | P206-A208 PolarHBondContact O-N 3.03Š|
| 207 | P | 40.6 | Very low | 35.4 | Very low | 115 Ų | 115 | 145.9 Ų | 145.9 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 128.3 | 179.5 | -17 | 29.7 | 0 | 0 | 0 | 111.1 | Y209 | P207-Y209 PolarHBondContact O-N 3.21Š|
| 208 | A | 36.2 | Very low | 34.9 | Very low | 97 Ų | 97 | 146.2 Ų | 146.2 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 123.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | P206 S210 | P206-A208 PolarHBondContact O-N 3.03Å; A208-S210 PolarHBondContact O-N 3.28Å |
| 209 | Y | 31.6 | Very low | 34.1 | Very low | 234 Ų | 234 | 149.4 Ų | 149.4 | 92% | 0.918 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 120.3 | 170.9 | -77.1 | -89.5 | 0 | 0 | 0 | 109.4 | P207 | P207-Y209 PolarHBondContact O-N 3.21Š|
| 210 | S | 37.2 | Very low | 33.5 | Very low | 109 Ų | 109 | 148.1 Ų | 148.1 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 146.9 | -178.5 | 37.9 | 0 | 0 | 0 | 0 | 112.5 | A208 | A208-S210 PolarHBondContact O-N 3.28Š|
| 211 | A | 32.3 | Very low | 33.8 | Very low | 100 Ų | 100 | 144 Ų | 144 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 134.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | N213 | A211-N213 PolarHBondContact O-N 3.27Š|
| 212 | V | 30.1 | Very low | 33.1 | Very low | 132 Ų | 132 | 137.7 Ų | 137.7 | 80% | 0.8 | 79% | 0.788 | S | S | * | * | trans | -71.9 | 110.4 | 178.5 | -168.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 213 | N | 30.1 | Very low | 32.7 | Very low | 158 Ų | 158 | 136.5 Ų | 136.5 | 85% | 0.845 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 128.6 | 166.5 | -118.9 | -20.4 | 0 | 0 | 0 | 108 | A211 H215 | A211-N213 PolarHBondContact O-N 3.27Å; N213-H215 PolarHBondContact O-N 3.27Å |
| 214 | Y | 28 | Very low | 32.4 | Very low | 224 Ų | 224 | 135.1 Ų | 135.1 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 126.1 | -179.9 | -75 | -92 | 0 | 0 | 0 | 110.6 | ||
| 215 | H | 29.1 | Very low | 31.8 | Very low | 157 Ų | 157 | 135 Ų | 135 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 129.4 | 173 | -164.1 | 72.9 | 0 | 0 | 0 | 109.2 | N213 N217 | N213-H215 PolarHBondContact O-N 3.27Å; H215-N217 PolarHBondContact CD2-OD1 3.1Å; H215-N217 VanDerWaalsContact CD2-OD1 3.28Å; H215-N217 PolarHBondContact NE2-OD1 3.13Å |
| 216 | C | 25.3 | Very low | 31.3 | Very low | 128 Ų | 128 | 135.4 Ų | 135.4 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | trans | -114.2 | 118.2 | 156.8 | -101.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 217 | N | 28.6 | Very low | 31.4 | Very low | 111 Ų | 111 | 135.2 Ų | 135.2 | 59% | 0.594 | 79% | 0.786 | S | S | * | * | trans | -53.6 | 159.4 | 164.3 | -86.2 | -3 | 0 | 0 | 0 | 111.4 | H215 | H215-N217 PolarHBondContact CD2-OD1 3.1Å; H215-N217 VanDerWaalsContact CD2-OD1 3.28Å; H215-N217 PolarHBondContact NE2-OD1 3.13Å | ||
| 218 | E | 30.3 | Very low | 30.7 | Very low | 163 Ų | 163 | 135.7 Ų | 135.7 | 76% | 0.762 | 78% | 0.783 | S | S | * | * | cis | -170.5 | 174.9 | 19 | -126.5 | 165.3 | 115 | 0 | 0 | 109.9 | ||||
| 219 | V | 31.7 | Very low | 30.1 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | trans | 106.9 | 110.8 | 159.7 | -156.1 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 220 | D | 31.1 | Very low | 29.7 | Very low | 145 Ų | 145 | 134.3 Ų | 134.3 | 78% | 0.775 | 78% | 0.782 | S | S | * | * | trans | -85.6 | -169.3 | -175.5 | -159.8 | -115.6 | 0 | 0 | 0 | 111.9 | ||||
| 221 | P | 45.9 | Very low | 29.1 | Very low | 110 Ų | 110 | 133.8 Ų | 133.8 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | -119.7 | 173.7 | -68.3 | 40.2 | -29.3 | 0 | 0 | 0 | 112.5 | |||||
| 222 | G | 26 | Very low | 28.8 | Very low | 72 Ų | 72 | 134 Ų | 134 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | trans | 157.2 | 97.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 223 | A | 28.6 | Very low | 28.5 | Very low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | trans | 58.9 | 146.2 | 139.4 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 224 | E | 25.6 | Very low | 28.2 | Very low | 182 Ų | 182 | 137.6 Ų | 137.6 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | trans | 98.1 | 91.4 | 155.5 | -52.5 | -149.7 | 143.2 | 0 | 0 | 119.9 | ||||
| 225 | V | 27.3 | Very low | 28.1 | Very low | 135 Ų | 135 | 131.8 Ų | 131.8 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | 28.8 | 130.7 | 113.8 | -165.1 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 226 | V | 27.6 | Very low | 28.1 | Very low | 126 Ų | 126 | 130 Ų | 130 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | trans | 128.3 | 134 | 139.7 | -178.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 227 | P | 36.9 | Very low | 28.8 | Very low | 102 Ų | 102 | 129 Ų | 129 | 66% | 0.662 | 76% | 0.763 | S | S | * | * | trans | -94.8 | 171 | -165.9 | 37.5 | -25.7 | 0 | 0 | 0 | 111.8 | ||||
| 228 | N | 25.5 | Very low | 28.8 | Very low | 126 Ų | 126 | 129.5 Ų | 129.5 | 67% | 0.674 | 77% | 0.772 | S | S | * | * | trans | -174.4 | 116.1 | 138.8 | -99 | 8.6 | 0 | 0 | 0 | 109.6 | ||||
| 229 | E | 23 | Very low | 28.7 | Very low | 160 Ų | 160 | 127.9 Ų | 127.9 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | 69.3 | 108 | 94.8 | -65.9 | -178.9 | 147.5 | 0 | 0 | 112.8 | |||||
| 230 | C | 24.2 | Very low | 28.5 | Very low | 141 Ų | 141 | 124.3 Ų | 124.3 | 95% | 0.953 | 77% | 0.771 | S | S | * | * | -161.3 | 141.2 | 121.8 | -101.5 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 231 | S | 23.8 | Very low | 28.5 | Very low | 99 Ų | 99 | 125.2 Ų | 125.2 | 69% | 0.692 | 78% | 0.776 | S | S | * | * | trans | -74.6 | 141.5 | -164.8 | 175.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 232 | V | 25.2 | Very low | 27.8 | Very low | 104 Ų | 104 | 123.6 Ų | 123.6 | 63% | 0.63 | 78% | 0.779 | S | S | * | * | trans | 4.4 | 133 | 133.9 | -174.2 | 0 | 0 | 0 | 0 | 117.4 | E234 | V232-E234 HydrophobicContact CG1-CB 4.34Š| ||
| 233 | H | 25.2 | Very low | 28.3 | Very low | 196 Ų | 196 | 126.1 Ų | 126.1 | 91% | 0.907 | 78% | 0.782 | S | S | * | * | -136.6 | 127 | 127.7 | -69.1 | -72.1 | 0 | 0 | 0 | 111.2 | |||||
| 234 | E | 24.2 | Very low | 28.7 | Very low | 169 Ų | 169 | 130.4 Ų | 130.4 | 79% | 0.79 | 79% | 0.785 | S | S | * | * | trans | -90.7 | 149 | -177.1 | 175.9 | 175.5 | 97.3 | 0 | 0 | 111.6 | V232 | V232-E234 HydrophobicContact CG1-CB 4.34Š| ||
| 235 | A | 25.7 | Very low | 29.3 | Very low | 103 Ų | 103 | 131.6 Ų | 131.6 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -157 | 119 | 147.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 236 | T | 28.6 | Very low | 30.3 | Very low | 118 Ų | 118 | 135.2 Ų | 135.2 | 72% | 0.724 | 79% | 0.792 | S | S | * | * | trans | -105.3 | 174.8 | 170.8 | -41.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 237 | P | 40.2 | Very low | 31.3 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | -101.1 | -174.6 | -101.5 | 38.6 | -19.6 | 0 | 0 | 0 | 113.4 | |||||
| 238 | P | 28.1 | Very low | 32 | Very low | 122 Ų | 122 | 135.8 Ų | 135.8 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | -146.5 | 146.7 | 97.5 | 34.7 | -16.9 | 0 | 0 | 0 | 116.1 | |||||
| 239 | S | 28.3 | Very low | 33.4 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 90% | 0.895 | 79% | 0.791 | S | S | * | * | trans | 21.1 | 121.8 | 142.1 | -160.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 240 | G | 27.5 | Very low | 34.7 | Very low | 67 Ų | 67 | 137.7 Ų | 137.7 | 69% | 0.691 | 80% | 0.797 | S | S | * | * | trans | 170.8 | 93.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 241 | N | 30.6 | Very low | 35.6 | Very low | 164 Ų | 164 | 135.2 Ų | 135.2 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | 17.3 | 113 | 154.2 | -59.7 | -40.7 | 0 | 0 | 0 | 118.4 | ||||
| 242 | G | 31.5 | Very low | 37 | Very low | 76 Ų | 76 | 135.6 Ų | 135.6 | 78% | 0.784 | 77% | 0.774 | S | S | * | * | trans | -66.7 | 145.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 243 | P | 36.7 | Very low | 38 | Very low | 124 Ų | 124 | 137.9 Ų | 137.9 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | trans | -91.9 | 114.7 | 161.3 | 31.1 | -24.7 | 0 | 0 | 0 | 109.8 | K245 | P243-K245 PolarHBondContact O-N 3.21Š| ||
| 244 | Q | 37.4 | Very low | 39.4 | Very low | 188 Ų | 188 | 133.2 Ų | 133.2 | 88% | 0.879 | 76% | 0.763 | S | S | * | * | trans | -63 | 126.6 | 168.4 | -83.8 | -163.6 | -36.1 | 0 | 0 | 110.4 | K246 | Q244-K246 PolarHBondContact O-N 3.36Š| ||
| 245 | K | 38.3 | Very low | 40.6 | Very low | 207 Ų | 207 | 129.9 Ų | 129.9 | 90% | 0.9 | 75% | 0.754 | S | S | * | * | trans | -61.4 | 115.8 | 173.5 | -68.8 | 177.5 | 176 | 178.4 | 0 | 109.9 | P243 | P243-K245 PolarHBondContact O-N 3.21Š| ||
| 246 | K | 47 | Very low | 41.7 | Very low | 211 Ų | 211 | 129.7 Ų | 129.7 | 92% | 0.917 | 74% | 0.742 | S | S | * | * | trans | -88.6 | 102.2 | 167.8 | -43.7 | 173.9 | -170.5 | -178 | 0 | 107 | Q244 | Q244-K246 PolarHBondContact O-N 3.36Š| ||
| 247 | S | 49.4 | Very low | 42.4 | Very low | 107 Ų | 107 | 128.4 Ų | 128.4 | 75% | 0.748 | 74% | 0.738 | S | S | * | * | trans | -152.7 | 67 | 173.7 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 248 | V | 52.5 | Low | 42.9 | Very low | 134 Ų | 134 | 128.1 Ų | 128.1 | 81% | 0.812 | 74% | 0.738 | S | S | * | * | trans | -148.3 | 150 | 153.7 | -176.8 | 0 | 0 | 0 | 0 | 106 | ||||
| 249 | D | 54 | Low | 43.8 | Very low | 96 Ų | 96 | 129.5 Ų | 129.5 | 51% | 0.513 | 74% | 0.737 | S | S | . | * | trans | 97.3 | 60 | 174.9 | -67.7 | -69.3 | 0 | 0 | 0 | 119.4 | ||||
| 250 | R | 49.8 | Very low | 44.7 | Very low | 230 Ų | 230 | 132.4 Ų | 132.4 | 87% | 0.868 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -115.3 | -8 | 149.1 | -88.4 | -172.4 | -167.4 | 176 | 4.8 | 114.9 | ||
| 251 | S | 44.3 | Very low | 45.2 | Very low | 89 Ų | 89 | 134.2 Ų | 134.2 | 62% | 0.622 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -85.3 | -29.7 | -178 | 60.3 | 0 | 0 | 0 | 0 | 113.5 | ||
| 252 | I | 53.1 | Low | 45.9 | Very low | 106 Ų | 106 | 131.7 Ų | 131.7 | 54% | 0.544 | 72% | 0.721 | S | S | . | * | H | α-helix | trans | -82.7 | -26.6 | -173.9 | -57.7 | -176.3 | 0 | 0 | 0 | 112.4 | T254 | I252-T254 PolarHBondContact O-N 3.31Å |
| 253 | Q | 46.4 | Very low | 46.5 | Very low | 153 Ų | 153 | 136.6 Ų | 136.6 | 72% | 0.715 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -72.6 | -24.2 | 178.9 | -79.6 | -177 | -6.2 | 0 | 0 | 114.6 | ||
| 254 | T | 54.4 | Low | 46.8 | Very low | 97 Ų | 97 | 138.2 Ų | 138.2 | 60% | 0.595 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -74.5 | -31.3 | -178.6 | -57.2 | 0 | 0 | 0 | 0 | 112 | I252 | I252-T254 PolarHBondContact O-N 3.31Å |
| 255 | V | 48.5 | Very low | 47.2 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 61% | 0.606 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -79 | -31.9 | -174.5 | -165.8 | 0 | 0 | 0 | 0 | 111.7 | ||
| 256 | V | 49.1 | Very low | 47.4 | Very low | 99 Ų | 99 | 137.4 Ų | 137.4 | 60% | 0.6 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -78 | -25.4 | -179.7 | -177.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 257 | S | 44.5 | Very low | 46.9 | Very low | 90 Ų | 90 | 138.6 Ų | 138.6 | 63% | 0.629 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -73.1 | -25.6 | 179.1 | -121.2 | 0 | 0 | 0 | 0 | 114.4 | L259 | S257-L259 VanDerWaalsContact C-N 3.34Å; S257-L259 PolarHBondContact O-N 3.42Å |
| 258 | C | 49.2 | Very low | 46.1 | Very low | 103 Ų | 103 | 141.7 Ų | 141.7 | 70% | 0.696 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -16.5 | 179.7 | -64.7 | 0 | 0 | 0 | 0 | 113.9 | ||
| 259 | L | 48.6 | Very low | 45.2 | Very low | 150 Ų | 150 | 140.8 Ų | 140.8 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -14.6 | -177.8 | -70.6 | 171.1 | 0 | 0 | 0 | 113.5 | S257 | S257-L259 VanDerWaalsContact C-N 3.34Å; S257-L259 PolarHBondContact O-N 3.42Å |
| 260 | F | 45.4 | Very low | 44.6 | Very low | 189 Ų | 189 | 142.2 Ų | 142.2 | 83% | 0.829 | 73% | 0.733 | S | S | * | * | trans | -118 | 41.4 | -175.2 | -124.5 | -92.9 | 0 | 0 | 0 | 112.3 | P262 | F260-P262 VanDerWaalsContact O-CD 3.29Å; F260-P262 WeakPolarHBondContact O-CD 3.08Å | ||
| 261 | N | 39.3 | Very low | 43.6 | Very low | 106 Ų | 106 | 137.7 Ų | 137.7 | 57% | 0.567 | 73% | 0.73 | S | S | * | * | trans | -99.4 | 103.2 | 174.5 | -149.6 | -26.3 | 0 | 0 | 0 | 110.1 | E263 | N261-E263 PolarHBondContact O-N 3.06Š| ||
| 262 | P | 45.5 | Very low | 43.3 | Very low | 111 Ų | 111 | 138.4 Ų | 138.4 | 72% | 0.721 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -71.7 | -7.7 | -173.7 | 27.8 | -34 | 0 | 0 | 0 | 114.4 | F260 N264 | F260-P262 VanDerWaalsContact O-CD 3.29Å; F260-P262 WeakPolarHBondContact O-CD 3.08Å; P262-N264 VanDerWaalsContact C-N 3.34Å; P262-N264 PolarHBondContact O-N 3.48Å |
| 263 | E | 42.7 | Very low | 42.5 | Very low | 179 Ų | 179 | 142.1 Ų | 142.1 | 84% | 0.836 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -81.3 | -6 | -178.5 | -67.9 | -119.1 | 120.4 | 0 | 0 | 114.6 | N261 | N261-E263 PolarHBondContact O-N 3.06Š|
| 264 | N | 43.1 | Very low | 42 | Very low | 157 Ų | 157 | 141.7 Ų | 141.7 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -97.6 | 13.3 | -178.9 | -110.8 | -11.2 | 0 | 0 | 0 | 114.4 | P262 L266 | P262-N264 VanDerWaalsContact C-N 3.34Å; P262-N264 PolarHBondContact O-N 3.48Å; N264-L266 PolarHBondContact O-N 3.1Å |
| 265 | R | 45.5 | Very low | 41.1 | Very low | 219 Ų | 219 | 144.9 Ų | 144.9 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -89 | 111.3 | 177.1 | -145.7 | 177.1 | -176.8 | 178.7 | 0.6 | 109.3 | ||||
| 266 | L | 43.6 | Very low | 40.5 | Very low | 159 Ų | 159 | 151 Ų | 151 | 83% | 0.832 | 78% | 0.776 | S | S | * | * | trans | 99.8 | 100.6 | 169.1 | -56.7 | 155.2 | 0 | 0 | 0 | 115.3 | N264 | N264-L266 PolarHBondContact O-N 3.1Š| ||
| 267 | R | 36.5 | Very low | 40.3 | Very low | 237 Ų | 237 | 156.1 Ų | 156.1 | 89% | 0.894 | 79% | 0.791 | S | S | * | * | -172.9 | 68.1 | 115.4 | -92.9 | 178.1 | -151.5 | -147.6 | 6.1 | 109.8 | T269 | R267-T269 PolarHBondContact O-N 3.28Š| |||
| 268 | N | 33.2 | Very low | 40.4 | Very low | 172 Ų | 172 | 161.3 Ų | 161.3 | 92% | 0.92 | 80% | 0.802 | S | S | * | * | trans | -89.2 | 89.8 | 156 | -98 | -35.9 | 0 | 0 | 0 | 106.7 | ||||
| 269 | T | 33.7 | Very low | 39.7 | Very low | 115 Ų | 115 | 162.2 Ų | 162.2 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | trans | -92.6 | 116.7 | 162.8 | -30.9 | 0 | 0 | 0 | 0 | 105.7 | R267 V271 | R267-T269 PolarHBondContact O-N 3.28Å; T269-V271 PolarHBondContact O-N 3.34Å; T269-V271 VanDerWaalsContact O-N 3.14Å | ||
| 270 | V | 40.9 | Very low | 39.5 | Very low | 125 Ų | 125 | 165.1 Ų | 165.1 | 76% | 0.758 | 81% | 0.806 | S | S | * | * | trans | -50.9 | 115.2 | 169.4 | 169 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 271 | V | 29 | Very low | 39.3 | Very low | 135 Ų | 135 | 165 Ų | 165 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -99.9 | 104.8 | 162.7 | 171.5 | 0 | 0 | 0 | 0 | 106.1 | T269 | T269-V271 PolarHBondContact O-N 3.34Å; T269-V271 VanDerWaalsContact O-N 3.14Å | ||
| 272 | T | 36.6 | Very low | 39.5 | Very low | 104 Ų | 104 | 165.7 Ų | 165.7 | 64% | 0.638 | 81% | 0.808 | S | S | * | * | trans | -64.9 | 144.6 | 172.2 | -39.9 | 0 | 0 | 0 | 0 | 109.6 | D274 | T272-D274 PolarHBondContact O-N 2.87Š| ||
| 273 | Q | 37 | Very low | 39 | Very low | 184 Ų | 184 | 169.5 Ų | 169.5 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -73.7 | 75.7 | -175.4 | -177.7 | -175.1 | -11.8 | 0 | 0 | 111.6 | ||
| 274 | D | 35.2 | Very low | 38.8 | Very low | 145 Ų | 145 | 169.3 Ų | 169.3 | 78% | 0.775 | 82% | 0.815 | S | S | * | * | trans | -147.2 | 5 | 172.5 | -83.7 | -52.7 | 0 | 0 | 0 | 116.9 | T272 | T272-D274 PolarHBondContact O-N 2.87Š| ||
| 275 | D | 36.7 | Very low | 38.4 | Very low | 164 Ų | 164 | 171.3 Ų | 171.3 | 88% | 0.877 | 82% | 0.816 | S | S | * | * | trans | -119 | 48.5 | -176.7 | -91.7 | -55.8 | 0 | 0 | 0 | 114.7 | ||||
| 276 | Y | 35.2 | Very low | 38.1 | Very low | 227 Ų | 227 | 172 Ų | 172 | 89% | 0.89 | 82% | 0.819 | S | S | * | * | trans | -111.5 | 42.9 | 176 | -135.4 | -90 | 0 | 0 | 0 | 114.2 | ||||
| 277 | F | 45.2 | Very low | 37.9 | Very low | 208 Ų | 208 | 175.6 Ų | 175.6 | 91% | 0.912 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -141.3 | 47.8 | 169.3 | -103.3 | -75.5 | 0 | 0 | 0 | 113.6 | ||
| 278 | K | 45.9 | Very low | 38 | Very low | 199 Ų | 199 | 170 Ų | 170 | 87% | 0.865 | 82% | 0.819 | S | S | * | * | trans | -177.1 | 96.2 | 154.3 | -112.7 | 172.6 | 176.9 | -171.1 | 0 | 112.3 | ||||
| 279 | D | 34.9 | Very low | 38.5 | Very low | 122 Ų | 122 | 173.1 Ų | 173.1 | 65% | 0.652 | 82% | 0.817 | S | S | * | * | trans | -159.3 | 83.8 | 136.5 | -117.8 | -38.1 | 0 | 0 | 0 | 111 | R281 | D279-R281 IonicContact OD1-CZ 3.61Å; D279-R281 IonicContact OD1-NE 3.1Å; D279-R281 PolarHBondContact OD1-NE 3.2Å; D279-R281 VanDerWaalsContact OD1-NE 3.1Å; D279-R281 IonicContact OD1-NH2 3.21Å; D279-R281 PolarHBondContact OD1-NH2 3.27Å; D279-R281 IonicContact OD2-NH2 3.81Å | ||
| 280 | K | 45.5 | Very low | 38.8 | Very low | 210 Ų | 210 | 172.5 Ų | 172.5 | 91% | 0.913 | 82% | 0.824 | S | S | * | * | trans | -84.8 | 89.6 | 150.2 | -81.8 | -174.8 | 176.9 | 179.3 | 0 | 107.1 | ||||
| 281 | R | 39.7 | Very low | 38.8 | Very low | 188 Ų | 188 | 175 Ų | 175 | 71% | 0.709 | 83% | 0.829 | S | S | * | * | trans | -141.5 | 99 | 161.7 | -88.8 | -175.6 | -69.6 | -154.6 | 1.9 | 111.8 | D279 | D279-R281 IonicContact OD1-CZ 3.61Å; D279-R281 IonicContact OD1-NE 3.1Å; D279-R281 PolarHBondContact OD1-NE 3.2Å; D279-R281 VanDerWaalsContact OD1-NE 3.1Å; D279-R281 IonicContact OD1-NH2 3.21Å; D279-R281 PolarHBondContact OD1-NH2 3.27Å; D279-R281 IonicContact OD2-NH2 3.81Å | ||
| 282 | V | 44.3 | Very low | 39.5 | Very low | 119 Ų | 119 | 177.2 Ų | 177.2 | 72% | 0.721 | 84% | 0.836 | S | S | * | * | trans | 18.8 | 104.7 | 137.6 | -171.3 | 0 | 0 | 0 | 0 | 115.5 | H284 | V282-H284 PolarHBondContact O-N 3.41Š| ||
| 283 | H | 35.8 | Very low | 39.9 | Very low | 192 Ų | 192 | 182.2 Ų | 182.2 | 89% | 0.889 | 85% | 0.848 | S | S | * | * | trans | -88 | 101.9 | 159 | -81.6 | -66 | 0 | 0 | 0 | 109.6 | F285 | H283-F285 PolarHBondContact O-N 2.86Š| ||
| 284 | H | 37.8 | Very low | 39.9 | Very low | 175 Ų | 175 | 178.7 Ų | 178.7 | 81% | 0.81 | 84% | 0.844 | S | S | * | * | trans | -69.6 | 114.6 | 162 | -93.4 | -74.8 | 0 | 0 | 0 | 109.2 | V282 R286 | V282-H284 PolarHBondContact O-N 3.41Å; H284-R286 PolarHBondContact O-N 3.44Å | ||
| 285 | F | 33.8 | Very low | 40.5 | Very low | 198 Ų | 198 | 182.1 Ų | 182.1 | 87% | 0.868 | 87% | 0.87 | S | S | * | * | trans | -71.7 | 113.4 | 169.3 | -163 | -97.7 | 0 | 0 | 0 | 109 | H283 R287 | H283-F285 PolarHBondContact O-N 2.86Å; F285-R287 PolarHBondContact O-N 3.3Å | ||
| 286 | R | 40.3 | Very low | 40.7 | Very low | 235 Ų | 235 | 183.1 Ų | 183.1 | 89% | 0.887 | 87% | 0.87 | S | S | * | * | trans | -74.5 | 108.3 | 177.9 | -151.8 | -179.1 | -176.3 | -160.7 | 1.9 | 108.3 | H284 S288 | H284-R286 PolarHBondContact O-N 3.44Å; R286-S288 PolarHBondContact O-N 3.45Å | ||
| 287 | R | 39.6 | Very low | 41 | Very low | 234 Ų | 234 | 180.7 Ų | 180.7 | 88% | 0.883 | 87% | 0.869 | S | S | * | * | trans | -69.5 | 112.1 | 178 | -162.4 | 177 | -171.1 | 178.4 | 2.6 | 109.7 | F285 R289 | F285-R287 PolarHBondContact O-N 3.3Å; R287-R289 PolarHBondContact O-N 3.23Å | ||
| 288 | S | 37.1 | Very low | 40.8 | Very low | 120 Ų | 120 | 179.2 Ų | 179.2 | 84% | 0.839 | 87% | 0.866 | S | S | * | * | trans | -68.6 | 122.5 | 171.4 | -55.8 | 0 | 0 | 0 | 0 | 110 | R286 | R286-S288 PolarHBondContact O-N 3.45Š| ||
| 289 | R | 44.2 | Very low | 40.5 | Very low | 237 Ų | 237 | 178.1 Ų | 178.1 | 89% | 0.894 | 87% | 0.866 | S | S | * | * | trans | -89.1 | 111.6 | 176.6 | -157.7 | -178.7 | -169 | -169.9 | 3.4 | 107.5 | R287 | R287-R289 PolarHBondContact O-N 3.23Š| ||
| 290 | A | 41.2 | Very low | 40.8 | Very low | 101 Ų | 101 | 181.6 Ų | 181.6 | 84% | 0.835 | 88% | 0.88 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 128 | 169 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 291 | M | 39.4 | Very low | 40.5 | Very low | 177 Ų | 177 | 179.7 Ų | 179.7 | 87% | 0.872 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -72 | 136.2 | -174.2 | -68.8 | -87.3 | -169.4 | 0 | 0 | 111.8 | ||
| 292 | L | 44.4 | Very low | 40.6 | Very low | 183 Ų | 183 | 179.1 Ų | 179.1 | 96% | 0.958 | 89% | 0.889 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 134.8 | 158.9 | -79.6 | 153.5 | 0 | 0 | 0 | 108.9 | ||
| 293 | K | 43.8 | Very low | 40.3 | Very low | 208 Ų | 208 | 183.7 Ų | 183.7 | 90% | 0.904 | 90% | 0.902 | S | S | * | * | trans | -124.1 | 105.7 | 165.3 | -158.2 | 165.6 | -175.9 | 177.6 | 0 | 107.9 | ||||
| 294 | S | 38.7 | Very low | 40.7 | Very low | 111 Ų | 111 | 183 Ų | 183 | 78% | 0.776 | 90% | 0.904 | S | S | * | * | trans | -103.5 | 126.9 | 158 | 66.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 295 | V | 48 | Very low | 40.9 | Very low | 217 Ų | 217 | 183.7 Ų | 183.7 | 100% | 1.315 | 91% | 0.912 | S | S | * | * | -157.3 | 0 | 124.4 | 170.4 | 0 | 0 | 0 | 0 | 105.2 |
Retrieved 295 of 295 residues in 103.4 ms
(Link to these results)